Program PWSCF v.5.4.0 starts on 15Mar2017 at 15:49:25 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 & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 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: ./AlPS4.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 22 20 5 1112 910 137 Max 23 21 6 1123 933 148 Sum 1649 1449 421 80537 66389 10321 bravais-lattice index = 14 lattice parameter (alat) = 10.6581 a.u. unit-cell volume = 1942.6891 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 40.0000 Ry charge density cutoff = 182.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.658055 celldm(2)= 1.000000 celldm(3)= 1.604610 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.604610 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.623204 ) 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 Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 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 1147 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) Al 3.00 26.98150 Al( 1.00) P 5.00 30.97380 P( 1.00) 4 Sym. Ops. (no inversion) found (note: 4 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2v (mm2) there are 5 classes and 1 irreducible representations the character table: E -E C2 s_v s_v' -C2 -s_v -s_v' G_5 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] s_v -s_v 3 -3 inv. 180 deg rotation - cart. axis [0,1,0] s_v'-s_v' 4 -4 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 255 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 2) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0039216 k( 3) = ( 0.0000000 0.0357143 -0.0000000), wk = 0.0039216 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0039216 k( 5) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0039216 k( 6) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0039216 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0039216 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0039216 k( 9) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0039216 k( 10) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0039216 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0039216 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0039216 k( 13) = ( 0.0000000 0.2142857 -0.0000000), wk = 0.0039216 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0039216 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0039216 k( 16) = ( 0.0000000 0.2678571 -0.0000000), wk = 0.0039216 k( 17) = ( 0.0000000 0.2857143 -0.0000000), wk = 0.0039216 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0039216 k( 19) = ( 0.0000000 0.3214286 -0.0000000), wk = 0.0039216 k( 20) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0039216 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0039216 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0039216 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0039216 k( 24) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0039216 k( 25) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0039216 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0039216 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0039216 k( 28) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0039216 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0039216 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0039216 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0039216 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0039216 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0039216 k( 36) = ( 0.1071429 0.5000000 -0.0000000), wk = 0.0039216 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0039216 k( 38) = ( 0.1428571 0.5000000 -0.0000000), wk = 0.0039216 k( 39) = ( 0.1607143 0.5000000 -0.0000000), wk = 0.0039216 k( 40) = ( 0.1785714 0.5000000 -0.0000000), wk = 0.0039216 k( 41) = ( 0.1964286 0.5000000 -0.0000000), wk = 0.0039216 k( 42) = ( 0.2142857 0.5000000 -0.0000000), wk = 0.0039216 k( 43) = ( 0.2321429 0.5000000 -0.0000000), wk = 0.0039216 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0039216 k( 45) = ( 0.2678571 0.5000000 -0.0000000), wk = 0.0039216 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0039216 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0039216 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0039216 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0039216 k( 50) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0039216 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0039216 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0039216 k( 53) = ( 0.4107143 0.5000000 -0.0000000), wk = 0.0039216 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0039216 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0039216 k( 56) = ( 0.4642857 0.5000000 -0.0000000), wk = 0.0039216 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0039216 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 60) = ( 0.4875000 0.4875000 -0.0000000), wk = 0.0039216 k( 61) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0039216 k( 62) = ( 0.4625000 0.4625000 -0.0000000), wk = 0.0039216 k( 63) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0039216 k( 64) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0039216 k( 65) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0039216 k( 66) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0039216 k( 67) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0039216 k( 68) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0039216 k( 69) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0039216 k( 70) = ( 0.3625000 0.3625000 -0.0000000), wk = 0.0039216 k( 71) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0039216 k( 72) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0039216 k( 73) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0039216 k( 74) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0039216 k( 75) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0039216 k( 76) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0039216 k( 77) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0039216 k( 78) = ( 0.2625000 0.2625000 -0.0000000), wk = 0.0039216 k( 79) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0039216 k( 80) = ( 0.2375000 0.2375000 -0.0000000), wk = 0.0039216 k( 81) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0039216 k( 82) = ( 0.2125000 0.2125000 -0.0000000), wk = 0.0039216 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0039216 k( 84) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0039216 k( 85) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0039216 k( 86) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0039216 k( 87) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0039216 k( 88) = ( 0.1375000 0.1375000 -0.0000000), wk = 0.0039216 k( 89) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0039216 k( 90) = ( 0.1125000 0.1125000 -0.0000000), wk = 0.0039216 k( 91) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0039216 k( 92) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0039216 k( 93) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0039216 k( 94) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0039216 k( 95) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0039216 k( 96) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0039216 k( 97) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0039216 k( 98) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0039216 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 101) = ( 0.0000000 0.0000000 0.0173112), wk = 0.0039216 k( 102) = ( 0.0000000 0.0000000 0.0346225), wk = 0.0039216 k( 103) = ( 0.0000000 0.0000000 0.0519337), wk = 0.0039216 k( 104) = ( 0.0000000 0.0000000 0.0692449), wk = 0.0039216 k( 105) = ( 0.0000000 0.0000000 0.0865562), wk = 0.0039216 k( 106) = ( 0.0000000 0.0000000 0.1038674), wk = 0.0039216 k( 107) = ( 0.0000000 0.0000000 0.1211786), wk = 0.0039216 k( 108) = ( 0.0000000 0.0000000 0.1384899), wk = 0.0039216 k( 109) = ( 0.0000000 0.0000000 0.1558011), wk = 0.0039216 k( 110) = ( 0.0000000 0.0000000 0.1731123), wk = 0.0039216 k( 111) = ( 0.0000000 0.0000000 0.1904236), wk = 0.0039216 k( 112) = ( 0.0000000 0.0000000 0.2077348), wk = 0.0039216 k( 113) = ( 0.0000000 0.0000000 0.2250460), wk = 0.0039216 k( 114) = ( 0.0000000 0.0000000 0.2423573), wk = 0.0039216 k( 115) = ( 0.0000000 0.0000000 0.2596685), wk = 0.0039216 k( 116) = ( 0.0000000 0.0000000 0.2769797), wk = 0.0039216 k( 117) = ( 0.0000000 0.0000000 0.2942910), wk = 0.0039216 k( 118) = ( 0.0000000 0.0000000 0.3116022), wk = 0.0039216 k( 119) = ( 0.0000000 0.0000000 0.3116022), wk = 0.0039216 k( 120) = ( 0.0000000 0.0178571 0.3116022), wk = 0.0039216 k( 121) = ( 0.0000000 0.0357143 0.3116022), wk = 0.0039216 k( 122) = ( 0.0000000 0.0535714 0.3116022), wk = 0.0039216 k( 123) = ( 0.0000000 0.0714286 0.3116022), wk = 0.0039216 k( 124) = ( 0.0000000 0.0892857 0.3116022), wk = 0.0039216 k( 125) = ( 0.0000000 0.1071429 0.3116022), wk = 0.0039216 k( 126) = ( 0.0000000 0.1250000 0.3116022), wk = 0.0039216 k( 127) = ( 0.0000000 0.1428571 0.3116022), wk = 0.0039216 k( 128) = ( 0.0000000 0.1607143 0.3116022), wk = 0.0039216 k( 129) = ( 0.0000000 0.1785714 0.3116022), wk = 0.0039216 k( 130) = ( 0.0000000 0.1964286 0.3116022), wk = 0.0039216 k( 131) = ( 0.0000000 0.2142857 0.3116022), wk = 0.0039216 k( 132) = ( 0.0000000 0.2321429 0.3116022), wk = 0.0039216 k( 133) = ( 0.0000000 0.2500000 0.3116022), wk = 0.0039216 k( 134) = ( 0.0000000 0.2678571 0.3116022), wk = 0.0039216 k( 135) = ( 0.0000000 0.2857143 0.3116022), wk = 0.0039216 k( 136) = ( 0.0000000 0.3035714 0.3116022), wk = 0.0039216 k( 137) = ( 0.0000000 0.3214286 0.3116022), wk = 0.0039216 k( 138) = ( 0.0000000 0.3392857 0.3116022), wk = 0.0039216 k( 139) = ( 0.0000000 0.3571429 0.3116022), wk = 0.0039216 k( 140) = ( 0.0000000 0.3750000 0.3116022), wk = 0.0039216 k( 141) = ( 0.0000000 0.3928571 0.3116022), wk = 0.0039216 k( 142) = ( 0.0000000 0.4107143 0.3116022), wk = 0.0039216 k( 143) = ( 0.0000000 0.4285714 0.3116022), wk = 0.0039216 k( 144) = ( 0.0000000 0.4464286 0.3116022), wk = 0.0039216 k( 145) = ( 0.0000000 0.4642857 0.3116022), wk = 0.0039216 k( 146) = ( 0.0000000 0.4821429 0.3116022), wk = 0.0039216 k( 147) = ( 0.0000000 0.5000000 0.3116022), wk = 0.0039216 k( 148) = ( 0.0000000 0.5000000 0.3116022), wk = 0.0039216 k( 149) = ( 0.0178571 0.5000000 0.3116022), wk = 0.0039216 k( 150) = ( 0.0357143 0.5000000 0.3116022), wk = 0.0039216 k( 151) = ( 0.0535714 0.5000000 0.3116022), wk = 0.0039216 k( 152) = ( 0.0714286 0.5000000 0.3116022), wk = 0.0039216 k( 153) = ( 0.0892857 0.5000000 0.3116022), wk = 0.0039216 k( 154) = ( 0.1071429 0.5000000 0.3116022), wk = 0.0039216 k( 155) = ( 0.1250000 0.5000000 0.3116022), wk = 0.0039216 k( 156) = ( 0.1428571 0.5000000 0.3116022), wk = 0.0039216 k( 157) = ( 0.1607143 0.5000000 0.3116022), wk = 0.0039216 k( 158) = ( 0.1785714 0.5000000 0.3116022), wk = 0.0039216 k( 159) = ( 0.1964286 0.5000000 0.3116022), wk = 0.0039216 k( 160) = ( 0.2142857 0.5000000 0.3116022), wk = 0.0039216 k( 161) = ( 0.2321429 0.5000000 0.3116022), wk = 0.0039216 k( 162) = ( 0.2500000 0.5000000 0.3116022), wk = 0.0039216 k( 163) = ( 0.2678571 0.5000000 0.3116022), wk = 0.0039216 k( 164) = ( 0.2857143 0.5000000 0.3116022), wk = 0.0039216 k( 165) = ( 0.3035714 0.5000000 0.3116022), wk = 0.0039216 k( 166) = ( 0.3214286 0.5000000 0.3116022), wk = 0.0039216 k( 167) = ( 0.3392857 0.5000000 0.3116022), wk = 0.0039216 k( 168) = ( 0.3571429 0.5000000 0.3116022), wk = 0.0039216 k( 169) = ( 0.3750000 0.5000000 0.3116022), wk = 0.0039216 k( 170) = ( 0.3928571 0.5000000 0.3116022), wk = 0.0039216 k( 171) = ( 0.4107143 0.5000000 0.3116022), wk = 0.0039216 k( 172) = ( 0.4285714 0.5000000 0.3116022), wk = 0.0039216 k( 173) = ( 0.4464286 0.5000000 0.3116022), wk = 0.0039216 k( 174) = ( 0.4642857 0.5000000 0.3116022), wk = 0.0039216 k( 175) = ( 0.4821429 0.5000000 0.3116022), wk = 0.0039216 k( 176) = ( 0.5000000 0.5000000 0.3116022), wk = 0.0039216 k( 177) = ( 0.5000000 0.5000000 0.3116022), wk = 0.0039216 k( 178) = ( 0.4875000 0.4875000 0.3116022), wk = 0.0039216 k( 179) = ( 0.4750000 0.4750000 0.3116022), wk = 0.0039216 k( 180) = ( 0.4625000 0.4625000 0.3116022), wk = 0.0039216 k( 181) = ( 0.4500000 0.4500000 0.3116022), wk = 0.0039216 k( 182) = ( 0.4375000 0.4375000 0.3116022), wk = 0.0039216 k( 183) = ( 0.4250000 0.4250000 0.3116022), wk = 0.0039216 k( 184) = ( 0.4125000 0.4125000 0.3116022), wk = 0.0039216 k( 185) = ( 0.4000000 0.4000000 0.3116022), wk = 0.0039216 k( 186) = ( 0.3875000 0.3875000 0.3116022), wk = 0.0039216 k( 187) = ( 0.3750000 0.3750000 0.3116022), wk = 0.0039216 k( 188) = ( 0.3625000 0.3625000 0.3116022), wk = 0.0039216 k( 189) = ( 0.3500000 0.3500000 0.3116022), wk = 0.0039216 k( 190) = ( 0.3375000 0.3375000 0.3116022), wk = 0.0039216 k( 191) = ( 0.3250000 0.3250000 0.3116022), wk = 0.0039216 k( 192) = ( 0.3125000 0.3125000 0.3116022), wk = 0.0039216 k( 193) = ( 0.3000000 0.3000000 0.3116022), wk = 0.0039216 k( 194) = ( 0.2875000 0.2875000 0.3116022), wk = 0.0039216 k( 195) = ( 0.2750000 0.2750000 0.3116022), wk = 0.0039216 k( 196) = ( 0.2625000 0.2625000 0.3116022), wk = 0.0039216 k( 197) = ( 0.2500000 0.2500000 0.3116022), wk = 0.0039216 k( 198) = ( 0.2375000 0.2375000 0.3116022), wk = 0.0039216 k( 199) = ( 0.2250000 0.2250000 0.3116022), wk = 0.0039216 k( 200) = ( 0.2125000 0.2125000 0.3116022), wk = 0.0039216 k( 201) = ( 0.2000000 0.2000000 0.3116022), wk = 0.0039216 k( 202) = ( 0.1875000 0.1875000 0.3116022), wk = 0.0039216 k( 203) = ( 0.1750000 0.1750000 0.3116022), wk = 0.0039216 k( 204) = ( 0.1625000 0.1625000 0.3116022), wk = 0.0039216 k( 205) = ( 0.1500000 0.1500000 0.3116022), wk = 0.0039216 k( 206) = ( 0.1375000 0.1375000 0.3116022), wk = 0.0039216 k( 207) = ( 0.1250000 0.1250000 0.3116022), wk = 0.0039216 k( 208) = ( 0.1125000 0.1125000 0.3116022), wk = 0.0039216 k( 209) = ( 0.1000000 0.1000000 0.3116022), wk = 0.0039216 k( 210) = ( 0.0875000 0.0875000 0.3116022), wk = 0.0039216 k( 211) = ( 0.0750000 0.0750000 0.3116022), wk = 0.0039216 k( 212) = ( 0.0625000 0.0625000 0.3116022), wk = 0.0039216 k( 213) = ( 0.0500000 0.0500000 0.3116022), wk = 0.0039216 k( 214) = ( 0.0375000 0.0375000 0.3116022), wk = 0.0039216 k( 215) = ( 0.0250000 0.0250000 0.3116022), wk = 0.0039216 k( 216) = ( 0.0125000 0.0125000 0.3116022), wk = 0.0039216 k( 217) = ( 0.0000000 0.0000000 0.3116022), wk = 0.0039216 k( 218) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 219) = ( 0.0000000 0.5000000 0.0173112), wk = 0.0039216 k( 220) = ( 0.0000000 0.5000000 0.0346225), wk = 0.0039216 k( 221) = ( 0.0000000 0.5000000 0.0519337), wk = 0.0039216 k( 222) = ( 0.0000000 0.5000000 0.0692449), wk = 0.0039216 k( 223) = ( 0.0000000 0.5000000 0.0865562), wk = 0.0039216 k( 224) = ( 0.0000000 0.5000000 0.1038674), wk = 0.0039216 k( 225) = ( 0.0000000 0.5000000 0.1211786), wk = 0.0039216 k( 226) = ( 0.0000000 0.5000000 0.1384899), wk = 0.0039216 k( 227) = ( 0.0000000 0.5000000 0.1558011), wk = 0.0039216 k( 228) = ( 0.0000000 0.5000000 0.1731123), wk = 0.0039216 k( 229) = ( 0.0000000 0.5000000 0.1904236), wk = 0.0039216 k( 230) = ( 0.0000000 0.5000000 0.2077348), wk = 0.0039216 k( 231) = ( 0.0000000 0.5000000 0.2250460), wk = 0.0039216 k( 232) = ( 0.0000000 0.5000000 0.2423573), wk = 0.0039216 k( 233) = ( 0.0000000 0.5000000 0.2596685), wk = 0.0039216 k( 234) = ( 0.0000000 0.5000000 0.2769797), wk = 0.0039216 k( 235) = ( 0.0000000 0.5000000 0.2942910), wk = 0.0039216 k( 236) = ( 0.0000000 0.5000000 0.3116022), wk = 0.0039216 k( 237) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 238) = ( 0.5000000 0.5000000 0.0173112), wk = 0.0039216 k( 239) = ( 0.5000000 0.5000000 0.0346225), wk = 0.0039216 k( 240) = ( 0.5000000 0.5000000 0.0519337), wk = 0.0039216 k( 241) = ( 0.5000000 0.5000000 0.0692449), wk = 0.0039216 k( 242) = ( 0.5000000 0.5000000 0.0865562), wk = 0.0039216 k( 243) = ( 0.5000000 0.5000000 0.1038674), wk = 0.0039216 k( 244) = ( 0.5000000 0.5000000 0.1211786), wk = 0.0039216 k( 245) = ( 0.5000000 0.5000000 0.1384899), wk = 0.0039216 k( 246) = ( 0.5000000 0.5000000 0.1558011), wk = 0.0039216 k( 247) = ( 0.5000000 0.5000000 0.1731123), wk = 0.0039216 k( 248) = ( 0.5000000 0.5000000 0.1904236), wk = 0.0039216 k( 249) = ( 0.5000000 0.5000000 0.2077348), wk = 0.0039216 k( 250) = ( 0.5000000 0.5000000 0.2250460), wk = 0.0039216 k( 251) = ( 0.5000000 0.5000000 0.2423573), wk = 0.0039216 k( 252) = ( 0.5000000 0.5000000 0.2596685), wk = 0.0039216 k( 253) = ( 0.5000000 0.5000000 0.2769797), wk = 0.0039216 k( 254) = ( 0.5000000 0.5000000 0.2942910), wk = 0.0039216 k( 255) = ( 0.5000000 0.5000000 0.3116022), wk = 0.0039216 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 2) = ( 0.0000000 0.0178571 0.0000000), wk = 0.0039216 k( 3) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0039216 k( 4) = ( 0.0000000 0.0535714 -0.0000000), wk = 0.0039216 k( 5) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0039216 k( 6) = ( 0.0000000 0.0892857 0.0000000), wk = 0.0039216 k( 7) = ( 0.0000000 0.1071429 -0.0000000), wk = 0.0039216 k( 8) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0039216 k( 9) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0039216 k( 10) = ( 0.0000000 0.1607143 0.0000000), wk = 0.0039216 k( 11) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0039216 k( 12) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0039216 k( 13) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0039216 k( 14) = ( 0.0000000 0.2321429 -0.0000000), wk = 0.0039216 k( 15) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0039216 k( 16) = ( 0.0000000 0.2678571 0.0000000), wk = 0.0039216 k( 17) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0039216 k( 18) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0039216 k( 19) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0039216 k( 20) = ( 0.0000000 0.3392857 0.0000000), wk = 0.0039216 k( 21) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0039216 k( 22) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0039216 k( 23) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0039216 k( 24) = ( 0.0000000 0.4107143 0.0000000), wk = 0.0039216 k( 25) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0039216 k( 26) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0039216 k( 27) = ( 0.0000000 0.4642857 -0.0000000), wk = 0.0039216 k( 28) = ( 0.0000000 0.4821429 0.0000000), wk = 0.0039216 k( 29) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 30) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 31) = ( 0.0178571 0.5000000 -0.0000000), wk = 0.0039216 k( 32) = ( 0.0357143 0.5000000 -0.0000000), wk = 0.0039216 k( 33) = ( 0.0535714 0.5000000 -0.0000000), wk = 0.0039216 k( 34) = ( 0.0714286 0.5000000 -0.0000000), wk = 0.0039216 k( 35) = ( 0.0892857 0.5000000 -0.0000000), wk = 0.0039216 k( 36) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0039216 k( 37) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0039216 k( 38) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0039216 k( 39) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0039216 k( 40) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0039216 k( 41) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0039216 k( 42) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0039216 k( 43) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0039216 k( 44) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0039216 k( 45) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0039216 k( 46) = ( 0.2857143 0.5000000 -0.0000000), wk = 0.0039216 k( 47) = ( 0.3035714 0.5000000 -0.0000000), wk = 0.0039216 k( 48) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0039216 k( 49) = ( 0.3392857 0.5000000 -0.0000000), wk = 0.0039216 k( 50) = ( 0.3571429 0.5000000 0.0000000), wk = 0.0039216 k( 51) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0039216 k( 52) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0039216 k( 53) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0039216 k( 54) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0039216 k( 55) = ( 0.4464286 0.5000000 -0.0000000), wk = 0.0039216 k( 56) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0039216 k( 57) = ( 0.4821429 0.5000000 -0.0000000), wk = 0.0039216 k( 58) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 59) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 60) = ( 0.4875000 0.4875000 -0.0000000), wk = 0.0039216 k( 61) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0039216 k( 62) = ( 0.4625000 0.4625000 -0.0000000), wk = 0.0039216 k( 63) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0039216 k( 64) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0039216 k( 65) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0039216 k( 66) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0039216 k( 67) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0039216 k( 68) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0039216 k( 69) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0039216 k( 70) = ( 0.3625000 0.3625000 -0.0000000), wk = 0.0039216 k( 71) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0039216 k( 72) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0039216 k( 73) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0039216 k( 74) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0039216 k( 75) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0039216 k( 76) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0039216 k( 77) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0039216 k( 78) = ( 0.2625000 0.2625000 0.0000000), wk = 0.0039216 k( 79) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0039216 k( 80) = ( 0.2375000 0.2375000 -0.0000000), wk = 0.0039216 k( 81) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0039216 k( 82) = ( 0.2125000 0.2125000 -0.0000000), wk = 0.0039216 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0039216 k( 84) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0039216 k( 85) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0039216 k( 86) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0039216 k( 87) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0039216 k( 88) = ( 0.1375000 0.1375000 -0.0000000), wk = 0.0039216 k( 89) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0039216 k( 90) = ( 0.1125000 0.1125000 -0.0000000), wk = 0.0039216 k( 91) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0039216 k( 92) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0039216 k( 93) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0039216 k( 94) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0039216 k( 95) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0039216 k( 96) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0039216 k( 97) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0039216 k( 98) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0039216 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039216 k( 101) = ( 0.0000000 0.0000000 0.0277778), wk = 0.0039216 k( 102) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0039216 k( 103) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0039216 k( 104) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0039216 k( 105) = ( 0.0000000 0.0000000 0.1388889), wk = 0.0039216 k( 106) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0039216 k( 107) = ( 0.0000000 0.0000000 0.1944444), wk = 0.0039216 k( 108) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0039216 k( 109) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0039216 k( 110) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0039216 k( 111) = ( 0.0000000 0.0000000 0.3055556), wk = 0.0039216 k( 112) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0039216 k( 113) = ( 0.0000000 0.0000000 0.3611111), wk = 0.0039216 k( 114) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0039216 k( 115) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0039216 k( 116) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0039216 k( 117) = ( 0.0000000 0.0000000 0.4722222), wk = 0.0039216 k( 118) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039216 k( 119) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039216 k( 120) = ( 0.0000000 0.0178571 0.5000000), wk = 0.0039216 k( 121) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0039216 k( 122) = ( 0.0000000 0.0535714 0.5000000), wk = 0.0039216 k( 123) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0039216 k( 124) = ( 0.0000000 0.0892857 0.5000000), wk = 0.0039216 k( 125) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0039216 k( 126) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0039216 k( 127) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0039216 k( 128) = ( 0.0000000 0.1607143 0.5000000), wk = 0.0039216 k( 129) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0039216 k( 130) = ( 0.0000000 0.1964286 0.5000000), wk = 0.0039216 k( 131) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0039216 k( 132) = ( 0.0000000 0.2321429 0.5000000), wk = 0.0039216 k( 133) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0039216 k( 134) = ( 0.0000000 0.2678571 0.5000000), wk = 0.0039216 k( 135) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0039216 k( 136) = ( 0.0000000 0.3035714 0.5000000), wk = 0.0039216 k( 137) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0039216 k( 138) = ( 0.0000000 0.3392857 0.5000000), wk = 0.0039216 k( 139) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0039216 k( 140) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0039216 k( 141) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0039216 k( 142) = ( 0.0000000 0.4107143 0.5000000), wk = 0.0039216 k( 143) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0039216 k( 144) = ( 0.0000000 0.4464286 0.5000000), wk = 0.0039216 k( 145) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0039216 k( 146) = ( 0.0000000 0.4821429 0.5000000), wk = 0.0039216 k( 147) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039216 k( 148) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039216 k( 149) = ( 0.0178571 0.5000000 0.5000000), wk = 0.0039216 k( 150) = ( 0.0357143 0.5000000 0.5000000), wk = 0.0039216 k( 151) = ( 0.0535714 0.5000000 0.5000000), wk = 0.0039216 k( 152) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0039216 k( 153) = ( 0.0892857 0.5000000 0.5000000), wk = 0.0039216 k( 154) = ( 0.1071429 0.5000000 0.5000000), wk = 0.0039216 k( 155) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0039216 k( 156) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0039216 k( 157) = ( 0.1607143 0.5000000 0.5000000), wk = 0.0039216 k( 158) = ( 0.1785714 0.5000000 0.5000000), wk = 0.0039216 k( 159) = ( 0.1964286 0.5000000 0.5000000), wk = 0.0039216 k( 160) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0039216 k( 161) = ( 0.2321429 0.5000000 0.5000000), wk = 0.0039216 k( 162) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0039216 k( 163) = ( 0.2678571 0.5000000 0.5000000), wk = 0.0039216 k( 164) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0039216 k( 165) = ( 0.3035714 0.5000000 0.5000000), wk = 0.0039216 k( 166) = ( 0.3214286 0.5000000 0.5000000), wk = 0.0039216 k( 167) = ( 0.3392857 0.5000000 0.5000000), wk = 0.0039216 k( 168) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0039216 k( 169) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0039216 k( 170) = ( 0.3928571 0.5000000 0.5000000), wk = 0.0039216 k( 171) = ( 0.4107143 0.5000000 0.5000000), wk = 0.0039216 k( 172) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0039216 k( 173) = ( 0.4464286 0.5000000 0.5000000), wk = 0.0039216 k( 174) = ( 0.4642857 0.5000000 0.5000000), wk = 0.0039216 k( 175) = ( 0.4821429 0.5000000 0.5000000), wk = 0.0039216 k( 176) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039216 k( 177) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039216 k( 178) = ( 0.4875000 0.4875000 0.5000000), wk = 0.0039216 k( 179) = ( 0.4750000 0.4750000 0.5000000), wk = 0.0039216 k( 180) = ( 0.4625000 0.4625000 0.5000000), wk = 0.0039216 k( 181) = ( 0.4500000 0.4500000 0.5000000), wk = 0.0039216 k( 182) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0039216 k( 183) = ( 0.4250000 0.4250000 0.5000000), wk = 0.0039216 k( 184) = ( 0.4125000 0.4125000 0.5000000), wk = 0.0039216 k( 185) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0039216 k( 186) = ( 0.3875000 0.3875000 0.5000000), wk = 0.0039216 k( 187) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0039216 k( 188) = ( 0.3625000 0.3625000 0.5000000), wk = 0.0039216 k( 189) = ( 0.3500000 0.3500000 0.5000000), wk = 0.0039216 k( 190) = ( 0.3375000 0.3375000 0.5000000), wk = 0.0039216 k( 191) = ( 0.3250000 0.3250000 0.5000000), wk = 0.0039216 k( 192) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0039216 k( 193) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0039216 k( 194) = ( 0.2875000 0.2875000 0.5000000), wk = 0.0039216 k( 195) = ( 0.2750000 0.2750000 0.5000000), wk = 0.0039216 k( 196) = ( 0.2625000 0.2625000 0.5000000), wk = 0.0039216 k( 197) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0039216 k( 198) = ( 0.2375000 0.2375000 0.5000000), wk = 0.0039216 k( 199) = ( 0.2250000 0.2250000 0.5000000), wk = 0.0039216 k( 200) = ( 0.2125000 0.2125000 0.5000000), wk = 0.0039216 k( 201) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0039216 k( 202) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0039216 k( 203) = ( 0.1750000 0.1750000 0.5000000), wk = 0.0039216 k( 204) = ( 0.1625000 0.1625000 0.5000000), wk = 0.0039216 k( 205) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0039216 k( 206) = ( 0.1375000 0.1375000 0.5000000), wk = 0.0039216 k( 207) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0039216 k( 208) = ( 0.1125000 0.1125000 0.5000000), wk = 0.0039216 k( 209) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0039216 k( 210) = ( 0.0875000 0.0875000 0.5000000), wk = 0.0039216 k( 211) = ( 0.0750000 0.0750000 0.5000000), wk = 0.0039216 k( 212) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0039216 k( 213) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0039216 k( 214) = ( 0.0375000 0.0375000 0.5000000), wk = 0.0039216 k( 215) = ( 0.0250000 0.0250000 0.5000000), wk = 0.0039216 k( 216) = ( 0.0125000 0.0125000 0.5000000), wk = 0.0039216 k( 217) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039216 k( 218) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0039216 k( 219) = ( 0.0000000 0.5000000 0.0277778), wk = 0.0039216 k( 220) = ( 0.0000000 0.5000000 0.0555556), wk = 0.0039216 k( 221) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0039216 k( 222) = ( 0.0000000 0.5000000 0.1111111), wk = 0.0039216 k( 223) = ( 0.0000000 0.5000000 0.1388889), wk = 0.0039216 k( 224) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0039216 k( 225) = ( 0.0000000 0.5000000 0.1944444), wk = 0.0039216 k( 226) = ( 0.0000000 0.5000000 0.2222222), wk = 0.0039216 k( 227) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0039216 k( 228) = ( 0.0000000 0.5000000 0.2777778), wk = 0.0039216 k( 229) = ( 0.0000000 0.5000000 0.3055556), wk = 0.0039216 k( 230) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0039216 k( 231) = ( 0.0000000 0.5000000 0.3611111), wk = 0.0039216 k( 232) = ( 0.0000000 0.5000000 0.3888889), wk = 0.0039216 k( 233) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0039216 k( 234) = ( 0.0000000 0.5000000 0.4444444), wk = 0.0039216 k( 235) = ( 0.0000000 0.5000000 0.4722222), wk = 0.0039216 k( 236) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039216 k( 237) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0039216 k( 238) = ( 0.5000000 0.5000000 0.0277778), wk = 0.0039216 k( 239) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0039216 k( 240) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0039216 k( 241) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0039216 k( 242) = ( 0.5000000 0.5000000 0.1388889), wk = 0.0039216 k( 243) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0039216 k( 244) = ( 0.5000000 0.5000000 0.1944444), wk = 0.0039216 k( 245) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0039216 k( 246) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0039216 k( 247) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0039216 k( 248) = ( 0.5000000 0.5000000 0.3055556), wk = 0.0039216 k( 249) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0039216 k( 250) = ( 0.5000000 0.5000000 0.3611111), wk = 0.0039216 k( 251) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0039216 k( 252) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0039216 k( 253) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0039216 k( 254) = ( 0.5000000 0.5000000 0.4722222), wk = 0.0039216 k( 255) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039216 Dense grid: 80537 G-vectors FFT dimensions: ( 45, 45, 75) Smooth grid: 66389 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.28 Mb ( 240, 76) NL pseudopotentials 0.75 Mb ( 120, 408) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 1117) G-vector shells 0.00 Mb ( 570) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.11 Mb ( 240, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.95 Mb ( 408, 2, 76) The potential is recalculated from file : ./AlPS4.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 5.7 secs Computing kpt #: 2 total cpu time spent up to now is 8.2 secs Computing kpt #: 3 total cpu time spent up to now is 10.6 secs Computing kpt #: 4 total cpu time spent up to now is 13.1 secs Computing kpt #: 5 total cpu time spent up to now is 15.6 secs Computing kpt #: 6 total cpu time spent up to now is 18.1 secs Computing kpt #: 7 total cpu time spent up to now is 20.5 secs Computing kpt #: 8 total cpu time spent up to now is 22.9 secs Computing kpt #: 9 total cpu time spent up to now is 25.4 secs Computing kpt #: 10 total cpu time spent up to now is 27.6 secs Computing kpt #: 11 total cpu time spent up to now is 29.6 secs Computing kpt #: 12 total cpu time spent up to now is 31.7 secs Computing kpt #: 13 total cpu time spent up to now is 33.8 secs Computing kpt #: 14 total cpu time spent up to now is 35.9 secs Computing kpt #: 15 total cpu time spent up to now is 38.0 secs Computing kpt #: 16 total cpu time spent up to now is 40.0 secs Computing kpt #: 17 total cpu time spent up to now is 42.0 secs Computing kpt #: 18 total cpu time spent up to now is 44.0 secs Computing kpt #: 19 total cpu time spent up to now is 45.8 secs Computing kpt #: 20 total cpu time spent up to now is 47.7 secs Computing kpt #: 21 total cpu time spent up to now is 49.6 secs Computing kpt #: 22 total cpu time spent up to now is 51.6 secs Computing kpt #: 23 total cpu time spent up to now is 54.1 secs Computing kpt #: 24 total cpu time spent up to now is 56.2 secs Computing kpt #: 25 total cpu time spent up to now is 58.2 secs Computing kpt #: 26 total cpu time spent up to now is 60.3 secs Computing kpt #: 27 total cpu time spent up to now is 62.4 secs Computing kpt #: 28 total cpu time spent up to now is 64.7 secs Computing kpt #: 29 total cpu time spent up to now is 66.7 secs Computing kpt #: 30 total cpu time spent up to now is 68.8 secs Computing kpt #: 31 total cpu time spent up to now is 70.8 secs Computing kpt #: 32 total cpu time spent up to now is 72.8 secs Computing kpt #: 33 total cpu time spent up to now is 74.6 secs Computing kpt #: 34 total cpu time spent up to now is 76.3 secs Computing kpt #: 35 total cpu time spent up to now is 78.1 secs Computing kpt #: 36 total cpu time spent up to now is 79.8 secs Computing kpt #: 37 total cpu time spent up to now is 81.5 secs Computing kpt #: 38 total cpu time spent up to now is 83.2 secs Computing kpt #: 39 total cpu time spent up to now is 84.9 secs Computing kpt #: 40 total cpu time spent up to now is 86.7 secs Computing kpt #: 41 total cpu time spent up to now is 88.4 secs Computing kpt #: 42 total cpu time spent up to now is 90.2 secs Computing kpt #: 43 total cpu time spent up to now is 91.9 secs Computing kpt #: 44 total cpu time spent up to now is 93.7 secs Computing kpt #: 45 total cpu time spent up to now is 95.4 secs Computing kpt #: 46 total cpu time spent up to now is 97.2 secs Computing kpt #: 47 total cpu time spent up to now is 99.0 secs Computing kpt #: 48 total cpu time spent up to now is 100.7 secs Computing kpt #: 49 total cpu time spent up to now is 102.5 secs Computing kpt #: 50 total cpu time spent up to now is 104.3 secs Computing kpt #: 51 total cpu time spent up to now is 106.1 secs Computing kpt #: 52 total cpu time spent up to now is 107.9 secs Computing kpt #: 53 total cpu time spent up to now is 109.7 secs Computing kpt #: 54 total cpu time spent up to now is 111.4 secs Computing kpt #: 55 total cpu time spent up to now is 113.3 secs Computing kpt #: 56 total cpu time spent up to now is 115.3 secs Computing kpt #: 57 total cpu time spent up to now is 117.3 secs Computing kpt #: 58 total cpu time spent up to now is 119.5 secs Computing kpt #: 59 total cpu time spent up to now is 121.9 secs Computing kpt #: 60 total cpu time spent up to now is 124.0 secs Computing kpt #: 61 total cpu time spent up to now is 125.9 secs Computing kpt #: 62 total cpu time spent up to now is 128.1 secs Computing kpt #: 63 total cpu time spent up to now is 130.3 secs Computing kpt #: 64 total cpu time spent up to now is 132.6 secs Computing kpt #: 65 total cpu time spent up to now is 135.2 secs Computing kpt #: 66 total cpu time spent up to now is 137.7 secs Computing kpt #: 67 total cpu time spent up to now is 141.0 secs Computing kpt #: 68 total cpu time spent up to now is 143.2 secs Computing kpt #: 69 total cpu time spent up to now is 145.2 secs Computing kpt #: 70 total cpu time spent up to now is 147.1 secs Computing kpt #: 71 total cpu time spent up to now is 149.0 secs Computing kpt #: 72 total cpu time spent up to now is 150.7 secs Computing kpt #: 73 total cpu time spent up to now is 152.4 secs Computing kpt #: 74 total cpu time spent up to now is 154.1 secs Computing kpt #: 75 total cpu time spent up to now is 155.7 secs Computing kpt #: 76 total cpu time spent up to now is 157.2 secs Computing kpt #: 77 total cpu time spent up to now is 158.6 secs Computing kpt #: 78 total cpu time spent up to now is 160.1 secs Computing kpt #: 79 total cpu time spent up to now is 161.6 secs Computing kpt #: 80 total cpu time spent up to now is 163.3 secs Computing kpt #: 81 total cpu time spent up to now is 164.9 secs Computing kpt #: 82 total cpu time spent up to now is 166.6 secs Computing kpt #: 83 total cpu time spent up to now is 168.3 secs Computing kpt #: 84 total cpu time spent up to now is 170.0 secs Computing kpt #: 85 total cpu time spent up to now is 171.7 secs Computing kpt #: 86 total cpu time spent up to now is 173.5 secs Computing kpt #: 87 total cpu time spent up to now is 175.2 secs Computing kpt #: 88 total cpu time spent up to now is 177.0 secs Computing kpt #: 89 total cpu time spent up to now is 178.9 secs Computing kpt #: 90 total cpu time spent up to now is 181.0 secs Computing kpt #: 91 total cpu time spent up to now is 182.8 secs Computing kpt #: 92 total cpu time spent up to now is 184.7 secs Computing kpt #: 93 total cpu time spent up to now is 187.1 secs Computing kpt #: 94 total cpu time spent up to now is 189.9 secs Computing kpt #: 95 total cpu time spent up to now is 192.6 secs Computing kpt #: 96 total cpu time spent up to now is 195.0 secs Computing kpt #: 97 total cpu time spent up to now is 197.5 secs Computing kpt #: 98 total cpu time spent up to now is 199.9 secs Computing kpt #: 99 total cpu time spent up to now is 202.3 secs Computing kpt #: 100 total cpu time spent up to now is 204.7 secs Computing kpt #: 101 total cpu time spent up to now is 206.9 secs Computing kpt #: 102 total cpu time spent up to now is 209.4 secs Computing kpt #: 103 total cpu time spent up to now is 211.8 secs Computing kpt #: 104 total cpu time spent up to now is 214.3 secs Computing kpt #: 105 total cpu time spent up to now is 216.7 secs Computing kpt #: 106 total cpu time spent up to now is 219.1 secs Computing kpt #: 107 total cpu time spent up to now is 221.7 secs Computing kpt #: 108 total cpu time spent up to now is 224.2 secs Computing kpt #: 109 total cpu time spent up to now is 226.8 secs Computing kpt #: 110 total cpu time spent up to now is 229.2 secs Computing kpt #: 111 total cpu time spent up to now is 231.2 secs Computing kpt #: 112 total cpu time spent up to now is 233.0 secs Computing kpt #: 113 total cpu time spent up to now is 234.8 secs Computing kpt #: 114 total cpu time spent up to now is 236.6 secs Computing kpt #: 115 total cpu time spent up to now is 238.4 secs Computing kpt #: 116 total cpu time spent up to now is 240.5 secs Computing kpt #: 117 total cpu time spent up to now is 242.2 secs Computing kpt #: 118 total cpu time spent up to now is 244.4 secs Computing kpt #: 119 total cpu time spent up to now is 246.2 secs Computing kpt #: 120 total cpu time spent up to now is 248.3 secs Computing kpt #: 121 total cpu time spent up to now is 250.0 secs Computing kpt #: 122 total cpu time spent up to now is 251.8 secs Computing kpt #: 123 total cpu time spent up to now is 253.6 secs Computing kpt #: 124 total cpu time spent up to now is 255.4 secs Computing kpt #: 125 total cpu time spent up to now is 257.1 secs Computing kpt #: 126 total cpu time spent up to now is 258.9 secs Computing kpt #: 127 total cpu time spent up to now is 260.6 secs Computing kpt #: 128 total cpu time spent up to now is 262.3 secs Computing kpt #: 129 total cpu time spent up to now is 264.0 secs Computing kpt #: 130 total cpu time spent up to now is 265.8 secs Computing kpt #: 131 total cpu time spent up to now is 267.5 secs Computing kpt #: 132 total cpu time spent up to now is 269.4 secs Computing kpt #: 133 total cpu time spent up to now is 271.3 secs Computing kpt #: 134 total cpu time spent up to now is 273.3 secs Computing kpt #: 135 total cpu time spent up to now is 275.4 secs Computing kpt #: 136 total cpu time spent up to now is 277.4 secs Computing kpt #: 137 total cpu time spent up to now is 279.4 secs Computing kpt #: 138 total cpu time spent up to now is 281.5 secs Computing kpt #: 139 total cpu time spent up to now is 283.4 secs Computing kpt #: 140 total cpu time spent up to now is 285.4 secs Computing kpt #: 141 total cpu time spent up to now is 287.5 secs Computing kpt #: 142 total cpu time spent up to now is 289.5 secs Computing kpt #: 143 total cpu time spent up to now is 291.7 secs Computing kpt #: 144 total cpu time spent up to now is 294.0 secs Computing kpt #: 145 total cpu time spent up to now is 296.1 secs Computing kpt #: 146 total cpu time spent up to now is 298.3 secs Computing kpt #: 147 total cpu time spent up to now is 300.2 secs Computing kpt #: 148 total cpu time spent up to now is 302.2 secs Computing kpt #: 149 total cpu time spent up to now is 304.2 secs Computing kpt #: 150 total cpu time spent up to now is 306.2 secs Computing kpt #: 151 total cpu time spent up to now is 308.2 secs Computing kpt #: 152 total cpu time spent up to now is 310.2 secs Computing kpt #: 153 total cpu time spent up to now is 312.0 secs Computing kpt #: 154 total cpu time spent up to now is 313.8 secs Computing kpt #: 155 total cpu time spent up to now is 315.5 secs Computing kpt #: 156 total cpu time spent up to now is 317.2 secs Computing kpt #: 157 total cpu time spent up to now is 318.9 secs Computing kpt #: 158 total cpu time spent up to now is 320.6 secs Computing kpt #: 159 total cpu time spent up to now is 322.3 secs Computing kpt #: 160 total cpu time spent up to now is 323.9 secs Computing kpt #: 161 total cpu time spent up to now is 325.6 secs Computing kpt #: 162 total cpu time spent up to now is 327.3 secs Computing kpt #: 163 total cpu time spent up to now is 329.0 secs Computing kpt #: 164 total cpu time spent up to now is 330.9 secs Computing kpt #: 165 total cpu time spent up to now is 332.5 secs Computing kpt #: 166 total cpu time spent up to now is 334.4 secs Computing kpt #: 167 total cpu time spent up to now is 336.4 secs Computing kpt #: 168 total cpu time spent up to now is 338.4 secs Computing kpt #: 169 total cpu time spent up to now is 340.6 secs Computing kpt #: 170 total cpu time spent up to now is 342.9 secs Computing kpt #: 171 total cpu time spent up to now is 345.3 secs Computing kpt #: 172 total cpu time spent up to now is 347.7 secs Computing kpt #: 173 total cpu time spent up to now is 350.3 secs Computing kpt #: 174 total cpu time spent up to now is 353.9 secs Computing kpt #: 175 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 358.2 secs Computing kpt #: 176 total cpu time spent up to now is 361.9 secs Computing kpt #: 177 total cpu time spent up to now is 365.6 secs Computing kpt #: 178 total cpu time spent up to now is 368.1 secs Computing kpt #: 179 total cpu time spent up to now is 370.0 secs Computing kpt #: 180 total cpu time spent up to now is 371.9 secs Computing kpt #: 181 total cpu time spent up to now is 373.5 secs Computing kpt #: 182 total cpu time spent up to now is 375.3 secs Computing kpt #: 183 total cpu time spent up to now is 377.1 secs Computing kpt #: 184 total cpu time spent up to now is 378.8 secs Computing kpt #: 185 total cpu time spent up to now is 380.5 secs Computing kpt #: 186 total cpu time spent up to now is 382.1 secs Computing kpt #: 187 total cpu time spent up to now is 383.8 secs Computing kpt #: 188 total cpu time spent up to now is 385.4 secs Computing kpt #: 189 total cpu time spent up to now is 387.0 secs Computing kpt #: 190 total cpu time spent up to now is 388.6 secs Computing kpt #: 191 total cpu time spent up to now is 390.2 secs Computing kpt #: 192 total cpu time spent up to now is 391.8 secs Computing kpt #: 193 total cpu time spent up to now is 393.4 secs Computing kpt #: 194 total cpu time spent up to now is 395.1 secs Computing kpt #: 195 total cpu time spent up to now is 396.6 secs Computing kpt #: 196 total cpu time spent up to now is 398.3 secs Computing kpt #: 197 total cpu time spent up to now is 399.9 secs Computing kpt #: 198 total cpu time spent up to now is 401.5 secs Computing kpt #: 199 total cpu time spent up to now is 403.1 secs Computing kpt #: 200 total cpu time spent up to now is 404.7 secs Computing kpt #: 201 total cpu time spent up to now is 406.4 secs Computing kpt #: 202 total cpu time spent up to now is 408.0 secs Computing kpt #: 203 total cpu time spent up to now is 409.7 secs Computing kpt #: 204 total cpu time spent up to now is 447.7 secs Computing kpt #: 205 total cpu time spent up to now is 449.4 secs Computing kpt #: 206 total cpu time spent up to now is 451.1 secs Computing kpt #: 207 total cpu time spent up to now is 452.8 secs Computing kpt #: 208 total cpu time spent up to now is 454.5 secs Computing kpt #: 209 total cpu time spent up to now is 456.3 secs Computing kpt #: 210 total cpu time spent up to now is 458.0 secs Computing kpt #: 211 total cpu time spent up to now is 459.8 secs Computing kpt #: 212 total cpu time spent up to now is 461.5 secs Computing kpt #: 213 total cpu time spent up to now is 463.3 secs Computing kpt #: 214 total cpu time spent up to now is 465.1 secs Computing kpt #: 215 total cpu time spent up to now is 467.2 secs Computing kpt #: 216 total cpu time spent up to now is 468.9 secs Computing kpt #: 217 total cpu time spent up to now is 471.1 secs Computing kpt #: 218 total cpu time spent up to now is 473.1 secs Computing kpt #: 219 total cpu time spent up to now is 475.4 secs Computing kpt #: 220 total cpu time spent up to now is 477.6 secs Computing kpt #: 221 total cpu time spent up to now is 480.1 secs Computing kpt #: 222 total cpu time spent up to now is 482.4 secs Computing kpt #: 223 total cpu time spent up to now is 484.4 secs Computing kpt #: 224 total cpu time spent up to now is 486.9 secs Computing kpt #: 225 total cpu time spent up to now is 489.3 secs Computing kpt #: 226 total cpu time spent up to now is 491.5 secs Computing kpt #: 227 total cpu time spent up to now is 493.5 secs Computing kpt #: 228 total cpu time spent up to now is 495.7 secs Computing kpt #: 229 total cpu time spent up to now is 497.8 secs Computing kpt #: 230 total cpu time spent up to now is 500.0 secs Computing kpt #: 231 total cpu time spent up to now is 502.2 secs Computing kpt #: 232 total cpu time spent up to now is 504.4 secs Computing kpt #: 233 total cpu time spent up to now is 506.4 secs Computing kpt #: 234 total cpu time spent up to now is 508.3 secs Computing kpt #: 235 total cpu time spent up to now is 510.4 secs Computing kpt #: 236 total cpu time spent up to now is 512.4 secs Computing kpt #: 237 total cpu time spent up to now is 514.5 secs Computing kpt #: 238 total cpu time spent up to now is 516.7 secs Computing kpt #: 239 total cpu time spent up to now is 519.0 secs Computing kpt #: 240 total cpu time spent up to now is 521.3 secs Computing kpt #: 241 total cpu time spent up to now is 523.6 secs Computing kpt #: 242 total cpu time spent up to now is 526.0 secs Computing kpt #: 243 total cpu time spent up to now is 528.4 secs Computing kpt #: 244 total cpu time spent up to now is 530.9 secs Computing kpt #: 245 total cpu time spent up to now is 533.1 secs Computing kpt #: 246 total cpu time spent up to now is 535.6 secs Computing kpt #: 247 total cpu time spent up to now is 538.1 secs Computing kpt #: 248 total cpu time spent up to now is 541.2 secs Computing kpt #: 249 total cpu time spent up to now is 544.1 secs Computing kpt #: 250 total cpu time spent up to now is 547.4 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 551.7 secs Computing kpt #: 252 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 556.1 secs Computing kpt #: 253 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 560.5 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 564.8 secs Computing kpt #: 255 total cpu time spent up to now is 567.7 secs ethr = 1.56E-08, avg # of iterations = 37.6 total cpu time spent up to now is 567.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8295 PWs) bands (ev): -13.8273 -13.8273 -13.7856 -13.7856 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6663 -6.6663 -6.6255 -6.6255 -6.5740 -6.5740 -6.4751 -6.4751 -3.6928 -3.6928 -3.3431 -3.3431 -2.2200 -2.2200 -2.1822 -2.1822 -1.9063 -1.9063 -1.8956 -1.8956 -1.7677 -1.7677 -1.7537 -1.7537 -0.0443 -0.0443 -0.0388 -0.0388 0.7346 0.7346 0.7357 0.7357 1.1861 1.1861 1.8080 1.8080 2.2957 2.2957 2.2985 2.2985 2.5078 2.5078 2.8679 2.8679 4.2212 4.2212 4.3826 4.3826 5.4128 5.4128 5.4177 5.4177 5.4477 5.4477 5.4478 5.4478 6.2139 6.2139 6.2717 6.2717 6.7162 6.7162 6.7303 6.7303 k = 0.0000 0.0179-0.0000 ( 8287 PWs) bands (ev): -13.8268 -13.8268 -13.7851 -13.7851 -11.1277 -11.1276 -11.1250 -11.1249 -8.9685 -8.9684 -8.9664 -8.9664 -6.6683 -6.6682 -6.6275 -6.6274 -6.5718 -6.5717 -6.4728 -6.4727 -3.6915 -3.6914 -3.3421 -3.3420 -2.2198 -2.2194 -2.1808 -2.1805 -1.9050 -1.9047 -1.8934 -1.8933 -1.7677 -1.7677 -1.7531 -1.7529 -0.0456 -0.0456 -0.0390 -0.0384 0.7333 0.7338 0.7360 0.7366 1.1876 1.1878 1.8095 1.8097 2.2853 2.2857 2.2973 2.2973 2.5063 2.5064 2.8661 2.8665 4.2221 4.2225 4.3840 4.3846 5.3805 5.4006 5.4133 5.4147 5.4406 5.4414 5.4557 5.4746 6.2166 6.2167 6.2723 6.2723 6.7179 6.7181 6.7316 6.7324 k = 0.0000 0.0357-0.0000 ( 8285 PWs) bands (ev): -13.8253 -13.8253 -13.7837 -13.7837 -11.1358 -11.1356 -11.1245 -11.1245 -8.9713 -8.9713 -8.9635 -8.9634 -6.6743 -6.6742 -6.6330 -6.6328 -6.5656 -6.5654 -6.4655 -6.4652 -3.6874 -3.6873 -3.3390 -3.3387 -2.2189 -2.2181 -2.1763 -2.1756 -1.9036 -1.9028 -1.8840 -1.8839 -1.7703 -1.7703 -1.7484 -1.7480 -0.0529 -0.0529 -0.0357 -0.0347 0.7290 0.7299 0.7385 0.7398 1.1923 1.1926 1.8140 1.8144 2.2512 2.2520 2.2975 2.2975 2.5020 2.5022 2.8611 2.8619 4.2250 4.2258 4.3889 4.3902 5.3341 5.3559 5.4023 5.4051 5.4252 5.4274 5.4804 5.4990 6.2248 6.2251 6.2739 6.2740 6.7233 6.7237 6.7366 6.7381 k = 0.0000 0.0536-0.0000 ( 8289 PWs) bands (ev): -13.8231 -13.8231 -13.7813 -13.7813 -11.1490 -11.1487 -11.1237 -11.1237 -8.9760 -8.9760 -8.9587 -8.9585 -6.6851 -6.6848 -6.6413 -6.6410 -6.5566 -6.5564 -6.4519 -6.4514 -3.6805 -3.6804 -3.3338 -3.3334 -2.2178 -2.2167 -2.1686 -2.1674 -1.9035 -1.9022 -1.8667 -1.8665 -1.7777 -1.7777 -1.7368 -1.7362 -0.0662 -0.0661 -0.0287 -0.0272 0.7218 0.7231 0.7430 0.7450 1.2000 1.2004 1.8214 1.8219 2.1955 2.1967 2.2981 2.2981 2.4950 2.4951 2.8530 2.8541 4.2295 4.2306 4.3978 4.3996 5.2775 5.2999 5.3693 5.3717 5.4180 5.4196 5.5024 5.5199 6.2381 6.2386 6.2761 6.2762 6.7323 6.7324 6.7457 6.7479 k = 0.0000 0.0714-0.0000 ( 8287 PWs) bands (ev): -13.8201 -13.8201 -13.7777 -13.7776 -11.1672 -11.1668 -11.1226 -11.1225 -8.9825 -8.9824 -8.9519 -8.9517 -6.7013 -6.7008 -6.6513 -6.6511 -6.5467 -6.5465 -6.4307 -6.4300 -3.6710 -3.6709 -3.3266 -3.3260 -2.2167 -2.2154 -2.1576 -2.1558 -1.9037 -1.9019 -1.8434 -1.8430 -1.7889 -1.7888 -1.7181 -1.7173 -0.0845 -0.0844 -0.0186 -0.0167 0.7120 0.7138 0.7494 0.7521 1.2103 1.2108 1.8314 1.8322 2.1199 2.1216 2.2989 2.2989 2.4851 2.4853 2.8421 2.8434 4.2349 4.2362 4.4111 4.4135 5.2104 5.2329 5.3178 5.3197 5.4143 5.4154 5.5220 5.5383 6.2560 6.2567 6.2781 6.2784 6.7408 6.7430 6.7593 6.7624 k = 0.0000 0.0893-0.0000 ( 8291 PWs) bands (ev): -13.8168 -13.8167 -13.7728 -13.7727 -11.1901 -11.1896 -11.1212 -11.1211 -8.9906 -8.9906 -8.9432 -8.9430 -6.7231 -6.7226 -6.6625 -6.6622 -6.5372 -6.5369 -6.4010 -6.4000 -3.6589 -3.6587 -3.3173 -3.3165 -2.2162 -2.2149 -2.1435 -2.1410 -1.9032 -1.9010 -1.8163 -1.8158 -1.8030 -1.8028 -1.6913 -1.6904 -0.1075 -0.1073 -0.0054 -0.0031 0.6997 0.7020 0.7579 0.7613 1.2231 1.2236 1.8435 1.8448 2.0264 2.0289 2.2999 2.3000 2.4726 2.4727 2.8284 2.8300 4.2402 4.2418 4.4295 4.4325 5.1324 5.1550 5.2521 5.2538 5.4106 5.4115 5.5403 5.5552 6.2775 6.2775 6.2804 6.2808 6.7191 6.7240 6.7658 6.7691 k = 0.0000 0.1071-0.0000 ( 8289 PWs) bands (ev): -13.8131 -13.8131 -13.7663 -13.7662 -11.2173 -11.2168 -11.1195 -11.1195 -9.0003 -9.0002 -8.9326 -8.9323 -6.7504 -6.7497 -6.6746 -6.6743 -6.5285 -6.5283 -6.3626 -6.3614 -3.6443 -3.6441 -3.3061 -3.3050 -2.2168 -2.2155 -2.1266 -2.1235 -1.9014 -1.8988 -1.8192 -1.8191 -1.7876 -1.7871 -1.6551 -1.6539 -0.1347 -0.1344 0.0107 0.0134 0.6852 0.6879 0.7684 0.7725 1.2378 1.2381 1.8553 1.8584 1.9182 1.9229 2.3011 2.3012 2.4575 2.4575 2.8124 2.8141 4.2447 4.2464 4.4535 4.4570 5.0437 5.0663 5.1743 5.1757 5.4065 5.4072 5.5579 5.5715 6.2792 6.2802 6.3039 6.3053 6.6617 6.6649 6.7811 6.7831 k = 0.0000 0.1250-0.0000 ( 8295 PWs) bands (ev): -13.8095 -13.8095 -13.7582 -13.7581 -11.2484 -11.2478 -11.1176 -11.1175 -9.0114 -9.0113 -8.9202 -8.9199 -6.7826 -6.7818 -6.6875 -6.6872 -6.5207 -6.5205 -6.3163 -6.3149 -3.6274 -3.6273 -3.2929 -3.2916 -2.2191 -2.2178 -2.1076 -2.1039 -1.8974 -1.8946 -1.8367 -1.8367 -1.7592 -1.7586 -1.6086 -1.6071 -0.1655 -0.1652 0.0297 0.0328 0.6685 0.6717 0.7808 0.7858 1.2540 1.2541 1.7921 1.7928 1.8781 1.8798 2.3025 2.3026 2.4397 2.4399 2.7942 2.7959 4.2480 4.2498 4.4833 4.4871 4.9446 4.9673 5.0862 5.0871 5.4018 5.4024 5.5752 5.5876 6.2782 6.2796 6.3328 6.3346 6.5925 6.5953 6.8000 6.8014 k = 0.0000 0.1429-0.0000 ( 8301 PWs) bands (ev): -13.8059 -13.8059 -13.7485 -13.7483 -11.2830 -11.2824 -11.1154 -11.1153 -9.0238 -9.0237 -8.9060 -8.9056 -6.8191 -6.8182 -6.7013 -6.7010 -6.5134 -6.5132 -6.2629 -6.2613 -3.6084 -3.6083 -3.2777 -3.2760 -2.2236 -2.2225 -2.0873 -2.0830 -1.8906 -1.8881 -1.8544 -1.8539 -1.7315 -1.7308 -1.5521 -1.5504 -0.1996 -0.1993 0.0516 0.0551 0.6499 0.6536 0.7954 0.8012 1.2704 1.2716 1.6587 1.6622 1.8952 1.8954 2.3041 2.3042 2.4196 2.4200 2.7743 2.7759 4.2497 4.2515 4.5186 4.5225 4.8359 4.8586 4.9895 4.9897 5.3966 5.3971 5.5928 5.6041 6.2764 6.2783 6.3647 6.3669 6.5153 6.5179 6.8018 6.8035 k = 0.0000 0.1607-0.0000 ( 8297 PWs) bands (ev): -13.8024 -13.8024 -13.7371 -13.7369 -11.3206 -11.3199 -11.1130 -11.1129 -9.0372 -9.0370 -8.8900 -8.8895 -6.8593 -6.8583 -6.7160 -6.7156 -6.5065 -6.5062 -6.2035 -6.2017 -3.5876 -3.5876 -3.2604 -3.2583 -2.2311 -2.2302 -2.0667 -2.0619 -1.8857 -1.8857 -1.8653 -1.8622 -1.7044 -1.7036 -1.4867 -1.4847 -0.2364 -0.2361 0.0763 0.0802 0.6296 0.6337 0.8121 0.8187 1.2850 1.2895 1.5160 1.5233 1.9136 1.9138 2.3056 2.3058 2.3973 2.3979 2.7529 2.7543 4.2497 4.2515 4.5589 4.5624 4.7184 4.7412 4.8855 4.8866 5.3909 5.3914 5.6108 5.6211 6.2745 6.2769 6.3982 6.4010 6.4327 6.4351 6.7844 6.7854 k = 0.0000 0.1786-0.0000 ( 8299 PWs) bands (ev): -13.7991 -13.7991 -13.7242 -13.7240 -11.3607 -11.3600 -11.1104 -11.1104 -9.0514 -9.0513 -8.8722 -8.8717 -6.9027 -6.9017 -6.7314 -6.7310 -6.4997 -6.4995 -6.1388 -6.1369 -3.5656 -3.5654 -3.2409 -3.2382 -2.2418 -2.2414 -2.0468 -2.0418 -1.8986 -1.8978 -1.8523 -1.8485 -1.6776 -1.6767 -1.4138 -1.4115 -0.2755 -0.2752 0.1037 0.1081 0.6075 0.6120 0.8310 0.8385 1.2835 1.3022 1.3717 1.3936 1.9326 1.9330 2.3071 2.3074 2.3732 2.3741 2.7303 2.7315 4.2481 4.2497 4.5930 4.6012 4.6035 4.6169 4.7775 4.7817 5.3847 5.3852 5.6294 5.6388 6.2730 6.2760 6.3413 6.3440 6.4379 6.4410 6.7647 6.7653 k = 0.0000 0.1964-0.0000 ( 8307 PWs) bands (ev): -13.7958 -13.7958 -13.7099 -13.7096 -11.4029 -11.4021 -11.1077 -11.1077 -9.0664 -9.0662 -8.8529 -8.8523 -6.9487 -6.9476 -6.7474 -6.7470 -6.4930 -6.4928 -6.0699 -6.0678 -3.5427 -3.5424 -3.2188 -3.2155 -2.2562 -2.2561 -2.0289 -2.0237 -1.9140 -1.9135 -1.8271 -1.8240 -1.6509 -1.6499 -1.3344 -1.3318 -0.3165 -0.3162 0.1337 0.1384 0.5836 0.5884 0.8523 0.8606 1.1875 1.2011 1.3362 1.3533 1.9518 1.9524 2.3079 2.3084 2.3481 2.3491 2.7069 2.7077 4.2449 4.2462 4.4606 4.4833 4.6160 4.6262 4.6896 4.7060 5.3782 5.3786 5.6487 5.6573 6.2477 6.2498 6.2747 6.2777 6.4771 6.4808 6.7433 6.7437 k = 0.0000 0.2143-0.0000 ( 8309 PWs) bands (ev): -13.7927 -13.7927 -13.6944 -13.6941 -11.4465 -11.4458 -11.1049 -11.1048 -9.0818 -9.0816 -8.8319 -8.8313 -6.9968 -6.9957 -6.7638 -6.7634 -6.4864 -6.4862 -5.9974 -5.9952 -3.5196 -3.5191 -3.1938 -3.1898 -2.2745 -2.2737 -2.0144 -2.0093 -1.9265 -1.9262 -1.7945 -1.7922 -1.6244 -1.6233 -1.2498 -1.2467 -0.3589 -0.3586 0.1661 0.1712 0.5574 0.5625 0.8759 0.8852 1.0366 1.0437 1.3542 1.3648 1.9708 1.9715 2.3039 2.3052 2.3262 2.3268 2.6829 2.6833 4.2398 4.2406 4.3222 4.3451 4.5285 4.5338 4.7191 4.7318 5.3712 5.3716 5.6688 5.6765 6.1523 6.1549 6.2764 6.2803 6.5186 6.5228 6.7203 6.7206 k = 0.0000 0.2321-0.0000 ( 8289 PWs) bands (ev): -13.7896 -13.7896 -13.6778 -13.6775 -11.4912 -11.4905 -11.1020 -11.1019 -9.0975 -9.0973 -8.8095 -8.8089 -7.0466 -7.0454 -6.7804 -6.7801 -6.4800 -6.4797 -5.9224 -5.9201 -3.4970 -3.4963 -3.1654 -3.1606 -2.2958 -2.2941 -2.0063 -2.0015 -1.9321 -1.9319 -1.7559 -1.7545 -1.5981 -1.5970 -1.1608 -1.1573 -0.4023 -0.4021 0.2007 0.2061 0.5274 0.5327 0.8781 0.8823 0.9032 0.9144 1.3740 1.3826 1.9893 1.9900 2.2833 2.2858 2.3197 2.3197 2.6585 2.6586 4.1786 4.2017 4.2316 4.2322 4.4177 4.4195 4.7736 4.7846 5.3640 5.3644 5.6895 5.6966 6.0551 6.0576 6.2820 6.2865 6.5617 6.5663 6.6960 6.6964 k = 0.0000 0.2500-0.0000 ( 8295 PWs) bands (ev): -13.7866 -13.7866 -13.6604 -13.6601 -11.5364 -11.5357 -11.0990 -11.0989 -9.1132 -9.1131 -8.7858 -8.7851 -7.0975 -7.0963 -6.7971 -6.7967 -6.4736 -6.4734 -5.8456 -5.8431 -3.4756 -3.4748 -3.1333 -3.1275 -2.3192 -2.3165 -2.0070 -2.0029 -1.9277 -1.9272 -1.7124 -1.7118 -1.5723 -1.5711 -1.0685 -1.0646 -0.4464 -0.4462 0.2372 0.2428 0.4884 0.4935 0.7262 0.7305 0.9316 0.9434 1.3941 1.4018 2.0070 2.0077 2.2546 2.2576 2.3204 2.3205 2.6337 2.6342 4.0309 4.0543 4.2120 4.2164 4.3103 4.3134 4.8321 4.8425 5.3564 5.3567 5.7109 5.7174 5.9574 5.9600 6.2916 6.2966 6.6059 6.6108 6.6706 6.6713 k = 0.0000 0.2679-0.0000 ( 8303 PWs) bands (ev): -13.7837 -13.7837 -13.6423 -13.6420 -11.5816 -11.5809 -11.0960 -11.0960 -9.1289 -9.1287 -8.7609 -8.7602 -7.1491 -7.1479 -6.8136 -6.8133 -6.4674 -6.4672 -5.7679 -5.7654 -3.4562 -3.4551 -3.0972 -3.0902 -2.3436 -2.3398 -2.0145 -2.0111 -1.9149 -1.9140 -1.6652 -1.6651 -1.5471 -1.5459 -0.9740 -0.9696 -0.4907 -0.4906 0.2752 0.2810 0.4215 0.4255 0.5995 0.6046 0.9638 0.9767 1.4141 1.4211 2.0237 2.0243 2.2241 2.2276 2.3224 2.3225 2.6089 2.6100 3.8799 3.9035 4.1483 4.1562 4.2456 4.2526 4.8921 4.9023 5.3484 5.3488 5.7330 5.7388 5.8607 5.8635 6.3060 6.3114 6.6414 6.6438 6.6512 6.6598 k = 0.0000 0.2857-0.0000 ( 8304 PWs) bands (ev): -13.7809 -13.7809 -13.6238 -13.6235 -11.6264 -11.6257 -11.0931 -11.0930 -9.1442 -9.1440 -8.7349 -8.7342 -7.2009 -7.1997 -6.8298 -6.8294 -6.4615 -6.4613 -5.6902 -5.6876 -3.4392 -3.4381 -3.0570 -3.0488 -2.3679 -2.3628 -2.0250 -2.0221 -1.8973 -1.8961 -1.6160 -1.6152 -1.5229 -1.5216 -0.8783 -0.8735 -0.5348 -0.5348 0.3005 0.3035 0.3154 0.3211 0.5253 0.5315 0.9996 1.0136 1.4336 1.4403 2.0391 2.0397 2.1931 2.1970 2.3247 2.3249 2.5845 2.5861 3.7264 3.7504 4.0451 4.0509 4.2276 4.2328 4.9525 4.9625 5.3399 5.3403 5.7539 5.7572 5.7680 5.7727 6.3259 6.3317 6.6166 6.6171 6.6960 6.7032 k = 0.0000 0.3036-0.0000 ( 8308 PWs) bands (ev): -13.7782 -13.7782 -13.6051 -13.6047 -11.6702 -11.6694 -11.0902 -11.0901 -9.1590 -9.1588 -8.7081 -8.7074 -7.2523 -7.2511 -6.8454 -6.8451 -6.4558 -6.4556 -5.6134 -5.6109 -3.4251 -3.4239 -3.0133 -3.0037 -2.3906 -2.3839 -2.0363 -2.0338 -1.8770 -1.8757 -1.5650 -1.5637 -1.4997 -1.4984 -0.7828 -0.7775 -0.5782 -0.5781 0.1494 0.1517 0.3542 0.3603 0.4839 0.4905 1.0392 1.0545 1.4526 1.4589 2.0531 2.0537 2.1620 2.1664 2.3273 2.3275 2.5606 2.5626 3.5713 3.5956 3.9368 3.9412 4.2170 4.2212 5.0119 5.0217 5.3306 5.3311 5.6749 5.6771 5.7793 5.7846 6.3520 6.3581 6.5894 6.5894 6.7406 6.7482 k = 0.0000 0.3214-0.0000 ( 8318 PWs) bands (ev): -13.7756 -13.7756 -13.5863 -13.5860 -11.7125 -11.7118 -11.0874 -11.0873 -9.1731 -9.1730 -8.6808 -8.6801 -7.3030 -7.3018 -6.8603 -6.8600 -6.4504 -6.4502 -5.5386 -5.5360 -3.4140 -3.4128 -2.9669 -2.9558 -2.4099 -2.4014 -2.0474 -2.0452 -1.8551 -1.8537 -1.5133 -1.5116 -1.4780 -1.4765 -0.6905 -0.6852 -0.6187 -0.6180 -0.0113 -0.0092 0.3937 0.4000 0.4538 0.4603 1.0832 1.0997 1.4709 1.4768 2.0657 2.0663 2.1315 2.1363 2.3300 2.3302 2.5373 2.5397 3.4154 3.4400 3.8310 3.8346 4.2078 4.2114 5.0693 5.0787 5.3199 5.3204 5.5896 5.5917 5.8027 5.8075 6.3847 6.3913 6.5615 6.5619 6.7842 6.7924 k = 0.0000 0.3393-0.0000 ( 8330 PWs) bands (ev): -13.7732 -13.7732 -13.5680 -13.5676 -11.7528 -11.7522 -11.0848 -11.0847 -9.1864 -9.1863 -8.6532 -8.6525 -7.3523 -7.3511 -6.8743 -6.8740 -6.4454 -6.4452 -5.4665 -5.4640 -3.4059 -3.4048 -2.9196 -2.9070 -2.4236 -2.4133 -2.0579 -2.0559 -1.8319 -1.8304 -1.4619 -1.4616 -1.4577 -1.4544 -0.6681 -0.6676 -0.5905 -0.5844 -0.1732 -0.1711 0.4225 0.4301 0.4383 0.4434 1.1322 1.1498 1.4882 1.4937 2.0765 2.0772 2.1022 2.1071 2.3327 2.3331 2.5148 2.5175 3.2595 3.2846 3.7303 3.7333 4.1992 4.2023 5.1235 5.1325 5.3062 5.3070 5.5121 5.5140 5.8264 5.8308 6.4241 6.4317 6.5335 6.5350 6.8261 6.8348 k = 0.0000 0.3571-0.0000 ( 8336 PWs) bands (ev): -13.7710 -13.7710 -13.5502 -13.5499 -11.7907 -11.7901 -11.0823 -11.0822 -9.1987 -9.1986 -8.6258 -8.6251 -7.3996 -7.3985 -6.8873 -6.8870 -6.4408 -6.4406 -5.3983 -5.3958 -3.4007 -3.3996 -2.8739 -2.8600 -2.4290 -2.4168 -2.0674 -2.0656 -1.8079 -1.8063 -1.4392 -1.4385 -1.4118 -1.4088 -0.7061 -0.7055 -0.5045 -0.4978 -0.3329 -0.3306 0.4026 0.4094 0.4729 0.4784 1.1867 1.2055 1.5043 1.5095 2.0725 2.0786 2.0875 2.0875 2.3356 2.3361 2.4930 2.4959 3.1045 3.1302 3.6361 3.6387 4.1911 4.1938 5.1736 5.1820 5.2868 5.2878 5.4466 5.4481 5.8501 5.8541 6.4668 6.4792 6.5061 6.5125 6.8657 6.8750 k = 0.0000 0.3750-0.0000 ( 8328 PWs) bands (ev): -13.7689 -13.7689 -13.5334 -13.5331 -11.8256 -11.8251 -11.0800 -11.0800 -9.2099 -9.2098 -8.5990 -8.5983 -7.4444 -7.4433 -6.8991 -6.8989 -6.4366 -6.4365 -5.3348 -5.3325 -3.3978 -3.3970 -2.8332 -2.8185 -2.4227 -2.4091 -2.0758 -2.0742 -1.7831 -1.7815 -1.4225 -1.4217 -1.3644 -1.3613 -0.7442 -0.7430 -0.4896 -0.4879 -0.4196 -0.4139 0.3816 0.3879 0.5088 0.5140 1.2476 1.2673 1.5192 1.5239 2.0467 2.0531 2.0951 2.0952 2.3386 2.3392 2.4720 2.4750 2.9516 2.9779 3.5499 3.5520 4.1835 4.1858 5.2187 5.2263 5.2574 5.2588 5.3983 5.3992 5.8734 5.8770 6.4720 6.4784 6.5349 6.5355 6.9022 6.9120 k = 0.0000 0.3929-0.0000 ( 8336 PWs) bands (ev): -13.7671 -13.7671 -13.5178 -13.5176 -11.8571 -11.8566 -11.0780 -11.0779 -9.2198 -9.2198 -8.5734 -8.5727 -7.4858 -7.4849 -6.9096 -6.9094 -6.4329 -6.4328 -5.2772 -5.2751 -3.3971 -3.3964 -2.8006 -2.7860 -2.4020 -2.3882 -2.0828 -2.0814 -1.7576 -1.7560 -1.4078 -1.4070 -1.3210 -1.3178 -0.7819 -0.7795 -0.6374 -0.6340 -0.3447 -0.3385 0.3625 0.3683 0.5421 0.5470 1.3153 1.3357 1.5327 1.5368 2.0227 2.0295 2.1018 2.1018 2.3415 2.3424 2.4512 2.4542 2.8025 2.8293 3.4726 3.4744 4.1766 4.1786 5.2177 5.2194 5.2583 5.2649 5.3683 5.3688 5.8960 5.8992 6.4492 6.4525 6.5944 6.5966 6.9348 6.9451 k = 0.0000 0.4107-0.0000 ( 8336 PWs) bands (ev): -13.7656 -13.7655 -13.5039 -13.5037 -11.8848 -11.8843 -11.0762 -11.0762 -9.2284 -9.2284 -8.5496 -8.5490 -7.5231 -7.5223 -6.9187 -6.9185 -6.4297 -6.4296 -5.2263 -5.2244 -3.3979 -3.3974 -2.7773 -2.7643 -2.3672 -2.3543 -2.0883 -2.0870 -1.7313 -1.7297 -1.3952 -1.3945 -1.2832 -1.2800 -0.8299 -0.8247 -0.7655 -0.7592 -0.2771 -0.2712 0.3456 0.3508 0.5720 0.5764 1.3902 1.4109 1.5445 1.5480 2.0012 2.0086 2.1072 2.1072 2.3443 2.3455 2.4287 2.4322 2.6604 2.6873 3.4053 3.4067 4.1705 4.1721 5.1743 5.1760 5.2918 5.2974 5.3511 5.3514 5.9174 5.9202 6.4258 6.4282 6.6609 6.6638 6.9628 6.9736 k = 0.0000 0.4286-0.0000 ( 8324 PWs) bands (ev): -13.7643 -13.7642 -13.4920 -13.4918 -11.9080 -11.9077 -11.0747 -11.0747 -9.2356 -9.2355 -8.5284 -8.5279 -7.5555 -7.5548 -6.9262 -6.9261 -6.4271 -6.4270 -5.1831 -5.1815 -3.3997 -3.3993 -2.7627 -2.7521 -2.3224 -2.3114 -2.0916 -2.0906 -1.7036 -1.7021 -1.3847 -1.3841 -1.2539 -1.2507 -0.9278 -0.9256 -0.8217 -0.8183 -0.2193 -0.2141 0.3313 0.3357 0.5978 0.6015 1.4724 1.4928 1.5545 1.5574 1.9825 1.9908 2.1114 2.1114 2.3456 2.3474 2.3968 2.4035 2.5359 2.5602 3.3489 3.3500 4.1653 4.1666 5.1339 5.1354 5.3189 5.3231 5.3411 5.3416 5.9369 5.9393 6.4043 6.4062 6.7313 6.7346 6.9851 6.9963 k = 0.0000 0.4464-0.0000 ( 8320 PWs) bands (ev): -13.7632 -13.7632 -13.4823 -13.4822 -11.9266 -11.9263 -11.0736 -11.0735 -9.2412 -9.2412 -8.5107 -8.5103 -7.5820 -7.5814 -6.9322 -6.9320 -6.4250 -6.4249 -5.1484 -5.1472 -3.4019 -3.4016 -2.7543 -2.7464 -2.2751 -2.2666 -2.0924 -2.0917 -1.6740 -1.6727 -1.3765 -1.3761 -1.2393 -1.2360 -1.0323 -1.0322 -0.8469 -0.8453 -0.1728 -0.1685 0.3198 0.3233 0.6187 0.6216 1.5610 1.5623 1.5647 1.5806 1.9669 1.9764 2.1145 2.1145 2.3145 2.3248 2.3604 2.3658 2.4599 2.4734 3.3042 3.3050 4.1612 4.1621 5.1003 5.1014 5.3322 5.3325 5.3426 5.3459 5.9537 5.9556 6.3860 6.3874 6.8019 6.8058 7.0005 7.0118 k = 0.0000 0.4643-0.0000 ( 8318 PWs) bands (ev): -13.7625 -13.7625 -13.4752 -13.4751 -11.9401 -11.9399 -11.0727 -11.0727 -9.2453 -9.2453 -8.4973 -8.4970 -7.6017 -7.6013 -6.9364 -6.9364 -6.4235 -6.4235 -5.1230 -5.1221 -3.4039 -3.4038 -2.7497 -2.7445 -2.2341 -2.2285 -2.0901 -2.0898 -1.6427 -1.6417 -1.3706 -1.3703 -1.2538 -1.2509 -1.1016 -1.1010 -0.8638 -0.8629 -0.1385 -0.1355 0.3116 0.3140 0.6342 0.6362 1.5684 1.5700 1.6533 1.6702 1.9539 1.9650 2.1166 2.1167 2.2123 2.2339 2.3605 2.3612 2.4311 2.4369 3.2718 3.2723 4.1582 4.1588 5.0753 5.0761 5.3292 5.3292 5.3568 5.3592 5.9669 5.9682 6.3719 6.3728 6.8679 6.8727 7.0073 7.0181 k = 0.0000 0.4821-0.0000 ( 8314 PWs) bands (ev): -13.7620 -13.7620 -13.4708 -13.4708 -11.9483 -11.9482 -11.0722 -11.0722 -9.2478 -9.2478 -8.4888 -8.4887 -7.6138 -7.6136 -6.9390 -6.9390 -6.4226 -6.4226 -5.1074 -5.1070 -3.4053 -3.4053 -2.7471 -2.7445 -2.2071 -2.2043 -2.0859 -2.0859 -1.6138 -1.6133 -1.3670 -1.3668 -1.2945 -1.2930 -1.1239 -1.1237 -0.8738 -0.8734 -0.1172 -0.1157 0.3067 0.3080 0.6439 0.6449 1.5722 1.5730 1.7405 1.7516 1.9430 1.9538 2.1172 2.1179 2.1203 2.1391 2.3629 2.3629 2.4193 2.4217 3.2522 3.2524 4.1564 4.1568 5.0600 5.0604 5.3271 5.3271 5.3661 5.3673 5.9754 5.9761 6.3630 6.3635 6.9221 6.9274 7.0044 7.0132 k = 0.0000 0.5000-0.0000 ( 8322 PWs) bands (ev): -13.7619 -13.7619 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4223 -6.4223 -5.1020 -5.1020 -3.4058 -3.4058 -2.7455 -2.7455 -2.1971 -2.1971 -2.0837 -2.0837 -1.6005 -1.6005 -1.3657 -1.3657 -1.3159 -1.3159 -1.1272 -1.1272 -0.8770 -0.8770 -0.1095 -0.1095 0.3055 0.3055 0.6475 0.6475 1.5737 1.5737 1.7885 1.7885 1.9402 1.9402 2.0874 2.0874 2.1184 2.1184 2.3639 2.3639 2.4164 2.4164 3.2457 3.2457 4.1560 4.1560 5.0550 5.0550 5.3263 5.3263 5.3696 5.3696 5.9786 5.9786 6.3601 6.3601 6.9504 6.9504 7.0015 7.0015 k = 0.0000 0.5000-0.0000 ( 8322 PWs) bands (ev): -13.7619 -13.7619 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4223 -6.4223 -5.1020 -5.1020 -3.4058 -3.4058 -2.7455 -2.7455 -2.1971 -2.1971 -2.0837 -2.0837 -1.6005 -1.6005 -1.3657 -1.3657 -1.3159 -1.3159 -1.1272 -1.1272 -0.8770 -0.8770 -0.1095 -0.1095 0.3055 0.3055 0.6475 0.6475 1.5737 1.5737 1.7885 1.7885 1.9402 1.9402 2.0874 2.0874 2.1184 2.1184 2.3639 2.3639 2.4164 2.4164 3.2457 3.2457 4.1560 4.1560 5.0550 5.0550 5.3263 5.3263 5.3696 5.3696 5.9786 5.9786 6.3601 6.3601 6.9504 6.9504 7.0015 7.0015 k = 0.0179 0.5000-0.0000 ( 8312 PWs) bands (ev): -13.7611 -13.7610 -13.4692 -13.4692 -11.9508 -11.9508 -11.0747 -11.0746 -9.2476 -9.2476 -8.4868 -8.4868 -7.6189 -7.6189 -6.9428 -6.9427 -6.4181 -6.4179 -5.1015 -5.1015 -3.4042 -3.4040 -2.7443 -2.7443 -2.1953 -2.1952 -2.0797 -2.0796 -1.5992 -1.5989 -1.3706 -1.3702 -1.3151 -1.3143 -1.1260 -1.1257 -0.8750 -0.8746 -0.1106 -0.1102 0.3066 0.3070 0.6451 0.6452 1.5762 1.5766 1.7872 1.7877 1.9386 1.9389 2.0867 2.0869 2.1184 2.1190 2.3528 2.3532 2.4139 2.4146 3.2464 3.2469 4.1573 4.1580 5.0524 5.0525 5.3175 5.3188 5.3690 5.3693 5.9707 5.9710 6.3520 6.3526 6.9529 6.9531 6.9959 6.9963 k = 0.0357 0.5000-0.0000 ( 8308 PWs) bands (ev): -13.7587 -13.7586 -13.4688 -13.4688 -11.9503 -11.9503 -11.0827 -11.0825 -9.2447 -9.2446 -8.4894 -8.4894 -7.6221 -7.6220 -6.9514 -6.9512 -6.4054 -6.4050 -5.1000 -5.0999 -3.3992 -3.3988 -2.7408 -2.7408 -2.1898 -2.1896 -2.0677 -2.0675 -1.5950 -1.5944 -1.3837 -1.3831 -1.3122 -1.3109 -1.1222 -1.1216 -0.8686 -0.8679 -0.1132 -0.1124 0.3103 0.3111 0.6380 0.6381 1.5840 1.5848 1.7838 1.7847 1.9340 1.9345 2.0847 2.0851 2.1190 2.1202 2.3202 2.3212 2.4074 2.4087 3.2490 3.2500 4.1619 4.1634 5.0447 5.0450 5.2925 5.2950 5.3678 5.3683 5.9475 5.9479 6.3285 6.3297 6.9601 6.9610 6.9829 6.9830 k = 0.0536 0.5000-0.0000 ( 8308 PWs) bands (ev): -13.7547 -13.7546 -13.4682 -13.4682 -11.9494 -11.9494 -11.0958 -11.0956 -9.2397 -9.2396 -8.4938 -8.4938 -7.6273 -7.6272 -6.9656 -6.9653 -6.3844 -6.3838 -5.0974 -5.0973 -3.3908 -3.3902 -2.7351 -2.7351 -2.1813 -2.1810 -2.0473 -2.0470 -1.5878 -1.5870 -1.4036 -1.4031 -1.3082 -1.3067 -1.1162 -1.1153 -0.8581 -0.8571 -0.1174 -0.1163 0.3164 0.3177 0.6263 0.6266 1.5967 1.5980 1.7784 1.7797 1.9262 1.9270 2.0814 2.0820 2.1201 2.1220 2.2676 2.2692 2.3969 2.3989 3.2535 3.2549 4.1696 4.1719 5.0315 5.0319 5.2524 5.2559 5.3662 5.3668 5.9094 5.9100 6.2902 6.2921 6.9622 6.9658 6.9740 6.9771 k = 0.0714 0.5000-0.0000 ( 8312 PWs) bands (ev): -13.7492 -13.7491 -13.4674 -13.4674 -11.9482 -11.9481 -11.1139 -11.1135 -9.2328 -9.2327 -8.4999 -8.4998 -7.6344 -7.6342 -6.9852 -6.9847 -6.3553 -6.3545 -5.0939 -5.0937 -3.3790 -3.3782 -2.7273 -2.7272 -2.1705 -2.1700 -2.0183 -2.0178 -1.5777 -1.5766 -1.4291 -1.4288 -1.3034 -1.3019 -1.1082 -1.1072 -0.8438 -0.8423 -0.1231 -0.1216 0.3251 0.3268 0.6105 0.6108 1.6138 1.6156 1.7710 1.7728 1.9143 1.9156 2.0766 2.0776 2.1214 2.1238 2.1974 2.2000 2.3829 2.3855 3.2597 3.2617 4.1801 4.1830 5.0115 5.0124 5.1993 5.2036 5.3644 5.3651 5.8573 5.8581 6.2381 6.2406 6.9473 6.9487 6.9913 6.9928 k = 0.0893 0.5000-0.0000 ( 8320 PWs) bands (ev): -13.7421 -13.7420 -13.4663 -13.4663 -11.9466 -11.9466 -11.1365 -11.1361 -9.2240 -9.2238 -8.5075 -8.5074 -7.6434 -7.6432 -7.0098 -7.0093 -6.3185 -6.3174 -5.0894 -5.0892 -3.3638 -3.3627 -2.7176 -2.7175 -2.1578 -2.1572 -1.9807 -1.9800 -1.5644 -1.5630 -1.4594 -1.4593 -1.2981 -1.2965 -1.0988 -1.0976 -0.8258 -0.8239 -0.1302 -0.1283 0.3363 0.3384 0.5909 0.5913 1.6344 1.6369 1.7620 1.7641 1.8963 1.8983 2.0683 2.0704 2.1151 2.1199 2.1228 2.1260 2.3659 2.3690 3.2676 3.2701 4.1928 4.1965 4.9820 4.9836 5.1374 5.1418 5.3628 5.3634 5.7925 5.7934 6.1733 6.1765 6.9321 6.9327 7.0127 7.0140 k = 0.1071 0.5000-0.0000 ( 8316 PWs) bands (ev): -13.7336 -13.7334 -13.4650 -13.4650 -11.9447 -11.9447 -11.1635 -11.1630 -9.2132 -9.2130 -8.5165 -8.5164 -7.6540 -7.6538 -7.0392 -7.0386 -6.2744 -6.2731 -5.0841 -5.0839 -3.3451 -3.3438 -2.7063 -2.7061 -2.1439 -2.1432 -1.9348 -1.9339 -1.5478 -1.5461 -1.4941 -1.4938 -1.2920 -1.2904 -1.0880 -1.0867 -0.8043 -0.8020 -0.1385 -0.1363 0.3499 0.3525 0.5679 0.5684 1.6573 1.6611 1.7514 1.7538 1.8648 1.8678 2.0203 2.0227 2.0717 2.0739 2.1226 2.1266 2.3465 2.3501 3.2771 3.2802 4.2072 4.2115 4.9363 4.9395 5.0746 5.0783 5.3620 5.3623 5.7161 5.7171 6.0973 6.1013 6.9187 6.9188 7.0375 7.0388 k = 0.1250 0.5000-0.0000 ( 8304 PWs) bands (ev): -13.7235 -13.7233 -13.4636 -13.4635 -11.9426 -11.9425 -11.1944 -11.1938 -9.2006 -9.2002 -8.5269 -8.5267 -7.6662 -7.6660 -7.0730 -7.0722 -6.2235 -6.2220 -5.0781 -5.0778 -3.3230 -3.3214 -2.6935 -2.6933 -2.1290 -2.1281 -1.8809 -1.8798 -1.5322 -1.5319 -1.5277 -1.5255 -1.2853 -1.2837 -1.0761 -1.0748 -0.7796 -0.7768 -0.1480 -0.1453 0.3659 0.3690 0.5419 0.5424 1.6805 1.6869 1.7393 1.7419 1.8024 1.8044 1.9527 1.9580 2.0639 2.0647 2.1213 2.1260 2.3260 2.3298 3.2881 3.2917 4.2225 4.2273 4.8662 4.8714 5.0209 5.0231 5.3624 5.3625 5.6298 5.6308 6.0115 6.0165 6.9072 6.9080 7.0651 7.0665 k = 0.1429 0.5000-0.0000 ( 8302 PWs) bands (ev): -13.7121 -13.7119 -13.4619 -13.4619 -11.9401 -11.9401 -11.2287 -11.2281 -9.1861 -9.1857 -8.5384 -8.5383 -7.6798 -7.6796 -7.1106 -7.1098 -6.1663 -6.1647 -5.0715 -5.0711 -3.2973 -3.2955 -2.6797 -2.6794 -2.1133 -2.1124 -1.8199 -1.8186 -1.5733 -1.5725 -1.5041 -1.5017 -1.2780 -1.2763 -1.0632 -1.0618 -0.7518 -0.7485 -0.1585 -0.1554 0.3844 0.3880 0.5132 0.5137 1.6760 1.6902 1.7191 1.7192 1.7284 1.7365 1.9146 1.9200 2.0575 2.0580 2.1172 2.1227 2.3055 2.3095 3.3002 3.3046 4.2378 4.2431 4.7723 4.7789 4.9773 4.9785 5.3641 5.3652 5.5349 5.5359 5.9176 5.9238 6.8985 6.8998 7.0948 7.0963 k = 0.1607 0.5000-0.0000 ( 8298 PWs) bands (ev): -13.6994 -13.6992 -13.4601 -13.4601 -11.9375 -11.9374 -11.2659 -11.2653 -9.1697 -9.1693 -8.5509 -8.5508 -7.6946 -7.6943 -7.1518 -7.1509 -6.1037 -6.1019 -5.0643 -5.0639 -3.2681 -3.2660 -2.6652 -2.6648 -2.0973 -2.0964 -1.7525 -1.7510 -1.6166 -1.6154 -1.4766 -1.4739 -1.2700 -1.2683 -1.0494 -1.0480 -0.7209 -0.7172 -0.1698 -0.1663 0.4051 0.4090 0.4825 0.4828 1.5578 1.5639 1.7127 1.7134 1.7403 1.7415 1.8919 1.8977 2.0519 2.0523 2.1089 2.1153 2.2870 2.2910 3.3133 3.3185 4.2521 4.2579 4.6618 4.6691 4.9383 4.9390 5.3678 5.3704 5.4331 5.4341 5.8174 5.8254 6.8927 6.8946 7.1258 7.1274 k = 0.1786 0.5000-0.0000 ( 8302 PWs) bands (ev): -13.6855 -13.6852 -13.4581 -13.4581 -11.9346 -11.9346 -11.3057 -11.3050 -9.1517 -9.1512 -8.5642 -8.5641 -7.7103 -7.7101 -7.1960 -7.1951 -6.0361 -6.0341 -5.0567 -5.0563 -3.2353 -3.2329 -2.6504 -2.6499 -2.0812 -2.0803 -1.6796 -1.6779 -1.6614 -1.6598 -1.4452 -1.4421 -1.2616 -1.2598 -1.0348 -1.0335 -0.6871 -0.6829 -0.1819 -0.1779 0.4266 0.4288 0.4515 0.4534 1.4163 1.4208 1.6981 1.7002 1.7563 1.7623 1.8769 1.8841 2.0475 2.0480 2.0952 2.1023 2.2721 2.2760 3.3269 3.3331 4.2645 4.2706 4.5405 4.5479 4.9001 4.9007 5.3253 5.3262 5.3740 5.3790 5.7131 5.7239 6.8902 6.8925 7.1576 7.1592 k = 0.1964 0.5000-0.0000 ( 8302 PWs) bands (ev): -13.6704 -13.6701 -13.4561 -13.4561 -11.9316 -11.9316 -11.3475 -11.3467 -9.1319 -9.1314 -8.5782 -8.5780 -7.7268 -7.7266 -7.2428 -7.2418 -5.9643 -5.9622 -5.0488 -5.0484 -3.1989 -3.1961 -2.6357 -2.6350 -2.0652 -2.0643 -1.7075 -1.7052 -1.6022 -1.6004 -1.4094 -1.4061 -1.2527 -1.2509 -1.0196 -1.0182 -0.6504 -0.6458 -0.1945 -0.1900 0.4093 0.4113 0.4574 0.4641 1.2663 1.2702 1.6829 1.6855 1.7649 1.7738 1.8705 1.8788 2.0453 2.0457 2.0756 2.0831 2.2618 2.2656 3.3405 3.3479 4.2741 4.2805 4.4117 4.4189 4.8614 4.8618 5.2140 5.2149 5.3781 5.3885 5.6083 5.6247 6.8910 6.8938 7.1893 7.1909 k = 0.2143 0.5000-0.0000 ( 8306 PWs) bands (ev): -13.6543 -13.6540 -13.4539 -13.4539 -11.9285 -11.9284 -11.3907 -11.3900 -9.1105 -9.1100 -8.5926 -8.5924 -7.7439 -7.7436 -7.2917 -7.2907 -5.8892 -5.8869 -5.0407 -5.0403 -3.1587 -3.1555 -2.6216 -2.6207 -2.0496 -2.0487 -1.7538 -1.7509 -1.5219 -1.5201 -1.3687 -1.3654 -1.2436 -1.2418 -1.0038 -1.0023 -0.6112 -0.6061 -0.2076 -0.2026 0.3723 0.3743 0.4857 0.4928 1.1115 1.1153 1.6674 1.6702 1.7622 1.7720 1.8737 1.8815 2.0414 2.0447 2.0563 2.0601 2.2561 2.2600 3.3531 3.3621 4.2784 4.2801 4.2850 4.2868 4.8214 4.8217 5.1000 5.1008 5.3679 5.3879 5.5166 5.5430 6.8956 6.8988 7.2203 7.2219 k = 0.2321 0.5000-0.0000 ( 8306 PWs) bands (ev): -13.6374 -13.6371 -13.4517 -13.4517 -11.9253 -11.9252 -11.4350 -11.4342 -9.0877 -9.0871 -8.6072 -8.6071 -7.7612 -7.7609 -7.3422 -7.3412 -5.8113 -5.8090 -5.0325 -5.0321 -3.1149 -3.1112 -2.6085 -2.6073 -2.0345 -2.0337 -1.7998 -1.7961 -1.4407 -1.4395 -1.3218 -1.3190 -1.2342 -1.2324 -0.9874 -0.9859 -0.5697 -0.5642 -0.2209 -0.2154 0.3317 0.3341 0.5176 0.5254 0.9548 0.9587 1.6519 1.6547 1.7506 1.7598 1.8816 1.8874 2.0152 2.0243 2.0575 2.0597 2.2541 2.2580 3.3628 3.3741 4.1438 4.1488 4.2824 4.2888 4.7800 4.7803 4.9846 4.9854 5.3134 5.3327 5.4841 5.5100 6.9040 6.9076 7.2500 7.2516 k = 0.2500 0.5000-0.0000 ( 8290 PWs) bands (ev): -13.6197 -13.6193 -13.4495 -13.4494 -11.9221 -11.9220 -11.4797 -11.4789 -9.0634 -9.0628 -8.6219 -8.6217 -7.7786 -7.7783 -7.3939 -7.3929 -5.7317 -5.7292 -5.0244 -5.0239 -3.0672 -3.0631 -2.5969 -2.5954 -2.0202 -2.0195 -1.8447 -1.8402 -1.3626 -1.3623 -1.2661 -1.2645 -1.2248 -1.2231 -0.9706 -0.9691 -0.5263 -0.5203 -0.2343 -0.2284 0.2873 0.2901 0.5529 0.5616 0.7991 0.8032 1.6364 1.6393 1.7338 1.7424 1.8878 1.8916 1.9818 1.9913 2.0706 2.0736 2.2546 2.2586 3.3665 3.3810 4.0123 4.0147 4.2802 4.2865 4.7374 4.7376 4.8694 4.8700 5.2205 5.2323 5.5025 5.5212 6.9167 6.9205 7.2777 7.2793 k = 0.2679 0.5000-0.0000 ( 8288 PWs) bands (ev): -13.6014 -13.6011 -13.4472 -13.4472 -11.9188 -11.9188 -11.5243 -11.5236 -9.0379 -9.0373 -8.6365 -8.6363 -7.7959 -7.7956 -7.4464 -7.4452 -5.6511 -5.6485 -5.0164 -5.0159 -3.0159 -3.0112 -2.5874 -2.5855 -2.0068 -2.0061 -1.8878 -1.8822 -1.2942 -1.2915 -1.2169 -1.2144 -1.1983 -1.1967 -0.9534 -0.9518 -0.4817 -0.4753 -0.2476 -0.2412 0.2369 0.2404 0.5918 0.6013 0.6483 0.6530 1.6211 1.6241 1.7145 1.7225 1.8898 1.8916 1.9465 1.9558 2.0901 2.0936 2.2567 2.2609 3.3577 3.3768 3.8898 3.8913 4.2740 4.2799 4.6932 4.6932 4.7560 4.7562 5.1153 5.1229 5.5363 5.5511 6.9339 6.9380 7.3029 7.3045 k = 0.2857 0.5000-0.0000 ( 8298 PWs) bands (ev): -13.5828 -13.5824 -13.4450 -13.4450 -11.9157 -11.9157 -11.5685 -11.5677 -9.0113 -9.0107 -8.6507 -8.6505 -7.8128 -7.8126 -7.4990 -7.4979 -5.5705 -5.5678 -5.0086 -5.0082 -2.9608 -2.9555 -2.5803 -2.5780 -1.9943 -1.9936 -1.9280 -1.9213 -1.2342 -1.2294 -1.2077 -1.2057 -1.1217 -1.1185 -0.9360 -0.9344 -0.4367 -0.4298 -0.2607 -0.2538 0.1761 0.1804 0.5088 0.5143 0.6347 0.6452 1.6063 1.6092 1.6939 1.7016 1.8856 1.8872 1.9125 1.9199 2.1141 2.1178 2.2598 2.2642 3.3254 3.3501 3.7862 3.7926 4.2641 4.2695 4.6351 4.6369 4.6561 4.6577 5.0079 5.0131 5.5774 5.5901 6.9562 6.9603 7.3251 7.3266 k = 0.3036 0.5000-0.0000 ( 8310 PWs) bands (ev): -13.5640 -13.5636 -13.4428 -13.4428 -11.9127 -11.9127 -11.6116 -11.6109 -8.9839 -8.9832 -8.6644 -8.6643 -7.8293 -7.8290 -7.5514 -7.5503 -5.4907 -5.4880 -5.0011 -5.0007 -2.9021 -2.8962 -2.5761 -2.5734 -1.9829 -1.9823 -1.9645 -1.9565 -1.2002 -1.1980 -1.1785 -1.1726 -1.0393 -1.0347 -0.9183 -0.9168 -0.3932 -0.3857 -0.2730 -0.2657 0.0980 0.1027 0.3907 0.3966 0.6819 0.6933 1.5922 1.5950 1.6728 1.6802 1.8636 1.8742 1.8914 1.8921 2.1406 2.1443 2.2634 2.2679 3.2578 3.2868 3.7190 3.7289 4.2510 4.2559 4.5321 4.5331 4.6063 4.6073 4.9020 4.9056 5.6229 5.6344 6.9839 6.9880 7.3439 7.3454 k = 0.3214 0.5000-0.0000 ( 8306 PWs) bands (ev): -13.5453 -13.5450 -13.4407 -13.4407 -11.9100 -11.9099 -11.6531 -11.6524 -8.9559 -8.9552 -8.6774 -8.6773 -7.8449 -7.8447 -7.6031 -7.6020 -5.4128 -5.4101 -4.9940 -4.9936 -2.8402 -2.8335 -2.5752 -2.5720 -1.9969 -1.9875 -1.9719 -1.9713 -1.1933 -1.1913 -1.1253 -1.1185 -0.9566 -0.9507 -0.9003 -0.8992 -0.3552 -0.3469 -0.2838 -0.2764 0.0002 0.0041 0.3013 0.3068 0.7341 0.7464 1.5788 1.5815 1.6518 1.6588 1.8293 1.8416 1.8813 1.8830 2.1680 2.1716 2.2670 2.2716 3.1549 3.1850 3.6907 3.7010 4.2355 4.2398 4.4289 4.4296 4.5607 4.5615 4.7997 4.8020 5.6711 5.6817 7.0176 7.0216 7.3591 7.3606 k = 0.3393 0.5000-0.0000 ( 8308 PWs) bands (ev): -13.5270 -13.5267 -13.4387 -13.4387 -11.9075 -11.9074 -11.6926 -11.6919 -8.9276 -8.9270 -8.6896 -8.6894 -7.8597 -7.8594 -7.6535 -7.6524 -5.3377 -5.3351 -4.9874 -4.9870 -2.7754 -2.7679 -2.5777 -2.5740 -2.0232 -2.0121 -1.9625 -1.9620 -1.1882 -1.1862 -1.0734 -1.0660 -0.8895 -0.8832 -0.8696 -0.8682 -0.3346 -0.3249 -0.2929 -0.2857 -0.1007 -0.0984 0.2368 0.2414 0.7916 0.8048 1.5664 1.5690 1.6313 1.6380 1.7941 1.8067 1.8739 1.8752 2.1952 2.1986 2.2703 2.2749 3.0285 3.0581 3.6888 3.6978 4.2185 4.2220 4.3308 4.3314 4.5154 4.5162 4.7024 4.7038 5.7203 5.7301 7.0578 7.0615 7.3709 7.3723 k = 0.3571 0.5000-0.0000 ( 8324 PWs) bands (ev): -13.5093 -13.5090 -13.4369 -13.4368 -11.9054 -11.9054 -11.7294 -11.7287 -8.8996 -8.8989 -8.7006 -8.7005 -7.8733 -7.8731 -7.7021 -7.7010 -5.2665 -5.2640 -4.9813 -4.9809 -2.7085 -2.7002 -2.5835 -2.5794 -2.0429 -2.0302 -1.9539 -1.9535 -1.1853 -1.1835 -1.0228 -1.0150 -0.8696 -0.8661 -0.7977 -0.7930 -0.3627 -0.3543 -0.3074 -0.2995 -0.1558 -0.1537 0.1880 0.1917 0.8552 0.8690 1.5551 1.5575 1.6116 1.6179 1.7602 1.7731 1.8668 1.8678 2.2214 2.2246 2.2726 2.2773 2.8901 2.9191 3.7012 3.7087 4.2006 4.2033 4.2395 4.2400 4.4706 4.4715 4.6114 4.6119 5.7687 5.7778 7.1051 7.1084 7.3794 7.3808 k = 0.3750 0.5000-0.0000 ( 8308 PWs) bands (ev): -13.4926 -13.4923 -13.4352 -13.4351 -11.9039 -11.9038 -11.7629 -11.7623 -8.8723 -8.8717 -8.7104 -8.7103 -7.8858 -7.8856 -7.7481 -7.7471 -5.2003 -5.1979 -4.9758 -4.9754 -2.6410 -2.6323 -2.5920 -2.5871 -2.0551 -2.0408 -1.9464 -1.9460 -1.1857 -1.1840 -0.9741 -0.9660 -0.8547 -0.8511 -0.7300 -0.7248 -0.4588 -0.4533 -0.3171 -0.3083 -0.1476 -0.1442 0.1489 0.1518 0.9251 0.9394 1.5451 1.5472 1.5931 1.5989 1.7286 1.7419 1.8599 1.8607 2.2458 2.2488 2.2731 2.2776 2.7476 2.7761 3.7212 3.7274 4.1553 4.1558 4.1834 4.1851 4.4268 4.4277 4.5276 4.5278 5.8150 5.8232 7.1599 7.1626 7.3852 7.3865 k = 0.3929 0.5000-0.0000 ( 8306 PWs) bands (ev): -13.4772 -13.4770 -13.4336 -13.4336 -11.9031 -11.9031 -11.7925 -11.7920 -8.8465 -8.8459 -8.7186 -8.7186 -7.8968 -7.8966 -7.7909 -7.7900 -5.1400 -5.1378 -4.9709 -4.9706 -2.6029 -2.6003 -2.5742 -2.5624 -2.0586 -2.0429 -1.9399 -1.9396 -1.1909 -1.1895 -0.9279 -0.9197 -0.8431 -0.8389 -0.6719 -0.6667 -0.5724 -0.5688 -0.3215 -0.3127 -0.1192 -0.1155 0.1166 0.1190 1.0017 1.0160 1.5365 1.5382 1.5762 1.5814 1.7001 1.7138 1.8535 1.8541 2.2680 2.2694 2.2709 2.2737 2.6072 2.6351 3.7452 3.7503 4.0805 4.0808 4.1663 4.1672 4.3844 4.3853 4.4518 4.4528 5.8576 5.8649 7.2225 7.2244 7.3888 7.3900 k = 0.4107 0.5000-0.0000 ( 8310 PWs) bands (ev): -13.4635 -13.4633 -13.4323 -13.4323 -11.9035 -11.9034 -11.8175 -11.8171 -8.8232 -8.8226 -8.7250 -8.7249 -7.9064 -7.9062 -7.8296 -7.8288 -5.0868 -5.0849 -4.9667 -4.9664 -2.6144 -2.6112 -2.5118 -2.5001 -2.0520 -2.0355 -1.9344 -1.9341 -1.2034 -1.2026 -0.8851 -0.8771 -0.8389 -0.8333 -0.6750 -0.6745 -0.6257 -0.6200 -0.3217 -0.3134 -0.0890 -0.0855 0.0904 0.0923 1.0846 1.0985 1.5294 1.5306 1.5612 1.5657 1.6754 1.6899 1.8478 1.8483 2.2557 2.2573 2.2878 2.2900 2.4792 2.5048 3.7710 3.7751 4.0152 4.0154 4.1510 4.1510 4.3442 4.3452 4.3856 4.3872 5.8954 5.9017 7.2927 7.2937 7.3908 7.3919 k = 0.4286 0.5000-0.0000 ( 8286 PWs) bands (ev): -13.4517 -13.4515 -13.4312 -13.4312 -11.9052 -11.9052 -11.8370 -11.8367 -8.8035 -8.8031 -8.7289 -8.7288 -7.9143 -7.9142 -7.8634 -7.8627 -5.0417 -5.0400 -4.9632 -4.9630 -2.6258 -2.6229 -2.4565 -2.4453 -2.0341 -2.0176 -1.9299 -1.9296 -1.2266 -1.2265 -0.8554 -0.8493 -0.8453 -0.8390 -0.7448 -0.7426 -0.5926 -0.5874 -0.3173 -0.3100 -0.0628 -0.0597 0.0707 0.0721 1.1729 1.1856 1.5238 1.5246 1.5485 1.5523 1.6559 1.6716 1.8430 1.8434 2.2056 2.2130 2.3043 2.3061 2.3889 2.4060 3.7968 3.8000 3.9603 3.9606 4.1371 4.1378 4.3072 4.3082 4.3298 4.3318 5.9275 5.9326 7.3699 7.3703 7.3917 7.3929 k = 0.4464 0.5000-0.0000 ( 8276 PWs) bands (ev): -13.4421 -13.4420 -13.4303 -13.4303 -11.9086 -11.9085 -11.8507 -11.8505 -8.7889 -8.7886 -8.7298 -8.7298 -7.9206 -7.9205 -7.8911 -7.8905 -5.0054 -5.0041 -4.9604 -4.9603 -2.6359 -2.6336 -2.4120 -2.4022 -2.0050 -1.9902 -1.9263 -1.9262 -1.2634 -1.2622 -0.8968 -0.8912 -0.8136 -0.8071 -0.7655 -0.7636 -0.5719 -0.5672 -0.3095 -0.3037 -0.0435 -0.0413 0.0582 0.0590 1.2637 1.2739 1.5199 1.5204 1.5382 1.5416 1.6438 1.6615 1.8391 1.8394 2.1050 2.1230 2.3176 2.3190 2.3520 2.3591 3.8208 3.8232 3.9168 3.9171 4.1261 4.1273 4.2749 4.2757 4.2853 4.2875 5.9532 5.9571 7.3919 7.3925 7.4531 7.4542 k = 0.4643 0.5000-0.0000 ( 8282 PWs) bands (ev): -13.4351 -13.4350 -13.4297 -13.4297 -11.9127 -11.9126 -11.8590 -11.8589 -8.7801 -8.7799 -8.7281 -8.7280 -7.9251 -7.9251 -7.9118 -7.9114 -4.9788 -4.9779 -4.9584 -4.9583 -2.6438 -2.6422 -2.3800 -2.3729 -1.9693 -1.9580 -1.9238 -1.9237 -1.3079 -1.3061 -0.9338 -0.9306 -0.7878 -0.7828 -0.7665 -0.7656 -0.5608 -0.5570 -0.3007 -0.2966 -0.0325 -0.0312 0.0530 0.0532 1.3498 1.3557 1.5175 1.5184 1.5303 1.5338 1.6438 1.6646 1.8363 1.8365 1.9877 2.0103 2.3273 2.3281 2.3403 2.3431 3.8409 3.8424 3.8853 3.8855 4.1184 4.1196 4.2491 4.2497 4.2530 4.2549 5.9720 5.9746 7.3919 7.3924 7.5398 7.5424 k = 0.4821 0.5000-0.0000 ( 8272 PWs) bands (ev): -13.4308 -13.4307 -13.4293 -13.4293 -11.9160 -11.9160 -11.8631 -11.8631 -8.7759 -8.7759 -8.7254 -8.7254 -7.9279 -7.9278 -7.9246 -7.9244 -4.9625 -4.9621 -4.9572 -4.9572 -2.6487 -2.6479 -2.3607 -2.3570 -1.9371 -1.9310 -1.9223 -1.9221 -1.3460 -1.3446 -0.9548 -0.9534 -0.7705 -0.7678 -0.7647 -0.7643 -0.5556 -0.5535 -0.2936 -0.2915 -0.0281 -0.0276 0.0523 0.0523 1.4145 1.4159 1.5173 1.5197 1.5243 1.5286 1.6657 1.6874 1.8345 1.8348 1.8808 1.9025 2.3331 2.3334 2.3366 2.3377 3.8544 3.8549 3.8665 3.8668 4.1140 4.1148 4.2322 4.2326 4.2335 4.2347 5.9837 5.9850 7.3919 7.3921 7.6252 7.6289 k = 0.5000 0.5000-0.0000 ( 8272 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9173 -11.9173 -11.8644 -11.8644 -8.7748 -8.7748 -8.7242 -8.7242 -7.9289 -7.9289 -7.9288 -7.9288 -4.9569 -4.9569 -4.9567 -4.9567 -2.6501 -2.6501 -2.3532 -2.3532 -1.9224 -1.9224 -1.9213 -1.9213 -1.3608 -1.3608 -0.9609 -0.9609 -0.7639 -0.7639 -0.7634 -0.7634 -0.5534 -0.5534 -0.2903 -0.2903 -0.0271 -0.0271 0.0526 0.0526 1.4377 1.4377 1.5198 1.5198 1.5241 1.5241 1.7022 1.7022 1.8343 1.8343 1.8346 1.8346 2.3345 2.3345 2.3366 2.3366 3.8574 3.8574 3.8622 3.8622 4.1129 4.1129 4.2266 4.2266 4.2272 4.2272 5.9880 5.9880 7.3919 7.3919 7.6792 7.6792 k = 0.5000 0.5000-0.0000 ( 8272 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9173 -11.9173 -11.8644 -11.8644 -8.7748 -8.7748 -8.7242 -8.7242 -7.9289 -7.9289 -7.9288 -7.9288 -4.9569 -4.9569 -4.9567 -4.9567 -2.6501 -2.6501 -2.3532 -2.3532 -1.9224 -1.9224 -1.9213 -1.9213 -1.3608 -1.3608 -0.9609 -0.9609 -0.7639 -0.7639 -0.7634 -0.7634 -0.5534 -0.5534 -0.2903 -0.2903 -0.0271 -0.0271 0.0526 0.0526 1.4377 1.4377 1.5198 1.5198 1.5241 1.5241 1.7022 1.7022 1.8343 1.8343 1.8346 1.8346 2.3345 2.3345 2.3366 2.3366 3.8574 3.8574 3.8622 3.8622 4.1129 4.1129 4.2266 4.2266 4.2272 4.2272 5.9880 5.9880 7.3919 7.3919 7.6792 7.6792 k = 0.4875 0.4875-0.0000 ( 8272 PWs) bands (ev): -13.4301 -13.4301 -13.4299 -13.4299 -11.9160 -11.9160 -11.8632 -11.8632 -8.7758 -8.7758 -8.7255 -8.7254 -7.9264 -7.9263 -7.9261 -7.9260 -4.9602 -4.9600 -4.9594 -4.9592 -2.6488 -2.6479 -2.3605 -2.3568 -1.9371 -1.9353 -1.9225 -1.9177 -1.3460 -1.3445 -0.9551 -0.9537 -0.7680 -0.7678 -0.7658 -0.7656 -0.5555 -0.5533 -0.2936 -0.2916 -0.0280 -0.0275 0.0521 0.0522 1.4164 1.4179 1.5131 1.5229 1.5233 1.5281 1.6584 1.6859 1.8508 1.8544 1.8704 1.8841 2.3339 2.3340 2.3360 2.3369 3.8584 3.8587 3.8620 3.8633 4.1140 4.1148 4.2324 4.2325 4.2329 4.2347 5.9837 5.9851 7.3918 7.3920 7.6277 7.6321 k = 0.4750 0.4750-0.0000 ( 8286 PWs) bands (ev): -13.4326 -13.4325 -13.4321 -13.4320 -11.9121 -11.9120 -11.8597 -11.8596 -8.7789 -8.7787 -8.7292 -8.7291 -7.9190 -7.9188 -7.9181 -7.9179 -4.9698 -4.9694 -4.9671 -4.9665 -2.6439 -2.6422 -2.3778 -2.3710 -1.9762 -1.9731 -1.9200 -1.9114 -1.3045 -1.3017 -0.9365 -0.9338 -0.7793 -0.7779 -0.7738 -0.7725 -0.5595 -0.5553 -0.3015 -0.2975 -0.0301 -0.0292 0.0508 0.0510 1.3648 1.3699 1.4934 1.5098 1.5306 1.5348 1.6111 1.6468 1.9050 1.9147 1.9435 1.9602 2.3316 2.3323 2.3364 2.3374 3.8617 3.8624 3.8632 3.8656 4.1184 4.1195 4.2496 4.2506 4.2510 4.2547 5.9723 5.9749 7.3911 7.3913 7.5486 7.5538 k = 0.4625 0.4625-0.0000 ( 8296 PWs) bands (ev): -13.4367 -13.4366 -13.4356 -13.4356 -11.9057 -11.9055 -11.8539 -11.8538 -8.7838 -8.7836 -8.7352 -8.7351 -7.9069 -7.9066 -7.9050 -7.9046 -4.9856 -4.9849 -4.9796 -4.9788 -2.6359 -2.6333 -2.4034 -2.3943 -2.0309 -2.0266 -1.9155 -1.9039 -1.2455 -1.2416 -0.9069 -0.9027 -0.7959 -0.7937 -0.7854 -0.7832 -0.5658 -0.5599 -0.3140 -0.3083 -0.0333 -0.0321 0.0487 0.0490 1.3005 1.3085 1.4549 1.4665 1.5413 1.5443 1.5952 1.6263 1.9798 1.9915 2.0266 2.0417 2.3291 2.3313 2.3386 2.3395 3.8660 3.8682 3.8686 3.8699 4.1262 4.1271 4.2777 4.2791 4.2814 4.2860 5.9540 5.9579 7.3845 7.3847 7.4725 7.4784 k = 0.4500 0.4500-0.0000 ( 8296 PWs) bands (ev): -13.4423 -13.4422 -13.4405 -13.4404 -11.8967 -11.8965 -11.8458 -11.8456 -8.7903 -8.7900 -8.7432 -8.7430 -7.8903 -7.8899 -7.8869 -7.8865 -5.0073 -5.0065 -4.9970 -4.9959 -2.6254 -2.6216 -2.4352 -2.4246 -2.0939 -2.0886 -1.9099 -1.8963 -1.1784 -1.1734 -0.8744 -0.8675 -0.8101 -0.8091 -0.7975 -0.7952 -0.5747 -0.5674 -0.3314 -0.3242 -0.0374 -0.0358 0.0459 0.0462 1.2325 1.2424 1.4021 1.4068 1.5548 1.5564 1.6023 1.6263 2.0634 2.0748 2.1074 2.1181 2.3314 2.3364 2.3445 2.3456 3.8719 3.8762 3.8779 3.8790 4.1373 4.1379 4.3158 4.3176 4.3223 4.3273 5.9290 5.9340 7.3463 7.3466 7.4288 7.4344 k = 0.4375 0.4375-0.0000 ( 8300 PWs) bands (ev): -13.4495 -13.4493 -13.4467 -13.4466 -11.8854 -11.8851 -11.8356 -11.8353 -8.7982 -8.7979 -8.7529 -8.7526 -7.8694 -7.8689 -7.8644 -7.8639 -5.0346 -5.0336 -5.0190 -5.0177 -2.6131 -2.6081 -2.4715 -2.4599 -2.1602 -2.1537 -1.9045 -1.8897 -1.1131 -1.1067 -0.8742 -0.8657 -0.8066 -0.8034 -0.7867 -0.7847 -0.5867 -0.5783 -0.3536 -0.3453 -0.0418 -0.0401 0.0424 0.0428 1.1651 1.1761 1.3445 1.3450 1.5709 1.5711 1.6194 1.6389 2.1461 2.1544 2.1708 2.1735 2.3510 2.3529 2.3614 2.3698 3.8815 3.8867 3.8917 3.8927 4.1515 4.1516 4.3630 4.3652 4.3722 4.3773 5.8977 5.9039 7.2717 7.2732 7.4229 7.4276 k = 0.4250 0.4250-0.0000 ( 8306 PWs) bands (ev): -13.4580 -13.4578 -13.4541 -13.4540 -11.8717 -11.8714 -11.8232 -11.8229 -8.8073 -8.8069 -8.7639 -8.7636 -7.8446 -7.8440 -7.8378 -7.8372 -5.0672 -5.0661 -5.0456 -5.0441 -2.6007 -2.5941 -2.5104 -2.4984 -2.2260 -2.2181 -1.8999 -1.8846 -1.0630 -1.0550 -0.9041 -0.8959 -0.7979 -0.7957 -0.7293 -0.7265 -0.6023 -0.5931 -0.3805 -0.3714 -0.0461 -0.0443 0.0384 0.0389 1.1004 1.1121 1.2856 1.2874 1.5886 1.5896 1.6422 1.6589 2.1943 2.1962 2.2136 2.2176 2.3860 2.3938 2.4136 2.4318 3.8955 3.9013 3.9100 3.9108 4.1677 4.1686 4.4183 4.4208 4.4302 4.4351 5.8607 5.8678 7.1898 7.1916 7.4262 7.4308 k = 0.4125 0.4125-0.0000 ( 8299 PWs) bands (ev): -13.4678 -13.4676 -13.4626 -13.4624 -11.8559 -11.8555 -11.8088 -11.8085 -8.8172 -8.8168 -8.7759 -8.7755 -7.8162 -7.8156 -7.8075 -7.8068 -5.1047 -5.1033 -5.0766 -5.0748 -2.5912 -2.5829 -2.5503 -2.5385 -2.2875 -2.2778 -1.8965 -1.8812 -1.0427 -1.0338 -0.9428 -0.9345 -0.7607 -0.7589 -0.6604 -0.6567 -0.6211 -0.6118 -0.4116 -0.4018 -0.0495 -0.0478 0.0339 0.0344 1.0395 1.0515 1.2300 1.2329 1.6088 1.6109 1.6689 1.6838 2.1912 2.1955 2.2485 2.2500 2.4516 2.4648 2.4990 2.5192 3.9142 3.9206 3.9330 3.9336 4.1861 4.1878 4.4810 4.4837 4.4952 4.4998 5.8184 5.8264 7.1075 7.1094 7.4322 7.4369 k = 0.4000 0.4000-0.0000 ( 8309 PWs) bands (ev): -13.4787 -13.4785 -13.4721 -13.4720 -11.8380 -11.8376 -11.7925 -11.7922 -8.8277 -8.8273 -8.7885 -8.7882 -7.7847 -7.7839 -7.7739 -7.7732 -5.1465 -5.1450 -5.1117 -5.1097 -2.5946 -2.5916 -2.5772 -2.5754 -2.3387 -2.3270 -1.8947 -1.8798 -1.0520 -1.0430 -0.9858 -0.9774 -0.6971 -0.6947 -0.6453 -0.6346 -0.5850 -0.5824 -0.4437 -0.4339 -0.0511 -0.0497 0.0291 0.0296 0.9832 0.9954 1.1785 1.1820 1.6314 1.6344 1.6985 1.7122 2.1770 2.1818 2.2592 2.2631 2.5425 2.5576 2.5979 2.6182 3.9381 3.9448 3.9608 3.9612 4.2064 4.2088 4.5500 4.5530 4.5663 4.5706 5.7714 5.7803 7.0265 7.0283 7.4311 7.4365 k = 0.3875 0.3875-0.0000 ( 8303 PWs) bands (ev): -13.4907 -13.4905 -13.4826 -13.4824 -11.8181 -11.8177 -11.7744 -11.7741 -8.8385 -8.8381 -8.8015 -8.8011 -7.7502 -7.7494 -7.7375 -7.7368 -5.1922 -5.1907 -5.1506 -5.1485 -2.6343 -2.6234 -2.5994 -2.5884 -2.3709 -2.3584 -1.8945 -1.8801 -1.0794 -1.0707 -1.0318 -1.0233 -0.6752 -0.6656 -0.6147 -0.6122 -0.5314 -0.5294 -0.4512 -0.4461 -0.0493 -0.0485 0.0242 0.0246 0.9319 0.9440 1.1315 1.1351 1.6562 1.6601 1.7298 1.7427 2.1579 2.1628 2.2609 2.2657 2.6450 2.6607 2.7029 2.7229 3.9670 3.9742 3.9935 3.9936 4.2279 4.2310 4.6248 4.6280 4.6429 4.6468 5.7203 5.7300 6.9476 6.9492 7.3874 7.3947 k = 0.3750 0.3750-0.0000 ( 8301 PWs) bands (ev): -13.5035 -13.5033 -13.4938 -13.4937 -11.7966 -11.7961 -11.7547 -11.7543 -8.8494 -8.8490 -8.8146 -8.8142 -7.7132 -7.7124 -7.6986 -7.6978 -5.2414 -5.2398 -5.1931 -5.1909 -2.6746 -2.6636 -2.6317 -2.6215 -2.3790 -2.3678 -1.8958 -1.8821 -1.1167 -1.1083 -1.0798 -1.0714 -0.7065 -0.6964 -0.5551 -0.5475 -0.5324 -0.5279 -0.3844 -0.3836 -0.0420 -0.0420 0.0195 0.0198 0.8859 0.8978 1.0886 1.0922 1.6831 1.6877 1.7613 1.7738 2.1373 2.1421 2.2583 2.2636 2.7529 2.7689 2.8113 2.8309 4.0012 4.0087 4.0307 4.0310 4.2502 4.2539 4.7045 4.7078 4.7243 4.7278 5.6659 5.6762 6.8712 6.8726 7.3433 7.3509 k = 0.3625 0.3625-0.0000 ( 8293 PWs) bands (ev): -13.5171 -13.5169 -13.5058 -13.5056 -11.7734 -11.7729 -11.7335 -11.7331 -8.8603 -8.8598 -8.8276 -8.8272 -7.6740 -7.6732 -7.6575 -7.6566 -5.2937 -5.2920 -5.2389 -5.2366 -2.7140 -2.7036 -2.6781 -2.6701 -2.3684 -2.3595 -1.8986 -1.8858 -1.1598 -1.1518 -1.1290 -1.1208 -0.7424 -0.7324 -0.6007 -0.5922 -0.4527 -0.4468 -0.2957 -0.2939 -0.0268 -0.0257 0.0160 0.0160 0.8451 0.8567 1.0500 1.0533 1.7118 1.7171 1.7911 1.8032 2.1180 2.1226 2.2533 2.2590 2.8638 2.8798 2.9217 2.9409 4.0403 4.0481 4.0725 4.0732 4.2728 4.2771 4.7883 4.7919 4.8098 4.8129 5.6087 5.6197 6.7979 6.7991 7.2997 7.3073 k = 0.3500 0.3500-0.0000 ( 8281 PWs) bands (ev): -13.5314 -13.5312 -13.5184 -13.5182 -11.7488 -11.7483 -11.7109 -11.7104 -8.8709 -8.8705 -8.8403 -8.8400 -7.6329 -7.6320 -7.6145 -7.6136 -5.3485 -5.3467 -5.2876 -5.2852 -2.7525 -2.7434 -2.7314 -2.7261 -2.3475 -2.3406 -1.9030 -1.8910 -1.2067 -1.1990 -1.1788 -1.1708 -0.7821 -0.7724 -0.6524 -0.6440 -0.3826 -0.3751 -0.2031 -0.2007 0.0019 0.0043 0.0157 0.0161 0.8095 0.8207 1.0152 1.0182 1.7421 1.7479 1.8160 1.8280 2.1032 2.1077 2.2468 2.2527 2.9764 2.9923 3.0333 3.0522 4.0843 4.0922 4.1186 4.1198 4.2954 4.3002 4.8756 4.8795 4.8990 4.9017 5.5494 5.5612 6.7280 6.7290 7.2564 7.2640 k = 0.3375 0.3375-0.0000 ( 8271 PWs) bands (ev): -13.5462 -13.5460 -13.5314 -13.5312 -11.7229 -11.7224 -11.6871 -11.6866 -8.8812 -8.8808 -8.8526 -8.8523 -7.5901 -7.5892 -7.5700 -7.5690 -5.4054 -5.4036 -5.3388 -5.3364 -2.7924 -2.7915 -2.7832 -2.7777 -2.3213 -2.3158 -1.9088 -1.8977 -1.2561 -1.2487 -1.2285 -1.2208 -0.8253 -0.8159 -0.7076 -0.6995 -0.3279 -0.3192 -0.1172 -0.1139 0.0241 0.0254 0.0513 0.0546 0.7790 0.7897 0.9841 0.9868 1.7736 1.7799 1.8320 1.8436 2.0973 2.1017 2.2390 2.2452 3.0900 3.1058 3.1457 3.1642 4.1327 4.1408 4.1689 4.1706 4.3175 4.3227 4.9654 4.9698 4.9912 4.9936 5.4891 5.5016 6.6619 6.6627 7.2133 7.2208 k = 0.3250 0.3250-0.0000 ( 8275 PWs) bands (ev): -13.5614 -13.5611 -13.5449 -13.5447 -11.6959 -11.6954 -11.6621 -11.6616 -8.8910 -8.8906 -8.8644 -8.8641 -7.5460 -7.5450 -7.5241 -7.5231 -5.4641 -5.4623 -5.3923 -5.3899 -2.8501 -2.8460 -2.8239 -2.8148 -2.2922 -2.2877 -1.9160 -1.9059 -1.3071 -1.3000 -1.2776 -1.2703 -0.8714 -0.8625 -0.7653 -0.7575 -0.2904 -0.2812 -0.0629 -0.0593 0.0687 0.0706 0.1199 0.1236 0.7534 0.7635 0.9565 0.9589 1.8061 1.8130 1.8354 1.8464 2.1041 2.1087 2.2302 2.2366 3.2040 3.2198 3.2583 3.2766 4.1850 4.1931 4.2230 4.2253 4.3390 4.3444 5.0562 5.0614 5.0859 5.0879 5.4288 5.4424 6.6001 6.6007 7.1702 7.1775 k = 0.3125 0.3125-0.0000 ( 8281 PWs) bands (ev): -13.5768 -13.5766 -13.5586 -13.5584 -11.6680 -11.6674 -11.6363 -11.6357 -8.9003 -8.8999 -8.8756 -8.8753 -7.5006 -7.4997 -7.4772 -7.4762 -5.5241 -5.5223 -5.4477 -5.4453 -2.9082 -2.9046 -2.8586 -2.8499 -2.2616 -2.2579 -1.9246 -1.9156 -1.3593 -1.3524 -1.3255 -1.3186 -0.9200 -0.9116 -0.8247 -0.8174 -0.2666 -0.2575 -0.0474 -0.0445 0.1552 0.1568 0.2051 0.2087 0.7323 0.7419 0.9323 0.9343 1.8241 1.8355 1.8407 1.8472 2.1239 2.1289 2.2205 2.2272 3.3181 3.3338 3.3709 3.3889 4.2403 4.2482 4.2806 4.2834 4.3602 4.3654 5.1445 5.1511 5.1825 5.1842 5.3718 5.3871 6.5428 6.5432 7.1270 7.1341 k = 0.3000 0.3000-0.0000 ( 8293 PWs) bands (ev): -13.5924 -13.5922 -13.5725 -13.5723 -11.6392 -11.6387 -11.6096 -11.6091 -8.9089 -8.9085 -8.8862 -8.8858 -7.4544 -7.4534 -7.4295 -7.4284 -5.5852 -5.5834 -5.5046 -5.5021 -2.9653 -2.9623 -2.8917 -2.8837 -2.2303 -2.2272 -1.9347 -1.9268 -1.4120 -1.4054 -1.3717 -1.3653 -0.9706 -0.9628 -0.8853 -0.8785 -0.2517 -0.2430 -0.0459 -0.0436 0.2572 0.2585 0.3013 0.3044 0.7157 0.7246 0.9113 0.9131 1.8041 1.8146 1.8740 1.8813 2.1541 2.1594 2.2101 2.2172 3.4319 3.4474 3.4831 3.5008 4.2966 4.3032 4.3412 4.3445 4.3830 4.3873 5.2135 5.2206 5.2806 5.2817 5.3368 5.3526 6.4905 6.4907 7.0836 7.0904 k = 0.2875 0.2875-0.0000 ( 8291 PWs) bands (ev): -13.6081 -13.6078 -13.5865 -13.5863 -11.6099 -11.6093 -11.5823 -11.5817 -8.9170 -8.9166 -8.8960 -8.8957 -7.4076 -7.4066 -7.3812 -7.3801 -5.6468 -5.6450 -5.5625 -5.5601 -3.0211 -3.0185 -2.9236 -2.9161 -2.1989 -2.1963 -1.9462 -1.9394 -1.4648 -1.4585 -1.4158 -1.4100 -1.0227 -1.0154 -0.9467 -0.9403 -0.2418 -0.2335 -0.0483 -0.0463 0.3636 0.3650 0.4037 0.4061 0.7036 0.7119 0.8938 0.8954 1.7767 1.7868 1.9079 1.9158 2.1904 2.1962 2.1995 2.2071 3.5451 3.5605 3.5946 3.6120 4.3472 4.3495 4.4041 4.4069 4.4157 4.4170 5.2091 5.2117 5.3784 5.3795 5.3861 5.3906 6.4433 6.4433 7.0399 7.0464 k = 0.2750 0.2750-0.0000 ( 8277 PWs) bands (ev): -13.6237 -13.6235 -13.6005 -13.6003 -11.5800 -11.5794 -11.5545 -11.5539 -8.9244 -8.9240 -8.9051 -8.9048 -7.3603 -7.3593 -7.3325 -7.3315 -5.7086 -5.7069 -5.6212 -5.6189 -3.0752 -3.0730 -2.9543 -2.9474 -2.1678 -2.1656 -1.9591 -1.9534 -1.5174 -1.5113 -1.4573 -1.4521 -1.0759 -1.0691 -1.0084 -1.0024 -0.2344 -0.2265 -0.0517 -0.0500 0.4705 0.4721 0.5077 0.5093 0.6977 0.7051 0.8805 0.8820 1.7450 1.7548 1.9414 1.9499 2.1879 2.1954 2.2324 2.2376 3.6574 3.6727 3.7052 3.7223 4.3764 4.3794 4.4607 4.4666 4.4702 4.4758 5.1571 5.1645 5.4714 5.4748 5.4794 5.4814 6.4014 6.4016 6.9958 7.0020 k = 0.2625 0.2625-0.0000 ( 8265 PWs) bands (ev): -13.6392 -13.6390 -13.6144 -13.6142 -11.5498 -11.5493 -11.5263 -11.5257 -8.9310 -8.9307 -8.9134 -8.9131 -7.3128 -7.3118 -7.2838 -7.2827 -5.7704 -5.7687 -5.6803 -5.6781 -3.1275 -3.1255 -2.9839 -2.9775 -2.1373 -2.1354 -1.9735 -1.9688 -1.5694 -1.5636 -1.4959 -1.4915 -1.1296 -1.1234 -1.0699 -1.0644 -0.2280 -0.2206 -0.0554 -0.0538 0.5744 0.5759 0.6024 0.6039 0.7072 0.7119 0.8734 0.8750 1.7107 1.7204 1.9736 1.9828 2.1771 2.1854 2.2753 2.2807 3.7686 3.7838 3.8147 3.8314 4.3902 4.3954 4.5232 4.5312 4.5362 4.5427 5.1002 5.1097 5.5675 5.5692 5.5786 5.5803 6.3650 6.3654 6.9514 6.9572 k = 0.2500 0.2500-0.0000 ( 8267 PWs) bands (ev): -13.6544 -13.6542 -13.6282 -13.6280 -11.5195 -11.5189 -11.4979 -11.4974 -8.9371 -8.9367 -8.9210 -8.9207 -7.2654 -7.2643 -7.2351 -7.2341 -5.8318 -5.8301 -5.7395 -5.7373 -3.1778 -3.1761 -3.0125 -3.0066 -2.1077 -2.1060 -1.9891 -1.9856 -1.6205 -1.6150 -1.5315 -1.5278 -1.1835 -1.1778 -1.1310 -1.1259 -0.2218 -0.2148 -0.0587 -0.0574 0.6476 0.6506 0.6678 0.6733 0.7680 0.7683 0.8793 0.8810 1.6750 1.6847 2.0031 2.0131 2.1680 2.1770 2.3194 2.3249 3.8785 3.8934 3.9228 3.9391 4.3977 4.4035 4.5919 4.6001 4.6030 4.6102 5.0442 5.0550 5.6646 5.6655 5.6774 5.6789 6.3343 6.3348 6.9066 6.9120 k = 0.2375 0.2375-0.0000 ( 8283 PWs) bands (ev): -13.6694 -13.6692 -13.6417 -13.6415 -11.4892 -11.4886 -11.4695 -11.4690 -8.9424 -8.9421 -8.9278 -8.9276 -7.2182 -7.2172 -7.1868 -7.1858 -5.8925 -5.8909 -5.7983 -5.7962 -3.2260 -3.2246 -3.0401 -3.0348 -2.0791 -2.0776 -2.0058 -2.0034 -1.6705 -1.6652 -1.5640 -1.5610 -1.2370 -1.2319 -1.1913 -1.1867 -0.2153 -0.2086 -0.0617 -0.0605 0.6563 0.6618 0.7331 0.7369 0.8677 0.8686 0.9156 0.9169 1.6386 1.6485 2.0273 2.0378 2.1632 2.1727 2.3639 2.3693 3.9869 4.0015 4.0293 4.0451 4.4008 4.4068 4.6634 4.6658 4.6734 4.6760 4.9918 5.0041 5.7612 5.7619 5.7751 5.7766 6.3091 6.3098 6.8614 6.8665 k = 0.2250 0.2250-0.0000 ( 8281 PWs) bands (ev): -13.6840 -13.6838 -13.6549 -13.6547 -11.4591 -11.4585 -11.4412 -11.4407 -8.9471 -8.9468 -8.9340 -8.9337 -7.1715 -7.1705 -7.1391 -7.1381 -5.9522 -5.9507 -5.8565 -5.8544 -3.2722 -3.2709 -3.0668 -3.0620 -2.0518 -2.0505 -2.0235 -2.0221 -1.7190 -1.7139 -1.5932 -1.5910 -1.2900 -1.2853 -1.2506 -1.2463 -0.2080 -0.2017 -0.0640 -0.0630 0.6588 0.6643 0.7601 0.7628 0.9759 0.9762 0.9921 0.9928 1.6020 1.6124 2.0425 2.0523 2.1674 2.1761 2.4080 2.4133 4.0934 4.1078 4.1341 4.1494 4.4002 4.4062 4.7230 4.7332 4.7380 4.7464 4.9484 4.9621 5.8567 5.8572 5.8712 5.8728 6.2893 6.2903 6.8159 6.8206 k = 0.2125 0.2125-0.0000 ( 8293 PWs) bands (ev): -13.6982 -13.6980 -13.6677 -13.6675 -11.4293 -11.4287 -11.4132 -11.4127 -8.9512 -8.9509 -8.9394 -8.9392 -7.1255 -7.1245 -7.0922 -7.0912 -6.0107 -6.0091 -5.9137 -5.9117 -3.3161 -3.3150 -3.0926 -3.0883 -2.0420 -2.0415 -2.0259 -2.0246 -1.7659 -1.7610 -1.6195 -1.6178 -1.3418 -1.3377 -1.3084 -1.3045 -0.1999 -0.1940 -0.0657 -0.0648 0.6608 0.6661 0.7663 0.7682 1.0816 1.0859 1.0899 1.0925 1.5657 1.5770 2.0461 2.0537 2.1831 2.1896 2.4515 2.4567 4.1980 4.2120 4.2368 4.2516 4.3963 4.4023 4.7601 4.7711 4.8100 4.8199 4.9290 4.9420 5.9502 5.9509 5.9650 5.9670 6.2748 6.2760 6.7702 6.7746 k = 0.2000 0.2000-0.0000 ( 8283 PWs) bands (ev): -13.7118 -13.7116 -13.6801 -13.6799 -11.3999 -11.3994 -11.3856 -11.3851 -8.9548 -8.9545 -8.9443 -8.9440 -7.0805 -7.0796 -7.0463 -7.0453 -6.0675 -6.0661 -5.9696 -5.9678 -3.3579 -3.3569 -3.1176 -3.1137 -2.0610 -2.0607 -2.0017 -2.0004 -1.8109 -1.8061 -1.6428 -1.6418 -1.3923 -1.3886 -1.3647 -1.3611 -0.1909 -0.1853 -0.0667 -0.0660 0.6635 0.6684 0.7653 0.7668 1.1848 1.1928 1.1962 1.2000 1.5304 1.5434 2.0399 2.0452 2.2072 2.2114 2.4940 2.4990 4.3004 4.3138 4.3373 4.3514 4.3898 4.3957 4.7598 4.7651 4.8828 4.8929 4.9539 4.9606 6.0412 6.0424 6.0559 6.0587 6.2651 6.2670 6.7244 6.7285 k = 0.1875 0.1875-0.0000 ( 8313 PWs) bands (ev): -13.7249 -13.7247 -13.6920 -13.6918 -11.3713 -11.3707 -11.3586 -11.3580 -8.9577 -8.9574 -8.9485 -8.9483 -7.0367 -7.0357 -7.0016 -7.0006 -6.1226 -6.1212 -6.0240 -6.0222 -3.3974 -3.3965 -3.1416 -3.1382 -2.0804 -2.0794 -1.9793 -1.9779 -1.8537 -1.8491 -1.6636 -1.6630 -1.4411 -1.4379 -1.4190 -1.4157 -0.1810 -0.1758 -0.0671 -0.0665 0.6670 0.6716 0.7621 0.7634 1.2846 1.2973 1.3038 1.3076 1.4969 1.5140 2.0275 2.0311 2.2353 2.2378 2.5351 2.5399 4.3798 4.3856 4.4005 4.4135 4.4363 4.4497 4.7319 4.7325 4.9543 4.9646 5.0067 5.0079 6.1288 6.1310 6.1421 6.1472 6.2606 6.2638 6.6786 6.6825 k = 0.1750 0.1750-0.0000 ( 8305 PWs) bands (ev): -13.7374 -13.7372 -13.7033 -13.7032 -11.3435 -11.3429 -11.3323 -11.3318 -8.9602 -8.9599 -8.9521 -8.9519 -6.9943 -6.9934 -6.9584 -6.9575 -6.1755 -6.1742 -6.0764 -6.0747 -3.4346 -3.4338 -3.1648 -3.1617 -2.0993 -2.0978 -1.9592 -1.9576 -1.8940 -1.8893 -1.6821 -1.6819 -1.4879 -1.4851 -1.4711 -1.4682 -0.1703 -0.1654 -0.0668 -0.0663 0.6712 0.6755 0.7583 0.7595 1.3690 1.3933 1.4090 1.4134 1.4724 1.4998 2.0115 2.0140 2.2647 2.2661 2.5746 2.5792 4.3688 4.3741 4.4978 4.5100 4.5319 4.5447 4.6930 4.6950 5.0238 5.0343 5.0652 5.0670 6.2094 6.2153 6.2165 6.2304 6.2651 6.2738 6.6332 6.6369 k = 0.1625 0.1625-0.0000 ( 8313 PWs) bands (ev): -13.7492 -13.7490 -13.7141 -13.7140 -11.3166 -11.3161 -11.3069 -11.3064 -8.9622 -8.9620 -8.9552 -8.9550 -6.9535 -6.9526 -6.9169 -6.9160 -6.2262 -6.2249 -6.1267 -6.1251 -3.4694 -3.4687 -3.1869 -3.1843 -2.1174 -2.1154 -1.9462 -1.9441 -1.9269 -1.9220 -1.6989 -1.6987 -1.5323 -1.5300 -1.5206 -1.5180 -0.1588 -0.1542 -0.0659 -0.0655 0.6761 0.6801 0.7546 0.7556 1.3982 1.4145 1.5111 1.5165 1.5221 1.5399 1.9934 1.9952 2.2940 2.2947 2.6123 2.6167 4.3559 4.3610 4.5921 4.6023 4.6243 4.6354 4.6547 4.6582 5.0905 5.1012 5.1243 5.1281 6.2449 6.2476 6.2977 6.3011 6.3194 6.3268 6.5885 6.5924 k = 0.1500 0.1500-0.0000 ( 8309 PWs) bands (ev): -13.7603 -13.7602 -13.7242 -13.7241 -11.2909 -11.2904 -11.2826 -11.2821 -8.9638 -8.9636 -8.9578 -8.9576 -6.9146 -6.9138 -6.8774 -6.8765 -6.2742 -6.2730 -6.1745 -6.1730 -3.5019 -3.5013 -3.2080 -3.2057 -2.1344 -2.1321 -1.9710 -1.9689 -1.9189 -1.9185 -1.7142 -1.7138 -1.5741 -1.5725 -1.5669 -1.5649 -0.1467 -0.1425 -0.0645 -0.0642 0.6816 0.6852 0.7511 0.7520 1.3822 1.3882 1.6103 1.6162 1.6171 1.6237 1.9743 1.9755 2.3226 2.3229 2.6479 2.6521 4.3418 4.3466 4.6131 4.6155 4.6843 4.6966 4.7156 4.7269 5.1537 5.1644 5.1821 5.1872 6.2528 6.2546 6.3735 6.3741 6.3954 6.3990 6.5457 6.5504 k = 0.1375 0.1375-0.0000 ( 8325 PWs) bands (ev): -13.7707 -13.7705 -13.7337 -13.7336 -11.2665 -11.2661 -11.2595 -11.2590 -8.9651 -8.9649 -8.9600 -8.9598 -6.8778 -6.8770 -6.8400 -6.8392 -6.3193 -6.3183 -6.2196 -6.2182 -3.5319 -3.5314 -3.2280 -3.2259 -2.1500 -2.1475 -2.0038 -2.0013 -1.9050 -1.9047 -1.7286 -1.7281 -1.6134 -1.6134 -1.6082 -1.6076 -0.1343 -0.1305 -0.0626 -0.0625 0.6874 0.6907 0.7480 0.7488 1.3570 1.3595 1.7060 1.7114 1.7117 1.7144 1.9548 1.9555 2.3499 2.3499 2.6814 2.6852 4.3271 4.3314 4.5771 4.5804 4.7721 4.7831 4.8024 4.8128 5.2126 5.2231 5.2370 5.2429 6.2587 6.2599 6.4339 6.4401 6.4681 6.4685 6.5116 6.5187 k = 0.1250 0.1250-0.0000 ( 8313 PWs) bands (ev): -13.7802 -13.7801 -13.7424 -13.7423 -11.2436 -11.2432 -11.2377 -11.2373 -8.9660 -8.9658 -8.9618 -8.9616 -6.8433 -6.8426 -6.8050 -6.8042 -6.3615 -6.3605 -6.2617 -6.2604 -3.5595 -3.5590 -3.2467 -3.2449 -2.1641 -2.1614 -2.0344 -2.0318 -1.8931 -1.8925 -1.7430 -1.7423 -1.6519 -1.6509 -1.6442 -1.6440 -0.1218 -0.1183 -0.0604 -0.0603 0.6935 0.6965 0.7453 0.7460 1.3309 1.3318 1.7972 1.8010 1.8017 1.8036 1.9360 1.9361 2.3755 2.3757 2.7125 2.7160 4.3121 4.3161 4.5436 4.5472 4.8564 4.8665 4.8856 4.8953 5.2664 5.2765 5.2880 5.2943 6.2645 6.2654 6.4403 6.4452 6.5259 6.5359 6.5382 6.5427 k = 0.1125 0.1125-0.0000 ( 8301 PWs) bands (ev): -13.7890 -13.7889 -13.7504 -13.7503 -11.2223 -11.2219 -11.2175 -11.2172 -8.9667 -8.9665 -8.9632 -8.9631 -6.8113 -6.8107 -6.7725 -6.7718 -6.4003 -6.3994 -6.3006 -6.2994 -3.5845 -3.5841 -3.2641 -3.2626 -2.1765 -2.1739 -2.0622 -2.0599 -1.8837 -1.8829 -1.7586 -1.7578 -1.6856 -1.6847 -1.6748 -1.6748 -0.1093 -0.1062 -0.0579 -0.0579 0.6996 0.7023 0.7430 0.7436 1.3057 1.3058 1.8772 1.8811 1.8842 1.8887 1.9219 1.9249 2.3994 2.3996 2.7410 2.7443 4.2972 4.3008 4.5130 4.5167 4.9367 4.9460 4.9650 4.9739 5.3146 5.3238 5.3344 5.3405 6.2699 6.2706 6.4082 6.4102 6.5856 6.5926 6.5987 6.6033 k = 0.1000 0.1000-0.0000 ( 8307 PWs) bands (ev): -13.7969 -13.7968 -13.7577 -13.7576 -11.2028 -11.2024 -11.1990 -11.1987 -8.9671 -8.9670 -8.9644 -8.9643 -6.7821 -6.7815 -6.7429 -6.7422 -6.4357 -6.4348 -6.3360 -6.3350 -3.6071 -3.6067 -3.2800 -3.2787 -2.1872 -2.1847 -2.0873 -2.0852 -1.8774 -1.8765 -1.7772 -1.7762 -1.7125 -1.7122 -1.7001 -1.6995 -0.0972 -0.0945 -0.0553 -0.0552 0.7057 0.7081 0.7411 0.7416 1.2818 1.2821 1.8888 1.8914 1.9639 1.9678 1.9719 1.9740 2.4212 2.4215 2.7669 2.7699 4.2829 4.2861 4.4856 4.4892 5.0127 5.0211 5.0402 5.0482 5.3565 5.3645 5.3754 5.3809 6.2746 6.2751 6.3725 6.3737 6.6418 6.6476 6.6554 6.6598 k = 0.0875 0.0875-0.0000 ( 8299 PWs) bands (ev): -13.8039 -13.8038 -13.7641 -13.7641 -11.1852 -11.1849 -11.1823 -11.1820 -8.9674 -8.9673 -8.9653 -8.9652 -6.7558 -6.7553 -6.7162 -6.7156 -6.4673 -6.4666 -6.3678 -6.3669 -3.6270 -3.6268 -3.2943 -3.2932 -2.1962 -2.1938 -2.1096 -2.1077 -1.8748 -1.8736 -1.7991 -1.7978 -1.7325 -1.7324 -1.7192 -1.7181 -0.0857 -0.0834 -0.0527 -0.0525 0.7116 0.7137 0.7395 0.7400 1.2602 1.2607 1.8736 1.8751 2.0371 2.0402 2.0428 2.0439 2.4409 2.4412 2.7901 2.7927 4.2695 4.2723 4.4613 4.4646 5.0840 5.0916 5.1106 5.1179 5.3916 5.3981 5.4102 5.4148 6.2779 6.2782 6.3385 6.3392 6.6921 6.6980 6.7055 6.7106 k = 0.0750 0.0750-0.0000 ( 8293 PWs) bands (ev): -13.8101 -13.8100 -13.7698 -13.7697 -11.1697 -11.1694 -11.1675 -11.1672 -8.9675 -8.9674 -8.9660 -8.9659 -6.7326 -6.7322 -6.6927 -6.6922 -6.4952 -6.4945 -6.3958 -6.3950 -3.6444 -3.6442 -3.3070 -3.3061 -2.2036 -2.2014 -2.1289 -2.1272 -1.8759 -1.8746 -1.8222 -1.8208 -1.7467 -1.7464 -1.7323 -1.7311 -0.0752 -0.0732 -0.0500 -0.0497 0.7170 0.7189 0.7383 0.7386 1.2410 1.2416 1.8578 1.8590 2.1026 2.1051 2.1074 2.1081 2.4583 2.4586 2.8103 2.8126 4.2573 4.2597 4.4402 4.4433 5.1501 5.1569 5.1761 5.1825 5.4194 5.4245 5.4382 5.4418 6.2795 6.2798 6.3073 6.3079 6.7346 6.7419 6.7462 6.7544 k = 0.0625 0.0625-0.0000 ( 8287 PWs) bands (ev): -13.8153 -13.8152 -13.7746 -13.7745 -11.1563 -11.1561 -11.1548 -11.1546 -8.9676 -8.9675 -8.9665 -8.9664 -6.7127 -6.7123 -6.6725 -6.6721 -6.5190 -6.5185 -6.4198 -6.4191 -3.6592 -3.6590 -3.3179 -3.3172 -2.2094 -2.2074 -2.1453 -2.1439 -1.8802 -1.8790 -1.8440 -1.8427 -1.7560 -1.7558 -1.7410 -1.7399 -0.0657 -0.0643 -0.0476 -0.0472 0.7220 0.7237 0.7373 0.7375 1.2245 1.2251 1.8435 1.8444 2.1596 2.1616 2.1638 2.1643 2.4732 2.4735 2.8276 2.8295 4.2465 4.2486 4.4224 4.4251 5.2107 5.2168 5.2360 5.2417 5.4397 5.4435 5.4588 5.4614 6.2793 6.2797 6.2800 6.2806 6.7579 6.7601 6.7641 6.7738 k = 0.0500 0.0500-0.0000 ( 8295 PWs) bands (ev): -13.8196 -13.8195 -13.7785 -13.7785 -11.1452 -11.1450 -11.1442 -11.1440 -8.9676 -8.9675 -8.9669 -8.9668 -6.6962 -6.6959 -6.6558 -6.6555 -6.5387 -6.5382 -6.4396 -6.4390 -3.6713 -3.6711 -3.3269 -3.3263 -2.2137 -2.2121 -2.1587 -2.1575 -1.8866 -1.8855 -1.8629 -1.8618 -1.7616 -1.7615 -1.7467 -1.7457 -0.0577 -0.0567 -0.0453 -0.0447 0.7263 0.7277 0.7366 0.7367 1.2108 1.2113 1.8312 1.8318 2.2075 2.2089 2.2112 2.2115 2.4855 2.4857 2.8419 2.8434 4.2375 4.2391 4.4078 4.4101 5.2654 5.2707 5.2900 5.2950 5.4522 5.4547 5.4717 5.4735 6.2567 6.2571 6.2782 6.2783 6.7450 6.7458 6.7560 6.7616 k = 0.0375 0.0375-0.0000 ( 8287 PWs) bands (ev): -13.8229 -13.8229 -13.7816 -13.7816 -11.1365 -11.1363 -11.1359 -11.1358 -8.9676 -8.9675 -8.9671 -8.9671 -6.6832 -6.6830 -6.6426 -6.6424 -6.5541 -6.5538 -6.4551 -6.4547 -3.6807 -3.6806 -3.3340 -3.3336 -2.2168 -2.2155 -2.1691 -2.1682 -1.8936 -1.8927 -1.8778 -1.8769 -1.7647 -1.7647 -1.7503 -1.7496 -0.0514 -0.0509 -0.0432 -0.0425 0.7298 0.7310 0.7360 0.7361 1.2000 1.2004 1.8212 1.8217 2.2455 2.2465 2.2489 2.2491 2.4952 2.4954 2.8531 2.8543 4.2303 4.2315 4.3966 4.3983 5.3138 5.3184 5.3376 5.3419 5.4569 5.4584 5.4768 5.4778 6.2382 6.2385 6.2761 6.2762 6.7324 6.7325 6.7449 6.7477 k = 0.0250 0.0250-0.0000 ( 8279 PWs) bands (ev): -13.8253 -13.8253 -13.7838 -13.7838 -11.1302 -11.1301 -11.1299 -11.1298 -8.9675 -8.9675 -8.9673 -8.9673 -6.6739 -6.6737 -6.6332 -6.6330 -6.5651 -6.5649 -6.4662 -6.4660 -3.6875 -3.6874 -3.3391 -3.3388 -2.2188 -2.2179 -2.1765 -2.1759 -1.9000 -1.8995 -1.8881 -1.8876 -1.7665 -1.7665 -1.7524 -1.7519 -0.0472 -0.0471 -0.0412 -0.0406 0.7324 0.7334 0.7355 0.7358 1.1922 1.1925 1.8139 1.8142 2.2731 2.2738 2.2763 2.2764 2.5021 2.5023 2.8612 2.8620 4.2251 4.2259 4.3886 4.3898 5.3554 5.3593 5.3781 5.3819 5.4539 5.4546 5.4741 5.4743 6.2247 6.2249 6.2739 6.2739 6.7232 6.7235 6.7365 6.7380 k = 0.0125 0.0125-0.0000 ( 8283 PWs) bands (ev): -13.8268 -13.8268 -13.7851 -13.7851 -11.1264 -11.1263 -11.1262 -11.1262 -8.9675 -8.9675 -8.9674 -8.9673 -6.6682 -6.6681 -6.6274 -6.6274 -6.5718 -6.5717 -6.4729 -6.4728 -3.6915 -3.6915 -3.3421 -3.3420 -2.2198 -2.2193 -2.1808 -2.1805 -1.9047 -1.9044 -1.8938 -1.8936 -1.7674 -1.7674 -1.7534 -1.7532 -0.0450 -0.0449 -0.0396 -0.0391 0.7340 0.7347 0.7354 0.7357 1.1876 1.1877 1.8095 1.8096 2.2899 2.2902 2.2929 2.2929 2.5064 2.5064 2.8661 2.8665 4.2220 4.2225 4.3840 4.3846 5.3894 5.3927 5.4092 5.4130 5.4449 5.4454 5.4635 5.4638 6.2166 6.2167 6.2723 6.2723 6.7179 6.7181 6.7316 6.7323 k = 0.0000 0.0000 0.0000 ( 8295 PWs) bands (ev): -13.8273 -13.8273 -13.7856 -13.7856 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6663 -6.6663 -6.6255 -6.6255 -6.5740 -6.5740 -6.4751 -6.4751 -3.6928 -3.6928 -3.3431 -3.3431 -2.2200 -2.2200 -2.1822 -2.1822 -1.9063 -1.9063 -1.8956 -1.8956 -1.7677 -1.7677 -1.7537 -1.7537 -0.0443 -0.0443 -0.0388 -0.0388 0.7346 0.7346 0.7357 0.7357 1.1861 1.1861 1.8080 1.8080 2.2957 2.2957 2.2985 2.2985 2.5078 2.5078 2.8679 2.8679 4.2212 4.2212 4.3826 4.3826 5.4128 5.4128 5.4177 5.4177 5.4477 5.4477 5.4478 5.4478 6.2139 6.2139 6.2717 6.2717 6.7162 6.7162 6.7303 6.7303 k = 0.0000 0.0000 0.0000 ( 8295 PWs) bands (ev): -13.8273 -13.8273 -13.7856 -13.7856 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6663 -6.6663 -6.6255 -6.6255 -6.5740 -6.5740 -6.4751 -6.4751 -3.6928 -3.6928 -3.3431 -3.3431 -2.2200 -2.2200 -2.1822 -2.1822 -1.9063 -1.9063 -1.8956 -1.8956 -1.7677 -1.7677 -1.7537 -1.7537 -0.0443 -0.0443 -0.0388 -0.0388 0.7346 0.7346 0.7357 0.7357 1.1861 1.1861 1.8080 1.8080 2.2957 2.2957 2.2985 2.2985 2.5078 2.5078 2.8679 2.8679 4.2212 4.2212 4.3826 4.3826 5.4128 5.4128 5.4177 5.4177 5.4477 5.4477 5.4478 5.4478 6.2139 6.2139 6.2717 6.2717 6.7162 6.7162 6.7303 6.7303 k = 0.0000 0.0000 0.0173 ( 8283 PWs) bands (ev): -13.8272 -13.8272 -13.7856 -13.7856 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6662 -6.6662 -6.6256 -6.6256 -6.5738 -6.5738 -6.4753 -6.4753 -3.6923 -3.6923 -3.3439 -3.3439 -2.2198 -2.2198 -2.1822 -2.1822 -1.9061 -1.9061 -1.8954 -1.8954 -1.7678 -1.7678 -1.7538 -1.7538 -0.0441 -0.0441 -0.0385 -0.0385 0.7342 0.7342 0.7352 0.7352 1.1869 1.1869 1.8065 1.8065 2.2956 2.2956 2.2984 2.2984 2.5084 2.5084 2.8672 2.8672 4.2227 4.2227 4.3833 4.3833 5.4128 5.4128 5.4177 5.4177 5.4476 5.4476 5.4477 5.4477 6.2138 6.2138 6.2708 6.2708 6.7182 6.7182 6.7322 6.7322 k = 0.0000 0.0000 0.0346 ( 8291 PWs) bands (ev): -13.8269 -13.8269 -13.7859 -13.7859 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6660 -6.6660 -6.6258 -6.6258 -6.5732 -6.5732 -6.4758 -6.4758 -3.6905 -3.6905 -3.3463 -3.3463 -2.2192 -2.2192 -2.1822 -2.1822 -1.9056 -1.9056 -1.8949 -1.8949 -1.7682 -1.7682 -1.7543 -1.7543 -0.0433 -0.0433 -0.0378 -0.0378 0.7328 0.7328 0.7339 0.7339 1.1894 1.1894 1.8018 1.8018 2.2956 2.2956 2.2983 2.2983 2.5104 2.5104 2.8650 2.8650 4.2272 4.2272 4.3854 4.3854 5.4128 5.4128 5.4176 5.4176 5.4472 5.4472 5.4473 5.4473 6.2135 6.2135 6.2681 6.2681 6.7241 6.7241 6.7382 6.7382 k = 0.0000 0.0000 0.0519 ( 8287 PWs) bands (ev): -13.8266 -13.8266 -13.7863 -13.7863 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6656 -6.6656 -6.6262 -6.6262 -6.5722 -6.5722 -6.4767 -6.4767 -3.6877 -3.6877 -3.3502 -3.3502 -2.2184 -2.2184 -2.1823 -2.1823 -1.9046 -1.9046 -1.8940 -1.8940 -1.7689 -1.7689 -1.7551 -1.7551 -0.0421 -0.0421 -0.0367 -0.0367 0.7307 0.7307 0.7317 0.7317 1.1935 1.1935 1.7940 1.7940 2.2954 2.2954 2.2981 2.2981 2.5136 2.5136 2.8614 2.8614 4.2345 4.2345 4.3889 4.3889 5.4128 5.4128 5.4175 5.4175 5.4466 5.4466 5.4468 5.4468 6.2131 6.2131 6.2637 6.2637 6.7340 6.7340 6.7480 6.7480 k = 0.0000 0.0000 0.0692 ( 8307 PWs) bands (ev): -13.8260 -13.8260 -13.7868 -13.7868 -11.1251 -11.1251 -11.1250 -11.1250 -8.9675 -8.9675 -8.9674 -8.9674 -6.6651 -6.6651 -6.6267 -6.6267 -6.5709 -6.5709 -6.4780 -6.4780 -3.6837 -3.6837 -3.3556 -3.3556 -2.2171 -2.2171 -2.1824 -2.1824 -1.9034 -1.9034 -1.8928 -1.8928 -1.7698 -1.7698 -1.7561 -1.7561 -0.0404 -0.0404 -0.0351 -0.0351 0.7277 0.7277 0.7287 0.7287 1.1993 1.1993 1.7833 1.7833 2.2953 2.2953 2.2979 2.2979 2.5180 2.5180 2.8564 2.8564 4.2446 4.2446 4.3935 4.3935 5.4128 5.4128 5.4173 5.4173 5.4459 5.4459 5.4460 5.4460 6.2123 6.2123 6.2577 6.2577 6.7476 6.7476 6.7614 6.7614 k = 0.0000 0.0000 0.0866 ( 8307 PWs) bands (ev): -13.8253 -13.8253 -13.7875 -13.7875 -11.1251 -11.1251 -11.1250 -11.1250 -8.9676 -8.9676 -8.9675 -8.9675 -6.6644 -6.6644 -6.6274 -6.6274 -6.5692 -6.5692 -6.4796 -6.4796 -3.6786 -3.6786 -3.3624 -3.3624 -2.2157 -2.2157 -2.1825 -2.1825 -1.9018 -1.9018 -1.8914 -1.8914 -1.7709 -1.7709 -1.7575 -1.7575 -0.0382 -0.0382 -0.0331 -0.0331 0.7240 0.7240 0.7250 0.7250 1.2067 1.2067 1.7699 1.7699 2.2951 2.2951 2.2976 2.2976 2.5237 2.5237 2.8500 2.8500 4.2571 4.2571 4.3993 4.3993 5.4128 5.4128 5.4171 5.4171 5.4449 5.4449 5.4451 5.4451 6.2110 6.2110 6.2503 6.2503 6.7646 6.7646 6.7782 6.7782 k = 0.0000 0.0000 0.1039 ( 8311 PWs) bands (ev): -13.8245 -13.8245 -13.7884 -13.7884 -11.1251 -11.1251 -11.1250 -11.1250 -8.9676 -8.9676 -8.9675 -8.9675 -6.6636 -6.6636 -6.6283 -6.6283 -6.5672 -6.5672 -6.4816 -6.4816 -3.6724 -3.6724 -3.3706 -3.3706 -2.2139 -2.2139 -2.1827 -2.1827 -1.8999 -1.8999 -1.8896 -1.8896 -1.7722 -1.7722 -1.7591 -1.7591 -0.0358 -0.0358 -0.0308 -0.0308 0.7197 0.7197 0.7207 0.7207 1.2159 1.2159 1.7538 1.7538 2.2948 2.2948 2.2972 2.2972 2.5306 2.5306 2.8424 2.8424 4.2718 4.2718 4.4060 4.4060 5.4128 5.4128 5.4168 5.4168 5.4438 5.4438 5.4441 5.4441 6.2092 6.2092 6.2417 6.2417 6.7848 6.7848 6.7980 6.7980 k = 0.0000 0.0000 0.1212 ( 8323 PWs) bands (ev): -13.8235 -13.8235 -13.7894 -13.7894 -11.1251 -11.1251 -11.1250 -11.1250 -8.9676 -8.9676 -8.9675 -8.9675 -6.6627 -6.6627 -6.6292 -6.6292 -6.5648 -6.5648 -6.4838 -6.4838 -3.6652 -3.6652 -3.3800 -3.3800 -2.2120 -2.2120 -2.1828 -2.1828 -1.8977 -1.8977 -1.8877 -1.8877 -1.7737 -1.7737 -1.7610 -1.7610 -0.0330 -0.0330 -0.0283 -0.0283 0.7149 0.7149 0.7159 0.7159 1.2267 1.2267 1.7353 1.7353 2.2946 2.2946 2.2968 2.2968 2.5387 2.5387 2.8335 2.8335 4.2882 4.2882 4.4134 4.4134 5.4127 5.4127 5.4165 5.4165 5.4427 5.4427 5.4430 5.4430 6.2067 6.2067 6.2321 6.2321 6.8077 6.8077 6.8200 6.8200 k = 0.0000 0.0000 0.1385 ( 8330 PWs) bands (ev): -13.8224 -13.8224 -13.7905 -13.7905 -11.1251 -11.1251 -11.1249 -11.1249 -8.9677 -8.9677 -8.9676 -8.9676 -6.6616 -6.6616 -6.6303 -6.6303 -6.5621 -6.5621 -6.4864 -6.4864 -3.6569 -3.6569 -3.3906 -3.3906 -2.2099 -2.2099 -2.1831 -2.1831 -1.8953 -1.8953 -1.8856 -1.8856 -1.7754 -1.7754 -1.7631 -1.7631 -0.0300 -0.0300 -0.0256 -0.0256 0.7098 0.7098 0.7108 0.7108 1.2393 1.2393 1.7146 1.7146 2.2943 2.2943 2.2964 2.2964 2.5478 2.5478 2.8235 2.8235 4.3061 4.3061 4.4214 4.4214 5.4127 5.4127 5.4161 5.4161 5.4415 5.4415 5.4418 5.4418 6.2035 6.2035 6.2219 6.2219 6.8322 6.8322 6.8423 6.8423 k = 0.0000 0.0000 0.1558 ( 8298 PWs) bands (ev): -13.8212 -13.8212 -13.7917 -13.7917 -11.1251 -11.1251 -11.1249 -11.1249 -8.9677 -8.9677 -8.9676 -8.9676 -6.6604 -6.6604 -6.6315 -6.6315 -6.5592 -6.5592 -6.4893 -6.4893 -3.6477 -3.6477 -3.4021 -3.4021 -2.2078 -2.2078 -2.1834 -2.1834 -1.8927 -1.8927 -1.8833 -1.8833 -1.7771 -1.7771 -1.7653 -1.7653 -0.0268 -0.0268 -0.0227 -0.0227 0.7045 0.7045 0.7054 0.7054 1.2535 1.2535 1.6921 1.6921 2.2941 2.2941 2.2960 2.2960 2.5580 2.5580 2.8124 2.8124 4.3248 4.3248 4.4295 4.4295 5.4126 5.4126 5.4157 5.4157 5.4403 5.4403 5.4407 5.4407 6.1995 6.1995 6.2113 6.2113 6.8556 6.8556 6.8589 6.8589 k = 0.0000 0.0000 0.1731 ( 8302 PWs) bands (ev): -13.8199 -13.8199 -13.7931 -13.7931 -11.1250 -11.1250 -11.1249 -11.1249 -8.9677 -8.9677 -8.9676 -8.9676 -6.6591 -6.6591 -6.6329 -6.6329 -6.5559 -6.5559 -6.4924 -6.4924 -3.6376 -3.6376 -3.4146 -3.4146 -2.2056 -2.2056 -2.1838 -2.1838 -1.8900 -1.8900 -1.8811 -1.8811 -1.7788 -1.7788 -1.7677 -1.7677 -0.0236 -0.0236 -0.0198 -0.0198 0.6991 0.6991 0.7000 0.7000 1.2694 1.2694 1.6679 1.6679 2.2938 2.2938 2.2956 2.2956 2.5691 2.5691 2.8004 2.8004 4.3440 4.3440 4.4375 4.4375 5.4125 5.4125 5.4153 5.4153 5.4392 5.4392 5.4396 5.4396 6.1948 6.1948 6.2008 6.2008 6.8659 6.8659 6.8699 6.8699 k = 0.0000 0.0000 0.1904 ( 8294 PWs) bands (ev): -13.8185 -13.8185 -13.7945 -13.7945 -11.1250 -11.1250 -11.1249 -11.1249 -8.9678 -8.9678 -8.9677 -8.9677 -6.6577 -6.6577 -6.6343 -6.6343 -6.5525 -6.5525 -6.4958 -6.4958 -3.6266 -3.6266 -3.4279 -3.4279 -2.2034 -2.2034 -2.1842 -2.1842 -1.8872 -1.8872 -1.8789 -1.8789 -1.7805 -1.7805 -1.7702 -1.7702 -0.0204 -0.0204 -0.0170 -0.0170 0.6939 0.6939 0.6947 0.6947 1.2870 1.2870 1.6424 1.6424 2.2936 2.2936 2.2951 2.2951 2.5811 2.5811 2.7874 2.7874 4.3632 4.3632 4.4451 4.4451 5.4125 5.4125 5.4149 5.4149 5.4381 5.4381 5.4385 5.4385 6.1895 6.1895 6.1908 6.1908 6.8686 6.8686 6.8743 6.8743 k = 0.0000 0.0000 0.2077 ( 8286 PWs) bands (ev): -13.8169 -13.8169 -13.7961 -13.7961 -11.1250 -11.1250 -11.1249 -11.1249 -8.9678 -8.9678 -8.9677 -8.9677 -6.6562 -6.6562 -6.6358 -6.6358 -6.5488 -6.5488 -6.4993 -6.4993 -3.6148 -3.6148 -3.4418 -3.4418 -2.2012 -2.2012 -2.1847 -2.1847 -1.8845 -1.8845 -1.8768 -1.8768 -1.7821 -1.7821 -1.7728 -1.7728 -0.0173 -0.0173 -0.0143 -0.0143 0.6889 0.6889 0.6897 0.6897 1.3061 1.3061 1.6158 1.6158 2.2934 2.2934 2.2947 2.2947 2.5939 2.5939 2.7738 2.7738 4.3818 4.3818 4.4519 4.4519 5.4124 5.4124 5.4145 5.4145 5.4372 5.4372 5.4376 5.4376 6.1814 6.1814 6.1837 6.1837 6.8700 6.8700 6.8755 6.8755 k = 0.0000 0.0000 0.2250 ( 8278 PWs) bands (ev): -13.8153 -13.8153 -13.7977 -13.7977 -11.1250 -11.1250 -11.1249 -11.1249 -8.9678 -8.9678 -8.9677 -8.9677 -6.6546 -6.6546 -6.6374 -6.6374 -6.5449 -6.5449 -6.5031 -6.5031 -3.6023 -3.6023 -3.4562 -3.4562 -2.1991 -2.1991 -2.1854 -2.1854 -1.8818 -1.8818 -1.8750 -1.8750 -1.7835 -1.7835 -1.7753 -1.7753 -0.0145 -0.0145 -0.0120 -0.0120 0.6845 0.6845 0.6851 0.6851 1.3268 1.3268 1.5884 1.5884 2.2932 2.2932 2.2944 2.2944 2.6075 2.6075 2.7595 2.7595 4.3993 4.3993 4.4576 4.4576 5.4124 5.4124 5.4141 5.4141 5.4363 5.4363 5.4367 5.4367 6.1732 6.1732 6.1778 6.1778 6.8710 6.8710 6.8757 6.8757 k = 0.0000 0.0000 0.2424 ( 8282 PWs) bands (ev): -13.8137 -13.8137 -13.7994 -13.7994 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9677 -8.9677 -6.6530 -6.6530 -6.6390 -6.6390 -6.5409 -6.5409 -6.5071 -6.5071 -3.5891 -3.5891 -3.4710 -3.4710 -2.1971 -2.1971 -2.1861 -2.1861 -1.8792 -1.8792 -1.8735 -1.8735 -1.7845 -1.7845 -1.7777 -1.7777 -0.0120 -0.0120 -0.0099 -0.0099 0.6806 0.6806 0.6811 0.6811 1.3489 1.3489 1.5606 1.5606 2.2931 2.2931 2.2940 2.2940 2.6217 2.6217 2.7447 2.7447 4.4153 4.4153 4.4618 4.4618 5.4123 5.4123 5.4137 5.4137 5.4357 5.4357 5.4360 5.4360 6.1665 6.1665 6.1720 6.1720 6.8717 6.8717 6.8756 6.8756 k = 0.0000 0.0000 0.2597 ( 8278 PWs) bands (ev): -13.8119 -13.8119 -13.8011 -13.8011 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6513 -6.6513 -6.6407 -6.6407 -6.5367 -6.5367 -6.5112 -6.5112 -3.5754 -3.5754 -3.4860 -3.4860 -2.1952 -2.1952 -2.1870 -2.1870 -1.8769 -1.8769 -1.8724 -1.8724 -1.7852 -1.7852 -1.7799 -1.7799 -0.0099 -0.0099 -0.0083 -0.0083 0.6774 0.6774 0.6778 0.6778 1.3723 1.3723 1.5325 1.5325 2.2930 2.2930 2.2937 2.2937 2.6364 2.6364 2.7294 2.7294 4.4295 4.4295 4.4642 4.4642 5.4123 5.4123 5.4133 5.4133 5.4352 5.4352 5.4355 5.4355 6.1613 6.1613 6.1666 6.1666 6.8724 6.8724 6.8754 6.8754 k = 0.0000 0.0000 0.2770 ( 8270 PWs) bands (ev): -13.8102 -13.8102 -13.8029 -13.8029 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6496 -6.6496 -6.6425 -6.6425 -6.5325 -6.5325 -6.5153 -6.5153 -3.5612 -3.5612 -3.5012 -3.5012 -2.1935 -2.1935 -2.1880 -2.1880 -1.8749 -1.8749 -1.8718 -1.8718 -1.7855 -1.7855 -1.7818 -1.7818 -0.0082 -0.0082 -0.0071 -0.0071 0.6751 0.6751 0.6754 0.6754 1.3970 1.3970 1.5044 1.5044 2.2930 2.2930 2.2935 2.2935 2.6515 2.6515 2.7139 2.7139 4.4415 4.4415 4.4646 4.4646 5.4124 5.4124 5.4130 5.4130 5.4348 5.4348 5.4350 5.4350 6.1580 6.1580 6.1621 6.1621 6.8730 6.8730 6.8750 6.8750 k = 0.0000 0.0000 0.2943 ( 8258 PWs) bands (ev): -13.8084 -13.8084 -13.8047 -13.8047 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6478 -6.6478 -6.6442 -6.6442 -6.5282 -6.5282 -6.5196 -6.5196 -3.5465 -3.5465 -3.5165 -3.5165 -2.1919 -2.1919 -2.1891 -2.1891 -1.8733 -1.8733 -1.8717 -1.8717 -1.7853 -1.7853 -1.7834 -1.7834 -0.0071 -0.0071 -0.0065 -0.0065 0.6737 0.6737 0.6739 0.6739 1.4227 1.4227 1.4766 1.4766 2.2930 2.2930 2.2933 2.2933 2.6669 2.6669 2.6983 2.6983 4.4511 4.4511 4.4626 4.4626 5.4124 5.4124 5.4128 5.4128 5.4346 5.4346 5.4348 5.4348 6.1565 6.1565 6.1587 6.1587 6.8735 6.8735 6.8745 6.8745 k = 0.0000 0.0000 0.3116 ( 8266 PWs) bands (ev): -13.8066 -13.8066 -13.8065 -13.8065 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6461 -6.6461 -6.6460 -6.6460 -6.5240 -6.5240 -6.5238 -6.5238 -3.5316 -3.5316 -3.5315 -3.5315 -2.1905 -2.1905 -2.1904 -2.1904 -1.8723 -1.8723 -1.8722 -1.8722 -1.7847 -1.7847 -1.7846 -1.7846 -0.0066 -0.0066 -0.0065 -0.0065 0.6733 0.6733 0.6734 0.6734 1.4492 1.4492 1.4493 1.4493 2.2931 2.2931 2.2932 2.2932 2.6825 2.6825 2.6826 2.6826 4.4581 4.4581 4.4581 4.4581 5.4125 5.4125 5.4126 5.4126 5.4346 5.4346 5.4347 5.4347 6.1567 6.1567 6.1568 6.1568 6.8740 6.8740 6.8741 6.8741 k = 0.0000 0.0000 0.3116 ( 8266 PWs) bands (ev): -13.8066 -13.8066 -13.8065 -13.8065 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6461 -6.6461 -6.6460 -6.6460 -6.5240 -6.5240 -6.5238 -6.5238 -3.5316 -3.5316 -3.5315 -3.5315 -2.1905 -2.1905 -2.1904 -2.1904 -1.8723 -1.8723 -1.8722 -1.8722 -1.7847 -1.7847 -1.7846 -1.7846 -0.0066 -0.0066 -0.0065 -0.0065 0.6733 0.6733 0.6734 0.6734 1.4492 1.4492 1.4493 1.4493 2.2931 2.2931 2.2932 2.2932 2.6825 2.6825 2.6826 2.6826 4.4581 4.4581 4.4581 4.4581 5.4125 5.4125 5.4126 5.4126 5.4346 5.4346 5.4347 5.4347 6.1567 6.1567 6.1568 6.1568 6.8740 6.8740 6.8741 6.8741 k = 0.0000 0.0179 0.3116 ( 8260 PWs) bands (ev): -13.8065 -13.8065 -13.8057 -13.8056 -11.1276 -11.1275 -11.1248 -11.1248 -8.9689 -8.9689 -8.9668 -8.9668 -6.6489 -6.6488 -6.6471 -6.6470 -6.5236 -6.5236 -6.5197 -6.5195 -3.5309 -3.5309 -3.5299 -3.5297 -2.1899 -2.1899 -2.1889 -2.1883 -1.8729 -1.8727 -1.8678 -1.8677 -1.7866 -1.7866 -1.7829 -1.7828 -0.0097 -0.0096 -0.0054 -0.0049 0.6715 0.6720 0.6742 0.6748 1.4498 1.4501 1.4527 1.4530 2.2815 2.2818 2.2932 2.2932 2.6798 2.6807 2.6814 2.6819 4.4577 4.4577 4.4603 4.4612 5.3759 5.3966 5.4085 5.4099 5.4291 5.4302 5.4445 5.4635 6.1582 6.1591 6.1593 6.1599 6.8670 6.8685 6.8729 6.8730 k = 0.0000 0.0357 0.3116 ( 8268 PWs) bands (ev): -13.8061 -13.8061 -13.8033 -13.8032 -11.1356 -11.1355 -11.1244 -11.1243 -8.9717 -8.9717 -8.9639 -8.9638 -6.6575 -6.6572 -6.6501 -6.6500 -6.5225 -6.5225 -6.5072 -6.5068 -3.5286 -3.5286 -3.5248 -3.5244 -2.1884 -2.1884 -2.1836 -2.1824 -1.8746 -1.8741 -1.8547 -1.8544 -1.7925 -1.7925 -1.7775 -1.7773 -0.0190 -0.0188 -0.0014 -0.0004 0.6667 0.6679 0.6774 0.6784 1.4517 1.4523 1.4628 1.4636 2.2472 2.2477 2.2935 2.2935 2.6724 2.6743 2.6784 2.6795 4.4565 4.4567 4.4677 4.4695 5.3300 5.3513 5.3912 5.3932 5.4212 5.4228 5.4695 5.4875 6.1634 6.1653 6.1673 6.1685 6.8479 6.8506 6.8692 6.8694 k = 0.0000 0.0536 0.3116 ( 8274 PWs) bands (ev): -13.8054 -13.8054 -13.7993 -13.7992 -11.1489 -11.1486 -11.1236 -11.1235 -8.9764 -8.9764 -8.9591 -8.9589 -6.6716 -6.6713 -6.6550 -6.6549 -6.5207 -6.5206 -6.4865 -6.4859 -3.5249 -3.5248 -3.5162 -3.5156 -2.1859 -2.1859 -2.1746 -2.1728 -1.8772 -1.8766 -1.8339 -1.8334 -1.8015 -1.8014 -1.7681 -1.7678 -0.0343 -0.0340 0.0054 0.0070 0.6591 0.6608 0.6828 0.6843 1.4549 1.4558 1.4795 1.4806 2.1913 2.1921 2.2941 2.2941 2.6605 2.6633 2.6738 2.6753 4.4546 4.4549 4.4802 4.4830 5.2743 5.2959 5.3551 5.3568 5.4172 5.4184 5.4910 5.5078 6.1721 6.1750 6.1803 6.1820 6.8170 6.8205 6.8633 6.8636 k = 0.0000 0.0714 0.3116 ( 8274 PWs) bands (ev): -13.8044 -13.8044 -13.7937 -13.7936 -11.1671 -11.1668 -11.1225 -11.1224 -8.9829 -8.9829 -8.9523 -8.9521 -6.6911 -6.6906 -6.6617 -6.6616 -6.5183 -6.5181 -6.4579 -6.4570 -3.5197 -3.5196 -3.5041 -3.5032 -2.1828 -2.1828 -2.1623 -2.1598 -1.8810 -1.8802 -1.8187 -1.8187 -1.8008 -1.8005 -1.7535 -1.7530 -0.0550 -0.0547 0.0151 0.0171 0.6489 0.6511 0.6905 0.6926 1.4593 1.4604 1.5020 1.5035 2.1153 2.1166 2.2949 2.2949 2.6442 2.6479 2.6674 2.6695 4.4519 4.4522 4.4977 4.5014 5.2080 5.2297 5.3032 5.3048 5.4140 5.4149 5.5102 5.5256 6.1839 6.1876 6.1975 6.1997 6.7751 6.7789 6.8550 6.8554 k = 0.0000 0.0893 0.3116 ( 8278 PWs) bands (ev): -13.8033 -13.8032 -13.7865 -13.7864 -11.1900 -11.1896 -11.1211 -11.1210 -8.9911 -8.9910 -8.9436 -8.9434 -6.7156 -6.7150 -6.6702 -6.6700 -6.5151 -6.5150 -6.4216 -6.4206 -3.5133 -3.5132 -3.4884 -3.4874 -2.1793 -2.1792 -2.1470 -2.1438 -1.8864 -1.8856 -1.8308 -1.8303 -1.7729 -1.7723 -1.7295 -1.7288 -0.0807 -0.0803 0.0276 0.0302 0.6362 0.6390 0.7004 0.7031 1.4648 1.4660 1.5296 1.5317 2.0214 2.0233 2.2959 2.2960 2.6238 2.6284 2.6595 2.6620 4.4481 4.4487 4.5201 4.5246 5.1307 5.1525 5.2378 5.2392 5.4104 5.4112 5.5281 5.5422 6.1979 6.2022 6.2184 6.2208 6.7228 6.7268 6.8445 6.8450 k = 0.0000 0.1071 0.3116 ( 8282 PWs) bands (ev): -13.8018 -13.8018 -13.7779 -13.7777 -11.2172 -11.2167 -11.1194 -11.1193 -9.0008 -9.0007 -8.9330 -8.9327 -6.7449 -6.7442 -6.6804 -6.6801 -6.5114 -6.5113 -6.3782 -6.3770 -3.5058 -3.5056 -3.4692 -3.4679 -2.1759 -2.1757 -2.1293 -2.1253 -1.8941 -1.8937 -1.8442 -1.8430 -1.7471 -1.7465 -1.6905 -1.6896 -0.1108 -0.1104 0.0430 0.0460 0.6214 0.6246 0.7127 0.7160 1.4711 1.4723 1.5613 1.5642 1.9118 1.9148 2.2971 2.2972 2.5996 2.6050 2.6500 2.6530 4.4432 4.4440 4.5470 4.5524 5.0425 5.0644 5.1605 5.1618 5.4064 5.4070 5.5454 5.5582 6.2133 6.2178 6.2428 6.2451 6.6611 6.6649 6.8319 6.8324 k = 0.0000 0.1250 0.3116 ( 8302 PWs) bands (ev): -13.8002 -13.8002 -13.7678 -13.7676 -11.2483 -11.2478 -11.1175 -11.1174 -9.0119 -9.0118 -8.9206 -8.9202 -6.7784 -6.7777 -6.6920 -6.6917 -6.5072 -6.5071 -6.3282 -6.3267 -3.4972 -3.4970 -3.4464 -3.4449 -2.1733 -2.1730 -2.1102 -2.1055 -1.9054 -1.9053 -1.8541 -1.8519 -1.7247 -1.7240 -1.6379 -1.6367 -0.1447 -0.1442 0.0611 0.0646 0.6046 0.6083 0.7274 0.7312 1.4778 1.4784 1.5954 1.6003 1.7890 1.7947 2.2985 2.2986 2.5719 2.5780 2.6391 2.6426 4.4371 4.4382 4.5781 4.5845 4.9439 4.9659 5.0730 5.0743 5.4017 5.4023 5.5627 5.5743 6.2288 6.2332 6.2704 6.2724 6.5908 6.5946 6.8172 6.8177 k = 0.0000 0.1429 0.3116 ( 8302 PWs) bands (ev): -13.7983 -13.7983 -13.7563 -13.7560 -11.2830 -11.2824 -11.1153 -11.1152 -9.0243 -9.0241 -8.9063 -8.9059 -6.8159 -6.8150 -6.7048 -6.7045 -6.5026 -6.5024 -6.2721 -6.2705 -3.4879 -3.4877 -3.4200 -3.4181 -2.1727 -2.1722 -2.0914 -2.0858 -1.9198 -1.9191 -1.8580 -1.8549 -1.7027 -1.7018 -1.5756 -1.5742 -0.1818 -0.1813 0.0820 0.0860 0.5860 0.5902 0.7444 0.7489 1.4817 1.4830 1.6182 1.6369 1.6592 1.6808 2.3001 2.3002 2.5409 2.5478 2.6268 2.6309 4.4294 4.4310 4.6130 4.6204 4.8356 4.8577 4.9771 4.9783 5.3966 5.3970 5.5804 5.5909 6.2437 6.2478 6.3013 6.3027 6.5132 6.5168 6.8005 6.8010 k = 0.0000 0.1607 0.3116 ( 8302 PWs) bands (ev): -13.7963 -13.7963 -13.7434 -13.7432 -11.3206 -11.3199 -11.1129 -11.1128 -9.0377 -9.0375 -8.8903 -8.8899 -6.8568 -6.8559 -6.7188 -6.7185 -6.4975 -6.4973 -6.2106 -6.2088 -3.4780 -3.4777 -3.3898 -3.3877 -2.1758 -2.1750 -2.0749 -2.0688 -1.9332 -1.9321 -1.8547 -1.8511 -1.6799 -1.6790 -1.5058 -1.5041 -0.2216 -0.2211 0.1057 0.1101 0.5661 0.5706 0.7639 0.7690 1.4568 1.4667 1.5362 1.5436 1.6812 1.6855 2.3018 2.3020 2.5071 2.5147 2.6134 2.6180 4.4198 4.4221 4.6503 4.6593 4.7183 4.7406 4.8750 4.8765 5.3909 5.3913 5.5986 5.6081 6.2575 6.2612 6.3350 6.3358 6.4295 6.4330 6.7820 6.7824 k = 0.0000 0.1786 0.3116 ( 8320 PWs) bands (ev): -13.7941 -13.7941 -13.7293 -13.7291 -11.3607 -11.3601 -11.1104 -11.1103 -9.0520 -9.0518 -8.8726 -8.8721 -6.9007 -6.8997 -6.7338 -6.7334 -6.4922 -6.4920 -6.1444 -6.1424 -3.4676 -3.4673 -3.3560 -3.3534 -2.1846 -2.1835 -2.0630 -2.0568 -1.9421 -1.9407 -1.8433 -1.8396 -1.6563 -1.6553 -1.4295 -1.4275 -0.2637 -0.2631 0.1319 0.1368 0.5449 0.5498 0.7859 0.7917 1.3360 1.3431 1.5166 1.5239 1.7237 1.7252 2.3037 2.3038 2.4709 2.4792 2.5990 2.6040 4.4077 4.4111 4.5931 4.6150 4.6844 4.6972 4.7727 4.7768 5.3848 5.3852 5.6174 5.6261 6.2701 6.2735 6.3389 6.3414 6.3738 6.3745 6.7617 6.7621 k = 0.0000 0.1964 0.3116 ( 8316 PWs) bands (ev): -13.7918 -13.7918 -13.7141 -13.7138 -11.4029 -11.4022 -11.1076 -11.1076 -9.0669 -9.0668 -8.8532 -8.8526 -6.9471 -6.9461 -6.7494 -6.7490 -6.4866 -6.4864 -6.0741 -6.0721 -3.4569 -3.4566 -3.3184 -3.3154 -2.2006 -2.1991 -2.0567 -2.0507 -1.9447 -1.9430 -1.8226 -1.8193 -1.6320 -1.6308 -1.3477 -1.3453 -0.3074 -0.3068 0.1607 0.1660 0.5227 0.5279 0.8105 0.8170 1.1825 1.1873 1.5231 1.5290 1.7672 1.7678 2.3056 2.3058 2.4327 2.4416 2.5837 2.5892 4.3916 4.3968 4.4608 4.4831 4.6407 4.6503 4.7545 4.7562 5.3782 5.3786 5.6371 5.6450 6.2452 6.2487 6.2845 6.2867 6.4117 6.4124 6.7398 6.7402 k = 0.0000 0.2143 0.3116 ( 8312 PWs) bands (ev): -13.7894 -13.7894 -13.6978 -13.6975 -11.4466 -11.4459 -11.1048 -11.1047 -9.0823 -9.0822 -8.8322 -8.8316 -6.9956 -6.9945 -6.7655 -6.7651 -6.4809 -6.4807 -6.0006 -5.9984 -3.4462 -3.4459 -3.2770 -3.2736 -2.2241 -2.2221 -2.0545 -2.0490 -1.9416 -1.9399 -1.7928 -1.7903 -1.6072 -1.6060 -1.2611 -1.2584 -0.3524 -0.3518 0.1919 0.1975 0.4998 0.5052 0.8377 0.8450 1.0206 1.0245 1.5322 1.5376 1.8110 1.8111 2.3076 2.3078 2.3930 2.4024 2.5676 2.5735 4.3224 4.3446 4.3670 4.3763 4.5382 4.5483 4.7957 4.8011 5.3713 5.3717 5.6575 5.6648 6.1503 6.1535 6.2968 6.2989 6.4527 6.4539 6.7164 6.7168 k = 0.0000 0.2321 0.3116 ( 8306 PWs) bands (ev): -13.7870 -13.7869 -13.6806 -13.6803 -11.4913 -11.4906 -11.1019 -11.1018 -9.0980 -9.0979 -8.8098 -8.8092 -7.0456 -7.0445 -6.7819 -6.7815 -6.4751 -6.4749 -5.9247 -5.9223 -3.4357 -3.4354 -3.2319 -3.2279 -2.2539 -2.2514 -2.0549 -2.0500 -1.9342 -1.9326 -1.7552 -1.7536 -1.5823 -1.5810 -1.1706 -1.1675 -0.3983 -0.3977 0.2252 0.2312 0.4762 0.4818 0.8528 0.8546 0.8691 0.8789 1.5420 1.5472 1.8544 1.8545 2.3093 2.3096 2.3524 2.3622 2.5510 2.5573 4.1788 4.2014 4.3210 4.3348 4.4486 4.4626 4.8433 4.8499 5.3641 5.3644 5.6788 5.6854 6.0532 6.0563 6.3113 6.3131 6.4957 6.4972 6.6917 6.6922 k = 0.0000 0.2500 0.3116 ( 8310 PWs) bands (ev): -13.7844 -13.7844 -13.6627 -13.6624 -11.5366 -11.5358 -11.0989 -11.0989 -9.1138 -9.1137 -8.7860 -8.7854 -7.0968 -7.0956 -6.7984 -6.7980 -6.4694 -6.4691 -5.8470 -5.8446 -3.4254 -3.4251 -3.1832 -3.1785 -2.2880 -2.2849 -2.0572 -2.0528 -1.9233 -1.9218 -1.7117 -1.7110 -1.5575 -1.5562 -1.0771 -1.0735 -0.4447 -0.4440 0.2603 0.2666 0.4522 0.4577 0.6846 0.6878 0.9014 0.9108 1.5521 1.5571 1.8970 1.8974 2.3043 2.3087 2.3177 2.3240 2.5340 2.5407 4.0310 4.0539 4.2389 4.2512 4.3991 4.4112 4.8925 4.8997 5.3565 5.3568 5.7007 5.7068 5.9557 5.9587 6.3282 6.3298 6.5401 6.5420 6.6659 6.6665 k = 0.0000 0.2679 0.3116 ( 8298 PWs) bands (ev): -13.7819 -13.7819 -13.6442 -13.6439 -11.5818 -11.5811 -11.0960 -11.0959 -9.1295 -9.1293 -8.7611 -8.7604 -7.1485 -7.1473 -6.8148 -6.8144 -6.4637 -6.4634 -5.7686 -5.7661 -3.4156 -3.4153 -3.1310 -3.1255 -2.3245 -2.3206 -2.0611 -2.0572 -1.9092 -1.9077 -1.6640 -1.6640 -1.5332 -1.5318 -0.9814 -0.9774 -0.4912 -0.4904 0.2970 0.3036 0.4269 0.4309 0.5151 0.5197 0.9379 0.9482 1.5622 1.5671 1.9386 1.9391 2.2664 2.2769 2.3157 2.3163 2.5168 2.5238 3.8798 3.9030 4.1350 4.1441 4.3727 4.3816 4.9421 4.9496 5.3485 5.3489 5.7234 5.7289 5.8590 5.8619 6.3485 6.3498 6.5856 6.5873 6.6392 6.6403 k = 0.0000 0.2857 0.3116 ( 8308 PWs) bands (ev): -13.7794 -13.7794 -13.6253 -13.6250 -11.6266 -11.6259 -11.0930 -11.0929 -9.1448 -9.1446 -8.7351 -8.7344 -7.2004 -7.1992 -6.8308 -6.8305 -6.4581 -6.4579 -5.6902 -5.6877 -3.4064 -3.4062 -3.0758 -3.0694 -2.3616 -2.3566 -2.0662 -2.0628 -1.8922 -1.8908 -1.6140 -1.6134 -1.5097 -1.5083 -0.8847 -0.8803 -0.5374 -0.5365 0.3338 0.3364 0.3386 0.3424 0.4092 0.4183 0.9781 0.9894 1.5721 1.5769 1.9787 1.9793 2.2247 2.2358 2.3176 2.3181 2.4995 2.5068 3.7261 3.7496 4.0252 4.0325 4.3523 4.3592 4.9909 4.9986 5.3400 5.3404 5.7466 5.7516 5.7646 5.7675 6.3727 6.3739 6.6102 6.6114 6.6320 6.6363 k = 0.0000 0.3036 0.3116 ( 8308 PWs) bands (ev): -13.7770 -13.7770 -13.6063 -13.6059 -11.6704 -11.6697 -11.0901 -11.0901 -9.1596 -9.1594 -8.7083 -8.7076 -7.2520 -7.2508 -6.8463 -6.8460 -6.4527 -6.4525 -5.6129 -5.6103 -3.3980 -3.3977 -3.0184 -3.0107 -2.3974 -2.3910 -2.0722 -2.0692 -1.8730 -1.8715 -1.5622 -1.5611 -1.4872 -1.4858 -0.7882 -0.7834 -0.5827 -0.5816 0.1687 0.1698 0.3701 0.3779 0.3869 0.3935 1.0222 1.0346 1.5818 1.5864 2.0169 2.0177 2.1833 2.1948 2.3198 2.3202 2.4823 2.4898 3.5706 3.5945 3.9159 3.9220 4.3336 4.3393 5.0381 5.0457 5.3307 5.3312 5.6737 5.6764 5.7704 5.7751 6.4013 6.4024 6.5834 6.5838 6.6781 6.6812 k = 0.0000 0.3214 0.3116 ( 8298 PWs) bands (ev): -13.7746 -13.7746 -13.5873 -13.5870 -11.7128 -11.7121 -11.0873 -11.0873 -9.1737 -9.1736 -8.6809 -8.6802 -7.3028 -7.3016 -6.8612 -6.8608 -6.4476 -6.4474 -5.5374 -5.5348 -3.3904 -3.3902 -2.9600 -2.9507 -2.4297 -2.4217 -2.0787 -2.0762 -1.8518 -1.8502 -1.5096 -1.5082 -1.4659 -1.4644 -0.6950 -0.6903 -0.6249 -0.6231 -0.0006 0.0009 0.3589 0.3666 0.4138 0.4201 1.0708 1.0842 1.5911 1.5956 2.0529 2.0538 2.1429 2.1547 2.3221 2.3225 2.4655 2.4730 3.4142 3.4384 3.8100 3.8153 4.3155 4.3203 5.0829 5.0903 5.3199 5.3205 5.5884 5.5908 5.7945 5.7989 6.4344 6.4351 6.5551 6.5564 6.7239 6.7267 k = 0.0000 0.3393 0.3116 ( 8298 PWs) bands (ev): -13.7724 -13.7724 -13.5687 -13.5684 -11.7531 -11.7525 -11.0847 -11.0846 -9.1870 -9.1869 -8.6533 -8.6526 -7.3522 -7.3510 -6.8751 -6.8748 -6.4429 -6.4427 -5.4647 -5.4622 -3.3837 -3.3836 -2.9031 -2.8918 -2.4557 -2.4455 -2.0855 -2.0832 -1.8290 -1.8273 -1.4572 -1.4562 -1.4462 -1.4441 -0.6761 -0.6748 -0.5940 -0.5881 -0.1678 -0.1660 0.3372 0.3445 0.4516 0.4580 1.1243 1.1387 1.5999 1.6042 2.0855 2.0871 2.1048 2.1163 2.3243 2.3249 2.4491 2.4567 3.2575 3.2822 3.7092 3.7140 4.2979 4.3022 5.1245 5.1315 5.3062 5.3070 5.5111 5.5132 5.8188 5.8229 6.4701 6.4716 6.5267 6.5309 6.7689 6.7713 k = 0.0000 0.3571 0.3116 ( 8296 PWs) bands (ev): -13.7703 -13.7703 -13.5508 -13.5505 -11.7911 -11.7905 -11.0822 -11.0822 -9.1994 -9.1992 -8.6259 -8.6251 -7.3996 -7.3985 -6.8881 -6.8878 -6.4385 -6.4383 -5.3960 -5.3935 -3.3781 -3.3780 -2.8516 -2.8383 -2.4707 -2.4581 -2.0921 -2.0902 -1.8050 -1.8032 -1.4281 -1.4273 -1.4062 -1.4037 -0.7163 -0.7145 -0.5067 -0.5004 -0.3314 -0.3291 0.3163 0.3233 0.4887 0.4948 1.1833 1.1987 1.6082 1.6123 2.0663 2.0790 2.1177 2.1184 2.3266 2.3272 2.4334 2.4409 3.1013 3.1266 3.6151 3.6193 4.2811 4.2847 5.1623 5.1687 5.2866 5.2877 5.4458 5.4474 5.8431 5.8468 6.4869 6.4971 6.5137 6.5272 6.8124 6.8142 k = 0.0000 0.3750 0.3116 ( 8304 PWs) bands (ev): -13.7684 -13.7684 -13.5338 -13.5335 -11.8260 -11.8255 -11.0800 -11.0799 -9.2106 -9.2104 -8.5990 -8.5983 -7.4445 -7.4434 -6.8998 -6.8996 -6.4345 -6.4343 -5.3320 -5.3297 -3.3734 -3.3734 -2.8111 -2.7964 -2.4682 -2.4539 -2.0984 -2.0968 -1.7800 -1.7781 -1.4118 -1.4109 -1.3575 -1.3552 -0.7569 -0.7543 -0.4912 -0.4893 -0.4205 -0.4152 0.2967 0.3032 0.5239 0.5297 1.2483 1.2645 1.6159 1.6196 2.0320 2.0450 2.1451 2.1459 2.3289 2.3296 2.4186 2.4258 2.9466 2.9725 3.5288 3.5326 4.2651 4.2683 5.1958 5.2016 5.2570 5.2585 5.3977 5.3987 5.8671 5.8705 6.4662 6.4703 6.5555 6.5636 6.8535 6.8544 k = 0.0000 0.3929 0.3116 ( 8308 PWs) bands (ev): -13.7667 -13.7667 -13.5181 -13.5179 -11.8576 -11.8571 -11.0779 -11.0779 -9.2205 -9.2204 -8.5733 -8.5727 -7.4860 -7.4851 -6.9103 -6.9100 -6.4309 -6.4308 -5.2739 -5.2718 -3.3698 -3.3698 -2.7862 -2.7720 -2.4430 -2.4288 -2.1042 -2.1028 -1.7540 -1.7519 -1.3974 -1.3965 -1.3124 -1.3102 -0.7988 -0.7945 -0.6409 -0.6369 -0.3442 -0.3384 0.2787 0.2847 0.5566 0.5618 1.3200 1.3367 1.6229 1.6262 2.0005 2.0140 2.1693 2.1702 2.3313 2.3322 2.4047 2.4115 2.7941 2.8207 3.4516 3.4549 4.2504 4.2532 5.2150 5.2171 5.2270 5.2319 5.3680 5.3684 5.8904 5.8934 6.4411 6.4438 6.5981 6.6055 6.8905 6.8908 k = 0.0000 0.4107 0.3116 ( 8300 PWs) bands (ev): -13.7652 -13.7652 -13.5041 -13.5039 -11.8852 -11.8848 -11.0762 -11.0761 -9.2291 -9.2290 -8.5495 -8.5489 -7.5234 -7.5226 -6.9193 -6.9191 -6.4279 -6.4277 -5.2226 -5.2207 -3.3672 -3.3672 -2.7764 -2.7643 -2.3968 -2.3844 -2.1093 -2.1081 -1.7267 -1.7245 -1.3850 -1.3843 -1.2719 -1.2700 -0.8564 -0.8494 -0.7660 -0.7594 -0.2752 -0.2697 0.2627 0.2681 0.5858 0.5905 1.3987 1.4155 1.6290 1.6319 1.9723 1.9866 2.1900 2.1909 2.3337 2.3348 2.3917 2.3982 2.6449 2.6723 3.3844 3.3873 4.2373 4.2396 5.1730 5.1747 5.2502 5.2546 5.3508 5.3511 5.9124 5.9151 6.4167 6.4189 6.6386 6.6458 6.9209 6.9224 k = 0.0000 0.4286 0.3116 ( 8296 PWs) bands (ev): -13.7640 -13.7639 -13.4921 -13.4919 -11.9086 -11.9082 -11.0747 -11.0746 -9.2363 -9.2362 -8.5283 -8.5278 -7.5559 -7.5551 -6.9268 -6.9267 -6.4253 -6.4252 -5.1791 -5.1775 -3.3654 -3.3653 -2.7764 -2.7671 -2.3383 -2.3283 -2.1135 -2.1126 -1.6976 -1.6954 -1.3748 -1.3742 -1.2376 -1.2360 -0.9606 -0.9563 -0.8257 -0.8217 -0.2161 -0.2112 0.2491 0.2536 0.6110 0.6149 1.4846 1.5008 1.6343 1.6367 1.9479 1.9634 2.2071 2.2079 2.3363 2.3377 2.3792 2.3853 2.5011 2.5292 3.3283 3.3306 4.2261 4.2280 5.1326 5.1341 5.2702 5.2738 5.3405 5.3406 5.9326 5.9349 6.3945 6.3963 6.6746 6.6815 6.9441 6.9467 k = 0.0000 0.4464 0.3116 ( 8296 PWs) bands (ev): -13.7630 -13.7630 -13.4824 -13.4822 -11.9271 -11.9269 -11.0735 -11.0735 -9.2419 -9.2419 -8.5105 -8.5101 -7.5824 -7.5818 -6.9328 -6.9326 -6.4233 -6.4232 -5.1442 -5.1429 -3.3642 -3.3642 -2.7807 -2.7741 -2.2774 -2.2698 -2.1167 -2.1161 -1.6658 -1.6637 -1.3668 -1.3663 -1.2120 -1.2111 -1.0781 -1.0756 -0.8540 -0.8521 -0.1682 -0.1642 0.2381 0.2417 0.6315 0.6345 1.5771 1.5917 1.6386 1.6404 1.9274 1.9448 2.2204 2.2211 2.3390 2.3405 2.3480 2.3642 2.3843 2.4022 3.2838 3.2856 4.2171 4.2185 5.0989 5.1001 5.2858 5.2885 5.3340 5.3341 5.9501 5.9519 6.3755 6.3769 6.7044 6.7103 6.9603 6.9633 k = 0.0000 0.4643 0.3116 ( 8288 PWs) bands (ev): -13.7623 -13.7622 -13.4752 -13.4751 -11.9407 -11.9405 -11.0727 -11.0726 -9.2460 -9.2460 -8.4971 -8.4968 -7.6021 -7.6017 -6.9370 -6.9369 -6.4219 -6.4218 -5.1186 -5.1177 -3.3636 -3.3635 -2.7856 -2.7813 -2.2238 -2.2186 -2.1188 -2.1184 -1.6307 -1.6289 -1.3610 -1.3607 -1.2168 -1.2168 -1.1615 -1.1594 -0.8722 -0.8712 -0.1329 -0.1301 0.2302 0.2327 0.6466 0.6487 1.6418 1.6431 1.6745 1.6852 1.9102 1.9308 2.2290 2.2299 2.2308 2.2579 2.3427 2.3449 2.3658 2.3712 3.2518 3.2530 4.2106 4.2115 5.0739 5.0747 5.2970 5.2988 5.3299 5.3299 5.9638 5.9651 6.3609 6.3618 6.7266 6.7310 6.9706 6.9732 k = 0.0000 0.4821 0.3116 ( 8288 PWs) bands (ev): -13.7618 -13.7618 -13.4708 -13.4707 -11.9489 -11.9488 -11.0721 -11.0721 -9.2485 -9.2485 -8.4886 -8.4884 -7.6143 -7.6141 -6.9396 -6.9396 -6.4210 -6.4210 -5.1029 -5.1025 -3.3633 -3.3632 -2.7888 -2.7868 -2.1865 -2.1839 -2.1196 -2.1194 -1.5962 -1.5951 -1.3575 -1.3573 -1.2836 -1.2835 -1.1650 -1.1642 -0.8829 -0.8824 -0.1110 -0.1095 0.2256 0.2269 0.6561 0.6572 1.6439 1.6445 1.7701 1.7728 1.8946 1.9177 2.1261 2.1505 2.2358 2.2360 2.3467 2.3494 2.3578 2.3620 3.2325 3.2331 4.2067 4.2072 5.0586 5.0590 5.3038 5.3047 5.3276 5.3276 5.9728 5.9734 6.3516 6.3521 6.7407 6.7430 6.9766 6.9780 k = 0.0000 0.5000 0.3116 ( 8284 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9516 -11.9516 -11.0720 -11.0720 -9.2493 -9.2493 -8.4857 -8.4857 -7.6184 -7.6184 -6.9404 -6.9404 -6.4207 -6.4207 -5.0975 -5.0975 -3.3632 -3.3632 -2.7893 -2.7893 -2.1725 -2.1725 -2.1196 -2.1196 -1.5789 -1.5789 -1.3563 -1.3563 -1.3161 -1.3161 -1.1619 -1.1619 -0.8862 -0.8862 -0.1031 -0.1031 0.2245 0.2245 0.6597 0.6597 1.6448 1.6448 1.8236 1.8236 1.8921 1.8921 2.0905 2.0905 2.2378 2.2378 2.3515 2.3515 2.3552 2.3552 3.2262 3.2262 4.2055 4.2055 5.0536 5.0536 5.3064 5.3064 5.3269 5.3269 5.9761 5.9761 6.3485 6.3485 6.7462 6.7462 6.9790 6.9790 k = 0.0000 0.5000 0.3116 ( 8284 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9516 -11.9516 -11.0720 -11.0720 -9.2493 -9.2493 -8.4857 -8.4857 -7.6184 -7.6184 -6.9404 -6.9404 -6.4207 -6.4207 -5.0975 -5.0975 -3.3632 -3.3632 -2.7893 -2.7893 -2.1725 -2.1725 -2.1196 -2.1196 -1.5789 -1.5789 -1.3563 -1.3563 -1.3161 -1.3161 -1.1619 -1.1619 -0.8862 -0.8862 -0.1031 -0.1031 0.2245 0.2245 0.6597 0.6597 1.6448 1.6448 1.8236 1.8236 1.8921 1.8921 2.0905 2.0905 2.2378 2.2378 2.3515 2.3515 2.3552 2.3552 3.2262 3.2262 4.2055 4.2055 5.0536 5.0536 5.3064 5.3064 5.3269 5.3269 5.9761 5.9761 6.3485 6.3485 6.7462 6.7462 6.9790 6.9790 k = 0.0179 0.5000 0.3116 ( 8288 PWs) bands (ev): -13.7609 -13.7609 -13.4692 -13.4692 -11.9514 -11.9514 -11.0747 -11.0746 -9.2483 -9.2483 -8.4866 -8.4865 -7.6194 -7.6194 -6.9434 -6.9433 -6.4165 -6.4163 -5.0970 -5.0969 -3.3616 -3.3614 -2.7881 -2.7881 -2.1711 -2.1710 -2.1152 -2.1151 -1.5776 -1.5774 -1.3614 -1.3604 -1.3145 -1.3138 -1.1611 -1.1609 -0.8846 -0.8842 -0.1040 -0.1036 0.2255 0.2259 0.6570 0.6572 1.6458 1.6460 1.8227 1.8230 1.8926 1.8930 2.0898 2.0899 2.2325 2.2343 2.3423 2.3426 2.3549 2.3559 3.2269 3.2274 4.2077 4.2085 5.0510 5.0511 5.3061 5.3061 5.3179 5.3193 5.9682 5.9683 6.3404 6.3408 6.7495 6.7495 6.9786 6.9787 k = 0.0357 0.5000 0.3116 ( 8292 PWs) bands (ev): -13.7585 -13.7584 -13.4688 -13.4688 -11.9508 -11.9508 -11.0826 -11.0825 -9.2454 -9.2453 -8.4892 -8.4892 -7.6226 -7.6225 -6.9520 -6.9518 -6.4038 -6.4034 -5.0954 -5.0953 -3.3568 -3.3563 -2.7844 -2.7843 -2.1670 -2.1667 -2.1021 -2.1019 -1.5733 -1.5728 -1.3740 -1.3724 -1.3105 -1.3095 -1.1584 -1.1580 -0.8793 -0.8784 -0.1063 -0.1054 0.2291 0.2299 0.6491 0.6495 1.6487 1.6491 1.8201 1.8207 1.8945 1.8954 2.0878 2.0879 2.2195 2.2229 2.3092 2.3094 2.3612 2.3622 3.2294 3.2303 4.2150 4.2165 5.0432 5.0434 5.2926 5.2953 5.3053 5.3053 5.9450 5.9452 6.3166 6.3174 6.7593 6.7594 6.9773 6.9774 k = 0.0536 0.5000 0.3116 ( 8292 PWs) bands (ev): -13.7545 -13.7544 -13.4682 -13.4682 -11.9499 -11.9499 -11.0958 -11.0955 -9.2404 -9.2403 -8.4936 -8.4936 -7.6278 -7.6277 -6.9662 -6.9659 -6.3827 -6.3821 -5.0928 -5.0927 -3.3486 -3.3479 -2.7782 -2.7782 -2.1604 -2.1600 -2.0800 -2.0797 -1.5660 -1.5652 -1.3923 -1.3904 -1.3057 -1.3047 -1.1539 -1.1533 -0.8702 -0.8689 -0.1099 -0.1086 0.2353 0.2365 0.6363 0.6370 1.6525 1.6531 1.8160 1.8168 1.8985 1.9002 2.0843 2.0846 2.2005 2.2050 2.2548 2.2553 2.3701 2.3710 3.2337 3.2350 4.2272 4.2295 5.0296 5.0301 5.2523 5.2561 5.3037 5.3037 5.9069 5.9072 6.2777 6.2790 6.7754 6.7756 6.9740 6.9743 k = 0.0714 0.5000 0.3116 ( 8296 PWs) bands (ev): -13.7490 -13.7489 -13.4673 -13.4673 -11.9487 -11.9487 -11.1138 -11.1135 -9.2335 -9.2333 -8.4997 -8.4996 -7.6349 -7.6348 -6.9858 -6.9854 -6.3536 -6.3527 -5.0893 -5.0891 -3.3372 -3.3361 -2.7698 -2.7697 -2.1517 -2.1512 -2.0493 -2.0489 -1.5556 -1.5545 -1.4155 -1.4134 -1.3008 -1.2999 -1.1478 -1.1471 -0.8574 -0.8556 -0.1149 -0.1131 0.2440 0.2456 0.6191 0.6199 1.6558 1.6566 1.8101 1.8113 1.9056 1.9082 2.0791 2.0797 2.1768 2.1771 2.1826 2.1863 2.3803 2.3809 3.2398 3.2415 4.2444 4.2473 5.0092 5.0102 5.1990 5.2035 5.3014 5.3015 5.8549 5.8552 6.2249 6.2265 6.7975 6.7978 6.9681 6.9687 k = 0.0893 0.5000 0.3116 ( 8296 PWs) bands (ev): -13.7419 -13.7418 -13.4663 -13.4663 -11.9471 -11.9471 -11.1366 -11.1361 -9.2246 -9.2244 -8.5073 -8.5072 -7.6439 -7.6438 -7.0105 -7.0099 -6.3166 -6.3156 -5.0848 -5.0846 -3.3224 -3.3211 -2.7592 -2.7591 -2.1411 -2.1405 -2.0102 -2.0096 -1.5418 -1.5405 -1.4431 -1.4409 -1.2958 -1.2952 -1.1402 -1.1393 -0.8409 -0.8387 -0.1211 -0.1189 0.2553 0.2573 0.5977 0.5987 1.6571 1.6580 1.8026 1.8041 1.9160 1.9204 2.0655 2.0678 2.0951 2.1001 2.1497 2.1566 2.3908 2.3911 3.2475 3.2498 4.2662 4.2697 4.9790 4.9809 5.1369 5.1416 5.2983 5.2983 5.7901 5.7904 6.1592 6.1611 6.8252 6.8256 6.9594 6.9606 k = 0.1071 0.5000 0.3116 ( 8308 PWs) bands (ev): -13.7334 -13.7332 -13.4650 -13.4650 -11.9452 -11.9452 -11.1636 -11.1631 -9.2139 -9.2136 -8.5164 -8.5163 -7.6546 -7.6544 -7.0399 -7.0393 -6.2724 -6.2712 -5.0795 -5.0792 -3.3043 -3.3026 -2.7466 -2.7465 -2.1289 -2.1282 -1.9632 -1.9625 -1.5247 -1.5231 -1.4750 -1.4726 -1.2908 -1.2903 -1.1310 -1.1301 -0.8207 -0.8180 -0.1285 -0.1259 0.2692 0.2717 0.5727 0.5738 1.6552 1.6562 1.7933 1.7952 1.9242 1.9373 1.9776 1.9866 2.0723 2.0739 2.1193 2.1267 2.4012 2.4015 3.2569 3.2597 4.2923 4.2964 4.9325 4.9362 5.0742 5.0779 5.2942 5.2942 5.7137 5.7141 6.0821 6.0843 6.8579 6.8585 6.9486 6.9506 k = 0.1250 0.5000 0.3116 ( 8304 PWs) bands (ev): -13.7234 -13.7232 -13.4635 -13.4635 -11.9430 -11.9429 -11.1944 -11.1939 -9.2012 -9.2008 -8.5267 -8.5266 -7.6669 -7.6667 -7.0737 -7.0730 -6.2214 -6.2200 -5.0735 -5.0732 -3.2828 -3.2808 -2.7323 -2.7322 -2.1153 -2.1145 -1.9089 -1.9081 -1.5107 -1.5083 -1.5038 -1.5017 -1.2857 -1.2853 -1.1206 -1.1195 -0.7968 -0.7937 -0.1371 -0.1340 0.2858 0.2887 0.5444 0.5457 1.6495 1.6503 1.7826 1.7846 1.8495 1.8578 1.9585 1.9624 2.0657 2.0660 2.0870 2.0942 2.4112 2.4119 3.2678 3.2711 4.3226 4.3272 4.8617 4.8677 5.0202 5.0223 5.2890 5.2891 5.6273 5.6277 5.9950 5.9975 6.8953 6.8954 6.9368 6.9400 k = 0.1429 0.5000 0.3116 ( 8288 PWs) bands (ev): -13.7120 -13.7118 -13.4619 -13.4618 -11.9405 -11.9405 -11.2288 -11.2282 -9.1866 -9.1862 -8.5383 -8.5382 -7.6805 -7.6803 -7.1114 -7.1106 -6.1642 -6.1625 -5.0668 -5.0665 -3.2580 -3.2557 -2.7166 -2.7164 -2.1008 -2.1000 -1.8481 -1.8472 -1.5498 -1.5471 -1.4789 -1.4768 -1.2803 -1.2800 -1.1088 -1.1077 -0.7693 -0.7658 -0.1468 -0.1432 0.3052 0.3085 0.5134 0.5148 1.6390 1.6396 1.7207 1.7279 1.7704 1.7733 1.9811 1.9812 2.0466 2.0553 2.0659 2.0672 2.4211 2.4222 3.2800 3.2840 4.3567 4.3617 4.7673 4.7749 4.9760 4.9770 5.2824 5.2827 5.5324 5.5328 5.8995 5.9024 6.9227 6.9250 6.9369 6.9434 k = 0.1607 0.5000 0.3116 ( 8296 PWs) bands (ev): -13.6993 -13.6990 -13.4601 -13.4600 -11.9378 -11.9378 -11.2661 -11.2655 -9.1703 -9.1698 -8.5509 -8.5507 -7.6954 -7.6951 -7.1526 -7.1517 -6.1014 -6.0996 -5.0596 -5.0592 -3.2298 -3.2271 -2.6995 -2.6994 -2.0856 -2.0848 -1.7815 -1.7805 -1.5920 -1.5890 -1.4498 -1.4474 -1.2747 -1.2746 -1.0958 -1.0946 -0.7382 -0.7343 -0.1574 -0.1534 0.3273 0.3310 0.4798 0.4813 1.5769 1.5784 1.6289 1.6363 1.7570 1.7599 1.9979 1.9993 2.0101 2.0199 2.0681 2.0703 2.4306 2.4322 3.2933 3.2981 4.3941 4.3995 4.6564 4.6648 4.9364 4.9369 5.2743 5.2749 5.4305 5.4309 5.7971 5.8004 6.9147 6.9161 6.9821 6.9857 k = 0.1786 0.5000 0.3116 ( 8276 PWs) bands (ev): -13.6853 -13.6851 -13.4581 -13.4581 -11.9349 -11.9348 -11.3060 -11.3053 -9.1521 -9.1517 -8.5642 -8.5641 -7.7111 -7.7109 -7.1969 -7.1959 -6.0336 -6.0317 -5.0520 -5.0516 -3.1982 -3.1951 -2.6816 -2.6814 -2.0701 -2.0693 -1.7102 -1.7092 -1.6366 -1.6333 -1.4161 -1.4135 -1.2689 -1.2688 -1.0816 -1.0804 -0.7038 -0.6995 -0.1690 -0.1644 0.3522 0.3562 0.4443 0.4457 1.4312 1.4326 1.6124 1.6168 1.7425 1.7456 1.9698 1.9805 2.0044 2.0056 2.0868 2.0883 2.4399 2.4419 3.3075 3.3132 4.4345 4.4402 4.5344 4.5430 4.8975 4.8979 5.2642 5.2656 5.3232 5.3237 5.6892 5.6932 6.9071 6.9093 7.0306 7.0341 k = 0.1964 0.5000 0.3116 ( 8284 PWs) bands (ev): -13.6703 -13.6700 -13.4560 -13.4560 -11.9318 -11.9317 -11.3478 -11.3471 -9.1323 -9.1318 -8.5782 -8.5781 -7.7277 -7.7274 -7.2437 -7.2427 -5.9617 -5.9596 -5.0441 -5.0437 -3.1632 -3.1596 -2.6629 -2.6628 -2.0546 -2.0538 -1.6833 -1.6795 -1.6354 -1.6344 -1.3772 -1.3746 -1.2629 -1.2629 -1.0663 -1.0650 -0.6661 -0.6615 -0.1814 -0.1763 0.3789 0.3810 0.4091 0.4099 1.2776 1.2796 1.5944 1.5985 1.7272 1.7305 1.9283 1.9396 2.0009 2.0018 2.1170 2.1178 2.4489 2.4513 3.3219 3.3288 4.4046 4.4132 4.4772 4.4834 4.8580 4.8584 5.2111 5.2112 5.2532 5.2553 5.5772 5.5825 6.9031 6.9058 7.0817 7.0855 k = 0.2143 0.5000 0.3116 ( 8272 PWs) bands (ev): -13.6542 -13.6539 -13.4539 -13.4539 -11.9286 -11.9285 -11.3912 -11.3904 -9.1109 -9.1103 -8.5927 -8.5925 -7.7447 -7.7444 -7.2926 -7.2916 -5.8863 -5.8841 -5.0360 -5.0356 -3.1247 -3.1207 -2.6439 -2.6439 -2.0394 -2.0387 -1.7313 -1.7270 -1.5584 -1.5578 -1.3325 -1.3301 -1.2568 -1.2567 -1.0500 -1.0487 -0.6255 -0.6205 -0.1945 -0.1890 0.3611 0.3648 0.4143 0.4210 1.1205 1.1229 1.5747 1.5789 1.7112 1.7146 1.8857 1.8975 1.9930 1.9936 2.1525 2.1528 2.4577 2.4604 3.3356 3.3440 4.2702 4.2780 4.5219 4.5282 4.8173 4.8178 5.0972 5.0974 5.2381 5.2426 5.4628 5.4703 6.9038 6.9068 7.1351 7.1392 k = 0.2321 0.5000 0.3116 ( 8276 PWs) bands (ev): -13.6372 -13.6369 -13.4517 -13.4517 -11.9252 -11.9252 -11.4355 -11.4348 -9.0879 -9.0873 -8.6074 -8.6073 -7.7621 -7.7618 -7.3432 -7.3421 -5.8083 -5.8059 -5.0278 -5.0274 -3.0830 -3.0783 -2.6248 -2.6248 -2.0247 -2.0240 -1.7802 -1.7752 -1.4811 -1.4811 -1.2813 -1.2792 -1.2504 -1.2504 -1.0327 -1.0314 -0.5822 -0.5769 -0.2082 -0.2022 0.3186 0.3222 0.4485 0.4554 0.9621 0.9649 1.5538 1.5582 1.6947 1.6981 1.8425 1.8548 1.9831 1.9836 2.1901 2.1901 2.4661 2.4691 3.3471 3.3577 4.1340 4.1404 4.5677 4.5743 4.7753 4.7760 4.9817 4.9820 5.2178 5.2278 5.3476 5.3606 6.9101 6.9132 7.1901 7.1946 k = 0.2500 0.5000 0.3116 ( 8272 PWs) bands (ev): -13.6195 -13.6192 -13.4494 -13.4494 -11.9218 -11.9218 -11.4804 -11.4796 -9.0635 -9.0629 -8.6222 -8.6220 -7.7796 -7.7793 -7.3949 -7.3939 -5.7285 -5.7260 -5.0197 -5.0192 -3.0378 -3.0326 -2.6059 -2.6058 -2.0107 -2.0101 -1.8292 -1.8234 -1.4066 -1.4055 -1.2448 -1.2441 -1.2215 -1.2211 -1.0147 -1.0133 -0.5366 -0.5310 -0.2226 -0.2161 0.2710 0.2751 0.4871 0.4944 0.8049 0.8083 1.5319 1.5366 1.6775 1.6809 1.7993 1.8120 1.9723 1.9727 2.2281 2.2284 2.4742 2.4775 3.3532 3.3670 4.0001 4.0041 4.6139 4.6210 4.7319 4.7334 4.8662 4.8664 5.1788 5.2035 5.2404 5.2681 6.9227 6.9258 7.2465 7.2512 k = 0.2679 0.5000 0.3116 ( 8296 PWs) bands (ev): -13.6013 -13.6009 -13.4472 -13.4472 -11.9185 -11.9184 -11.5252 -11.5245 -9.0379 -9.0373 -8.6369 -8.6367 -7.7969 -7.7966 -7.4474 -7.4463 -5.6477 -5.6451 -5.0117 -5.0112 -2.9895 -2.9835 -2.5875 -2.5871 -1.9975 -1.9969 -1.8776 -1.8709 -1.3360 -1.3335 -1.2382 -1.2378 -1.1554 -1.1548 -0.9960 -0.9945 -0.4893 -0.4834 -0.2373 -0.2304 0.2169 0.2217 0.5299 0.5377 0.6528 0.6569 1.5096 1.5145 1.6597 1.6627 1.7570 1.7700 1.9612 1.9615 2.2659 2.2663 2.4819 2.4855 3.3479 3.3663 3.8758 3.8759 4.6564 4.6676 4.6874 4.6933 4.7519 4.7520 5.0950 5.1097 5.2024 5.2204 6.9421 6.9452 7.3035 7.3085 k = 0.2857 0.5000 0.3116 ( 8296 PWs) bands (ev): -13.5826 -13.5823 -13.4450 -13.4449 -11.9151 -11.9150 -11.5696 -11.5689 -9.0111 -9.0105 -8.6513 -8.6511 -7.8139 -7.8136 -7.5001 -7.4990 -5.5669 -5.5642 -5.0039 -5.0034 -2.9383 -2.9314 -2.5698 -2.5691 -1.9853 -1.9847 -1.9246 -1.9167 -1.2700 -1.2659 -1.2319 -1.2316 -1.0827 -1.0806 -0.9767 -0.9753 -0.4408 -0.4346 -0.2524 -0.2451 0.1517 0.1574 0.5117 0.5167 0.5771 0.5854 1.4872 1.4923 1.6408 1.6428 1.7171 1.7297 1.9500 1.9503 2.3028 2.3033 2.4892 2.4931 3.3197 3.3442 3.7680 3.7732 4.6365 4.6380 4.6428 4.6439 4.7112 4.7132 4.9906 4.9982 5.1835 5.1948 6.9689 6.9717 7.3608 7.3660 k = 0.3036 0.5000 0.3116 ( 8292 PWs) bands (ev): -13.5639 -13.5635 -13.4428 -13.4428 -11.9118 -11.9117 -11.6130 -11.6123 -8.9835 -8.9828 -8.6652 -8.6651 -7.8303 -7.8300 -7.5525 -7.5514 -5.4869 -5.4842 -4.9964 -4.9960 -2.8844 -2.8766 -2.5530 -2.5520 -1.9740 -1.9735 -1.9692 -1.9599 -1.2265 -1.2255 -1.2071 -1.2024 -1.0054 -1.0017 -0.9568 -0.9557 -0.3922 -0.3857 -0.2676 -0.2600 0.0685 0.0746 0.3909 0.3965 0.6291 0.6379 1.4649 1.4702 1.6193 1.6197 1.6820 1.6928 1.9390 1.9392 2.3382 2.3388 2.4960 2.5002 3.2551 3.2845 3.6973 3.7066 4.5309 4.5310 4.5953 4.5963 4.7545 4.7558 4.8860 4.8891 5.1651 5.1737 7.0033 7.0058 7.4178 7.4233 k = 0.3214 0.5000 0.3116 ( 8292 PWs) bands (ev): -13.5452 -13.5449 -13.4407 -13.4407 -11.9086 -11.9086 -11.6550 -11.6543 -8.9552 -8.9545 -8.6785 -8.6784 -7.8460 -7.8458 -7.6042 -7.6031 -5.4088 -5.4061 -4.9893 -4.9889 -2.8285 -2.8198 -2.5374 -2.5359 -2.0102 -1.9991 -1.9636 -1.9632 -1.2203 -1.2197 -1.1483 -1.1423 -0.9419 -0.9375 -0.9207 -0.9192 -0.3459 -0.3387 -0.2818 -0.2742 -0.0371 -0.0315 0.2972 0.3024 0.6865 0.6955 1.4431 1.4484 1.5906 1.5952 1.6539 1.6615 1.9283 1.9285 2.3719 2.3725 2.5022 2.5068 3.1525 3.1836 3.6683 3.6783 4.4270 4.4270 4.5493 4.5499 4.7637 4.7770 4.8042 4.8172 5.1467 5.1537 7.0455 7.0476 7.4741 7.4797 k = 0.3393 0.5000 0.3116 ( 8300 PWs) bands (ev): -13.5269 -13.5266 -13.4387 -13.4387 -11.9056 -11.9055 -11.6950 -11.6943 -8.9266 -8.9259 -8.6910 -8.6909 -7.8608 -7.8606 -7.6547 -7.6536 -5.3336 -5.3309 -4.9827 -4.9823 -2.7717 -2.7619 -2.5232 -2.5211 -2.0459 -2.0329 -1.9543 -1.9540 -1.2147 -1.2142 -1.0917 -1.0848 -0.9212 -0.9182 -0.8429 -0.8390 -0.3162 -0.3067 -0.2856 -0.2794 -0.1565 -0.1524 0.2278 0.2321 0.7495 0.7586 1.4220 1.4274 1.5575 1.5666 1.6327 1.6369 1.9182 1.9184 2.4033 2.4040 2.5077 2.5127 3.0247 3.0557 3.6675 3.6763 4.3286 4.3286 4.5032 4.5034 4.6752 4.6821 4.8399 4.8472 5.1285 5.1344 7.0955 7.0972 7.5290 7.5347 k = 0.3571 0.5000 0.3116 ( 8300 PWs) bands (ev): -13.5092 -13.5089 -13.4368 -13.4368 -11.9028 -11.9027 -11.7325 -11.7319 -8.8980 -8.8973 -8.7026 -8.7025 -7.8745 -7.8743 -7.7032 -7.7022 -5.2622 -5.2597 -4.9766 -4.9763 -2.7154 -2.7047 -2.5110 -2.5079 -2.0742 -2.0590 -1.9460 -1.9457 -1.2095 -1.2090 -1.0373 -1.0298 -0.9041 -0.9009 -0.7654 -0.7609 -0.3300 -0.3213 -0.3162 -0.3097 -0.2170 -0.2133 0.1744 0.1778 0.8187 0.8275 1.4020 1.4074 1.5232 1.5359 1.6161 1.6180 1.9087 1.9089 2.4323 2.4329 2.5119 2.5175 2.8840 2.9148 3.6818 3.6891 4.2369 4.2370 4.4573 4.4573 4.5840 4.5892 4.8775 4.8834 5.1108 5.1159 7.1534 7.1544 7.5821 7.5879 k = 0.3750 0.5000 0.3116 ( 8304 PWs) bands (ev): -13.4926 -13.4923 -13.4351 -13.4351 -11.9002 -11.9001 -11.7671 -11.7665 -8.8699 -8.8693 -8.7132 -8.7131 -7.8869 -7.8867 -7.7493 -7.7483 -5.1959 -5.1934 -4.9711 -4.9708 -2.6617 -2.6503 -2.5010 -2.4969 -2.0921 -2.0748 -1.9387 -1.9384 -1.2047 -1.2042 -0.9853 -0.9775 -0.8903 -0.8865 -0.6922 -0.6874 -0.4495 -0.4456 -0.3379 -0.3287 -0.1839 -0.1794 0.1309 0.1336 0.8942 0.9023 1.3834 1.3885 1.4901 1.5058 1.6023 1.6030 1.9001 1.9003 2.4584 2.4591 2.5136 2.5202 2.7389 2.7703 3.7038 3.7099 4.1529 4.1530 4.4120 4.4121 4.4994 4.5037 4.9118 4.9169 5.0940 5.0984 7.2188 7.2191 7.6328 7.6386 k = 0.3929 0.5000 0.3116 ( 8316 PWs) bands (ev): -13.4772 -13.4769 -13.4336 -13.4336 -11.8978 -11.8978 -11.7983 -11.7978 -8.8430 -8.8424 -8.7226 -8.7224 -7.8980 -7.8978 -7.7921 -7.7912 -5.1355 -5.1333 -4.9662 -4.9659 -2.6132 -2.6019 -2.4937 -2.4885 -2.0963 -2.0775 -1.9324 -1.9322 -1.2004 -1.2000 -0.9363 -0.9284 -0.8836 -0.8786 -0.6251 -0.6205 -0.5765 -0.5743 -0.3545 -0.3453 -0.1440 -0.1395 0.0942 0.0964 0.9762 0.9826 1.3664 1.3713 1.4598 1.4788 1.5906 1.5906 1.8924 1.8925 2.4815 2.4822 2.5049 2.5118 2.6022 2.6338 3.7300 3.7349 4.0777 4.0779 4.3679 4.3681 4.4233 4.4269 4.9425 4.9468 5.0785 5.0822 7.2909 7.2913 7.6804 7.6861 k = 0.4107 0.5000 0.3116 ( 8328 PWs) bands (ev): -13.4634 -13.4632 -13.4323 -13.4323 -11.8958 -11.8958 -11.8256 -11.8252 -8.8179 -8.8173 -8.7307 -8.7306 -7.9076 -7.9074 -7.8309 -7.8301 -5.0823 -5.0803 -4.9620 -4.9618 -2.5725 -2.5622 -2.4894 -2.4834 -2.0840 -2.0649 -1.9271 -1.9269 -1.1966 -1.1963 -0.8955 -0.8913 -0.8877 -0.8828 -0.6839 -0.6831 -0.5657 -0.5610 -0.3709 -0.3621 -0.1066 -0.1025 0.0633 0.0649 1.0639 1.0671 1.3514 1.3558 1.4338 1.4570 1.5805 1.5808 1.8857 1.8858 2.4209 2.4350 2.5016 2.5021 2.5480 2.5586 3.7580 3.7620 4.0122 4.0124 4.3258 4.3262 4.3569 4.3599 4.9689 4.9725 5.0647 5.0678 7.3692 7.3705 7.7241 7.7296 k = 0.4286 0.5000 0.3116 ( 8340 PWs) bands (ev): -13.4516 -13.4515 -13.4312 -13.4312 -11.8941 -11.8941 -11.8486 -11.8483 -8.7954 -8.7949 -8.7374 -8.7373 -7.9156 -7.9154 -7.8646 -7.8639 -5.0371 -5.0354 -4.9585 -4.9583 -2.5410 -2.5326 -2.4881 -2.4819 -2.0549 -2.0372 -1.9227 -1.9226 -1.1935 -1.1932 -0.9461 -0.9375 -0.8504 -0.8430 -0.7464 -0.7440 -0.5152 -0.5111 -0.3866 -0.3784 -0.0738 -0.0702 0.0375 0.0388 1.1525 1.1552 1.3387 1.3425 1.4146 1.4444 1.5723 1.5727 1.8801 1.8802 2.2813 2.3036 2.5180 2.5185 2.5448 2.5476 3.7861 3.7894 3.9572 3.9574 4.2868 4.2872 4.3012 4.3036 4.9910 4.9939 5.0530 5.0555 7.4535 7.4557 7.7631 7.7683 k = 0.4464 0.5000 0.3116 ( 8340 PWs) bands (ev): -13.4421 -13.4420 -13.4303 -13.4303 -11.8928 -11.8927 -11.8670 -11.8667 -8.7765 -8.7761 -8.7427 -8.7427 -7.9218 -7.9218 -7.8923 -7.8918 -5.0008 -4.9995 -4.9558 -4.9556 -2.5185 -2.5124 -2.4888 -2.4834 -2.0135 -1.9987 -1.9193 -1.9192 -1.1910 -1.1908 -1.0287 -1.0213 -0.8158 -0.8093 -0.7640 -0.7622 -0.4747 -0.4714 -0.4005 -0.3936 -0.0468 -0.0440 0.0171 0.0181 1.2299 1.2425 1.3285 1.3316 1.4088 1.4485 1.5660 1.5664 1.8757 1.8757 2.1425 2.1669 2.5310 2.5314 2.5457 2.5466 3.8125 3.8150 3.9136 3.9138 4.2523 4.2527 4.2570 4.2588 5.0084 5.0106 5.0436 5.0455 7.5430 7.5461 7.7959 7.8007 k = 0.4643 0.5000 0.3116 ( 8364 PWs) bands (ev): -13.4351 -13.4350 -13.4297 -13.4296 -11.8918 -11.8918 -11.8803 -11.8801 -8.7620 -8.7618 -8.7466 -8.7465 -7.9264 -7.9263 -7.9130 -7.9127 -4.9742 -4.9733 -4.9538 -4.9537 -2.5038 -2.4999 -2.4904 -2.4865 -1.9684 -1.9576 -1.9169 -1.9168 -1.1891 -1.1890 -1.1098 -1.1042 -0.7886 -0.7837 -0.7658 -0.7648 -0.4450 -0.4427 -0.4117 -0.4065 -0.0267 -0.0248 0.0023 0.0029 1.2832 1.3012 1.3213 1.3234 1.4380 1.4820 1.5615 1.5618 1.8725 1.8725 2.0135 2.0376 2.5404 2.5407 2.5469 2.5472 3.8349 3.8366 3.8819 3.8821 4.2243 4.2247 4.2250 4.2262 5.0210 5.0225 5.0368 5.0381 7.6367 7.6408 7.8175 7.8195 k = 0.4821 0.5000 0.3116 ( 8360 PWs) bands (ev): -13.4308 -13.4307 -13.4293 -13.4293 -11.8912 -11.8912 -11.8884 -11.8883 -8.7529 -8.7528 -8.7489 -8.7489 -7.9291 -7.9291 -7.9258 -7.9256 -4.9579 -4.9575 -4.9526 -4.9526 -2.4952 -2.4933 -2.4915 -2.4895 -1.9314 -1.9256 -1.9154 -1.9154 -1.1880 -1.1879 -1.1676 -1.1645 -0.7706 -0.7680 -0.7644 -0.7640 -0.4267 -0.4255 -0.4186 -0.4158 -0.0141 -0.0131 -0.0067 -0.0064 1.3072 1.3170 1.3171 1.3181 1.5069 1.5366 1.5588 1.5590 1.8705 1.8706 1.9088 1.9278 2.5461 2.5462 2.5478 2.5479 3.8504 3.8513 3.8628 3.8628 4.2057 4.2058 4.2060 4.2063 5.0288 5.0295 5.0328 5.0334 7.7334 7.7384 7.8234 7.8238 k = 0.5000 0.5000 0.3116 ( 8344 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8911 -11.8911 -11.8910 -11.8910 -8.7498 -8.7498 -8.7497 -8.7497 -7.9301 -7.9301 -7.9300 -7.9300 -4.9523 -4.9523 -4.9522 -4.9522 -2.4916 -2.4916 -2.4915 -2.4915 -1.9151 -1.9151 -1.9149 -1.9149 -1.1877 -1.1877 -1.1876 -1.1876 -0.7636 -0.7636 -0.7634 -0.7634 -0.4202 -0.4202 -0.4200 -0.4200 -0.0096 -0.0096 -0.0095 -0.0095 1.3159 1.3159 1.3160 1.3160 1.5579 1.5579 1.5580 1.5580 1.8698 1.8698 1.8699 1.8699 2.5480 2.5480 2.5481 2.5481 3.8563 3.8563 3.8564 3.8564 4.1993 4.1993 4.1994 4.1994 5.0316 5.0316 5.0317 5.0317 7.8247 7.8247 7.8248 7.8248 k = 0.5000 0.5000 0.3116 ( 8344 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8911 -11.8911 -11.8910 -11.8910 -8.7498 -8.7498 -8.7497 -8.7497 -7.9301 -7.9301 -7.9300 -7.9300 -4.9523 -4.9523 -4.9522 -4.9522 -2.4916 -2.4916 -2.4915 -2.4915 -1.9151 -1.9151 -1.9149 -1.9149 -1.1877 -1.1877 -1.1876 -1.1876 -0.7636 -0.7636 -0.7634 -0.7634 -0.4202 -0.4202 -0.4200 -0.4200 -0.0096 -0.0096 -0.0095 -0.0095 1.3159 1.3159 1.3160 1.3160 1.5579 1.5579 1.5580 1.5580 1.8698 1.8698 1.8699 1.8699 2.5480 2.5480 2.5481 2.5481 3.8563 3.8563 3.8564 3.8564 4.1993 4.1993 4.1994 4.1994 5.0316 5.0316 5.0317 5.0317 7.8247 7.8247 7.8248 7.8248 k = 0.4875 0.4875 0.3116 ( 8362 PWs) bands (ev): -13.4301 -13.4300 -13.4299 -13.4299 -11.8899 -11.8898 -11.8898 -11.8897 -8.7510 -8.7509 -8.7508 -8.7507 -7.9276 -7.9275 -7.9274 -7.9274 -4.9553 -4.9552 -4.9550 -4.9549 -2.4938 -2.4937 -2.4910 -2.4909 -1.9241 -1.9240 -1.9199 -1.9198 -1.1782 -1.1782 -1.1760 -1.1759 -0.7678 -0.7676 -0.7658 -0.7657 -0.4228 -0.4227 -0.4205 -0.4204 -0.0105 -0.0104 -0.0097 -0.0096 1.3116 1.3116 1.3185 1.3185 1.5278 1.5279 1.5504 1.5505 1.8877 1.8878 1.9028 1.9029 2.5469 2.5470 2.5470 2.5471 3.8564 3.8565 3.8571 3.8572 4.2056 4.2057 4.2060 4.2061 5.0308 5.0308 5.0315 5.0315 7.7611 7.7612 7.7672 7.7673 k = 0.4750 0.4750 0.3116 ( 8370 PWs) bands (ev): -13.4324 -13.4323 -13.4322 -13.4322 -11.8862 -11.8861 -11.8861 -11.8860 -8.7544 -8.7542 -8.7542 -8.7540 -7.9199 -7.9198 -7.9196 -7.9195 -4.9640 -4.9638 -4.9633 -4.9632 -2.4977 -2.4976 -2.4920 -2.4919 -1.9454 -1.9452 -1.9374 -1.9373 -1.1491 -1.1490 -1.1449 -1.1448 -0.7779 -0.7778 -0.7741 -0.7740 -0.4285 -0.4284 -0.4240 -0.4239 -0.0123 -0.0122 -0.0108 -0.0107 1.3032 1.3033 1.3173 1.3174 1.4792 1.4793 1.5168 1.5169 1.9473 1.9474 1.9694 1.9695 2.5437 2.5438 2.5440 2.5440 3.8578 3.8579 3.8591 3.8592 4.2244 4.2245 4.2253 4.2254 5.0289 5.0290 5.0303 5.0304 7.6895 7.6896 7.6948 7.6949 k = 0.4625 0.4625 0.3116 ( 8354 PWs) bands (ev): -13.4362 -13.4361 -13.4361 -13.4360 -11.8801 -11.8800 -11.8799 -11.8798 -8.7598 -8.7597 -8.7595 -8.7594 -7.9073 -7.9072 -7.9069 -7.9068 -4.9782 -4.9780 -4.9772 -4.9771 -2.5036 -2.5035 -2.4953 -2.4952 -1.9750 -1.9749 -1.9637 -1.9636 -1.1047 -1.1046 -1.0988 -1.0987 -0.7926 -0.7925 -0.7873 -0.7871 -0.4374 -0.4373 -0.4310 -0.4309 -0.0150 -0.0149 -0.0128 -0.0127 1.2854 1.2855 1.3041 1.3042 1.4372 1.4373 1.4822 1.4823 2.0286 2.0287 2.0529 2.0530 2.5385 2.5385 2.5389 2.5390 3.8613 3.8614 3.8631 3.8632 4.2549 4.2550 4.2563 4.2563 5.0261 5.0261 5.0282 5.0282 7.6173 7.6173 7.6219 7.6219 k = 0.4500 0.4500 0.3116 ( 8350 PWs) bands (ev): -13.4415 -13.4414 -13.4413 -13.4412 -11.8716 -11.8715 -11.8713 -11.8712 -8.7671 -8.7670 -8.7667 -8.7666 -7.8899 -7.8898 -7.8894 -7.8893 -4.9977 -4.9976 -4.9965 -4.9964 -2.5123 -2.5122 -2.5014 -2.5013 -2.0087 -2.0086 -1.9946 -1.9945 -1.0515 -1.0514 -1.0442 -1.0441 -0.8086 -0.8085 -0.8021 -0.8020 -0.4498 -0.4497 -0.4419 -0.4418 -0.0183 -0.0182 -0.0154 -0.0153 1.2529 1.2529 1.2679 1.2680 1.4202 1.4203 1.4625 1.4626 2.1208 2.1209 2.1452 2.1453 2.5313 2.5314 2.5322 2.5323 3.8678 3.8678 3.8701 3.8702 4.2958 4.2959 4.2976 4.2976 5.0222 5.0223 5.0250 5.0250 7.5453 7.5453 7.5491 7.5492 k = 0.4375 0.4375 0.3116 ( 8348 PWs) bands (ev): -13.4482 -13.4480 -13.4480 -13.4478 -11.8608 -11.8607 -11.8605 -11.8604 -8.7759 -8.7758 -8.7755 -8.7753 -7.8682 -7.8681 -7.8676 -7.8675 -5.0225 -5.0224 -5.0210 -5.0209 -2.5247 -2.5246 -2.5115 -2.5114 -2.0423 -2.0422 -2.0260 -2.0259 -1.0013 -1.0012 -0.9929 -0.9928 -0.8166 -0.8165 -0.8101 -0.8100 -0.4660 -0.4659 -0.4569 -0.4568 -0.0220 -0.0219 -0.0185 -0.0184 1.2070 1.2071 1.2152 1.2153 1.4251 1.4252 1.4602 1.4603 2.2191 2.2192 2.2424 2.2424 2.5225 2.5225 2.5245 2.5246 3.8781 3.8782 3.8809 3.8810 4.3459 4.3460 4.3480 4.3481 5.0173 5.0173 5.0207 5.0208 7.4740 7.4740 7.4772 7.4773 k = 0.4250 0.4250 0.3116 ( 8338 PWs) bands (ev): -13.4561 -13.4559 -13.4559 -13.4557 -11.8478 -11.8477 -11.8474 -11.8473 -8.7860 -8.7858 -8.7854 -8.7853 -7.8425 -7.8424 -7.8418 -7.8417 -5.0522 -5.0520 -5.0504 -5.0503 -2.5416 -2.5415 -2.5265 -2.5264 -2.0727 -2.0726 -2.0547 -2.0546 -0.9760 -0.9759 -0.9673 -0.9672 -0.7959 -0.7958 -0.7918 -0.7917 -0.4860 -0.4859 -0.4760 -0.4759 -0.0258 -0.0258 -0.0219 -0.0218 1.1538 1.1538 1.1589 1.1589 1.4414 1.4414 1.4706 1.4707 2.3203 2.3204 2.3405 2.3406 2.5130 2.5130 2.5180 2.5180 3.8930 3.8931 3.8962 3.8963 4.4040 4.4041 4.4065 4.4066 5.0112 5.0113 5.0154 5.0155 7.4038 7.4039 7.4064 7.4065 k = 0.4125 0.4125 0.3116 ( 8328 PWs) bands (ev): -13.4652 -13.4651 -13.4650 -13.4649 -11.8327 -11.8326 -11.8322 -11.8321 -8.7969 -8.7968 -8.7963 -8.7962 -7.8131 -7.8131 -7.8123 -7.8123 -5.0865 -5.0863 -5.0845 -5.0844 -2.5637 -2.5636 -2.5475 -2.5474 -2.0974 -2.0973 -2.0787 -2.0786 -0.9868 -0.9867 -0.9780 -0.9779 -0.7394 -0.7393 -0.7370 -0.7369 -0.5091 -0.5090 -0.4986 -0.4985 -0.0294 -0.0293 -0.0250 -0.0249 1.0982 1.0982 1.1045 1.1045 1.4639 1.4639 1.4893 1.4893 2.4173 2.4174 2.4264 2.4265 2.5086 2.5086 2.5253 2.5253 3.9128 3.9128 3.9164 3.9165 4.4691 4.4692 4.4720 4.4721 5.0041 5.0042 5.0090 5.0091 7.3351 7.3352 7.3372 7.3372 k = 0.4000 0.4000 0.3116 ( 8318 PWs) bands (ev): -13.4755 -13.4753 -13.4752 -13.4751 -11.8156 -11.8155 -11.8151 -11.8150 -8.8085 -8.8084 -8.8079 -8.8078 -7.7806 -7.7805 -7.7797 -7.7796 -5.1250 -5.1249 -5.1229 -5.1227 -2.5912 -2.5911 -2.5746 -2.5745 -2.1153 -2.1152 -2.0966 -2.0965 -1.0182 -1.0181 -1.0090 -1.0089 -0.6686 -0.6685 -0.6654 -0.6653 -0.5313 -0.5312 -0.5210 -0.5209 -0.0322 -0.0321 -0.0274 -0.0273 1.0445 1.0446 1.0528 1.0528 1.4906 1.4907 1.5135 1.5135 2.4545 2.4545 2.4628 2.4628 2.5577 2.5577 2.5894 2.5895 3.9377 3.9378 3.9418 3.9419 4.5402 4.5403 4.5438 4.5439 4.9959 4.9959 5.0016 5.0017 7.2681 7.2682 7.2697 7.2698 k = 0.3875 0.3875 0.3116 ( 8306 PWs) bands (ev): -13.4867 -13.4865 -13.4864 -13.4863 -11.7966 -11.7965 -11.7961 -11.7960 -8.8204 -8.8203 -8.8198 -8.8197 -7.7451 -7.7450 -7.7442 -7.7441 -5.1675 -5.1674 -5.1652 -5.1651 -2.6237 -2.6236 -2.6075 -2.6074 -2.1262 -2.1261 -2.1081 -2.1080 -1.0589 -1.0588 -1.0494 -1.0493 -0.6204 -0.6203 -0.6155 -0.6154 -0.5246 -0.5245 -0.5196 -0.5196 -0.0334 -0.0333 -0.0283 -0.0282 0.9946 0.9947 1.0043 1.0044 1.5206 1.5207 1.5417 1.5418 2.4471 2.4472 2.4540 2.4540 2.6599 2.6600 2.6903 2.6904 3.9679 3.9680 3.9724 3.9724 4.6166 4.6167 4.6209 4.6210 4.9865 4.9866 4.9932 4.9932 7.2031 7.2031 7.2044 7.2045 k = 0.3750 0.3750 0.3116 ( 8306 PWs) bands (ev): -13.4987 -13.4986 -13.4985 -13.4983 -11.7760 -11.7759 -11.7754 -11.7753 -8.8325 -8.8323 -8.8318 -8.8317 -7.7071 -7.7070 -7.7061 -7.7060 -5.2135 -5.2134 -5.2111 -5.2110 -2.6606 -2.6605 -2.6451 -2.6450 -2.1307 -2.1306 -2.1138 -2.1137 -1.1045 -1.1044 -1.0949 -1.0948 -0.6366 -0.6365 -0.6279 -0.6279 -0.4574 -0.4573 -0.4547 -0.4546 -0.0316 -0.0315 -0.0261 -0.0261 0.9489 0.9490 0.9596 0.9597 1.5531 1.5532 1.5730 1.5730 2.4317 2.4317 2.4374 2.4375 2.7700 2.7701 2.7992 2.7992 4.0033 4.0034 4.0081 4.0082 4.6971 4.6971 4.7027 4.7028 4.9762 4.9762 4.9840 4.9841 7.1402 7.1402 7.1414 7.1415 k = 0.3625 0.3625 0.3116 ( 8286 PWs) bands (ev): -13.5115 -13.5114 -13.5112 -13.5111 -11.7538 -11.7537 -11.7532 -11.7531 -8.8444 -8.8443 -8.8437 -8.8436 -7.6669 -7.6668 -7.6659 -7.6658 -5.2627 -5.2626 -5.2602 -5.2601 -2.7007 -2.7006 -2.6864 -2.6862 -2.1299 -2.1298 -2.1145 -2.1144 -1.1532 -1.1531 -1.1435 -1.1434 -0.6745 -0.6744 -0.6652 -0.6651 -0.3746 -0.3745 -0.3701 -0.3700 -0.0240 -0.0239 -0.0182 -0.0182 0.9076 0.9077 0.9189 0.9190 1.5875 1.5875 1.6065 1.6065 2.4132 2.4133 2.4184 2.4184 2.8822 2.8823 2.9107 2.9108 4.0437 4.0438 4.0489 4.0490 4.7800 4.7801 4.7882 4.7883 4.9651 4.9652 4.9752 4.9753 7.0796 7.0796 7.0809 7.0810 k = 0.3500 0.3500 0.3116 ( 8296 PWs) bands (ev): -13.5250 -13.5248 -13.5247 -13.5245 -11.7302 -11.7301 -11.7296 -11.7295 -8.8561 -8.8560 -8.8554 -8.8553 -7.6248 -7.6247 -7.6238 -7.6237 -5.3147 -5.3146 -5.3121 -5.3119 -2.7431 -2.7430 -2.7300 -2.7299 -2.1249 -2.1249 -2.1110 -2.1109 -1.2039 -1.2038 -1.1943 -1.1942 -0.7193 -0.7192 -0.7100 -0.7099 -0.2957 -0.2956 -0.2897 -0.2896 -0.0051 -0.0050 0.0008 0.0009 0.8706 0.8707 0.8823 0.8824 1.6232 1.6232 1.6414 1.6415 2.3931 2.3931 2.3979 2.3980 2.9956 2.9957 3.0236 3.0237 4.0890 4.0890 4.0946 4.0947 4.8598 4.8598 4.8751 4.8751 4.9552 4.9553 4.9715 4.9716 7.0215 7.0215 7.0231 7.0232 k = 0.3375 0.3375 0.3116 ( 8288 PWs) bands (ev): -13.5389 -13.5388 -13.5386 -13.5384 -11.7053 -11.7052 -11.7047 -11.7046 -8.8674 -8.8673 -8.8667 -8.8666 -7.5811 -7.5810 -7.5800 -7.5799 -5.3690 -5.3689 -5.3663 -5.3662 -2.7870 -2.7869 -2.7751 -2.7749 -2.1168 -2.1167 -2.1044 -2.1043 -1.2559 -1.2558 -1.2464 -1.2463 -0.7681 -0.7680 -0.7591 -0.7590 -0.2325 -0.2324 -0.2255 -0.2254 0.0339 0.0340 0.0395 0.0396 0.8378 0.8379 0.8496 0.8497 1.6594 1.6595 1.6771 1.6772 2.3720 2.3721 2.3767 2.3768 3.1094 3.1095 3.1371 3.1372 4.1388 4.1389 4.1449 4.1450 4.9078 4.9078 4.9271 4.9272 4.9822 4.9823 5.0009 5.0010 6.9660 6.9661 6.9681 6.9681 k = 0.3250 0.3250 0.3116 ( 8282 PWs) bands (ev): -13.5532 -13.5531 -13.5529 -13.5527 -11.6794 -11.6793 -11.6787 -11.6786 -8.8783 -8.8782 -8.8776 -8.8774 -7.5361 -7.5360 -7.5349 -7.5348 -5.4253 -5.4252 -5.4226 -5.4225 -2.8315 -2.8314 -2.8208 -2.8207 -2.1064 -2.1063 -2.0953 -2.0952 -1.3084 -1.3083 -1.2991 -1.2990 -0.8200 -0.8199 -0.8114 -0.8113 -0.1919 -0.1918 -0.1847 -0.1846 0.0991 0.0992 0.1038 0.1039 0.8089 0.8089 0.8207 0.8208 1.6956 1.6956 1.7128 1.7129 2.3507 2.3507 2.3554 2.3555 3.2234 3.2235 3.2508 3.2509 4.1929 4.1930 4.1994 4.1995 4.9077 4.9077 4.9182 4.9182 5.0715 5.0716 5.0795 5.0795 6.9133 6.9134 6.9157 6.9158 k = 0.3125 0.3125 0.3116 ( 8288 PWs) bands (ev): -13.5678 -13.5677 -13.5675 -13.5673 -11.6525 -11.6524 -11.6518 -11.6516 -8.8885 -8.8884 -8.8878 -8.8877 -7.4899 -7.4898 -7.4887 -7.4886 -5.4832 -5.4831 -5.4805 -5.4804 -2.8762 -2.8761 -2.8665 -2.8664 -2.0944 -2.0943 -2.0845 -2.0844 -1.3611 -1.3610 -1.3521 -1.3520 -0.8741 -0.8740 -0.8660 -0.8658 -0.1701 -0.1700 -0.1631 -0.1630 0.1858 0.1859 0.1895 0.1896 0.7836 0.7837 0.7953 0.7953 1.7308 1.7308 1.7476 1.7476 2.3298 2.3299 2.3348 2.3348 3.3371 3.3372 3.3643 3.3644 4.2510 4.2511 4.2579 4.2579 4.8943 4.8944 4.9029 4.9030 5.1676 5.1677 5.1721 5.1722 6.8634 6.8634 6.8662 6.8662 k = 0.3000 0.3000 0.3116 ( 8302 PWs) bands (ev): -13.5826 -13.5824 -13.5822 -13.5821 -11.6248 -11.6246 -11.6240 -11.6239 -8.8981 -8.8980 -8.8974 -8.8973 -7.4429 -7.4428 -7.4417 -7.4416 -5.5423 -5.5422 -5.5397 -5.5395 -2.9207 -2.9206 -2.9119 -2.9118 -2.0814 -2.0813 -2.0726 -2.0725 -1.4135 -1.4134 -1.4048 -1.4047 -0.9299 -0.9298 -0.9223 -0.9221 -0.1590 -0.1589 -0.1522 -0.1521 0.2852 0.2853 0.2881 0.2882 0.7617 0.7618 0.7731 0.7732 1.7638 1.7638 1.7802 1.7802 2.3104 2.3104 2.3157 2.3157 3.4503 3.4504 3.4773 3.4774 4.3126 4.3127 4.3198 4.3199 4.8774 4.8774 4.8856 4.8857 5.2658 5.2659 5.2688 5.2688 6.8162 6.8163 6.8194 6.8194 k = 0.2875 0.2875 0.3116 ( 8296 PWs) bands (ev): -13.5974 -13.5973 -13.5971 -13.5969 -11.5964 -11.5963 -11.5957 -11.5955 -8.9071 -8.9070 -8.9064 -8.9063 -7.3952 -7.3952 -7.3941 -7.3940 -5.6023 -5.6022 -5.5997 -5.5996 -2.9645 -2.9644 -2.9566 -2.9565 -2.0679 -2.0678 -2.0601 -2.0600 -1.4651 -1.4650 -1.4567 -1.4566 -0.9869 -0.9868 -0.9797 -0.9796 -0.1530 -0.1529 -0.1464 -0.1463 0.3913 0.3914 0.3937 0.3938 0.7430 0.7431 0.7541 0.7542 1.7934 1.7934 1.8094 1.8094 2.2937 2.2937 2.2995 2.2995 3.5627 3.5628 3.5896 3.5897 4.3772 4.3773 4.3848 4.3849 4.8587 4.8587 4.8669 4.8670 5.3651 5.3652 5.3673 5.3673 6.7718 6.7719 6.7753 6.7753 k = 0.2750 0.2750 0.3116 ( 8304 PWs) bands (ev): -13.6122 -13.6121 -13.6119 -13.6117 -11.5676 -11.5674 -11.5668 -11.5667 -8.9153 -8.9152 -8.9146 -8.9145 -7.3472 -7.3471 -7.3461 -7.3460 -5.6628 -5.6627 -5.6602 -5.6601 -3.0075 -3.0074 -3.0004 -3.0003 -2.0543 -2.0543 -2.0474 -2.0473 -1.5156 -1.5155 -1.5075 -1.5074 -1.0445 -1.0444 -1.0378 -1.0377 -0.1493 -0.1492 -0.1429 -0.1428 0.5008 0.5009 0.5029 0.5030 0.7275 0.7275 0.7381 0.7382 1.8178 1.8179 1.8333 1.8333 2.2811 2.2811 2.2877 2.2877 3.6740 3.6741 3.7008 3.7009 4.4443 4.4444 4.4523 4.4524 4.8389 4.8389 4.8472 4.8473 5.4648 5.4649 5.4666 5.4667 6.7300 6.7300 6.7337 6.7337 k = 0.2625 0.2625 0.3116 ( 8300 PWs) bands (ev): -13.6269 -13.6268 -13.6266 -13.6265 -11.5384 -11.5383 -11.5376 -11.5375 -8.9228 -8.9227 -8.9222 -8.9221 -7.2991 -7.2990 -7.2979 -7.2978 -5.7234 -5.7233 -5.7209 -5.7208 -3.0495 -3.0494 -3.0431 -3.0430 -2.0411 -2.0411 -2.0349 -2.0348 -1.5644 -1.5643 -1.5568 -1.5567 -1.1023 -1.1022 -1.0961 -1.0960 -0.1463 -0.1462 -0.1401 -0.1401 0.6103 0.6103 0.6127 0.6128 0.7165 0.7166 0.7260 0.7261 1.8354 1.8355 1.8504 1.8504 2.2744 2.2744 2.2818 2.2818 3.7841 3.7842 3.8107 3.8108 4.5132 4.5133 4.5215 4.5216 4.8185 4.8186 4.8270 4.8270 5.5645 5.5646 5.5660 5.5661 6.6905 6.6906 6.6946 6.6946 k = 0.2500 0.2500 0.3116 ( 8316 PWs) bands (ev): -13.6414 -13.6413 -13.6411 -13.6410 -11.5090 -11.5089 -11.5083 -11.5082 -8.9297 -8.9295 -8.9290 -8.9289 -7.2510 -7.2509 -7.2498 -7.2497 -5.7839 -5.7837 -5.7814 -5.7813 -3.0903 -3.0902 -3.0846 -3.0845 -2.0287 -2.0287 -2.0231 -2.0231 -1.6111 -1.6110 -1.6039 -1.6038 -1.1600 -1.1599 -1.1543 -1.1542 -0.1434 -0.1433 -0.1374 -0.1373 0.6866 0.6866 0.6965 0.6966 0.7408 0.7409 0.7444 0.7445 1.8447 1.8448 1.8590 1.8590 2.2751 2.2751 2.2832 2.2832 3.8927 3.8928 3.9192 3.9193 4.5826 4.5827 4.5914 4.5915 4.7983 4.7984 4.8071 4.8072 5.6636 5.6636 5.6650 5.6651 6.6534 6.6534 6.6576 6.6577 k = 0.2375 0.2375 0.3116 ( 8320 PWs) bands (ev): -13.6557 -13.6555 -13.6554 -13.6552 -11.4797 -11.4795 -11.4789 -11.4788 -8.9358 -8.9357 -8.9351 -8.9350 -7.2032 -7.2031 -7.2020 -7.2019 -5.8438 -5.8437 -5.8414 -5.8413 -3.1298 -3.1297 -3.1247 -3.1246 -2.0176 -2.0176 -2.0126 -2.0125 -1.6552 -1.6551 -1.6485 -1.6484 -1.2172 -1.2171 -1.2119 -1.2118 -0.1400 -0.1399 -0.1342 -0.1341 0.6862 0.6863 0.6966 0.6967 0.8451 0.8452 0.8478 0.8479 1.8451 1.8451 1.8586 1.8586 2.2836 2.2837 2.2924 2.2924 3.9996 3.9997 4.0258 4.0260 4.6497 4.6498 4.6590 4.6591 4.7806 4.7807 4.7905 4.7905 5.7616 5.7616 5.7629 5.7630 6.6182 6.6182 6.6226 6.6227 k = 0.2250 0.2250 0.3116 ( 8312 PWs) bands (ev): -13.6696 -13.6694 -13.6693 -13.6691 -11.4504 -11.4503 -11.4497 -11.4496 -8.9412 -8.9411 -8.9406 -8.9405 -7.1560 -7.1559 -7.1548 -7.1547 -5.9029 -5.9027 -5.9006 -5.9004 -3.1680 -3.1679 -3.1633 -3.1632 -2.0085 -2.0084 -2.0040 -2.0039 -1.6959 -1.6958 -1.6898 -1.6897 -1.2734 -1.2733 -1.2685 -1.2684 -0.1359 -0.1358 -0.1302 -0.1301 0.6797 0.6798 0.6896 0.6897 0.9569 0.9570 0.9597 0.9598 1.8369 1.8369 1.8496 1.8496 2.2997 2.2998 2.3088 2.3089 4.1045 4.1046 4.1306 4.1307 4.7000 4.7001 4.7106 4.7107 4.7786 4.7786 4.7913 4.7914 5.8580 5.8581 5.8594 5.8595 6.5847 6.5847 6.5894 6.5894 k = 0.2125 0.2125 0.3116 ( 8302 PWs) bands (ev): -13.6831 -13.6829 -13.6828 -13.6826 -11.4215 -11.4214 -11.4207 -11.4206 -8.9460 -8.9459 -8.9454 -8.9453 -7.1095 -7.1094 -7.1083 -7.1082 -5.9608 -5.9607 -5.9586 -5.9585 -3.2046 -3.2045 -3.2004 -3.2003 -2.0021 -2.0020 -1.9980 -1.9979 -1.7324 -1.7323 -1.7269 -1.7268 -1.3285 -1.3284 -1.3240 -1.3239 -0.1309 -0.1308 -0.1255 -0.1254 0.6739 0.6740 0.6833 0.6834 1.0686 1.0687 1.0717 1.0718 1.8214 1.8215 1.8335 1.8336 2.3219 2.3219 2.3312 2.3312 4.2072 4.2073 4.2330 4.2331 4.7059 4.7060 4.7148 4.7149 4.8239 4.8240 4.8363 4.8364 5.9524 5.9524 5.9538 5.9539 6.5526 6.5526 6.5575 6.5575 k = 0.2000 0.2000 0.3116 ( 8298 PWs) bands (ev): -13.6961 -13.6960 -13.6958 -13.6957 -11.3930 -11.3929 -11.3923 -11.3922 -8.9501 -8.9500 -8.9496 -8.9495 -7.0639 -7.0638 -7.0628 -7.0627 -6.0173 -6.0172 -6.0152 -6.0151 -3.2397 -3.2396 -3.2359 -3.2358 -1.9996 -1.9995 -1.9957 -1.9957 -1.7635 -1.7634 -1.7589 -1.7588 -1.3821 -1.3820 -1.3780 -1.3779 -0.1250 -0.1249 -0.1198 -0.1197 0.6692 0.6693 0.6782 0.6782 1.1791 1.1792 1.1827 1.1828 1.8004 1.8004 1.8121 1.8121 2.3485 2.3485 2.3577 2.3578 4.3074 4.3075 4.3328 4.3329 4.6902 4.6903 4.6981 4.6982 4.8901 4.8902 4.9019 4.9020 6.0441 6.0442 6.0458 6.0459 6.5217 6.5217 6.5268 6.5268 k = 0.1875 0.1875 0.3116 ( 8300 PWs) bands (ev): -13.7086 -13.7085 -13.7083 -13.7082 -11.3651 -11.3650 -11.3644 -11.3643 -8.9537 -8.9536 -8.9532 -8.9531 -7.0197 -7.0196 -7.0186 -7.0185 -6.0721 -6.0720 -6.0701 -6.0700 -3.2731 -3.2730 -3.2698 -3.2697 -2.0020 -2.0019 -1.9983 -1.9982 -1.7881 -1.7880 -1.7844 -1.7843 -1.4340 -1.4339 -1.4302 -1.4301 -0.1182 -0.1181 -0.1132 -0.1131 0.6657 0.6658 0.6741 0.6742 1.2874 1.2875 1.2919 1.2920 1.7754 1.7754 1.7870 1.7870 2.3779 2.3780 2.3870 2.3870 4.4045 4.4046 4.4293 4.4294 4.6709 4.6709 4.6784 4.6785 4.9588 4.9589 4.9707 4.9708 6.1326 6.1327 6.1347 6.1348 6.4918 6.4918 6.4971 6.4971 k = 0.1750 0.1750 0.3116 ( 8296 PWs) bands (ev): -13.7205 -13.7204 -13.7203 -13.7201 -11.3380 -11.3379 -11.3374 -11.3372 -8.9568 -8.9566 -8.9563 -8.9561 -6.9768 -6.9767 -6.9758 -6.9757 -6.1249 -6.1248 -6.1230 -6.1229 -3.3048 -3.3047 -3.3018 -3.3017 -2.0100 -2.0099 -2.0063 -2.0062 -1.8056 -1.8055 -1.8027 -1.8027 -1.4838 -1.4837 -1.4803 -1.4802 -0.1105 -0.1104 -0.1058 -0.1057 0.6631 0.6632 0.6711 0.6712 1.3928 1.3928 1.3986 1.3987 1.7477 1.7478 1.7599 1.7600 2.4088 2.4089 2.4176 2.4177 4.4967 4.4968 4.5201 4.5202 4.6528 4.6528 4.6611 4.6612 5.0265 5.0266 5.0386 5.0387 6.2169 6.2170 6.2201 6.2202 6.4627 6.4627 6.4686 6.4687 k = 0.1625 0.1625 0.3116 ( 8304 PWs) bands (ev): -13.7318 -13.7317 -13.7316 -13.7314 -11.3119 -11.3118 -11.3113 -11.3111 -8.9593 -8.9592 -8.9588 -8.9587 -6.9356 -6.9355 -6.9347 -6.9346 -6.1754 -6.1753 -6.1737 -6.1735 -3.3348 -3.3347 -3.3321 -3.3320 -2.0233 -2.0232 -2.0195 -2.0194 -1.8162 -1.8161 -1.8141 -1.8140 -1.5314 -1.5313 -1.5282 -1.5281 -0.1021 -0.1020 -0.0976 -0.0975 0.6615 0.6616 0.6690 0.6691 1.4933 1.4933 1.5021 1.5022 1.7188 1.7189 1.7332 1.7333 2.4402 2.4403 2.4486 2.4487 4.5721 4.5722 4.5892 4.5893 4.6474 4.6474 4.6638 4.6639 5.0917 5.0918 5.1042 5.1043 6.2945 6.2946 6.3009 6.3010 6.4349 6.4350 6.4430 6.4430 k = 0.1500 0.1500 0.3116 ( 8304 PWs) bands (ev): -13.7425 -13.7423 -13.7422 -13.7421 -11.2869 -11.2868 -11.2863 -11.2861 -8.9614 -8.9613 -8.9610 -8.9609 -6.8964 -6.8963 -6.8954 -6.8953 -6.2234 -6.2233 -6.2218 -6.2216 -3.3628 -3.3627 -3.3605 -3.3604 -2.0406 -2.0405 -2.0367 -2.0366 -1.8214 -1.8213 -1.8197 -1.8197 -1.5764 -1.5763 -1.5735 -1.5734 -0.0930 -0.0929 -0.0888 -0.0887 0.6607 0.6608 0.6677 0.6677 1.5827 1.5828 1.5998 1.5999 1.6914 1.6915 1.7133 1.7133 2.4713 2.4714 2.4793 2.4794 4.5868 4.5869 4.5961 4.5962 4.7009 4.7010 4.7256 4.7257 5.1536 5.1537 5.1665 5.1666 6.3529 6.3530 6.3697 6.3698 6.4152 6.4153 6.4324 6.4325 k = 0.1375 0.1375 0.3116 ( 8312 PWs) bands (ev): -13.7524 -13.7522 -13.7522 -13.7520 -11.2631 -11.2630 -11.2625 -11.2624 -8.9631 -8.9630 -8.9627 -8.9626 -6.8593 -6.8591 -6.8584 -6.8583 -6.2686 -6.2685 -6.2671 -6.2670 -3.3890 -3.3889 -3.3869 -3.3868 -2.0600 -2.0599 -2.0562 -2.0561 -1.8228 -1.8227 -1.8214 -1.8213 -1.6187 -1.6186 -1.6161 -1.6160 -0.0834 -0.0833 -0.0795 -0.0794 0.6605 0.6606 0.6670 0.6671 1.6282 1.6283 1.6476 1.6477 1.7098 1.7099 1.7331 1.7331 2.5015 2.5016 2.5090 2.5091 4.5730 4.5730 4.5802 4.5803 4.7815 4.7816 4.8065 4.8066 5.2113 5.2114 5.2247 5.2248 6.3566 6.3567 6.3691 6.3691 6.4603 6.4604 6.4723 6.4724 k = 0.1250 0.1250 0.3116 ( 8320 PWs) bands (ev): -13.7615 -13.7614 -13.7613 -13.7612 -11.2408 -11.2406 -11.2402 -11.2401 -8.9645 -8.9644 -8.9641 -8.9640 -6.8245 -6.8244 -6.8236 -6.8235 -6.3108 -6.3107 -6.3094 -6.3093 -3.4131 -3.4130 -3.4113 -3.4112 -2.0801 -2.0800 -2.0764 -2.0763 -1.8220 -1.8220 -1.8207 -1.8207 -1.6578 -1.6577 -1.6555 -1.6554 -0.0735 -0.0734 -0.0700 -0.0699 0.6610 0.6610 0.6669 0.6670 1.6163 1.6164 1.6232 1.6233 1.7962 1.7962 1.8059 1.8060 2.5303 2.5304 2.5372 2.5373 4.5558 4.5559 4.5621 4.5622 4.8626 4.8627 4.8873 4.8874 5.2640 5.2641 5.2780 5.2781 6.3341 6.3342 6.3425 6.3426 6.5264 6.5265 6.5340 6.5341 k = 0.1125 0.1125 0.3116 ( 8316 PWs) bands (ev): -13.7699 -13.7698 -13.7698 -13.7696 -11.2200 -11.2199 -11.2195 -11.2194 -8.9655 -8.9654 -8.9652 -8.9651 -6.7922 -6.7921 -6.7915 -6.7914 -6.3497 -6.3496 -6.3484 -6.3483 -3.4352 -3.4351 -3.4336 -3.4335 -2.0997 -2.0996 -2.0962 -2.0961 -1.8203 -1.8203 -1.8191 -1.8190 -1.6935 -1.6934 -1.6915 -1.6914 -0.0635 -0.0635 -0.0603 -0.0602 0.6618 0.6619 0.6673 0.6674 1.5916 1.5917 1.5953 1.5954 1.8816 1.8817 1.8872 1.8873 2.5573 2.5574 2.5636 2.5637 4.5388 4.5388 4.5444 4.5444 4.9407 4.9408 4.9651 4.9652 5.3111 5.3112 5.3257 5.3258 6.3077 6.3078 6.3146 6.3146 6.5889 6.5890 6.5950 6.5950 k = 0.1000 0.1000 0.3116 ( 8316 PWs) bands (ev): -13.7775 -13.7774 -13.7773 -13.7772 -11.2010 -11.2008 -11.2005 -11.2004 -8.9663 -8.9662 -8.9660 -8.9659 -6.7628 -6.7627 -6.7621 -6.7620 -6.3852 -6.3851 -6.3840 -6.3839 -3.4551 -3.4550 -3.4537 -3.4536 -2.1181 -2.1180 -2.1149 -2.1148 -1.8188 -1.8187 -1.8175 -1.8175 -1.7251 -1.7250 -1.7233 -1.7233 -0.0537 -0.0536 -0.0507 -0.0507 0.6631 0.6631 0.6680 0.6681 1.5655 1.5656 1.5683 1.5684 1.9614 1.9615 1.9652 1.9653 2.5821 2.5822 2.5878 2.5879 4.5227 4.5228 4.5277 4.5278 5.0150 5.0151 5.0391 5.0392 5.3520 5.3521 5.3672 5.3673 6.2810 6.2811 6.2870 6.2870 6.6462 6.6463 6.6515 6.6516 k = 0.0875 0.0875 0.3116 ( 8306 PWs) bands (ev): -13.7842 -13.7841 -13.7841 -13.7840 -11.1838 -11.1837 -11.1834 -11.1833 -8.9669 -8.9668 -8.9666 -8.9665 -6.7363 -6.7362 -6.7357 -6.7356 -6.4170 -6.4168 -6.4159 -6.4158 -3.4729 -3.4728 -3.4717 -3.4716 -2.1348 -2.1347 -2.1319 -2.1318 -1.8188 -1.8188 -1.8176 -1.8175 -1.7515 -1.7514 -1.7501 -1.7500 -0.0442 -0.0441 -0.0416 -0.0415 0.6645 0.6646 0.6689 0.6690 1.5406 1.5407 1.5430 1.5431 2.0345 2.0346 2.0372 2.0373 2.6046 2.6047 2.6097 2.6098 4.5080 4.5081 4.5124 4.5125 5.0849 5.0850 5.1086 5.1087 5.3862 5.3863 5.4020 5.4021 6.2553 6.2553 6.2605 6.2606 6.6977 6.6978 6.7026 6.7027 k = 0.0750 0.0750 0.3116 ( 8302 PWs) bands (ev): -13.7901 -13.7900 -13.7900 -13.7899 -11.1686 -11.1685 -11.1682 -11.1681 -8.9673 -8.9672 -8.9671 -8.9670 -6.7129 -6.7128 -6.7124 -6.7123 -6.4449 -6.4448 -6.4440 -6.4439 -3.4884 -3.4883 -3.4874 -3.4873 -2.1495 -2.1494 -2.1470 -2.1469 -1.8226 -1.8225 -1.8213 -1.8213 -1.7706 -1.7705 -1.7696 -1.7696 -0.0353 -0.0352 -0.0330 -0.0330 0.6661 0.6662 0.6699 0.6700 1.5178 1.5179 1.5198 1.5199 2.1000 2.1001 2.1020 2.1021 2.6245 2.6246 2.6289 2.6290 4.4949 4.4950 4.4988 4.4988 5.1498 5.1499 5.1731 5.1732 5.4132 5.4133 5.4297 5.4298 6.2313 6.2313 6.2358 6.2359 6.7431 6.7432 6.7476 6.7477 k = 0.0625 0.0625 0.3116 ( 8282 PWs) bands (ev): -13.7951 -13.7950 -13.7950 -13.7949 -11.1555 -11.1554 -11.1552 -11.1551 -8.9676 -8.9675 -8.9674 -8.9673 -6.6928 -6.6927 -6.6924 -6.6923 -6.4688 -6.4687 -6.4681 -6.4679 -3.5015 -3.5015 -3.5007 -3.5006 -2.1622 -2.1620 -2.1600 -2.1599 -1.8318 -1.8317 -1.8306 -1.8305 -1.7808 -1.7808 -1.7802 -1.7802 -0.0273 -0.0272 -0.0254 -0.0253 0.6678 0.6678 0.6710 0.6710 1.4976 1.4977 1.4994 1.4995 2.1570 2.1571 2.1585 2.1586 2.6417 2.6418 2.6454 2.6455 4.4837 4.4837 4.4869 4.4870 5.2094 5.2095 5.2323 5.2324 5.4327 5.4328 5.4500 5.4501 6.2097 6.2098 6.2136 6.2136 6.7821 6.7821 6.7862 6.7863 k = 0.0500 0.0500 0.3116 ( 8282 PWs) bands (ev): -13.7993 -13.7992 -13.7991 -13.7990 -11.1447 -11.1446 -11.1444 -11.1443 -8.9678 -8.9676 -8.9676 -8.9675 -6.6762 -6.6761 -6.6758 -6.6757 -6.4886 -6.4884 -6.4880 -6.4878 -3.5124 -3.5123 -3.5117 -3.5116 -2.1725 -2.1724 -2.1708 -2.1707 -1.8441 -1.8440 -1.8431 -1.8430 -1.7845 -1.7844 -1.7841 -1.7840 -0.0203 -0.0202 -0.0187 -0.0187 0.6693 0.6694 0.6719 0.6720 1.4805 1.4806 1.4820 1.4821 2.2049 2.2050 2.2060 2.2061 2.6560 2.6561 2.6589 2.6590 4.4743 4.4744 4.4769 4.4770 5.2633 5.2634 5.2857 5.2858 5.4446 5.4447 5.4625 5.4626 6.1911 6.1912 6.1943 6.1943 6.8144 6.8144 6.8180 6.8181 k = 0.0375 0.0375 0.3116 ( 8278 PWs) bands (ev): -13.8025 -13.8024 -13.8023 -13.8023 -11.1362 -11.1360 -11.1360 -11.1358 -8.9679 -8.9677 -8.9677 -8.9676 -6.6631 -6.6630 -6.6629 -6.6627 -6.5040 -6.5039 -6.5036 -6.5035 -3.5209 -3.5208 -3.5204 -3.5203 -2.1805 -2.1804 -2.1792 -2.1791 -1.8558 -1.8557 -1.8550 -1.8550 -1.7853 -1.7852 -1.7850 -1.7849 -0.0146 -0.0145 -0.0134 -0.0133 0.6707 0.6708 0.6727 0.6728 1.4669 1.4670 1.4681 1.4681 2.2429 2.2430 2.2437 2.2438 2.6672 2.6673 2.6695 2.6696 4.4670 4.4671 4.4690 4.4691 5.3109 5.3110 5.3329 5.3330 5.4486 5.4487 5.4672 5.4673 6.1761 6.1762 6.1785 6.1786 6.8398 6.8399 6.8429 6.8430 k = 0.0250 0.0250 0.3116 ( 8262 PWs) bands (ev): -13.8048 -13.8047 -13.8046 -13.8046 -11.1300 -11.1299 -11.1299 -11.1297 -8.9679 -8.9678 -8.9678 -8.9677 -6.6537 -6.6536 -6.6535 -6.6534 -6.5151 -6.5150 -6.5148 -6.5147 -3.5269 -3.5268 -3.5266 -3.5265 -2.1862 -2.1861 -2.1853 -2.1852 -1.8649 -1.8648 -1.8644 -1.8643 -1.7851 -1.7850 -1.7849 -1.7849 -0.0103 -0.0102 -0.0095 -0.0094 0.6719 0.6720 0.6732 0.6733 1.4571 1.4571 1.4578 1.4579 2.2705 2.2706 2.2710 2.2711 2.6755 2.6755 2.6770 2.6771 4.4618 4.4619 4.4632 4.4632 5.3520 5.3521 5.3735 5.3736 5.4448 5.4449 5.4639 5.4640 6.1652 6.1653 6.1668 6.1669 6.8584 6.8584 6.8606 6.8606 k = 0.0125 0.0125 0.3116 ( 8260 PWs) bands (ev): -13.8062 -13.8061 -13.8060 -13.8060 -11.1263 -11.1262 -11.1261 -11.1261 -8.9679 -8.9679 -8.9678 -8.9678 -6.6480 -6.6479 -6.6479 -6.6478 -6.5218 -6.5217 -6.5216 -6.5215 -3.5305 -3.5304 -3.5303 -3.5302 -2.1895 -2.1894 -2.1891 -2.1890 -1.8705 -1.8704 -1.8702 -1.8702 -1.7848 -1.7847 -1.7847 -1.7846 -0.0076 -0.0075 -0.0072 -0.0071 0.6728 0.6728 0.6734 0.6735 1.4511 1.4512 1.4515 1.4516 2.2873 2.2874 2.2876 2.2877 2.6806 2.6806 2.6813 2.6814 4.4588 4.4589 4.4595 4.4596 5.3861 5.3862 5.4067 5.4068 5.4334 5.4335 5.4529 5.4530 6.1586 6.1587 6.1595 6.1595 6.8698 6.8699 6.8709 6.8710 k = 0.0000 0.0000 0.3116 ( 8266 PWs) bands (ev): -13.8066 -13.8066 -13.8065 -13.8065 -11.1250 -11.1250 -11.1249 -11.1249 -8.9679 -8.9679 -8.9678 -8.9678 -6.6461 -6.6461 -6.6460 -6.6460 -6.5240 -6.5240 -6.5238 -6.5238 -3.5316 -3.5316 -3.5315 -3.5315 -2.1905 -2.1905 -2.1904 -2.1904 -1.8723 -1.8723 -1.8722 -1.8722 -1.7847 -1.7847 -1.7846 -1.7846 -0.0066 -0.0066 -0.0065 -0.0065 0.6733 0.6733 0.6734 0.6734 1.4492 1.4492 1.4493 1.4493 2.2931 2.2931 2.2932 2.2932 2.6825 2.6825 2.6826 2.6826 4.4581 4.4581 4.4581 4.4581 5.4125 5.4125 5.4126 5.4126 5.4346 5.4346 5.4347 5.4347 6.1567 6.1567 6.1568 6.1568 6.8740 6.8740 6.8741 6.8741 k = 0.0000 0.5000-0.0000 ( 8322 PWs) bands (ev): -13.7619 -13.7619 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4223 -6.4223 -5.1020 -5.1020 -3.4058 -3.4058 -2.7455 -2.7455 -2.1971 -2.1971 -2.0837 -2.0837 -1.6005 -1.6005 -1.3657 -1.3657 -1.3159 -1.3159 -1.1272 -1.1272 -0.8770 -0.8770 -0.1095 -0.1095 0.3055 0.3055 0.6475 0.6475 1.5737 1.5737 1.7885 1.7885 1.9402 1.9402 2.0874 2.0874 2.1184 2.1184 2.3639 2.3639 2.4164 2.4164 3.2457 3.2457 4.1560 4.1560 5.0550 5.0550 5.3263 5.3263 5.3696 5.3696 5.9786 5.9786 6.3601 6.3601 6.9504 6.9504 7.0015 7.0015 k = 0.0000 0.5000 0.0173 ( 8316 PWs) bands (ev): -13.7619 -13.7619 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4223 -6.4223 -5.1020 -5.1020 -3.4055 -3.4055 -2.7458 -2.7458 -2.1970 -2.1970 -2.0839 -2.0839 -1.6003 -1.6003 -1.3657 -1.3657 -1.3160 -1.3160 -1.1275 -1.1275 -0.8771 -0.8771 -0.1095 -0.1095 0.3049 0.3049 0.6476 0.6476 1.5743 1.5743 1.7887 1.7887 1.9398 1.9398 2.0875 2.0875 2.1193 2.1193 2.3639 2.3639 2.4159 2.4159 3.2456 3.2456 4.1565 4.1565 5.0550 5.0550 5.3263 5.3263 5.3688 5.3688 5.9786 5.9786 6.3600 6.3600 6.9486 6.9486 7.0016 7.0016 k = 0.0000 0.5000 0.0346 ( 8318 PWs) bands (ev): -13.7619 -13.7619 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4222 -6.4222 -5.1019 -5.1019 -3.4046 -3.4046 -2.7467 -2.7467 -2.1966 -2.1966 -2.0845 -2.0845 -1.5998 -1.5998 -1.3655 -1.3655 -1.3160 -1.3160 -1.1282 -1.1282 -0.8773 -0.8773 -0.1094 -0.1094 0.3030 0.3030 0.6479 0.6479 1.5758 1.5758 1.7895 1.7895 1.9387 1.9387 2.0876 2.0876 2.1220 2.1220 2.3636 2.3636 2.4146 2.4146 3.2452 3.2452 4.1579 4.1579 5.0550 5.0550 5.3263 5.3263 5.3666 5.3666 5.9786 5.9786 6.3596 6.3596 6.9432 6.9432 7.0018 7.0018 k = 0.0000 0.5000 0.0519 ( 8314 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9510 -11.9510 -11.0720 -11.0720 -9.2486 -9.2486 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4222 -6.4222 -5.1017 -5.1017 -3.4031 -3.4031 -2.7482 -2.7482 -2.1960 -2.1960 -2.0856 -2.0856 -1.5990 -1.5990 -1.3651 -1.3651 -1.3160 -1.3160 -1.1295 -1.1295 -0.8777 -0.8777 -0.1091 -0.1091 0.2999 0.2999 0.6483 0.6483 1.5784 1.5784 1.7907 1.7907 1.9369 1.9369 2.0877 2.0877 2.1265 2.1265 2.3632 2.3632 2.4123 2.4123 3.2445 3.2445 4.1602 4.1602 5.0549 5.0549 5.3263 5.3263 5.3632 5.3632 5.9785 5.9785 6.3592 6.3592 6.9345 6.9345 7.0022 7.0022 k = 0.0000 0.5000 0.0692 ( 8314 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9511 -11.9511 -11.0720 -11.0720 -9.2487 -9.2487 -8.4859 -8.4859 -7.6179 -7.6179 -6.9399 -6.9399 -6.4221 -6.4221 -5.1015 -5.1015 -3.4011 -3.4011 -2.7503 -2.7503 -2.1951 -2.1951 -2.0871 -2.0871 -1.5979 -1.5979 -1.3646 -1.3646 -1.3160 -1.3160 -1.1312 -1.1312 -0.8782 -0.8782 -0.1088 -0.1088 0.2957 0.2957 0.6489 0.6489 1.5819 1.5819 1.7924 1.7924 1.9344 1.9344 2.0879 2.0879 2.1325 2.1325 2.3627 2.3627 2.4093 2.4093 3.2436 3.2436 4.1633 4.1633 5.0548 5.0548 5.3263 5.3263 5.3586 5.3586 5.9783 5.9783 6.3585 6.3585 6.9229 6.9229 7.0025 7.0025 k = 0.0000 0.5000 0.0866 ( 8318 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9511 -11.9511 -11.0720 -11.0720 -9.2487 -9.2487 -8.4858 -8.4858 -7.6180 -7.6180 -6.9400 -6.9400 -6.4220 -6.4220 -5.1012 -5.1012 -3.3987 -3.3987 -2.7528 -2.7528 -2.1939 -2.1939 -2.0889 -2.0889 -1.5966 -1.5966 -1.3641 -1.3641 -1.3161 -1.3161 -1.1333 -1.1333 -0.8788 -0.8788 -0.1084 -0.1084 0.2906 0.2906 0.6496 0.6496 1.5863 1.5863 1.7945 1.7945 1.9313 1.9313 2.0881 2.0881 2.1399 2.1399 2.3620 2.3620 2.4056 2.4056 3.2424 3.2424 4.1670 4.1670 5.0547 5.0547 5.3263 5.3263 5.3533 5.3533 5.9782 5.9782 6.3577 6.3577 6.9090 6.9090 7.0026 7.0026 k = 0.0000 0.5000 0.1039 ( 8314 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9512 -11.9512 -11.0720 -11.0720 -9.2488 -9.2488 -8.4858 -8.4858 -7.6180 -7.6180 -6.9400 -6.9400 -6.4219 -6.4219 -5.1009 -5.1009 -3.3957 -3.3957 -2.7558 -2.7558 -2.1926 -2.1926 -2.0911 -2.0911 -1.5951 -1.5951 -1.3634 -1.3634 -1.3161 -1.3161 -1.1358 -1.1358 -0.8795 -0.8795 -0.1079 -0.1079 0.2846 0.2846 0.6505 0.6505 1.5913 1.5913 1.7969 1.7969 1.9278 1.9278 2.0884 2.0884 2.1485 2.1485 2.3612 2.3612 2.4012 2.4012 3.2411 3.2411 4.1711 4.1711 5.0547 5.0547 5.3262 5.3262 5.3474 5.3474 5.9780 5.9780 6.3568 6.3568 6.8934 6.8934 7.0024 7.0024 k = 0.0000 0.5000 0.1212 ( 8314 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9512 -11.9512 -11.0720 -11.0720 -9.2488 -9.2488 -8.4858 -8.4858 -7.6180 -7.6180 -6.9401 -6.9401 -6.4218 -6.4218 -5.1005 -5.1005 -3.3925 -3.3925 -2.7592 -2.7592 -2.1910 -2.1910 -2.0936 -2.0936 -1.5934 -1.5934 -1.3626 -1.3626 -1.3161 -1.3161 -1.1385 -1.1385 -0.8803 -0.8803 -0.1074 -0.1074 0.2781 0.2781 0.6514 0.6514 1.5969 1.5969 1.7997 1.7997 1.9239 1.9239 2.0886 2.0886 2.1579 2.1579 2.3604 2.3604 2.3963 2.3963 3.2396 3.2396 4.1756 4.1756 5.0545 5.0545 5.3260 5.3260 5.3414 5.3414 5.9778 5.9778 6.3558 6.3558 6.8765 6.8765 7.0016 7.0016 k = 0.0000 0.5000 0.1385 ( 8302 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9512 -11.9512 -11.0720 -11.0720 -9.2489 -9.2489 -8.4858 -8.4858 -7.6181 -7.6181 -6.9401 -6.9401 -6.4216 -6.4216 -5.1002 -5.1002 -3.3890 -3.3890 -2.7628 -2.7628 -2.1893 -2.1893 -2.0963 -2.0963 -1.5916 -1.5916 -1.3618 -1.3618 -1.3161 -1.3161 -1.1414 -1.1414 -0.8811 -0.8811 -0.1069 -0.1069 0.2712 0.2712 0.6524 0.6524 1.6029 1.6029 1.8026 1.8026 1.9198 1.9198 2.0889 2.0889 2.1680 2.1680 2.3595 2.3595 2.3911 2.3911 3.2380 3.2380 4.1801 4.1801 5.0544 5.0544 5.3257 5.3257 5.3356 5.3356 5.9776 5.9776 6.3548 6.3548 6.8590 6.8590 7.0004 7.0004 k = 0.0000 0.5000 0.1558 ( 8314 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9513 -11.9513 -11.0720 -11.0720 -9.2489 -9.2489 -8.4858 -8.4858 -7.6181 -7.6181 -6.9402 -6.9402 -6.4215 -6.4215 -5.0998 -5.0998 -3.3853 -3.3853 -2.7665 -2.7665 -2.1873 -2.1873 -2.0992 -2.0992 -1.5897 -1.5897 -1.3610 -1.3610 -1.3162 -1.3162 -1.1444 -1.1444 -0.8819 -0.8819 -0.1063 -0.1063 0.2642 0.2642 0.6535 0.6535 1.6090 1.6090 1.8057 1.8057 1.9156 1.9156 2.0891 2.0891 2.1784 2.1784 2.3586 2.3586 2.3856 2.3856 3.2363 3.2363 4.1846 4.1846 5.0543 5.0543 5.3248 5.3248 5.3308 5.3308 5.9773 5.9773 6.3538 6.3538 6.8414 6.8414 6.9986 6.9986 k = 0.0000 0.5000 0.1731 ( 8326 PWs) bands (ev): -13.7618 -13.7618 -13.4693 -13.4693 -11.9513 -11.9513 -11.0720 -11.0720 -9.2490 -9.2490 -8.4858 -8.4858 -7.6182 -7.6182 -6.9402 -6.9402 -6.4213 -6.4213 -5.0994 -5.0994 -3.3816 -3.3816 -2.7704 -2.7704 -2.1853 -2.1853 -2.1022 -2.1022 -1.5878 -1.5878 -1.3602 -1.3602 -1.3162 -1.3162 -1.1474 -1.1474 -0.8827 -0.8827 -0.1058 -0.1058 0.2572 0.2572 0.6545 0.6545 1.6152 1.6152 1.8088 1.8088 1.9114 1.9114 2.0894 2.0894 2.1887 2.1887 2.3577 2.3577 2.3801 2.3801 3.2346 3.2346 4.1889 4.1889 5.0542 5.0542 5.3222 5.3222 5.3282 5.3282 5.9771 5.9771 6.3528 6.3528 6.8241 6.8241 6.9962 6.9963 k = 0.0000 0.5000 0.1904 ( 8332 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9514 -11.9514 -11.0720 -11.0720 -9.2491 -9.2491 -8.4857 -8.4857 -7.6182 -7.6182 -6.9403 -6.9403 -6.4212 -6.4212 -5.0990 -5.0990 -3.3779 -3.3779 -2.7741 -2.7741 -2.1831 -2.1831 -2.1053 -2.1053 -1.5860 -1.5860 -1.3594 -1.3594 -1.3162 -1.3162 -1.1503 -1.1503 -0.8834 -0.8834 -0.1052 -0.1052 0.2504 0.2504 0.6556 0.6556 1.6212 1.6212 1.8118 1.8118 1.9073 1.9073 2.0896 2.0896 2.1987 2.1987 2.3569 2.3569 2.3747 2.3747 3.2330 3.2330 4.1927 4.1927 5.0541 5.0541 5.3184 5.3184 5.3274 5.3274 5.9769 5.9769 6.3519 6.3519 6.8077 6.8077 6.9936 6.9936 k = 0.0000 0.5000 0.2077 ( 8314 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9514 -11.9514 -11.0720 -11.0720 -9.2491 -9.2491 -8.4857 -8.4857 -7.6182 -7.6182 -6.9403 -6.9403 -6.4211 -6.4211 -5.0986 -5.0986 -3.3745 -3.3745 -2.7777 -2.7777 -2.1810 -2.1810 -2.1084 -2.1084 -1.5843 -1.5843 -1.3587 -1.3587 -1.3162 -1.3162 -1.1531 -1.1531 -0.8841 -0.8841 -0.1047 -0.1047 0.2441 0.2441 0.6565 0.6565 1.6269 1.6269 1.8146 1.8146 1.9036 1.9036 2.0899 2.0899 2.2081 2.2081 2.3561 2.3561 2.3696 2.3696 3.2314 3.2314 4.1962 4.1962 5.0540 5.0540 5.3149 5.3149 5.3272 5.3272 5.9767 5.9767 6.3510 6.3510 6.7926 6.7926 6.9906 6.9906 k = 0.0000 0.5000 0.2250 ( 8302 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9515 -11.9515 -11.0720 -11.0720 -9.2492 -9.2492 -8.4857 -8.4857 -7.6183 -7.6183 -6.9403 -6.9403 -6.4210 -6.4210 -5.0983 -5.0983 -3.3713 -3.3713 -2.7810 -2.7810 -2.1788 -2.1788 -2.1113 -2.1113 -1.5828 -1.5828 -1.3580 -1.3580 -1.3161 -1.3161 -1.1556 -1.1556 -0.8847 -0.8847 -0.1043 -0.1043 0.2385 0.2385 0.6574 0.6574 1.6320 1.6320 1.8172 1.8172 1.9003 1.9003 2.0900 2.0900 2.2166 2.2166 2.3554 2.3554 2.3649 2.3649 3.2299 3.2299 4.1991 4.1991 5.0539 5.0539 5.3121 5.3121 5.3270 5.3270 5.9765 5.9765 6.3503 6.3503 6.7792 6.7792 6.9877 6.9877 k = 0.0000 0.5000 0.2424 ( 8296 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9515 -11.9515 -11.0720 -11.0720 -9.2492 -9.2492 -8.4857 -8.4857 -7.6183 -7.6183 -6.9404 -6.9404 -6.4209 -6.4209 -5.0980 -5.0980 -3.3685 -3.3685 -2.7838 -2.7838 -2.1768 -2.1768 -2.1140 -2.1140 -1.5815 -1.5815 -1.3574 -1.3574 -1.3161 -1.3161 -1.1578 -1.1578 -0.8853 -0.8853 -0.1039 -0.1039 0.2336 0.2336 0.6582 0.6582 1.6364 1.6364 1.8194 1.8194 1.8974 1.8974 2.0902 2.0902 2.2239 2.2239 2.3546 2.3546 2.3610 2.3610 3.2287 3.2287 4.2014 4.2014 5.0538 5.0538 5.3099 5.3099 5.3270 5.3270 5.9764 5.9764 6.3497 6.3497 6.7677 6.7677 6.9849 6.9849 k = 0.0000 0.5000 0.2597 ( 8292 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9515 -11.9515 -11.0720 -11.0720 -9.2492 -9.2492 -8.4857 -8.4857 -7.6183 -7.6183 -6.9404 -6.9404 -6.4208 -6.4208 -5.0978 -5.0978 -3.3662 -3.3662 -2.7862 -2.7862 -2.1751 -2.1751 -2.1163 -2.1163 -1.5804 -1.5804 -1.3569 -1.3569 -1.3161 -1.3161 -1.1596 -1.1596 -0.8857 -0.8857 -0.1036 -0.1036 0.2297 0.2297 0.6588 0.6588 1.6400 1.6400 1.8212 1.8212 1.8951 1.8951 2.0903 2.0903 2.2298 2.2298 2.3538 2.3538 2.3580 2.3580 3.2276 3.2276 4.2032 4.2032 5.0537 5.0537 5.3083 5.3083 5.3269 5.3269 5.9762 5.9762 6.3492 6.3492 6.7585 6.7585 6.9824 6.9824 k = 0.0000 0.5000 0.2770 ( 8280 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9516 -11.9516 -11.0720 -11.0720 -9.2493 -9.2493 -8.4857 -8.4857 -7.6183 -7.6183 -6.9404 -6.9404 -6.4207 -6.4207 -5.0976 -5.0976 -3.3645 -3.3645 -2.7879 -2.7879 -2.1737 -2.1737 -2.1180 -2.1180 -1.5796 -1.5796 -1.3566 -1.3566 -1.3161 -1.3161 -1.1609 -1.1609 -0.8860 -0.8860 -0.1033 -0.1033 0.2268 0.2268 0.6593 0.6593 1.6426 1.6426 1.8225 1.8225 1.8935 1.8935 2.0904 2.0904 2.2342 2.2342 2.3528 2.3528 2.3562 2.3562 3.2269 3.2269 4.2045 4.2045 5.0536 5.0536 5.3072 5.3072 5.3269 5.3269 5.9761 5.9761 6.3488 6.3488 6.7517 6.7517 6.9806 6.9806 k = 0.0000 0.5000 0.2943 ( 8282 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9516 -11.9516 -11.0720 -11.0720 -9.2493 -9.2493 -8.4857 -8.4857 -7.6183 -7.6183 -6.9404 -6.9404 -6.4207 -6.4207 -5.0975 -5.0975 -3.3635 -3.3635 -2.7890 -2.7890 -2.1728 -2.1728 -2.1192 -2.1192 -1.5791 -1.5791 -1.3563 -1.3563 -1.3161 -1.3161 -1.1617 -1.1617 -0.8862 -0.8862 -0.1032 -0.1032 0.2251 0.2251 0.6596 0.6596 1.6443 1.6443 1.8233 1.8233 1.8925 1.8925 2.0905 2.0905 2.2369 2.2369 2.3519 2.3519 2.3554 2.3554 3.2264 3.2264 4.2053 4.2053 5.0536 5.0536 5.3066 5.3066 5.3269 5.3269 5.9761 5.9761 6.3486 6.3486 6.7476 6.7476 6.9794 6.9794 k = 0.0000 0.5000 0.3116 ( 8284 PWs) bands (ev): -13.7617 -13.7617 -13.4693 -13.4693 -11.9516 -11.9516 -11.0720 -11.0720 -9.2493 -9.2493 -8.4857 -8.4857 -7.6184 -7.6184 -6.9404 -6.9404 -6.4207 -6.4207 -5.0975 -5.0975 -3.3632 -3.3632 -2.7893 -2.7893 -2.1725 -2.1725 -2.1196 -2.1196 -1.5789 -1.5789 -1.3563 -1.3563 -1.3161 -1.3161 -1.1619 -1.1619 -0.8862 -0.8862 -0.1031 -0.1031 0.2245 0.2245 0.6597 0.6597 1.6448 1.6448 1.8236 1.8236 1.8921 1.8921 2.0905 2.0905 2.2378 2.2378 2.3515 2.3515 2.3552 2.3552 3.2262 3.2262 4.2055 4.2055 5.0536 5.0536 5.3064 5.3064 5.3269 5.3269 5.9761 5.9761 6.3485 6.3485 6.7462 6.7462 6.9790 6.9790 k = 0.5000 0.5000-0.0000 ( 8272 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9173 -11.9173 -11.8644 -11.8644 -8.7748 -8.7748 -8.7242 -8.7242 -7.9289 -7.9289 -7.9288 -7.9288 -4.9569 -4.9569 -4.9567 -4.9567 -2.6501 -2.6501 -2.3532 -2.3532 -1.9224 -1.9224 -1.9213 -1.9213 -1.3608 -1.3608 -0.9609 -0.9609 -0.7639 -0.7639 -0.7634 -0.7634 -0.5534 -0.5534 -0.2903 -0.2903 -0.0271 -0.0271 0.0526 0.0526 1.4377 1.4377 1.5198 1.5198 1.5241 1.5241 1.7022 1.7022 1.8343 1.8343 1.8346 1.8346 2.3345 2.3345 2.3366 2.3366 3.8574 3.8574 3.8622 3.8622 4.1129 4.1129 4.2266 4.2266 4.2272 4.2272 5.9880 5.9880 7.3919 7.3919 7.6792 7.6792 k = 0.5000 0.5000 0.0173 ( 8264 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9172 -11.9172 -11.8645 -11.8645 -8.7747 -8.7747 -8.7243 -8.7243 -7.9289 -7.9289 -7.9288 -7.9288 -4.9569 -4.9569 -4.9567 -4.9567 -2.6495 -2.6495 -2.3537 -2.3537 -1.9224 -1.9224 -1.9213 -1.9213 -1.3602 -1.3602 -0.9619 -0.9619 -0.7639 -0.7639 -0.7634 -0.7634 -0.5529 -0.5529 -0.2908 -0.2908 -0.0270 -0.0270 0.0522 0.0522 1.4381 1.4381 1.5176 1.5176 1.5221 1.5221 1.7016 1.7016 1.8349 1.8349 1.8352 1.8352 2.3363 2.3363 2.3384 2.3384 3.8574 3.8574 3.8622 3.8622 4.1164 4.1164 4.2264 4.2264 4.2271 4.2271 5.9842 5.9842 7.3944 7.3944 7.6798 7.6798 k = 0.5000 0.5000 0.0346 ( 8288 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9169 -11.9169 -11.8648 -11.8648 -8.7744 -8.7744 -8.7246 -8.7246 -7.9289 -7.9289 -7.9288 -7.9288 -4.9568 -4.9568 -4.9566 -4.9566 -2.6476 -2.6476 -2.3551 -2.3551 -1.9222 -1.9222 -1.9211 -1.9211 -1.3585 -1.3585 -0.9648 -0.9648 -0.7639 -0.7639 -0.7634 -0.7634 -0.5514 -0.5514 -0.2923 -0.2923 -0.0270 -0.0270 0.0510 0.0510 1.4390 1.4390 1.5114 1.5114 1.5161 1.5161 1.6998 1.6998 1.8367 1.8367 1.8370 1.8370 2.3418 2.3418 2.3438 2.3438 3.8574 3.8574 3.8620 3.8620 4.1269 4.1269 4.2258 4.2258 4.2266 4.2266 5.9727 5.9727 7.4017 7.4017 7.6817 7.6817 k = 0.5000 0.5000 0.0519 ( 8288 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9164 -11.9164 -11.8653 -11.8653 -8.7740 -8.7740 -8.7251 -8.7251 -7.9289 -7.9289 -7.9288 -7.9288 -4.9566 -4.9566 -4.9564 -4.9564 -2.6445 -2.6445 -2.3575 -2.3575 -1.9219 -1.9219 -1.9209 -1.9209 -1.3557 -1.3557 -0.9695 -0.9695 -0.7639 -0.7639 -0.7634 -0.7634 -0.5489 -0.5489 -0.2947 -0.2947 -0.0268 -0.0268 0.0491 0.0491 1.4404 1.4404 1.5015 1.5015 1.5068 1.5068 1.6967 1.6967 1.8394 1.8394 1.8396 1.8396 2.3506 2.3506 2.3525 2.3525 3.8573 3.8573 3.8619 3.8619 4.1441 4.1441 4.2249 4.2249 4.2260 4.2260 5.9536 5.9536 7.4139 7.4139 7.6849 7.6849 k = 0.5000 0.5000 0.0692 ( 8272 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9157 -11.9157 -11.8660 -11.8660 -8.7733 -8.7733 -8.7258 -8.7258 -7.9290 -7.9290 -7.9289 -7.9289 -4.9564 -4.9564 -4.9562 -4.9562 -2.6401 -2.6401 -2.3609 -2.3609 -1.9216 -1.9216 -1.9206 -1.9206 -1.3517 -1.3517 -0.9761 -0.9761 -0.7639 -0.7639 -0.7634 -0.7634 -0.5453 -0.5453 -0.2980 -0.2980 -0.0267 -0.0267 0.0465 0.0465 1.4420 1.4420 1.4887 1.4887 1.4951 1.4951 1.6925 1.6925 1.8427 1.8427 1.8428 1.8428 2.3624 2.3624 2.3642 2.3642 3.8572 3.8572 3.8616 3.8616 4.1676 4.1676 4.2236 4.2236 4.2256 4.2256 5.9273 5.9273 7.4308 7.4308 7.6893 7.6893 k = 0.5000 0.5000 0.0866 ( 8288 PWs) bands (ev): -13.4293 -13.4293 -13.4292 -13.4292 -11.9149 -11.9149 -11.8669 -11.8669 -8.7725 -8.7725 -8.7266 -8.7266 -7.9291 -7.9291 -7.9290 -7.9290 -4.9561 -4.9561 -4.9559 -4.9559 -2.6346 -2.6346 -2.3652 -2.3652 -1.9211 -1.9211 -1.9202 -1.9202 -1.3466 -1.3466 -0.9844 -0.9844 -0.7639 -0.7639 -0.7634 -0.7634 -0.5408 -0.5408 -0.3023 -0.3023 -0.0264 -0.0264 0.0433 0.0433 1.4430 1.4430 1.4736 1.4736 1.4825 1.4825 1.6872 1.6872 1.8463 1.8463 1.8464 1.8464 2.3767 2.3767 2.3783 2.3783 3.8571 3.8571 3.8613 3.8613 4.1955 4.1955 4.2220 4.2220 4.2270 4.2270 5.8939 5.8939 7.4524 7.4524 7.6949 7.6949 k = 0.5000 0.5000 0.1039 ( 8296 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9138 -11.9138 -11.8680 -11.8680 -8.7715 -8.7715 -8.7277 -8.7277 -7.9292 -7.9292 -7.9291 -7.9291 -4.9558 -4.9558 -4.9556 -4.9556 -2.6279 -2.6279 -2.3704 -2.3704 -1.9206 -1.9206 -1.9197 -1.9197 -1.3404 -1.3404 -0.9943 -0.9943 -0.7639 -0.7639 -0.7634 -0.7634 -0.5354 -0.5354 -0.3074 -0.3074 -0.0261 -0.0261 0.0396 0.0396 1.4409 1.4409 1.4569 1.4569 1.4722 1.4722 1.6808 1.6808 1.8498 1.8498 1.8500 1.8500 2.3930 2.3930 2.3944 2.3944 3.8570 3.8570 3.8609 3.8609 4.2136 4.2136 4.2201 4.2201 4.2444 4.2444 5.8538 5.8538 7.4785 7.4785 7.7015 7.7015 k = 0.5000 0.5000 0.1212 ( 8292 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9126 -11.9126 -11.8692 -11.8692 -8.7703 -8.7703 -8.7289 -8.7289 -7.9293 -7.9293 -7.9292 -7.9292 -4.9554 -4.9554 -4.9552 -4.9552 -2.6202 -2.6202 -2.3765 -2.3765 -1.9201 -1.9201 -1.9192 -1.9192 -1.3331 -1.3331 -1.0058 -1.0058 -0.7638 -0.7638 -0.7634 -0.7634 -0.5292 -0.5292 -0.3134 -0.3134 -0.0257 -0.0257 0.0355 0.0355 1.4321 1.4321 1.4394 1.4394 1.4686 1.4686 1.6735 1.6735 1.8532 1.8532 1.8534 1.8534 2.4106 2.4106 2.4119 2.4119 3.8568 3.8568 3.8605 3.8605 4.2152 4.2152 4.2181 4.2181 4.2839 4.2839 5.8075 5.8075 7.5089 7.5089 7.7091 7.7091 k = 0.5000 0.5000 0.1385 ( 8292 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9112 -11.9112 -11.8706 -11.8706 -8.7690 -8.7690 -8.7302 -8.7302 -7.9294 -7.9294 -7.9293 -7.9293 -4.9550 -4.9550 -4.9549 -4.9549 -2.6115 -2.6115 -2.3835 -2.3835 -1.9195 -1.9195 -1.9186 -1.9186 -1.3247 -1.3247 -1.0187 -1.0187 -0.7638 -0.7638 -0.7634 -0.7634 -0.5220 -0.5220 -0.3202 -0.3202 -0.0252 -0.0252 0.0311 0.0311 1.4179 1.4179 1.4217 1.4217 1.4708 1.4708 1.6653 1.6653 1.8563 1.8563 1.8566 1.8566 2.4290 2.4290 2.4301 2.4301 3.8567 3.8567 3.8600 3.8600 4.2140 4.2140 4.2158 4.2158 4.3318 4.3318 5.7553 5.7553 7.5434 7.5434 7.7177 7.7177 k = 0.5000 0.5000 0.1558 ( 8284 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9097 -11.9097 -11.8722 -11.8722 -8.7675 -8.7675 -8.7317 -8.7317 -7.9295 -7.9295 -7.9294 -7.9294 -4.9546 -4.9546 -4.9545 -4.9545 -2.6019 -2.6019 -2.3914 -2.3914 -1.9188 -1.9188 -1.9181 -1.9181 -1.3152 -1.3152 -1.0328 -1.0328 -0.7638 -0.7638 -0.7634 -0.7634 -0.5141 -0.5141 -0.3278 -0.3278 -0.0245 -0.0245 0.0265 0.0265 1.4020 1.4020 1.4042 1.4042 1.4757 1.4757 1.6564 1.6564 1.8590 1.8590 1.8594 1.8594 2.4475 2.4475 2.4485 2.4485 3.8565 3.8565 3.8596 3.8596 4.2121 4.2121 4.2135 4.2135 4.3856 4.3856 5.6978 5.6978 7.5817 7.5817 7.7270 7.7270 k = 0.5000 0.5000 0.1731 ( 8268 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9080 -11.9080 -11.8739 -11.8739 -8.7659 -8.7659 -8.7334 -8.7334 -7.9296 -7.9296 -7.9295 -7.9295 -4.9542 -4.9542 -4.9541 -4.9541 -2.5915 -2.5915 -2.4000 -2.4000 -1.9182 -1.9182 -1.9175 -1.9175 -1.3047 -1.3047 -1.0480 -1.0480 -0.7638 -0.7638 -0.7634 -0.7634 -0.5055 -0.5055 -0.3361 -0.3361 -0.0237 -0.0237 0.0219 0.0219 1.3861 1.3861 1.3875 1.3875 1.4821 1.4821 1.6467 1.6467 1.8615 1.8615 1.8618 1.8618 2.4657 2.4657 2.4665 2.4665 3.8564 3.8564 3.8591 3.8591 4.2100 4.2100 4.2111 4.2111 4.4443 4.4443 5.6354 5.6354 7.6237 7.6237 7.7370 7.7370 k = 0.5000 0.5000 0.1904 ( 8292 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9062 -11.9062 -11.8758 -11.8758 -8.7642 -8.7642 -8.7351 -8.7351 -7.9297 -7.9297 -7.9296 -7.9296 -4.9538 -4.9538 -4.9537 -4.9537 -2.5804 -2.5804 -2.4094 -2.4094 -1.9176 -1.9176 -1.9170 -1.9170 -1.2931 -1.2931 -1.0642 -1.0642 -0.7637 -0.7637 -0.7634 -0.7634 -0.4963 -0.4963 -0.3451 -0.3451 -0.0228 -0.0228 0.0173 0.0173 1.3711 1.3711 1.3720 1.3720 1.4894 1.4894 1.6365 1.6365 1.8635 1.8635 1.8639 1.8639 2.4830 2.4830 2.4837 2.4837 3.8563 3.8563 3.8587 3.8587 4.2079 4.2079 4.2088 4.2088 4.5074 4.5074 5.5689 5.5689 7.6689 7.6689 7.7475 7.7475 k = 0.5000 0.5000 0.2077 ( 8308 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9042 -11.9042 -11.8778 -11.8778 -8.7623 -8.7623 -8.7370 -8.7370 -7.9298 -7.9298 -7.9297 -7.9297 -4.9535 -4.9535 -4.9533 -4.9533 -2.5687 -2.5687 -2.4196 -2.4196 -1.9170 -1.9170 -1.9165 -1.9165 -1.2806 -1.2806 -1.0810 -1.0810 -0.7637 -0.7637 -0.7634 -0.7634 -0.4865 -0.4865 -0.3546 -0.3546 -0.0216 -0.0216 0.0128 0.0128 1.3573 1.3573 1.3579 1.3579 1.4976 1.4976 1.6258 1.6258 1.8652 1.8652 1.8656 1.8656 2.4990 2.4990 2.4995 2.4995 3.8562 3.8562 3.8582 3.8582 4.2058 4.2058 4.2066 4.2066 4.5745 4.5745 5.4986 5.4986 7.7171 7.7171 7.7584 7.7584 k = 0.5000 0.5000 0.2250 ( 8308 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9022 -11.9022 -11.8798 -11.8798 -8.7604 -8.7604 -8.7390 -8.7390 -7.9299 -7.9299 -7.9298 -7.9298 -4.9531 -4.9531 -4.9530 -4.9530 -2.5564 -2.5564 -2.4304 -2.4304 -1.9165 -1.9165 -1.9160 -1.9160 -1.2670 -1.2670 -1.0984 -1.0984 -0.7637 -0.7637 -0.7634 -0.7634 -0.4761 -0.4761 -0.3647 -0.3647 -0.0202 -0.0202 0.0084 0.0084 1.3451 1.3451 1.3455 1.3455 1.5064 1.5064 1.6148 1.6148 1.8667 1.8667 1.8670 1.8670 2.5132 2.5132 2.5136 2.5136 3.8561 3.8561 3.8578 3.8578 4.2040 4.2040 4.2046 4.2046 4.6451 4.6451 5.4252 5.4252 7.7678 7.7678 7.7696 7.7696 k = 0.5000 0.5000 0.2424 ( 8340 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.9001 -11.9001 -11.8820 -11.8820 -8.7583 -8.7583 -8.7410 -8.7410 -7.9300 -7.9300 -7.9299 -7.9299 -4.9529 -4.9529 -4.9527 -4.9527 -2.5438 -2.5438 -2.4417 -2.4417 -1.9160 -1.9160 -1.9156 -1.9156 -1.2526 -1.2526 -1.1162 -1.1162 -0.7636 -0.7636 -0.7634 -0.7634 -0.4654 -0.4654 -0.3752 -0.3752 -0.0186 -0.0186 0.0043 0.0043 1.3348 1.3348 1.3351 1.3351 1.5158 1.5158 1.6035 1.6035 1.8678 1.8678 1.8681 1.8681 2.5253 2.5253 2.5257 2.5257 3.8560 3.8560 3.8574 3.8574 4.2024 4.2024 4.2029 4.2029 4.7186 4.7186 5.3493 5.3493 7.7810 7.7810 7.8196 7.8197 k = 0.5000 0.5000 0.2597 ( 8360 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8979 -11.8979 -11.8842 -11.8842 -8.7563 -8.7563 -8.7432 -8.7432 -7.9300 -7.9300 -7.9299 -7.9299 -4.9526 -4.9526 -4.9525 -4.9525 -2.5309 -2.5309 -2.4536 -2.4536 -1.9156 -1.9156 -1.9153 -1.9153 -1.2374 -1.2374 -1.1342 -1.1342 -0.7636 -0.7636 -0.7634 -0.7634 -0.4544 -0.4544 -0.3861 -0.3861 -0.0168 -0.0168 0.0004 0.0004 1.3267 1.3267 1.3269 1.3269 1.5257 1.5257 1.5921 1.5921 1.8687 1.8687 1.8689 1.8689 2.5351 2.5351 2.5353 2.5353 3.8560 3.8560 3.8571 3.8571 4.2010 4.2010 4.2014 4.2014 4.7945 4.7945 5.2714 5.2714 7.7923 7.7923 7.8402 7.8408 k = 0.5000 0.5000 0.2770 ( 8368 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8956 -11.8956 -11.8865 -11.8865 -8.7541 -8.7541 -8.7453 -8.7453 -7.9301 -7.9301 -7.9300 -7.9300 -4.9524 -4.9524 -4.9523 -4.9523 -2.5178 -2.5178 -2.4660 -2.4660 -1.9153 -1.9153 -1.9151 -1.9151 -1.2214 -1.2214 -1.1522 -1.1522 -0.7636 -0.7636 -0.7634 -0.7634 -0.4431 -0.4431 -0.3973 -0.3973 -0.0147 -0.0147 -0.0033 -0.0033 1.3207 1.3207 1.3209 1.3209 1.5361 1.5361 1.5806 1.5806 1.8693 1.8693 1.8695 1.8695 2.5422 2.5422 2.5424 2.5424 3.8561 3.8561 3.8568 3.8568 4.2001 4.2001 4.2003 4.2003 4.8724 4.8724 5.1921 5.1921 7.8035 7.8035 7.8407 7.8420 k = 0.5000 0.5000 0.2943 ( 8376 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8934 -11.8934 -11.8887 -11.8887 -8.7519 -8.7519 -8.7475 -8.7475 -7.9301 -7.9301 -7.9300 -7.9300 -4.9523 -4.9523 -4.9522 -4.9522 -2.5047 -2.5047 -2.4786 -2.4786 -1.9151 -1.9151 -1.9150 -1.9150 -1.2048 -1.2048 -1.1701 -1.1701 -0.7636 -0.7636 -0.7634 -0.7634 -0.4316 -0.4316 -0.4086 -0.4086 -0.0123 -0.0123 -0.0066 -0.0066 1.3171 1.3171 1.3172 1.3172 1.5469 1.5469 1.5692 1.5692 1.8697 1.8697 1.8698 1.8698 2.5466 2.5466 2.5467 2.5467 3.8562 3.8562 3.8565 3.8565 4.1995 4.1995 4.1997 4.1997 4.9516 4.9516 5.1120 5.1120 7.8143 7.8143 7.8342 7.8343 k = 0.5000 0.5000 0.3116 ( 8344 PWs) bands (ev): -13.4293 -13.4293 -13.4291 -13.4291 -11.8911 -11.8911 -11.8910 -11.8910 -8.7498 -8.7498 -8.7497 -8.7497 -7.9301 -7.9301 -7.9300 -7.9300 -4.9523 -4.9523 -4.9522 -4.9522 -2.4916 -2.4916 -2.4915 -2.4915 -1.9151 -1.9151 -1.9149 -1.9149 -1.1877 -1.1877 -1.1876 -1.1876 -0.7636 -0.7636 -0.7634 -0.7634 -0.4202 -0.4202 -0.4200 -0.4200 -0.0096 -0.0096 -0.0095 -0.0095 1.3159 1.3159 1.3160 1.3160 1.5579 1.5579 1.5580 1.5580 1.8698 1.8698 1.8699 1.8699 2.5480 2.5480 2.5481 2.5481 3.8563 3.8563 3.8564 3.8564 4.1993 4.1993 4.1994 4.1994 5.0316 5.0316 5.0317 5.0317 7.8247 7.8247 7.8248 7.8248 Writing output data file AlPS4.save init_run : 1.44s CPU 0.80s WALL ( 1 calls) electrons : 629.33s CPU 564.54s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.16s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 629.31s CPU 564.52s WALL ( 1 calls) v_of_rho : 0.02s 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 : 0.71s CPU 0.37s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.50s CPU 0.49s WALL ( 255 calls) cegterg : 550.86s CPU 513.12s WALL ( 617 calls) Called by sum_band: Called by *egterg: h_psi : 349.05s CPU 292.60s WALL ( 10458 calls) s_psi : 37.29s CPU 31.21s WALL ( 10458 calls) g_psi : 0.39s CPU 0.37s WALL ( 9586 calls) cdiaghg : 181.95s CPU 177.60s WALL ( 9841 calls) cegterg:over : 18.97s CPU 18.85s WALL ( 9586 calls) cegterg:upda : 12.64s CPU 12.91s WALL ( 9586 calls) cegterg:last : 7.17s CPU 7.24s WALL ( 1382 calls) cdiaghg:chol : 7.52s CPU 7.62s WALL ( 9841 calls) cdiaghg:inve : 5.06s CPU 5.07s WALL ( 9841 calls) cdiaghg:para : 9.73s CPU 10.13s WALL ( 19682 calls) Called by h_psi: h_psi:vloc : 276.72s CPU 230.77s WALL ( 10458 calls) h_psi:vnl : 71.92s CPU 61.44s WALL ( 10458 calls) add_vuspsi : 41.34s CPU 34.42s WALL ( 10458 calls) General routines calbec : 30.54s CPU 26.98s WALL ( 10458 calls) fft : 0.11s CPU 0.06s WALL ( 19 calls) ffts : 0.03s CPU 0.01s WALL ( 4 calls) fftw : 270.42s CPU 224.91s WALL ( 1229248 calls) interpolate : 0.04s CPU 0.02s WALL ( 4 calls) davcio : 0.26s CPU 7.44s WALL ( 510 calls) Parallel routines fft_scatter : 172.61s CPU 159.19s WALL ( 1229271 calls) PWSCF : 11m13.04s CPU 10m22.97s WALL This run was terminated on: 15:59:48 15Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=