Program PWSCF v.5.1.1 starts on 23Jul2015 at 11: 9:38 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./PbO.save/ file Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 30 17 5 1088 471 77 Max 32 18 6 1091 492 84 Sum 1457 845 249 52271 23093 3839 bravais-lattice index = 14 lattice parameter (alat) = 7.4972 a.u. unit-cell volume = 530.2764 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.497164 celldm(2)= 1.000000 celldm(3)= 1.258378 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 1.258378 ) 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 0.794674 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pb read from file: /home/autes/Pseudo/Pb.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 75f9fe62f948a5acf869e43db2c29526 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Pb 14.00 207.20000 Pb( 1.00) 8 Sym. Ops. (no inversion) found (note: 8 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 = 3 180 deg rotation - cart. axis [1,1,0] cryst. s( 3) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 3) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,-1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 4) = ( -0.0000000 -1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 5) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 6) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 6) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 7) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 8) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group D_2d (-42m) there are 7 classes and 2 irreducible representations the character table: E -E C2 2S4 -2S4 2C2' 2s_d -C2 -2C2' -2s_d G_6 2.00 -2.00 0.00 1.41 -1.41 0.00 0.00 G_7 2.00 -2.00 0.00 -1.41 1.41 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C2' -2C2' 3 -3 4 -4 2s_d -2s_d 5 -5 6 -6 2S4 7 8 -E -1 -2S4 -7 -8 Cartesian axes number of k points= 377 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0026525 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0026525 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0026525 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0026525 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0026525 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0026525 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0026525 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0026525 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0026525 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0026525 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0026525 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0026525 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0026525 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0026525 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0026525 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0026525 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0026525 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0026525 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0026525 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0026525 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0026525 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0026525 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0026525 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0026525 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0026525 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0026525 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0026525 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0026525 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0026525 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0026525 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0026525 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0026525 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0026525 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0026525 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0026525 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0026525 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0026525 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0026525 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0026525 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026525 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026525 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0026525 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0026525 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0026525 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0026525 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0026525 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0026525 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0026525 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0026525 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0026525 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0026525 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0026525 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0026525 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0026525 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0026525 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0026525 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0026525 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0026525 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0026525 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0026525 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0026525 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0026525 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0026525 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0026525 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0026525 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0026525 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0026525 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0026525 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0026525 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0026525 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0026525 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0026525 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0026525 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0026525 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0026525 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0026525 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0026525 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0026525 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0026525 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0026525 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026525 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026525 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0026525 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0026525 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0026525 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0026525 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0026525 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0026525 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0026525 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0026525 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0026525 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0026525 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0026525 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0026525 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0026525 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0026525 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0026525 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0026525 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0026525 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0026525 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0026525 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0026525 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0026525 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0026525 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0026525 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0026525 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0026525 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0026525 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0026525 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0026525 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0026525 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0026525 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0026525 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0026525 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0026525 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0026525 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0026525 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0026525 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0026525 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0026525 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0026525 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0026525 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0026525 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0026525 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0026525 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0026525 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0026525 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0026525 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0026525 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0026525 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0026525 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0026525 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0026525 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0026525 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0026525 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0026525 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0026525 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 141) = ( 0.0000000 0.0000000 0.0124168), wk = 0.0026525 k( 142) = ( 0.0000000 0.0000000 0.0248336), wk = 0.0026525 k( 143) = ( 0.0000000 0.0000000 0.0372503), wk = 0.0026525 k( 144) = ( 0.0000000 0.0000000 0.0496671), wk = 0.0026525 k( 145) = ( 0.0000000 0.0000000 0.0620839), wk = 0.0026525 k( 146) = ( 0.0000000 0.0000000 0.0745007), wk = 0.0026525 k( 147) = ( 0.0000000 0.0000000 0.0869174), wk = 0.0026525 k( 148) = ( 0.0000000 0.0000000 0.0993342), wk = 0.0026525 k( 149) = ( 0.0000000 0.0000000 0.1117510), wk = 0.0026525 k( 150) = ( 0.0000000 0.0000000 0.1241678), wk = 0.0026525 k( 151) = ( 0.0000000 0.0000000 0.1365845), wk = 0.0026525 k( 152) = ( 0.0000000 0.0000000 0.1490013), wk = 0.0026525 k( 153) = ( 0.0000000 0.0000000 0.1614181), wk = 0.0026525 k( 154) = ( 0.0000000 0.0000000 0.1738349), wk = 0.0026525 k( 155) = ( 0.0000000 0.0000000 0.1862516), wk = 0.0026525 k( 156) = ( 0.0000000 0.0000000 0.1986684), wk = 0.0026525 k( 157) = ( 0.0000000 0.0000000 0.2110852), wk = 0.0026525 k( 158) = ( 0.0000000 0.0000000 0.2235020), wk = 0.0026525 k( 159) = ( 0.0000000 0.0000000 0.2359187), wk = 0.0026525 k( 160) = ( 0.0000000 0.0000000 0.2483355), wk = 0.0026525 k( 161) = ( 0.0000000 0.0000000 0.2607523), wk = 0.0026525 k( 162) = ( 0.0000000 0.0000000 0.2731691), wk = 0.0026525 k( 163) = ( 0.0000000 0.0000000 0.2855859), wk = 0.0026525 k( 164) = ( 0.0000000 0.0000000 0.2980026), wk = 0.0026525 k( 165) = ( 0.0000000 0.0000000 0.3104194), wk = 0.0026525 k( 166) = ( 0.0000000 0.0000000 0.3228362), wk = 0.0026525 k( 167) = ( 0.0000000 0.0000000 0.3352530), wk = 0.0026525 k( 168) = ( 0.0000000 0.0000000 0.3476697), wk = 0.0026525 k( 169) = ( 0.0000000 0.0000000 0.3600865), wk = 0.0026525 k( 170) = ( 0.0000000 0.0000000 0.3725033), wk = 0.0026525 k( 171) = ( 0.0000000 0.0000000 0.3849201), wk = 0.0026525 k( 172) = ( 0.0000000 0.0000000 0.3973368), wk = 0.0026525 k( 173) = ( 0.0000000 0.0000000 0.3973368), wk = 0.0026525 k( 174) = ( 0.0000000 0.0125000 0.3973368), wk = 0.0026525 k( 175) = ( 0.0000000 0.0250000 0.3973368), wk = 0.0026525 k( 176) = ( 0.0000000 0.0375000 0.3973368), wk = 0.0026525 k( 177) = ( 0.0000000 0.0500000 0.3973368), wk = 0.0026525 k( 178) = ( 0.0000000 0.0625000 0.3973368), wk = 0.0026525 k( 179) = ( 0.0000000 0.0750000 0.3973368), wk = 0.0026525 k( 180) = ( 0.0000000 0.0875000 0.3973368), wk = 0.0026525 k( 181) = ( 0.0000000 0.1000000 0.3973368), wk = 0.0026525 k( 182) = ( 0.0000000 0.1125000 0.3973368), wk = 0.0026525 k( 183) = ( 0.0000000 0.1250000 0.3973368), wk = 0.0026525 k( 184) = ( 0.0000000 0.1375000 0.3973368), wk = 0.0026525 k( 185) = ( 0.0000000 0.1500000 0.3973368), wk = 0.0026525 k( 186) = ( 0.0000000 0.1625000 0.3973368), wk = 0.0026525 k( 187) = ( 0.0000000 0.1750000 0.3973368), wk = 0.0026525 k( 188) = ( 0.0000000 0.1875000 0.3973368), wk = 0.0026525 k( 189) = ( 0.0000000 0.2000000 0.3973368), wk = 0.0026525 k( 190) = ( 0.0000000 0.2125000 0.3973368), wk = 0.0026525 k( 191) = ( 0.0000000 0.2250000 0.3973368), wk = 0.0026525 k( 192) = ( 0.0000000 0.2375000 0.3973368), wk = 0.0026525 k( 193) = ( 0.0000000 0.2500000 0.3973368), wk = 0.0026525 k( 194) = ( 0.0000000 0.2625000 0.3973368), wk = 0.0026525 k( 195) = ( 0.0000000 0.2750000 0.3973368), wk = 0.0026525 k( 196) = ( 0.0000000 0.2875000 0.3973368), wk = 0.0026525 k( 197) = ( 0.0000000 0.3000000 0.3973368), wk = 0.0026525 k( 198) = ( 0.0000000 0.3125000 0.3973368), wk = 0.0026525 k( 199) = ( 0.0000000 0.3250000 0.3973368), wk = 0.0026525 k( 200) = ( 0.0000000 0.3375000 0.3973368), wk = 0.0026525 k( 201) = ( 0.0000000 0.3500000 0.3973368), wk = 0.0026525 k( 202) = ( 0.0000000 0.3625000 0.3973368), wk = 0.0026525 k( 203) = ( 0.0000000 0.3750000 0.3973368), wk = 0.0026525 k( 204) = ( 0.0000000 0.3875000 0.3973368), wk = 0.0026525 k( 205) = ( 0.0000000 0.4000000 0.3973368), wk = 0.0026525 k( 206) = ( 0.0000000 0.4125000 0.3973368), wk = 0.0026525 k( 207) = ( 0.0000000 0.4250000 0.3973368), wk = 0.0026525 k( 208) = ( 0.0000000 0.4375000 0.3973368), wk = 0.0026525 k( 209) = ( 0.0000000 0.4500000 0.3973368), wk = 0.0026525 k( 210) = ( 0.0000000 0.4625000 0.3973368), wk = 0.0026525 k( 211) = ( 0.0000000 0.4750000 0.3973368), wk = 0.0026525 k( 212) = ( 0.0000000 0.4875000 0.3973368), wk = 0.0026525 k( 213) = ( 0.0000000 0.5000000 0.3973368), wk = 0.0026525 k( 214) = ( 0.0000000 0.5000000 0.3973368), wk = 0.0026525 k( 215) = ( 0.0125000 0.5000000 0.3973368), wk = 0.0026525 k( 216) = ( 0.0250000 0.5000000 0.3973368), wk = 0.0026525 k( 217) = ( 0.0375000 0.5000000 0.3973368), wk = 0.0026525 k( 218) = ( 0.0500000 0.5000000 0.3973368), wk = 0.0026525 k( 219) = ( 0.0625000 0.5000000 0.3973368), wk = 0.0026525 k( 220) = ( 0.0750000 0.5000000 0.3973368), wk = 0.0026525 k( 221) = ( 0.0875000 0.5000000 0.3973368), wk = 0.0026525 k( 222) = ( 0.1000000 0.5000000 0.3973368), wk = 0.0026525 k( 223) = ( 0.1125000 0.5000000 0.3973368), wk = 0.0026525 k( 224) = ( 0.1250000 0.5000000 0.3973368), wk = 0.0026525 k( 225) = ( 0.1375000 0.5000000 0.3973368), wk = 0.0026525 k( 226) = ( 0.1500000 0.5000000 0.3973368), wk = 0.0026525 k( 227) = ( 0.1625000 0.5000000 0.3973368), wk = 0.0026525 k( 228) = ( 0.1750000 0.5000000 0.3973368), wk = 0.0026525 k( 229) = ( 0.1875000 0.5000000 0.3973368), wk = 0.0026525 k( 230) = ( 0.2000000 0.5000000 0.3973368), wk = 0.0026525 k( 231) = ( 0.2125000 0.5000000 0.3973368), wk = 0.0026525 k( 232) = ( 0.2250000 0.5000000 0.3973368), wk = 0.0026525 k( 233) = ( 0.2375000 0.5000000 0.3973368), wk = 0.0026525 k( 234) = ( 0.2500000 0.5000000 0.3973368), wk = 0.0026525 k( 235) = ( 0.2625000 0.5000000 0.3973368), wk = 0.0026525 k( 236) = ( 0.2750000 0.5000000 0.3973368), wk = 0.0026525 k( 237) = ( 0.2875000 0.5000000 0.3973368), wk = 0.0026525 k( 238) = ( 0.3000000 0.5000000 0.3973368), wk = 0.0026525 k( 239) = ( 0.3125000 0.5000000 0.3973368), wk = 0.0026525 k( 240) = ( 0.3250000 0.5000000 0.3973368), wk = 0.0026525 k( 241) = ( 0.3375000 0.5000000 0.3973368), wk = 0.0026525 k( 242) = ( 0.3500000 0.5000000 0.3973368), wk = 0.0026525 k( 243) = ( 0.3625000 0.5000000 0.3973368), wk = 0.0026525 k( 244) = ( 0.3750000 0.5000000 0.3973368), wk = 0.0026525 k( 245) = ( 0.3875000 0.5000000 0.3973368), wk = 0.0026525 k( 246) = ( 0.4000000 0.5000000 0.3973368), wk = 0.0026525 k( 247) = ( 0.4125000 0.5000000 0.3973368), wk = 0.0026525 k( 248) = ( 0.4250000 0.5000000 0.3973368), wk = 0.0026525 k( 249) = ( 0.4375000 0.5000000 0.3973368), wk = 0.0026525 k( 250) = ( 0.4500000 0.5000000 0.3973368), wk = 0.0026525 k( 251) = ( 0.4625000 0.5000000 0.3973368), wk = 0.0026525 k( 252) = ( 0.4750000 0.5000000 0.3973368), wk = 0.0026525 k( 253) = ( 0.4875000 0.5000000 0.3973368), wk = 0.0026525 k( 254) = ( 0.5000000 0.5000000 0.3973368), wk = 0.0026525 k( 255) = ( 0.5000000 0.5000000 0.3973368), wk = 0.0026525 k( 256) = ( 0.4910714 0.4910714 0.3973368), wk = 0.0026525 k( 257) = ( 0.4821429 0.4821429 0.3973368), wk = 0.0026525 k( 258) = ( 0.4732143 0.4732143 0.3973368), wk = 0.0026525 k( 259) = ( 0.4642857 0.4642857 0.3973368), wk = 0.0026525 k( 260) = ( 0.4553571 0.4553571 0.3973368), wk = 0.0026525 k( 261) = ( 0.4464286 0.4464286 0.3973368), wk = 0.0026525 k( 262) = ( 0.4375000 0.4375000 0.3973368), wk = 0.0026525 k( 263) = ( 0.4285714 0.4285714 0.3973368), wk = 0.0026525 k( 264) = ( 0.4196429 0.4196429 0.3973368), wk = 0.0026525 k( 265) = ( 0.4107143 0.4107143 0.3973368), wk = 0.0026525 k( 266) = ( 0.4017857 0.4017857 0.3973368), wk = 0.0026525 k( 267) = ( 0.3928571 0.3928571 0.3973368), wk = 0.0026525 k( 268) = ( 0.3839286 0.3839286 0.3973368), wk = 0.0026525 k( 269) = ( 0.3750000 0.3750000 0.3973368), wk = 0.0026525 k( 270) = ( 0.3660714 0.3660714 0.3973368), wk = 0.0026525 k( 271) = ( 0.3571429 0.3571429 0.3973368), wk = 0.0026525 k( 272) = ( 0.3482143 0.3482143 0.3973368), wk = 0.0026525 k( 273) = ( 0.3392857 0.3392857 0.3973368), wk = 0.0026525 k( 274) = ( 0.3303571 0.3303571 0.3973368), wk = 0.0026525 k( 275) = ( 0.3214286 0.3214286 0.3973368), wk = 0.0026525 k( 276) = ( 0.3125000 0.3125000 0.3973368), wk = 0.0026525 k( 277) = ( 0.3035714 0.3035714 0.3973368), wk = 0.0026525 k( 278) = ( 0.2946429 0.2946429 0.3973368), wk = 0.0026525 k( 279) = ( 0.2857143 0.2857143 0.3973368), wk = 0.0026525 k( 280) = ( 0.2767857 0.2767857 0.3973368), wk = 0.0026525 k( 281) = ( 0.2678571 0.2678571 0.3973368), wk = 0.0026525 k( 282) = ( 0.2589286 0.2589286 0.3973368), wk = 0.0026525 k( 283) = ( 0.2500000 0.2500000 0.3973368), wk = 0.0026525 k( 284) = ( 0.2410714 0.2410714 0.3973368), wk = 0.0026525 k( 285) = ( 0.2321429 0.2321429 0.3973368), wk = 0.0026525 k( 286) = ( 0.2232143 0.2232143 0.3973368), wk = 0.0026525 k( 287) = ( 0.2142857 0.2142857 0.3973368), wk = 0.0026525 k( 288) = ( 0.2053571 0.2053571 0.3973368), wk = 0.0026525 k( 289) = ( 0.1964286 0.1964286 0.3973368), wk = 0.0026525 k( 290) = ( 0.1875000 0.1875000 0.3973368), wk = 0.0026525 k( 291) = ( 0.1785714 0.1785714 0.3973368), wk = 0.0026525 k( 292) = ( 0.1696429 0.1696429 0.3973368), wk = 0.0026525 k( 293) = ( 0.1607143 0.1607143 0.3973368), wk = 0.0026525 k( 294) = ( 0.1517857 0.1517857 0.3973368), wk = 0.0026525 k( 295) = ( 0.1428571 0.1428571 0.3973368), wk = 0.0026525 k( 296) = ( 0.1339286 0.1339286 0.3973368), wk = 0.0026525 k( 297) = ( 0.1250000 0.1250000 0.3973368), wk = 0.0026525 k( 298) = ( 0.1160714 0.1160714 0.3973368), wk = 0.0026525 k( 299) = ( 0.1071429 0.1071429 0.3973368), wk = 0.0026525 k( 300) = ( 0.0982143 0.0982143 0.3973368), wk = 0.0026525 k( 301) = ( 0.0892857 0.0892857 0.3973368), wk = 0.0026525 k( 302) = ( 0.0803571 0.0803571 0.3973368), wk = 0.0026525 k( 303) = ( 0.0714286 0.0714286 0.3973368), wk = 0.0026525 k( 304) = ( 0.0625000 0.0625000 0.3973368), wk = 0.0026525 k( 305) = ( 0.0535714 0.0535714 0.3973368), wk = 0.0026525 k( 306) = ( 0.0446429 0.0446429 0.3973368), wk = 0.0026525 k( 307) = ( 0.0357143 0.0357143 0.3973368), wk = 0.0026525 k( 308) = ( 0.0267857 0.0267857 0.3973368), wk = 0.0026525 k( 309) = ( 0.0178571 0.0178571 0.3973368), wk = 0.0026525 k( 310) = ( 0.0089286 0.0089286 0.3973368), wk = 0.0026525 k( 311) = ( 0.0000000 0.0000000 0.3973368), wk = 0.0026525 k( 312) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026525 k( 313) = ( 0.0000000 0.5000000 0.0124168), wk = 0.0026525 k( 314) = ( 0.0000000 0.5000000 0.0248336), wk = 0.0026525 k( 315) = ( 0.0000000 0.5000000 0.0372503), wk = 0.0026525 k( 316) = ( 0.0000000 0.5000000 0.0496671), wk = 0.0026525 k( 317) = ( 0.0000000 0.5000000 0.0620839), wk = 0.0026525 k( 318) = ( 0.0000000 0.5000000 0.0745007), wk = 0.0026525 k( 319) = ( 0.0000000 0.5000000 0.0869174), wk = 0.0026525 k( 320) = ( 0.0000000 0.5000000 0.0993342), wk = 0.0026525 k( 321) = ( 0.0000000 0.5000000 0.1117510), wk = 0.0026525 k( 322) = ( 0.0000000 0.5000000 0.1241678), wk = 0.0026525 k( 323) = ( 0.0000000 0.5000000 0.1365845), wk = 0.0026525 k( 324) = ( 0.0000000 0.5000000 0.1490013), wk = 0.0026525 k( 325) = ( 0.0000000 0.5000000 0.1614181), wk = 0.0026525 k( 326) = ( 0.0000000 0.5000000 0.1738349), wk = 0.0026525 k( 327) = ( 0.0000000 0.5000000 0.1862516), wk = 0.0026525 k( 328) = ( 0.0000000 0.5000000 0.1986684), wk = 0.0026525 k( 329) = ( 0.0000000 0.5000000 0.2110852), wk = 0.0026525 k( 330) = ( 0.0000000 0.5000000 0.2235020), wk = 0.0026525 k( 331) = ( 0.0000000 0.5000000 0.2359187), wk = 0.0026525 k( 332) = ( 0.0000000 0.5000000 0.2483355), wk = 0.0026525 k( 333) = ( 0.0000000 0.5000000 0.2607523), wk = 0.0026525 k( 334) = ( 0.0000000 0.5000000 0.2731691), wk = 0.0026525 k( 335) = ( 0.0000000 0.5000000 0.2855859), wk = 0.0026525 k( 336) = ( 0.0000000 0.5000000 0.2980026), wk = 0.0026525 k( 337) = ( 0.0000000 0.5000000 0.3104194), wk = 0.0026525 k( 338) = ( 0.0000000 0.5000000 0.3228362), wk = 0.0026525 k( 339) = ( 0.0000000 0.5000000 0.3352530), wk = 0.0026525 k( 340) = ( 0.0000000 0.5000000 0.3476697), wk = 0.0026525 k( 341) = ( 0.0000000 0.5000000 0.3600865), wk = 0.0026525 k( 342) = ( 0.0000000 0.5000000 0.3725033), wk = 0.0026525 k( 343) = ( 0.0000000 0.5000000 0.3849201), wk = 0.0026525 k( 344) = ( 0.0000000 0.5000000 0.3973368), wk = 0.0026525 k( 345) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0026525 k( 346) = ( 0.5000000 0.5000000 0.0124168), wk = 0.0026525 k( 347) = ( 0.5000000 0.5000000 0.0248336), wk = 0.0026525 k( 348) = ( 0.5000000 0.5000000 0.0372503), wk = 0.0026525 k( 349) = ( 0.5000000 0.5000000 0.0496671), wk = 0.0026525 k( 350) = ( 0.5000000 0.5000000 0.0620839), wk = 0.0026525 k( 351) = ( 0.5000000 0.5000000 0.0745007), wk = 0.0026525 k( 352) = ( 0.5000000 0.5000000 0.0869174), wk = 0.0026525 k( 353) = ( 0.5000000 0.5000000 0.0993342), wk = 0.0026525 k( 354) = ( 0.5000000 0.5000000 0.1117510), wk = 0.0026525 k( 355) = ( 0.5000000 0.5000000 0.1241678), wk = 0.0026525 k( 356) = ( 0.5000000 0.5000000 0.1365845), wk = 0.0026525 k( 357) = ( 0.5000000 0.5000000 0.1490013), wk = 0.0026525 k( 358) = ( 0.5000000 0.5000000 0.1614181), wk = 0.0026525 k( 359) = ( 0.5000000 0.5000000 0.1738349), wk = 0.0026525 k( 360) = ( 0.5000000 0.5000000 0.1862516), wk = 0.0026525 k( 361) = ( 0.5000000 0.5000000 0.1986684), wk = 0.0026525 k( 362) = ( 0.5000000 0.5000000 0.2110852), wk = 0.0026525 k( 363) = ( 0.5000000 0.5000000 0.2235020), wk = 0.0026525 k( 364) = ( 0.5000000 0.5000000 0.2359187), wk = 0.0026525 k( 365) = ( 0.5000000 0.5000000 0.2483355), wk = 0.0026525 k( 366) = ( 0.5000000 0.5000000 0.2607523), wk = 0.0026525 k( 367) = ( 0.5000000 0.5000000 0.2731691), wk = 0.0026525 k( 368) = ( 0.5000000 0.5000000 0.2855859), wk = 0.0026525 k( 369) = ( 0.5000000 0.5000000 0.2980026), wk = 0.0026525 k( 370) = ( 0.5000000 0.5000000 0.3104194), wk = 0.0026525 k( 371) = ( 0.5000000 0.5000000 0.3228362), wk = 0.0026525 k( 372) = ( 0.5000000 0.5000000 0.3352530), wk = 0.0026525 k( 373) = ( 0.5000000 0.5000000 0.3476697), wk = 0.0026525 k( 374) = ( 0.5000000 0.5000000 0.3600865), wk = 0.0026525 k( 375) = ( 0.5000000 0.5000000 0.3725033), wk = 0.0026525 k( 376) = ( 0.5000000 0.5000000 0.3849201), wk = 0.0026525 k( 377) = ( 0.5000000 0.5000000 0.3973368), wk = 0.0026525 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 2) = ( 0.0000000 0.0125000 0.0000000), wk = 0.0026525 k( 3) = ( 0.0000000 0.0250000 0.0000000), wk = 0.0026525 k( 4) = ( 0.0000000 0.0375000 0.0000000), wk = 0.0026525 k( 5) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0026525 k( 6) = ( 0.0000000 0.0625000 0.0000000), wk = 0.0026525 k( 7) = ( 0.0000000 0.0750000 0.0000000), wk = 0.0026525 k( 8) = ( 0.0000000 0.0875000 0.0000000), wk = 0.0026525 k( 9) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0026525 k( 10) = ( 0.0000000 0.1125000 0.0000000), wk = 0.0026525 k( 11) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0026525 k( 12) = ( 0.0000000 0.1375000 0.0000000), wk = 0.0026525 k( 13) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0026525 k( 14) = ( 0.0000000 0.1625000 0.0000000), wk = 0.0026525 k( 15) = ( 0.0000000 0.1750000 0.0000000), wk = 0.0026525 k( 16) = ( 0.0000000 0.1875000 0.0000000), wk = 0.0026525 k( 17) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0026525 k( 18) = ( 0.0000000 0.2125000 0.0000000), wk = 0.0026525 k( 19) = ( 0.0000000 0.2250000 0.0000000), wk = 0.0026525 k( 20) = ( 0.0000000 0.2375000 0.0000000), wk = 0.0026525 k( 21) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0026525 k( 22) = ( 0.0000000 0.2625000 0.0000000), wk = 0.0026525 k( 23) = ( 0.0000000 0.2750000 0.0000000), wk = 0.0026525 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0026525 k( 25) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0026525 k( 26) = ( 0.0000000 0.3125000 0.0000000), wk = 0.0026525 k( 27) = ( 0.0000000 0.3250000 0.0000000), wk = 0.0026525 k( 28) = ( 0.0000000 0.3375000 0.0000000), wk = 0.0026525 k( 29) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0026525 k( 30) = ( 0.0000000 0.3625000 0.0000000), wk = 0.0026525 k( 31) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0026525 k( 32) = ( 0.0000000 0.3875000 0.0000000), wk = 0.0026525 k( 33) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0026525 k( 34) = ( 0.0000000 0.4125000 0.0000000), wk = 0.0026525 k( 35) = ( 0.0000000 0.4250000 0.0000000), wk = 0.0026525 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0026525 k( 37) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0026525 k( 38) = ( 0.0000000 0.4625000 0.0000000), wk = 0.0026525 k( 39) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0026525 k( 40) = ( 0.0000000 0.4875000 0.0000000), wk = 0.0026525 k( 41) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026525 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026525 k( 43) = ( 0.0125000 0.5000000 0.0000000), wk = 0.0026525 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0026525 k( 45) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0026525 k( 46) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0026525 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0026525 k( 48) = ( 0.0750000 0.5000000 0.0000000), wk = 0.0026525 k( 49) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0026525 k( 50) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0026525 k( 51) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0026525 k( 52) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0026525 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0026525 k( 54) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0026525 k( 55) = ( 0.1625000 0.5000000 0.0000000), wk = 0.0026525 k( 56) = ( 0.1750000 0.5000000 0.0000000), wk = 0.0026525 k( 57) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0026525 k( 58) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0026525 k( 59) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0026525 k( 60) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0026525 k( 61) = ( 0.2375000 0.5000000 0.0000000), wk = 0.0026525 k( 62) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0026525 k( 63) = ( 0.2625000 0.5000000 0.0000000), wk = 0.0026525 k( 64) = ( 0.2750000 0.5000000 0.0000000), wk = 0.0026525 k( 65) = ( 0.2875000 0.5000000 0.0000000), wk = 0.0026525 k( 66) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0026525 k( 67) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0026525 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0026525 k( 69) = ( 0.3375000 0.5000000 0.0000000), wk = 0.0026525 k( 70) = ( 0.3500000 0.5000000 0.0000000), wk = 0.0026525 k( 71) = ( 0.3625000 0.5000000 0.0000000), wk = 0.0026525 k( 72) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0026525 k( 73) = ( 0.3875000 0.5000000 0.0000000), wk = 0.0026525 k( 74) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0026525 k( 75) = ( 0.4125000 0.5000000 0.0000000), wk = 0.0026525 k( 76) = ( 0.4250000 0.5000000 0.0000000), wk = 0.0026525 k( 77) = ( 0.4375000 0.5000000 0.0000000), wk = 0.0026525 k( 78) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0026525 k( 79) = ( 0.4625000 0.5000000 0.0000000), wk = 0.0026525 k( 80) = ( 0.4750000 0.5000000 0.0000000), wk = 0.0026525 k( 81) = ( 0.4875000 0.5000000 0.0000000), wk = 0.0026525 k( 82) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026525 k( 83) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026525 k( 84) = ( 0.4910714 0.4910714 0.0000000), wk = 0.0026525 k( 85) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0026525 k( 86) = ( 0.4732143 0.4732143 0.0000000), wk = 0.0026525 k( 87) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0026525 k( 88) = ( 0.4553571 0.4553571 0.0000000), wk = 0.0026525 k( 89) = ( 0.4464286 0.4464286 0.0000000), wk = 0.0026525 k( 90) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0026525 k( 91) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0026525 k( 92) = ( 0.4196429 0.4196429 0.0000000), wk = 0.0026525 k( 93) = ( 0.4107143 0.4107143 0.0000000), wk = 0.0026525 k( 94) = ( 0.4017857 0.4017857 0.0000000), wk = 0.0026525 k( 95) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0026525 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0026525 k( 97) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0026525 k( 98) = ( 0.3660714 0.3660714 0.0000000), wk = 0.0026525 k( 99) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0026525 k( 100) = ( 0.3482143 0.3482143 0.0000000), wk = 0.0026525 k( 101) = ( 0.3392857 0.3392857 0.0000000), wk = 0.0026525 k( 102) = ( 0.3303571 0.3303571 0.0000000), wk = 0.0026525 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0026525 k( 104) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0026525 k( 105) = ( 0.3035714 0.3035714 0.0000000), wk = 0.0026525 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0026525 k( 107) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0026525 k( 108) = ( 0.2767857 0.2767857 0.0000000), wk = 0.0026525 k( 109) = ( 0.2678571 0.2678571 0.0000000), wk = 0.0026525 k( 110) = ( 0.2589286 0.2589286 0.0000000), wk = 0.0026525 k( 111) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0026525 k( 112) = ( 0.2410714 0.2410714 0.0000000), wk = 0.0026525 k( 113) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0026525 k( 114) = ( 0.2232143 0.2232143 0.0000000), wk = 0.0026525 k( 115) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0026525 k( 116) = ( 0.2053571 0.2053571 0.0000000), wk = 0.0026525 k( 117) = ( 0.1964286 0.1964286 0.0000000), wk = 0.0026525 k( 118) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0026525 k( 119) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0026525 k( 120) = ( 0.1696429 0.1696429 0.0000000), wk = 0.0026525 k( 121) = ( 0.1607143 0.1607143 0.0000000), wk = 0.0026525 k( 122) = ( 0.1517857 0.1517857 0.0000000), wk = 0.0026525 k( 123) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0026525 k( 124) = ( 0.1339286 0.1339286 0.0000000), wk = 0.0026525 k( 125) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0026525 k( 126) = ( 0.1160714 0.1160714 0.0000000), wk = 0.0026525 k( 127) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0026525 k( 128) = ( 0.0982143 0.0982143 0.0000000), wk = 0.0026525 k( 129) = ( 0.0892857 0.0892857 0.0000000), wk = 0.0026525 k( 130) = ( 0.0803571 0.0803571 0.0000000), wk = 0.0026525 k( 131) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0026525 k( 132) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0026525 k( 133) = ( 0.0535714 0.0535714 0.0000000), wk = 0.0026525 k( 134) = ( 0.0446429 0.0446429 0.0000000), wk = 0.0026525 k( 135) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0026525 k( 136) = ( 0.0267857 0.0267857 0.0000000), wk = 0.0026525 k( 137) = ( 0.0178571 0.0178571 0.0000000), wk = 0.0026525 k( 138) = ( 0.0089286 0.0089286 0.0000000), wk = 0.0026525 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026525 k( 141) = ( 0.0000000 0.0000000 0.0156250), wk = 0.0026525 k( 142) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0026525 k( 143) = ( 0.0000000 0.0000000 0.0468750), wk = 0.0026525 k( 144) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0026525 k( 145) = ( 0.0000000 0.0000000 0.0781250), wk = 0.0026525 k( 146) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0026525 k( 147) = ( 0.0000000 0.0000000 0.1093750), wk = 0.0026525 k( 148) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0026525 k( 149) = ( 0.0000000 0.0000000 0.1406250), wk = 0.0026525 k( 150) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0026525 k( 151) = ( 0.0000000 0.0000000 0.1718750), wk = 0.0026525 k( 152) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0026525 k( 153) = ( 0.0000000 0.0000000 0.2031250), wk = 0.0026525 k( 154) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0026525 k( 155) = ( 0.0000000 0.0000000 0.2343750), wk = 0.0026525 k( 156) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0026525 k( 157) = ( 0.0000000 0.0000000 0.2656250), wk = 0.0026525 k( 158) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0026525 k( 159) = ( 0.0000000 0.0000000 0.2968750), wk = 0.0026525 k( 160) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0026525 k( 161) = ( 0.0000000 0.0000000 0.3281250), wk = 0.0026525 k( 162) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0026525 k( 163) = ( 0.0000000 0.0000000 0.3593750), wk = 0.0026525 k( 164) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0026525 k( 165) = ( 0.0000000 0.0000000 0.3906250), wk = 0.0026525 k( 166) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0026525 k( 167) = ( 0.0000000 0.0000000 0.4218750), wk = 0.0026525 k( 168) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0026525 k( 169) = ( 0.0000000 0.0000000 0.4531250), wk = 0.0026525 k( 170) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0026525 k( 171) = ( 0.0000000 0.0000000 0.4843750), wk = 0.0026525 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026525 k( 173) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026525 k( 174) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0026525 k( 175) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0026525 k( 176) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0026525 k( 177) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0026525 k( 178) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0026525 k( 179) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0026525 k( 180) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0026525 k( 181) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0026525 k( 182) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0026525 k( 183) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0026525 k( 184) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0026525 k( 185) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0026525 k( 186) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0026525 k( 187) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0026525 k( 188) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0026525 k( 189) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0026525 k( 190) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0026525 k( 191) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0026525 k( 192) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0026525 k( 193) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0026525 k( 194) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0026525 k( 195) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0026525 k( 196) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0026525 k( 197) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0026525 k( 198) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0026525 k( 199) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0026525 k( 200) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0026525 k( 201) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0026525 k( 202) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0026525 k( 203) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0026525 k( 204) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0026525 k( 205) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0026525 k( 206) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0026525 k( 207) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0026525 k( 208) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0026525 k( 209) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0026525 k( 210) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0026525 k( 211) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0026525 k( 212) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0026525 k( 213) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026525 k( 214) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026525 k( 215) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0026525 k( 216) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0026525 k( 217) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0026525 k( 218) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0026525 k( 219) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0026525 k( 220) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0026525 k( 221) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0026525 k( 222) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0026525 k( 223) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0026525 k( 224) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0026525 k( 225) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0026525 k( 226) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0026525 k( 227) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0026525 k( 228) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0026525 k( 229) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0026525 k( 230) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0026525 k( 231) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0026525 k( 232) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0026525 k( 233) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0026525 k( 234) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0026525 k( 235) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0026525 k( 236) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0026525 k( 237) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0026525 k( 238) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0026525 k( 239) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0026525 k( 240) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0026525 k( 241) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0026525 k( 242) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0026525 k( 243) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0026525 k( 244) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0026525 k( 245) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0026525 k( 246) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0026525 k( 247) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0026525 k( 248) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0026525 k( 249) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0026525 k( 250) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0026525 k( 251) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0026525 k( 252) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0026525 k( 253) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0026525 k( 254) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026525 k( 255) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026525 k( 256) = ( 0.4910714 0.4910714 0.5000000), wk = 0.0026525 k( 257) = ( 0.4821429 0.4821429 0.5000000), wk = 0.0026525 k( 258) = ( 0.4732143 0.4732143 0.5000000), wk = 0.0026525 k( 259) = ( 0.4642857 0.4642857 0.5000000), wk = 0.0026525 k( 260) = ( 0.4553571 0.4553571 0.5000000), wk = 0.0026525 k( 261) = ( 0.4464286 0.4464286 0.5000000), wk = 0.0026525 k( 262) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0026525 k( 263) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0026525 k( 264) = ( 0.4196429 0.4196429 0.5000000), wk = 0.0026525 k( 265) = ( 0.4107143 0.4107143 0.5000000), wk = 0.0026525 k( 266) = ( 0.4017857 0.4017857 0.5000000), wk = 0.0026525 k( 267) = ( 0.3928571 0.3928571 0.5000000), wk = 0.0026525 k( 268) = ( 0.3839286 0.3839286 0.5000000), wk = 0.0026525 k( 269) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0026525 k( 270) = ( 0.3660714 0.3660714 0.5000000), wk = 0.0026525 k( 271) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0026525 k( 272) = ( 0.3482143 0.3482143 0.5000000), wk = 0.0026525 k( 273) = ( 0.3392857 0.3392857 0.5000000), wk = 0.0026525 k( 274) = ( 0.3303571 0.3303571 0.5000000), wk = 0.0026525 k( 275) = ( 0.3214286 0.3214286 0.5000000), wk = 0.0026525 k( 276) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0026525 k( 277) = ( 0.3035714 0.3035714 0.5000000), wk = 0.0026525 k( 278) = ( 0.2946429 0.2946429 0.5000000), wk = 0.0026525 k( 279) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0026525 k( 280) = ( 0.2767857 0.2767857 0.5000000), wk = 0.0026525 k( 281) = ( 0.2678571 0.2678571 0.5000000), wk = 0.0026525 k( 282) = ( 0.2589286 0.2589286 0.5000000), wk = 0.0026525 k( 283) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0026525 k( 284) = ( 0.2410714 0.2410714 0.5000000), wk = 0.0026525 k( 285) = ( 0.2321429 0.2321429 0.5000000), wk = 0.0026525 k( 286) = ( 0.2232143 0.2232143 0.5000000), wk = 0.0026525 k( 287) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0026525 k( 288) = ( 0.2053571 0.2053571 0.5000000), wk = 0.0026525 k( 289) = ( 0.1964286 0.1964286 0.5000000), wk = 0.0026525 k( 290) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0026525 k( 291) = ( 0.1785714 0.1785714 0.5000000), wk = 0.0026525 k( 292) = ( 0.1696429 0.1696429 0.5000000), wk = 0.0026525 k( 293) = ( 0.1607143 0.1607143 0.5000000), wk = 0.0026525 k( 294) = ( 0.1517857 0.1517857 0.5000000), wk = 0.0026525 k( 295) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0026525 k( 296) = ( 0.1339286 0.1339286 0.5000000), wk = 0.0026525 k( 297) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0026525 k( 298) = ( 0.1160714 0.1160714 0.5000000), wk = 0.0026525 k( 299) = ( 0.1071429 0.1071429 0.5000000), wk = 0.0026525 k( 300) = ( 0.0982143 0.0982143 0.5000000), wk = 0.0026525 k( 301) = ( 0.0892857 0.0892857 0.5000000), wk = 0.0026525 k( 302) = ( 0.0803571 0.0803571 0.5000000), wk = 0.0026525 k( 303) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0026525 k( 304) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0026525 k( 305) = ( 0.0535714 0.0535714 0.5000000), wk = 0.0026525 k( 306) = ( 0.0446429 0.0446429 0.5000000), wk = 0.0026525 k( 307) = ( 0.0357143 0.0357143 0.5000000), wk = 0.0026525 k( 308) = ( 0.0267857 0.0267857 0.5000000), wk = 0.0026525 k( 309) = ( 0.0178571 0.0178571 0.5000000), wk = 0.0026525 k( 310) = ( 0.0089286 0.0089286 0.5000000), wk = 0.0026525 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026525 k( 312) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026525 k( 313) = ( 0.0000000 0.5000000 0.0156250), wk = 0.0026525 k( 314) = ( 0.0000000 0.5000000 0.0312500), wk = 0.0026525 k( 315) = ( 0.0000000 0.5000000 0.0468750), wk = 0.0026525 k( 316) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0026525 k( 317) = ( 0.0000000 0.5000000 0.0781250), wk = 0.0026525 k( 318) = ( 0.0000000 0.5000000 0.0937500), wk = 0.0026525 k( 319) = ( 0.0000000 0.5000000 0.1093750), wk = 0.0026525 k( 320) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0026525 k( 321) = ( 0.0000000 0.5000000 0.1406250), wk = 0.0026525 k( 322) = ( 0.0000000 0.5000000 0.1562500), wk = 0.0026525 k( 323) = ( 0.0000000 0.5000000 0.1718750), wk = 0.0026525 k( 324) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0026525 k( 325) = ( 0.0000000 0.5000000 0.2031250), wk = 0.0026525 k( 326) = ( 0.0000000 0.5000000 0.2187500), wk = 0.0026525 k( 327) = ( 0.0000000 0.5000000 0.2343750), wk = 0.0026525 k( 328) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0026525 k( 329) = ( 0.0000000 0.5000000 0.2656250), wk = 0.0026525 k( 330) = ( 0.0000000 0.5000000 0.2812500), wk = 0.0026525 k( 331) = ( 0.0000000 0.5000000 0.2968750), wk = 0.0026525 k( 332) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0026525 k( 333) = ( 0.0000000 0.5000000 0.3281250), wk = 0.0026525 k( 334) = ( 0.0000000 0.5000000 0.3437500), wk = 0.0026525 k( 335) = ( 0.0000000 0.5000000 0.3593750), wk = 0.0026525 k( 336) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0026525 k( 337) = ( 0.0000000 0.5000000 0.3906250), wk = 0.0026525 k( 338) = ( 0.0000000 0.5000000 0.4062500), wk = 0.0026525 k( 339) = ( 0.0000000 0.5000000 0.4218750), wk = 0.0026525 k( 340) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0026525 k( 341) = ( 0.0000000 0.5000000 0.4531250), wk = 0.0026525 k( 342) = ( 0.0000000 0.5000000 0.4687500), wk = 0.0026525 k( 343) = ( 0.0000000 0.5000000 0.4843750), wk = 0.0026525 k( 344) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026525 k( 345) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0026525 k( 346) = ( 0.5000000 0.5000000 0.0156250), wk = 0.0026525 k( 347) = ( 0.5000000 0.5000000 0.0312500), wk = 0.0026525 k( 348) = ( 0.5000000 0.5000000 0.0468750), wk = 0.0026525 k( 349) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0026525 k( 350) = ( 0.5000000 0.5000000 0.0781250), wk = 0.0026525 k( 351) = ( 0.5000000 0.5000000 0.0937500), wk = 0.0026525 k( 352) = ( 0.5000000 0.5000000 0.1093750), wk = 0.0026525 k( 353) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0026525 k( 354) = ( 0.5000000 0.5000000 0.1406250), wk = 0.0026525 k( 355) = ( 0.5000000 0.5000000 0.1562500), wk = 0.0026525 k( 356) = ( 0.5000000 0.5000000 0.1718750), wk = 0.0026525 k( 357) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0026525 k( 358) = ( 0.5000000 0.5000000 0.2031250), wk = 0.0026525 k( 359) = ( 0.5000000 0.5000000 0.2187500), wk = 0.0026525 k( 360) = ( 0.5000000 0.5000000 0.2343750), wk = 0.0026525 k( 361) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0026525 k( 362) = ( 0.5000000 0.5000000 0.2656250), wk = 0.0026525 k( 363) = ( 0.5000000 0.5000000 0.2812500), wk = 0.0026525 k( 364) = ( 0.5000000 0.5000000 0.2968750), wk = 0.0026525 k( 365) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0026525 k( 366) = ( 0.5000000 0.5000000 0.3281250), wk = 0.0026525 k( 367) = ( 0.5000000 0.5000000 0.3437500), wk = 0.0026525 k( 368) = ( 0.5000000 0.5000000 0.3593750), wk = 0.0026525 k( 369) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0026525 k( 370) = ( 0.5000000 0.5000000 0.3906250), wk = 0.0026525 k( 371) = ( 0.5000000 0.5000000 0.4062500), wk = 0.0026525 k( 372) = ( 0.5000000 0.5000000 0.4218750), wk = 0.0026525 k( 373) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0026525 k( 374) = ( 0.5000000 0.5000000 0.4531250), wk = 0.0026525 k( 375) = ( 0.5000000 0.5000000 0.4687500), wk = 0.0026525 k( 376) = ( 0.5000000 0.5000000 0.4843750), wk = 0.0026525 k( 377) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0026525 Dense grid: 52271 G-vectors FFT dimensions: ( 45, 45, 60) Smooth grid: 23093 G-vectors FFT dimensions: ( 36, 36, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 140, 48) NL pseudopotentials 0.10 Mb ( 70, 96) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 1089) G-vector shells 0.00 Mb ( 543) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.41 Mb ( 140, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.14 Mb ( 96, 2, 48) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./PbO.save/charge-density.dat Starting wfc are 52 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.7 secs Computing kpt #: 2 total cpu time spent up to now is 43.2 secs Computing kpt #: 3 total cpu time spent up to now is 44.6 secs Computing kpt #: 4 total cpu time spent up to now is 45.8 secs Computing kpt #: 5 total cpu time spent up to now is 47.0 secs Computing kpt #: 6 total cpu time spent up to now is 48.3 secs Computing kpt #: 7 total cpu time spent up to now is 49.6 secs Computing kpt #: 8 total cpu time spent up to now is 50.9 secs Computing kpt #: 9 total cpu time spent up to now is 52.2 secs Computing kpt #: 10 total cpu time spent up to now is 53.4 secs Computing kpt #: 11 total cpu time spent up to now is 54.6 secs Computing kpt #: 12 total cpu time spent up to now is 55.7 secs Computing kpt #: 13 total cpu time spent up to now is 56.9 secs Computing kpt #: 14 total cpu time spent up to now is 58.0 secs Computing kpt #: 15 total cpu time spent up to now is 59.1 secs Computing kpt #: 16 total cpu time spent up to now is 60.1 secs Computing kpt #: 17 total cpu time spent up to now is 61.2 secs Computing kpt #: 18 total cpu time spent up to now is 62.4 secs Computing kpt #: 19 total cpu time spent up to now is 63.5 secs Computing kpt #: 20 total cpu time spent up to now is 64.6 secs Computing kpt #: 21 total cpu time spent up to now is 65.6 secs Computing kpt #: 22 total cpu time spent up to now is 66.7 secs Computing kpt #: 23 total cpu time spent up to now is 67.9 secs Computing kpt #: 24 total cpu time spent up to now is 68.9 secs Computing kpt #: 25 total cpu time spent up to now is 70.1 secs Computing kpt #: 26 total cpu time spent up to now is 71.2 secs Computing kpt #: 27 total cpu time spent up to now is 72.3 secs Computing kpt #: 28 total cpu time spent up to now is 73.3 secs Computing kpt #: 29 total cpu time spent up to now is 74.5 secs Computing kpt #: 30 total cpu time spent up to now is 75.6 secs Computing kpt #: 31 total cpu time spent up to now is 76.7 secs Computing kpt #: 32 total cpu time spent up to now is 77.8 secs Computing kpt #: 33 total cpu time spent up to now is 78.8 secs Computing kpt #: 34 total cpu time spent up to now is 79.9 secs Computing kpt #: 35 total cpu time spent up to now is 80.9 secs Computing kpt #: 36 total cpu time spent up to now is 82.4 secs Computing kpt #: 37 total cpu time spent up to now is 84.9 secs Computing kpt #: 38 total cpu time spent up to now is 87.4 secs Computing kpt #: 39 total cpu time spent up to now is 88.6 secs Computing kpt #: 40 total cpu time spent up to now is 89.9 secs Computing kpt #: 41 total cpu time spent up to now is 91.1 secs Computing kpt #: 42 total cpu time spent up to now is 92.4 secs Computing kpt #: 43 total cpu time spent up to now is 93.7 secs Computing kpt #: 44 total cpu time spent up to now is 94.9 secs Computing kpt #: 45 total cpu time spent up to now is 96.4 secs Computing kpt #: 46 total cpu time spent up to now is 97.7 secs Computing kpt #: 47 total cpu time spent up to now is 98.9 secs Computing kpt #: 48 total cpu time spent up to now is 100.1 secs Computing kpt #: 49 total cpu time spent up to now is 101.3 secs Computing kpt #: 50 total cpu time spent up to now is 102.4 secs Computing kpt #: 51 total cpu time spent up to now is 103.6 secs Computing kpt #: 52 total cpu time spent up to now is 105.4 secs Computing kpt #: 53 total cpu 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Computing kpt #: 145 total cpu time spent up to now is 229.8 secs Computing kpt #: 146 total cpu time spent up to now is 230.9 secs Computing kpt #: 147 total cpu time spent up to now is 232.2 secs Computing kpt #: 148 total cpu time spent up to now is 233.4 secs Computing kpt #: 149 total cpu time spent up to now is 234.5 secs Computing kpt #: 150 total cpu time spent up to now is 235.6 secs Computing kpt #: 151 total cpu time spent up to now is 236.6 secs Computing kpt #: 152 total cpu time spent up to now is 237.7 secs Computing kpt #: 153 total cpu time spent up to now is 238.7 secs Computing kpt #: 154 total cpu time spent up to now is 240.2 secs Computing kpt #: 155 total cpu time spent up to now is 241.3 secs Computing kpt #: 156 total cpu time spent up to now is 242.2 secs Computing kpt #: 157 total cpu time spent up to now is 243.2 secs Computing kpt #: 158 total cpu time spent up to now is 244.1 secs Computing kpt #: 159 total cpu time spent up to now is 245.0 secs Computing kpt #: 160 total cpu time spent up to now is 246.6 secs Computing kpt #: 161 total cpu time spent up to now is 247.6 secs Computing kpt #: 162 total cpu time spent up to now is 248.5 secs Computing kpt #: 163 total cpu time spent up to now is 249.4 secs Computing kpt #: 164 total cpu time spent up to now is 250.4 secs Computing kpt #: 165 total cpu time spent up to now is 251.4 secs Computing kpt #: 166 total cpu time spent up to now is 252.4 secs Computing kpt #: 167 total cpu time spent up to now is 253.4 secs Computing kpt #: 168 total cpu time spent up to now is 254.3 secs Computing kpt #: 169 total cpu time spent up to now is 255.5 secs Computing kpt #: 170 total cpu time spent up to now is 256.4 secs Computing kpt #: 171 total cpu time spent up to now is 257.3 secs Computing kpt #: 172 total cpu time spent up to now is 258.2 secs Computing kpt #: 173 total cpu time spent up to now is 259.0 secs Computing kpt #: 174 total cpu time spent up to now is 260.0 secs Computing kpt #: 175 total cpu time spent up to now is 260.9 secs Computing kpt #: 176 total cpu time spent up to now is 262.1 secs Computing kpt #: 177 total cpu time spent up to now is 263.2 secs Computing kpt #: 178 total cpu time spent up to now is 264.2 secs Computing kpt #: 179 total cpu time spent up to now is 265.2 secs Computing kpt #: 180 total cpu time spent up to now is 266.2 secs Computing kpt #: 181 total cpu time spent up to now is 267.3 secs Computing kpt #: 182 total cpu time spent up to now is 268.3 secs Computing kpt #: 183 total cpu time spent up to now is 269.3 secs Computing kpt #: 184 total cpu time spent up to now is 270.2 secs Computing kpt #: 185 total cpu time spent up to now is 271.2 secs Computing kpt #: 186 total cpu time spent up to now is 272.3 secs Computing kpt #: 187 total cpu time spent up to now is 273.3 secs Computing kpt #: 188 total cpu time spent up to now is 274.4 secs Computing kpt #: 189 total cpu time spent up to now is 275.4 secs Computing kpt #: 190 total cpu 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up to now is 291.9 secs Computing kpt #: 206 total cpu time spent up to now is 292.8 secs Computing kpt #: 207 total cpu time spent up to now is 293.8 secs Computing kpt #: 208 total cpu time spent up to now is 294.9 secs Computing kpt #: 209 total cpu time spent up to now is 295.9 secs Computing kpt #: 210 total cpu time spent up to now is 297.0 secs Computing kpt #: 211 total cpu time spent up to now is 298.1 secs Computing kpt #: 212 total cpu time spent up to now is 299.2 secs Computing kpt #: 213 total cpu time spent up to now is 300.2 secs Computing kpt #: 214 total cpu time spent up to now is 301.1 secs Computing kpt #: 215 total cpu time spent up to now is 302.2 secs Computing kpt #: 216 total cpu time spent up to now is 303.2 secs Computing kpt #: 217 total cpu time spent up to now is 304.2 secs Computing kpt #: 218 total cpu time spent up to now is 305.3 secs Computing kpt #: 219 total cpu time spent up to now is 306.3 secs Computing kpt #: 220 total cpu time spent up to now is 307.4 secs Computing kpt #: 221 total cpu time spent up to now is 308.5 secs Computing kpt #: 222 total cpu time spent up to now is 309.6 secs Computing kpt #: 223 total cpu time spent up to now is 310.6 secs Computing kpt #: 224 total cpu time spent up to now is 311.7 secs Computing kpt #: 225 total cpu time spent up to now is 312.7 secs Computing kpt #: 226 total cpu time spent up to now is 313.7 secs Computing kpt #: 227 total cpu time spent up to now is 314.8 secs Computing kpt #: 228 total cpu time spent up to now is 316.1 secs Computing kpt #: 229 total cpu time spent up to now is 317.1 secs Computing kpt #: 230 total cpu time spent up to now is 318.2 secs Computing kpt #: 231 total cpu time spent up to now is 319.2 secs Computing kpt #: 232 total cpu time spent up to now is 320.5 secs Computing kpt #: 233 total cpu time spent up to now is 321.5 secs Computing kpt #: 234 total cpu time spent up to now is 322.8 secs Computing kpt #: 235 total cpu time spent up to now is 323.8 secs Computing kpt #: 236 total cpu time spent up to now is 324.9 secs Computing kpt #: 237 total cpu time spent up to now is 326.1 secs Computing kpt #: 238 total cpu time spent up to now is 327.2 secs Computing kpt #: 239 total cpu time spent up to now is 328.2 secs Computing kpt #: 240 total cpu time spent up to now is 329.2 secs Computing kpt #: 241 total cpu time spent up to now is 330.2 secs Computing kpt #: 242 total cpu time spent up to now is 331.3 secs Computing kpt #: 243 total cpu time spent up to now is 332.8 secs Computing kpt #: 244 total cpu time spent up to now is 333.9 secs Computing kpt #: 245 total cpu time spent up to now is 335.0 secs Computing kpt #: 246 total cpu time spent up to now is 336.0 secs Computing kpt #: 247 total cpu time spent up to now is 337.1 secs Computing kpt #: 248 total cpu time spent up to now is 338.1 secs Computing kpt #: 249 total cpu time spent up to now is 339.2 secs Computing kpt #: 250 total cpu time spent up to now is 340.4 secs Computing kpt #: 251 total cpu time spent up to now is 341.6 secs Computing kpt #: 252 total cpu time spent up to now is 342.7 secs Computing kpt #: 253 total cpu time spent up to now is 343.7 secs Computing kpt #: 254 total cpu time spent up to now is 344.7 secs Computing kpt #: 255 total cpu time spent up to now is 345.6 secs Computing kpt #: 256 total cpu time spent up to now is 346.6 secs Computing kpt #: 257 total cpu time spent up to now is 347.8 secs Computing kpt #: 258 total cpu time spent up to now is 348.8 secs Computing kpt #: 259 total cpu time spent up to now is 349.8 secs Computing kpt #: 260 total cpu time spent up to now is 350.9 secs Computing kpt #: 261 total cpu time spent up to now is 351.9 secs Computing kpt #: 262 total cpu time spent up to now is 353.0 secs Computing kpt #: 263 total cpu time spent up to now is 354.1 secs Computing kpt #: 264 total cpu time spent up to now is 355.9 secs Computing kpt #: 265 total cpu time spent up to now is 357.1 secs Computing kpt #: 266 total cpu time spent up to now is 358.1 secs Computing kpt #: 267 total cpu time spent up to now is 359.1 secs Computing kpt #: 268 total cpu time spent up to now is 360.2 secs Computing kpt #: 269 total cpu time spent up to now is 361.5 secs Computing kpt #: 270 total cpu time spent up to now is 362.7 secs Computing kpt #: 271 total cpu time spent up to now is 363.7 secs Computing kpt #: 272 total cpu time spent up to now is 364.7 secs Computing kpt #: 273 total cpu time spent up to now is 365.9 secs Computing kpt #: 274 total cpu time spent up to now is 367.0 secs Computing kpt #: 275 total cpu time spent up to now is 368.2 secs Computing kpt #: 276 total cpu time spent up to now is 369.2 secs Computing kpt #: 277 total cpu time spent up to now is 370.3 secs Computing kpt #: 278 total cpu time spent up to now is 371.6 secs Computing kpt #: 279 total cpu time spent up to now is 372.7 secs Computing kpt #: 280 total cpu time spent up to now is 373.8 secs Computing kpt #: 281 total cpu time spent up to now is 374.8 secs Computing kpt #: 282 total cpu time spent up to now is 375.9 secs Computing kpt #: 283 total cpu time spent up to now is 376.9 secs Computing kpt #: 284 total cpu time spent up to now is 377.9 secs Computing kpt #: 285 total cpu time spent up to now is 378.9 secs Computing kpt #: 286 total cpu time spent up to now is 380.1 secs Computing kpt #: 287 total cpu time spent up to now is 381.1 secs Computing kpt #: 288 total cpu time spent up to now is 382.2 secs Computing kpt #: 289 total cpu time spent up to now is 383.2 secs Computing kpt #: 290 total cpu time spent up to now is 384.2 secs Computing kpt #: 291 total cpu time spent up to now is 385.1 secs Computing kpt #: 292 total cpu time spent up to now is 386.1 secs Computing kpt #: 293 total cpu time spent up to now is 387.2 secs Computing kpt #: 294 total cpu time spent up to now is 388.3 secs Computing kpt #: 295 total cpu time spent up to now is 389.6 secs Computing kpt #: 296 total cpu 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is 421.5 secs Computing kpt #: 327 total cpu time spent up to now is 422.7 secs Computing kpt #: 328 total cpu time spent up to now is 424.0 secs Computing kpt #: 329 total cpu time spent up to now is 425.1 secs Computing kpt #: 330 total cpu time spent up to now is 426.4 secs Computing kpt #: 331 total cpu time spent up to now is 427.4 secs Computing kpt #: 332 total cpu time spent up to now is 428.4 secs Computing kpt #: 333 total cpu time spent up to now is 429.4 secs Computing kpt #: 334 total cpu time spent up to now is 430.5 secs Computing kpt #: 335 total cpu time spent up to now is 431.7 secs Computing kpt #: 336 total cpu time spent up to now is 432.8 secs Computing kpt #: 337 total cpu time spent up to now is 434.0 secs Computing kpt #: 338 total cpu time spent up to now is 435.2 secs Computing kpt #: 339 total cpu time spent up to now is 436.2 secs Computing kpt #: 340 total cpu time spent up to now is 437.2 secs Computing kpt #: 341 total cpu time spent up to now is 438.2 secs Computing kpt #: 342 total cpu time spent up to now is 439.2 secs Computing kpt #: 343 total cpu time spent up to now is 440.2 secs Computing kpt #: 344 total cpu time spent up to now is 441.3 secs Computing kpt #: 345 total cpu time spent up to now is 442.6 secs Computing kpt #: 346 total cpu time spent up to now is 443.7 secs Computing kpt #: 347 total cpu time spent up to now is 444.7 secs Computing kpt #: 348 total cpu time spent up to now is 446.2 secs Computing kpt #: 349 total cpu time spent up to now is 447.2 secs Computing kpt #: 350 total cpu time spent up to now is 448.3 secs Computing kpt #: 351 total cpu time spent up to now is 449.3 secs Computing kpt #: 352 total cpu time spent up to now is 450.3 secs Computing kpt #: 353 total cpu time spent up to now is 451.4 secs Computing kpt #: 354 total cpu time spent up to now is 452.4 secs Computing kpt #: 355 total cpu time spent up to now is 453.6 secs Computing kpt #: 356 total cpu time spent up to now is 454.9 secs Computing kpt #: 357 total cpu time spent up to now is 455.9 secs Computing kpt #: 358 total cpu time spent up to now is 457.1 secs Computing kpt #: 359 total cpu time spent up to now is 458.2 secs Computing kpt #: 360 total cpu time spent up to now is 459.2 secs Computing kpt #: 361 total cpu time spent up to now is 460.3 secs Computing kpt #: 362 total cpu time spent up to now is 461.4 secs Computing kpt #: 363 total cpu time spent up to now is 462.8 secs Computing kpt #: 364 total cpu time spent up to now is 463.9 secs Computing kpt #: 365 total cpu time spent up to now is 465.0 secs Computing kpt #: 366 total cpu time spent up to now is 466.0 secs Computing kpt #: 367 total cpu time spent up to now is 467.1 secs Computing kpt #: 368 total cpu time spent up to now is 468.1 secs Computing kpt #: 369 total cpu time spent up to now is 469.1 secs Computing kpt #: 370 total cpu time spent up to now is 470.1 secs Computing kpt #: 371 total cpu time spent up to now is 471.2 secs Computing kpt #: 372 total cpu time spent up to now is 472.3 secs Computing kpt #: 373 total cpu time spent up to now is 473.3 secs Computing kpt #: 374 total cpu time spent up to now is 474.3 secs Computing kpt #: 375 total cpu time spent up to now is 475.3 secs Computing kpt #: 376 total cpu time spent up to now is 476.3 secs Computing kpt #: 377 total cpu time spent up to now is 477.3 secs ethr = 2.50E-11, avg # of iterations = 24.7 total cpu time spent up to now is 477.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2873 PWs) bands (ev): -9.6935 -9.6935 -9.3356 -9.3356 -8.4302 -8.4302 -8.4300 -8.4300 -8.3738 -8.3738 -7.5169 -7.5169 -6.0112 -6.0112 -5.8799 -5.8799 -5.8720 -5.8720 -5.8582 -5.8582 -5.7343 -5.7343 -4.9386 -4.9386 1.7232 1.7232 2.2776 2.2776 4.2565 4.2565 4.6415 4.6415 6.9642 6.9642 7.0897 7.0897 7.1757 7.1757 8.8916 8.8916 11.1151 11.1151 13.2780 13.2780 14.1971 14.1971 15.0168 15.0168 k = 0.0000 0.0125-0.0000 ( 2875 PWs) bands (ev): -9.6932 -9.6932 -9.3356 -9.3356 -8.4302 -8.4302 -8.4300 -8.4300 -8.3735 -8.3735 -7.5171 -7.5171 -6.0111 -6.0111 -5.8800 -5.8800 -5.8717 -5.8717 -5.8582 -5.8582 -5.7343 -5.7343 -4.9389 -4.9389 1.7223 1.7223 2.2777 2.2777 4.2572 4.2572 4.6422 4.6422 6.9596 6.9596 7.0894 7.0894 7.1752 7.1752 8.8918 8.8918 11.1198 11.1198 13.2754 13.2754 14.1951 14.1951 15.0101 15.0101 k = 0.0000 0.0250-0.0000 ( 2865 PWs) bands (ev): -9.6925 -9.6925 -9.3355 -9.3355 -8.4304 -8.4304 -8.4298 -8.4298 -8.3727 -8.3727 -7.5175 -7.5175 -6.0108 -6.0108 -5.8803 -5.8803 -5.8710 -5.8710 -5.8581 -5.8581 -5.7341 -5.7341 -4.9397 -4.9397 1.7198 1.7198 2.2781 2.2781 4.2596 4.2596 4.6443 4.6443 6.9464 6.9464 7.0881 7.0881 7.1739 7.1739 8.8927 8.8927 11.1335 11.1335 13.2677 13.2677 14.1893 14.1893 14.9914 14.9914 k = 0.0000 0.0375-0.0000 ( 2867 PWs) bands (ev): -9.6912 -9.6912 -9.3354 -9.3354 -8.4306 -8.4306 -8.4296 -8.4296 -8.3713 -8.3713 -7.5183 -7.5183 -6.0102 -6.0102 -5.8807 -5.8807 -5.8700 -5.8700 -5.8580 -5.8580 -5.7338 -5.7338 -4.9411 -4.9411 1.7156 1.7156 2.2788 2.2788 4.2634 4.2634 4.6477 4.6477 6.9256 6.9256 7.0851 7.0851 7.1715 7.1715 8.8941 8.8941 11.1562 11.1562 13.2546 13.2546 14.1796 14.1796 14.9633 14.9633 k = 0.0000 0.0500-0.0000 ( 2871 PWs) bands (ev): -9.6895 -9.6895 -9.3353 -9.3353 -8.4308 -8.4308 -8.4293 -8.4293 -8.3694 -8.3694 -7.5194 -7.5194 -6.0095 -6.0095 -5.8810 -5.8810 -5.8687 -5.8687 -5.8578 -5.8578 -5.7334 -5.7334 -4.9430 -4.9430 1.7098 1.7098 2.2795 2.2795 4.2688 4.2688 4.6526 4.6526 6.8984 6.8984 7.0799 7.0799 7.1678 7.1678 8.8957 8.8957 11.1875 11.1875 13.2356 13.2356 14.1662 14.1662 14.9299 14.9299 k = 0.0000 0.0625-0.0000 ( 2873 PWs) bands (ev): -9.6873 -9.6873 -9.3352 -9.3352 -8.4311 -8.4311 -8.4289 -8.4289 -8.3670 -8.3670 -7.5208 -7.5208 -6.0085 -6.0085 -5.8813 -5.8813 -5.8673 -5.8673 -5.8576 -5.8576 -5.7329 -5.7329 -4.9455 -4.9455 1.7025 1.7025 2.2804 2.2804 4.2758 4.2758 4.6589 4.6589 6.8660 6.8660 7.0722 7.0722 7.1623 7.1623 8.8975 8.8975 11.2267 11.2267 13.2102 13.2102 14.1495 14.1495 14.8948 14.8948 k = 0.0000 0.0750-0.0000 ( 2883 PWs) bands (ev): -9.6846 -9.6846 -9.3351 -9.3351 -8.4314 -8.4314 -8.4283 -8.4283 -8.3641 -8.3641 -7.5225 -7.5225 -6.0073 -6.0073 -5.8816 -5.8816 -5.8659 -5.8659 -5.8571 -5.8571 -5.7323 -5.7323 -4.9485 -4.9485 1.6938 1.6938 2.2814 2.2814 4.2843 4.2843 4.6666 4.6666 6.8294 6.8294 7.0619 7.0619 7.1550 7.1550 8.8991 8.8991 11.2733 11.2733 13.1781 13.1781 14.1302 14.1302 14.8614 14.8614 k = 0.0000 0.0875-0.0000 ( 2887 PWs) bands (ev): -9.6815 -9.6815 -9.3350 -9.3349 -8.4316 -8.4316 -8.4277 -8.4277 -8.3608 -8.3608 -7.5246 -7.5246 -6.0059 -6.0059 -5.8817 -5.8817 -5.8644 -5.8644 -5.8565 -5.8565 -5.7315 -5.7315 -4.9521 -4.9521 1.6838 1.6838 2.2822 2.2822 4.2944 4.2944 4.6759 4.6759 6.7892 6.7892 7.0489 7.0489 7.1456 7.1456 8.9003 8.9003 11.3265 11.3265 13.1390 13.1390 14.1090 14.1090 14.8318 14.8318 k = 0.0000 0.1000-0.0000 ( 2883 PWs) bands (ev): -9.6779 -9.6779 -9.3349 -9.3349 -8.4318 -8.4318 -8.4270 -8.4270 -8.3569 -8.3569 -7.5271 -7.5271 -6.0043 -6.0043 -5.8817 -5.8817 -5.8630 -5.8630 -5.8556 -5.8556 -5.7306 -5.7306 -4.9563 -4.9563 1.6725 1.6725 2.2829 2.2829 4.3060 4.3060 4.6866 4.6866 6.7464 6.7464 7.0335 7.0335 7.1340 7.1340 8.9006 8.9006 11.3855 11.3855 13.0930 13.0930 14.0870 14.0870 14.8073 14.8073 k = 0.0000 0.1125-0.0000 ( 2887 PWs) bands (ev): -9.6739 -9.6739 -9.3349 -9.3349 -8.4319 -8.4319 -8.4262 -8.4262 -8.3525 -8.3525 -7.5299 -7.5299 -6.0025 -6.0025 -5.8817 -5.8817 -5.8616 -5.8616 -5.8545 -5.8545 -5.7295 -5.7295 -4.9612 -4.9612 1.6603 1.6603 2.2832 2.2832 4.3192 4.3192 4.6990 4.6990 6.7016 6.7016 7.0157 7.0157 7.1202 7.1202 8.8996 8.8996 11.4494 11.4494 13.0406 13.0406 14.0653 14.0653 14.7883 14.7883 k = 0.0000 0.1250-0.0000 ( 2885 PWs) bands (ev): -9.6695 -9.6695 -9.3349 -9.3349 -8.4319 -8.4319 -8.4253 -8.4253 -8.3476 -8.3476 -7.5332 -7.5332 -6.0006 -6.0006 -5.8816 -5.8816 -5.8603 -5.8603 -5.8530 -5.8530 -5.7282 -5.7282 -4.9666 -4.9666 1.6471 1.6471 2.2831 2.2831 4.3339 4.3339 4.7129 4.7129 6.6555 6.6555 6.9957 6.9957 7.1042 7.1042 8.8970 8.8970 11.5172 11.5172 12.9829 12.9829 14.0444 14.0444 14.7746 14.7746 k = 0.0000 0.1375-0.0000 ( 2887 PWs) bands (ev): -9.6648 -9.6648 -9.3351 -9.3351 -8.4318 -8.4318 -8.4242 -8.4242 -8.3422 -8.3422 -7.5369 -7.5368 -5.9984 -5.9984 -5.8815 -5.8815 -5.8591 -5.8591 -5.8513 -5.8513 -5.7267 -5.7267 -4.9727 -4.9727 1.6333 1.6333 2.2823 2.2823 4.3501 4.3502 4.7285 4.7285 6.6087 6.6087 6.9734 6.9734 7.0860 7.0860 8.8921 8.8921 11.5879 11.5879 12.9210 12.9210 14.0249 14.0249 14.7658 14.7658 k = 0.0000 0.1500-0.0000 ( 2887 PWs) bands (ev): -9.6596 -9.6596 -9.3355 -9.3355 -8.4317 -8.4317 -8.4231 -8.4231 -8.3362 -8.3362 -7.5410 -7.5410 -5.9960 -5.9960 -5.8814 -5.8814 -5.8577 -5.8577 -5.8494 -5.8494 -5.7249 -5.7249 -4.9795 -4.9795 1.6189 1.6189 2.2808 2.2808 4.3680 4.3680 4.7457 4.7457 6.5619 6.5619 6.9491 6.9491 7.0657 7.0657 8.8846 8.8846 11.6602 11.6602 12.8567 12.8567 14.0069 14.0069 14.7614 14.7614 k = 0.0000 0.1625-0.0000 ( 2885 PWs) bands (ev): -9.6542 -9.6542 -9.3360 -9.3360 -8.4314 -8.4314 -8.4220 -8.4220 -8.3296 -8.3296 -7.5456 -7.5456 -5.9935 -5.9935 -5.8814 -5.8814 -5.8561 -5.8561 -5.8473 -5.8473 -5.7230 -5.7230 -4.9869 -4.9869 1.6042 1.6042 2.2782 2.2782 4.3873 4.3873 4.7646 4.7646 6.5157 6.5157 6.9229 6.9229 7.0435 7.0435 8.8740 8.8740 11.7329 11.7329 12.7918 12.7918 13.9904 13.9904 14.7610 14.7610 k = 0.0000 0.1750-0.0000 ( 2887 PWs) bands (ev): -9.6484 -9.6484 -9.3366 -9.3366 -8.4311 -8.4311 -8.4207 -8.4207 -8.3223 -8.3223 -7.5507 -7.5506 -5.9909 -5.9909 -5.8815 -5.8815 -5.8543 -5.8543 -5.8452 -5.8452 -5.7206 -5.7206 -4.9951 -4.9951 1.5893 1.5893 2.2746 2.2746 4.4083 4.4083 4.7851 4.7851 6.4705 6.4705 6.8948 6.8948 7.0194 7.0194 8.8598 8.8598 11.8045 11.8045 12.7282 12.7282 13.9756 13.9756 14.7640 14.7640 k = 0.0000 0.1875-0.0000 ( 2882 PWs) bands (ev): -9.6423 -9.6423 -9.3375 -9.3375 -8.4307 -8.4307 -8.4195 -8.4195 -8.3144 -8.3144 -7.5562 -7.5562 -5.9881 -5.9881 -5.8817 -5.8817 -5.8523 -5.8523 -5.8430 -5.8430 -5.7180 -5.7180 -5.0039 -5.0039 1.5745 1.5745 2.2696 2.2696 4.4308 4.4308 4.8073 4.8073 6.4269 6.4269 6.8650 6.8650 6.9937 6.9937 8.8415 8.8415 11.8732 11.8732 12.6679 12.6679 13.9625 13.9625 14.7702 14.7702 k = 0.0000 0.2000-0.0000 ( 2878 PWs) bands (ev): -9.6360 -9.6360 -9.3387 -9.3387 -8.4302 -8.4302 -8.4182 -8.4182 -8.3056 -8.3056 -7.5624 -7.5624 -5.9852 -5.9852 -5.8820 -5.8820 -5.8500 -5.8500 -5.8407 -5.8407 -5.7149 -5.7149 -5.0134 -5.0134 1.5600 1.5600 2.2632 2.2632 4.4549 4.4549 4.8312 4.8312 6.3852 6.3852 6.8335 6.8335 6.9665 6.9665 8.8187 8.8187 11.9369 11.9369 12.6132 12.6132 13.9516 13.9516 14.7792 14.7792 k = 0.0000 0.2125-0.0000 ( 2882 PWs) bands (ev): -9.6294 -9.6294 -9.3401 -9.3401 -8.4297 -8.4297 -8.4169 -8.4169 -8.2961 -8.2961 -7.5691 -7.5691 -5.9822 -5.9822 -5.8824 -5.8824 -5.8475 -5.8475 -5.8383 -5.8383 -5.7114 -5.7114 -5.0237 -5.0237 1.5459 1.5459 2.2551 2.2551 4.4805 4.4805 4.8567 4.8567 6.3458 6.3458 6.8006 6.8006 6.9380 6.9380 8.7911 8.7911 11.9929 11.9929 12.5664 12.5664 13.9433 13.9433 14.7909 14.7909 k = 0.0000 0.2250-0.0000 ( 2878 PWs) bands (ev): -9.6226 -9.6226 -9.3417 -9.3417 -8.4291 -8.4291 -8.4157 -8.4157 -8.2858 -8.2858 -7.5763 -7.5763 -5.9792 -5.9792 -5.8830 -5.8830 -5.8449 -5.8449 -5.8359 -5.8359 -5.7074 -5.7074 -5.0346 -5.0346 1.5325 1.5325 2.2453 2.2453 4.5078 4.5078 4.8838 4.8838 6.3089 6.3089 6.7663 6.7663 6.9086 6.9086 8.7584 8.7585 12.0384 12.0384 12.5302 12.5302 13.9385 13.9385 14.8049 14.8049 k = 0.0000 0.2375-0.0000 ( 2876 PWs) bands (ev): -9.6156 -9.6156 -9.3437 -9.3437 -8.4285 -8.4285 -8.4145 -8.4145 -8.2747 -8.2747 -7.5842 -7.5842 -5.9761 -5.9761 -5.8837 -5.8837 -5.8422 -5.8422 -5.8334 -5.8334 -5.7028 -5.7028 -5.0463 -5.0463 1.5200 1.5200 2.2336 2.2336 4.5366 4.5366 4.9126 4.9126 6.2744 6.2744 6.7308 6.7308 6.8784 6.8784 8.7205 8.7205 12.0704 12.0704 12.5067 12.5067 13.9382 13.9382 14.8211 14.8211 k = 0.0000 0.2500-0.0000 ( 2876 PWs) bands (ev): -9.6084 -9.6084 -9.3460 -9.3460 -8.4278 -8.4278 -8.4133 -8.4133 -8.2627 -8.2627 -7.5927 -7.5927 -5.9730 -5.9730 -5.8845 -5.8845 -5.8395 -5.8395 -5.8308 -5.8308 -5.6975 -5.6975 -5.0588 -5.0588 1.5084 1.5084 2.2199 2.2199 4.5671 4.5671 4.9430 4.9430 6.2425 6.2426 6.6944 6.6944 6.8480 6.8480 8.6773 8.6773 12.0877 12.0877 12.4966 12.4966 13.9434 13.9434 14.8392 14.8392 k = 0.0000 0.2625-0.0000 ( 2880 PWs) bands (ev): -9.6011 -9.6011 -9.3486 -9.3486 -8.4271 -8.4271 -8.4123 -8.4123 -8.2498 -8.2498 -7.6018 -7.6018 -5.9699 -5.9699 -5.8854 -5.8854 -5.8369 -5.8369 -5.8281 -5.8281 -5.6915 -5.6915 -5.0719 -5.0719 1.4981 1.4981 2.2043 2.2043 4.5991 4.5991 4.9749 4.9749 6.2130 6.2130 6.6570 6.6570 6.8178 6.8178 8.6288 8.6288 12.0919 12.0919 12.4973 12.4973 13.9550 13.9550 14.8587 14.8587 k = 0.0000 0.2750-0.0000 ( 2880 PWs) bands (ev): -9.5936 -9.5936 -9.3515 -9.3515 -8.4263 -8.4263 -8.4113 -8.4113 -8.2361 -8.2361 -7.6116 -7.6116 -5.9668 -5.9668 -5.8864 -5.8864 -5.8344 -5.8344 -5.8254 -5.8254 -5.6847 -5.6847 -5.0858 -5.0858 1.4892 1.4892 2.1866 2.1866 4.6327 4.6327 5.0082 5.0082 6.1854 6.1854 6.6190 6.6190 6.7884 6.7884 8.5751 8.5751 12.0871 12.0871 12.5044 12.5044 13.9739 13.9739 14.8793 14.8793 k = 0.0000 0.2875-0.0000 ( 2876 PWs) bands (ev): -9.5860 -9.5860 -9.3548 -9.3548 -8.4255 -8.4255 -8.4104 -8.4104 -8.2216 -8.2216 -7.6220 -7.6220 -5.9637 -5.9637 -5.8875 -5.8875 -5.8321 -5.8321 -5.8226 -5.8226 -5.6770 -5.6770 -5.1003 -5.1003 1.4818 1.4818 2.1668 2.1668 4.6678 4.6678 5.0431 5.0431 6.1592 6.1592 6.5803 6.5803 6.7608 6.7608 8.5164 8.5164 12.0776 12.0776 12.5129 12.5129 14.0004 14.0004 14.9006 14.9006 k = 0.0000 0.3000-0.0000 ( 2878 PWs) bands (ev): -9.5783 -9.5783 -9.3583 -9.3583 -8.4247 -8.4247 -8.4097 -8.4097 -8.2062 -8.2062 -7.6331 -7.6331 -5.9606 -5.9606 -5.8886 -5.8886 -5.8299 -5.8299 -5.8199 -5.8199 -5.6684 -5.6684 -5.1156 -5.1156 1.4761 1.4761 2.1451 2.1451 4.7045 4.7045 5.0793 5.0793 6.1337 6.1337 6.5410 6.5410 6.7358 6.7358 8.4531 8.4531 12.0669 12.0669 12.5194 12.5194 14.0345 14.0345 14.9220 14.9220 k = 0.0000 0.3125-0.0000 ( 2870 PWs) bands (ev): -9.5705 -9.5705 -9.3622 -9.3622 -8.4239 -8.4239 -8.4090 -8.4090 -8.1901 -8.1901 -7.6448 -7.6448 -5.9575 -5.9575 -5.8899 -5.8899 -5.8279 -5.8279 -5.8174 -5.8174 -5.6589 -5.6589 -5.1314 -5.1314 1.4722 1.4722 2.1214 2.1214 4.7427 4.7427 5.1169 5.1169 6.1081 6.1081 6.5012 6.5012 6.7146 6.7146 8.3855 8.3855 12.0570 12.0570 12.5219 12.5219 14.0757 14.0757 14.9430 14.9430 k = 0.0000 0.3250-0.0000 ( 2870 PWs) bands (ev): -9.5627 -9.5627 -9.3665 -9.3665 -8.4230 -8.4230 -8.4085 -8.4085 -8.1733 -8.1733 -7.6572 -7.6572 -5.9545 -5.9545 -5.8912 -5.8912 -5.8259 -5.8259 -5.8150 -5.8150 -5.6484 -5.6484 -5.1479 -5.1479 1.4702 1.4702 2.0960 2.0960 4.7825 4.7825 5.1558 5.1558 6.0814 6.0814 6.4607 6.4607 6.6985 6.6985 8.3140 8.3140 12.0492 12.0492 12.5196 12.5196 14.1234 14.1234 14.9631 14.9631 k = 0.0000 0.3375-0.0000 ( 2870 PWs) bands (ev): -9.5548 -9.5548 -9.3710 -9.3710 -8.4221 -8.4221 -8.4081 -8.4081 -8.1557 -8.1557 -7.6703 -7.6703 -5.9516 -5.9516 -5.8927 -5.8927 -5.8241 -5.8241 -5.8129 -5.8129 -5.6369 -5.6369 -5.1650 -5.1650 1.4702 1.4702 2.0689 2.0689 4.8236 4.8236 5.1958 5.1958 6.0529 6.0529 6.4194 6.4194 6.6885 6.6885 8.2393 8.2393 12.0442 12.0442 12.5123 12.5123 14.1763 14.1763 14.9816 14.9816 k = 0.0000 0.3500-0.0000 ( 2870 PWs) bands (ev): -9.5468 -9.5468 -9.3758 -9.3758 -8.4213 -8.4213 -8.4078 -8.4078 -8.1376 -8.1376 -7.6841 -7.6841 -5.9486 -5.9486 -5.8941 -5.8941 -5.8223 -5.8223 -5.8110 -5.8110 -5.6245 -5.6245 -5.1827 -5.1827 1.4724 1.4724 2.0404 2.0404 4.8662 4.8662 5.2371 5.2371 6.0217 6.0217 6.3771 6.3771 6.6857 6.6857 8.1616 8.1616 12.0423 12.0423 12.5006 12.5006 14.2333 14.2333 14.9980 14.9980 k = 0.0000 0.3625-0.0000 ( 2876 PWs) bands (ev): -9.5389 -9.5388 -9.3810 -9.3810 -8.4204 -8.4204 -8.4076 -8.4076 -8.1188 -8.1188 -7.6986 -7.6986 -5.9458 -5.9458 -5.8957 -5.8957 -5.8207 -5.8207 -5.8094 -5.8094 -5.6112 -5.6112 -5.2008 -5.2008 1.4767 1.4767 2.0105 2.0105 4.9102 4.9102 5.2793 5.2793 5.9877 5.9877 6.3338 6.3338 6.6906 6.6906 8.0816 8.0816 12.0435 12.0435 12.4849 12.4849 14.2933 14.2933 15.0117 15.0117 k = 0.0000 0.3750-0.0000 ( 2876 PWs) bands (ev): -9.5309 -9.5309 -9.3864 -9.3864 -8.4195 -8.4195 -8.4075 -8.4075 -8.0996 -8.0996 -7.7136 -7.7136 -5.9429 -5.9429 -5.8973 -5.8973 -5.8190 -5.8190 -5.8080 -5.8080 -5.5970 -5.5970 -5.2194 -5.2194 1.4832 1.4832 1.9796 1.9796 4.9554 4.9554 5.3226 5.3226 5.9506 5.9506 6.2894 6.2894 6.7035 6.7035 7.9999 7.9999 12.0478 12.0478 12.4660 12.4660 14.3550 14.3550 15.0222 15.0222 k = 0.0000 0.3875-0.0000 ( 2876 PWs) bands (ev): -9.5229 -9.5229 -9.3921 -9.3921 -8.4186 -8.4186 -8.4075 -8.4075 -8.0799 -8.0799 -7.7294 -7.7294 -5.9401 -5.9401 -5.8990 -5.8990 -5.8175 -5.8175 -5.8070 -5.8070 -5.5819 -5.5819 -5.2384 -5.2384 1.4919 1.4919 1.9479 1.9479 5.0018 5.0018 5.3667 5.3667 5.9107 5.9107 6.2439 6.2439 6.7243 6.7243 7.9168 7.9168 12.0549 12.0550 12.4445 12.4445 14.4173 14.4173 15.0290 15.0290 k = 0.0000 0.4000-0.0000 ( 2878 PWs) bands (ev): -9.5149 -9.5149 -9.3980 -9.3980 -8.4177 -8.4177 -8.4076 -8.4076 -8.0599 -8.0599 -7.7457 -7.7457 -5.9374 -5.9374 -5.9008 -5.9008 -5.8160 -5.8160 -5.8061 -5.8061 -5.5661 -5.5661 -5.2578 -5.2578 1.5029 1.5029 1.9156 1.9156 5.0494 5.0494 5.4115 5.4115 5.8682 5.8682 6.1975 6.1975 6.7526 6.7526 7.8329 7.8329 12.0648 12.0648 12.4211 12.4211 14.4794 14.4794 15.0317 15.0317 k = 0.0000 0.4125-0.0000 ( 2878 PWs) bands (ev): -9.5069 -9.5069 -9.4042 -9.4042 -8.4168 -8.4168 -8.4078 -8.4078 -8.0396 -8.0396 -7.7627 -7.7627 -5.9347 -5.9347 -5.9026 -5.9026 -5.8146 -5.8146 -5.8056 -5.8056 -5.5495 -5.5495 -5.2775 -5.2775 1.5161 1.5161 1.8830 1.8830 5.0980 5.0980 5.4567 5.4567 5.8237 5.8237 6.1503 6.1503 6.7880 6.7880 7.7488 7.7488 12.0771 12.0771 12.3963 12.3963 14.5403 14.5403 15.0301 15.0301 k = 0.0000 0.4250-0.0000 ( 2878 PWs) bands (ev): -9.4990 -9.4990 -9.4106 -9.4106 -8.4159 -8.4159 -8.4080 -8.4080 -8.0190 -8.0190 -7.7802 -7.7802 -5.9320 -5.9320 -5.9045 -5.9045 -5.8133 -5.8133 -5.8052 -5.8052 -5.5323 -5.5323 -5.2974 -5.2974 1.5315 1.5315 1.8503 1.8503 5.1475 5.1475 5.5018 5.5018 5.7780 5.7780 6.1023 6.1023 6.8299 6.8299 7.6648 7.6648 12.0917 12.0917 12.3706 12.3706 14.5994 14.5994 15.0240 15.0240 k = 0.0000 0.4375-0.0000 ( 2882 PWs) bands (ev): -9.4911 -9.4911 -9.4172 -9.4172 -8.4150 -8.4150 -8.4084 -8.4084 -7.9983 -7.9983 -7.7982 -7.7982 -5.9294 -5.9294 -5.9065 -5.9065 -5.8120 -5.8120 -5.8051 -5.8051 -5.5144 -5.5144 -5.3175 -5.3175 1.5490 1.5490 1.8178 1.8178 5.1978 5.1978 5.5456 5.5456 5.7328 5.7328 6.0538 6.0538 6.8778 6.8778 7.5815 7.5815 12.1082 12.1083 12.3443 12.3443 14.6560 14.6560 15.0131 15.0131 k = 0.0000 0.4500-0.0000 ( 2884 PWs) bands (ev): -9.4832 -9.4832 -9.4240 -9.4240 -8.4142 -8.4142 -8.4088 -8.4088 -7.9776 -7.9776 -7.8168 -7.8168 -5.9269 -5.9269 -5.9085 -5.9085 -5.8108 -5.8108 -5.8052 -5.8052 -5.4961 -5.4961 -5.3378 -5.3378 1.5687 1.5687 1.7857 1.7857 5.2488 5.2488 5.5825 5.5825 5.6937 5.6937 6.0049 6.0049 6.9312 6.9312 7.4992 7.4992 12.1267 12.1267 12.3178 12.3178 14.7097 14.7097 14.9975 14.9975 k = 0.0000 0.4625-0.0000 ( 2880 PWs) bands (ev): -9.4755 -9.4755 -9.4309 -9.4309 -8.4134 -8.4134 -8.4093 -8.4093 -7.9568 -7.9568 -7.8358 -7.8358 -5.9244 -5.9244 -5.9106 -5.9106 -5.8097 -5.8097 -5.8054 -5.8054 -5.4773 -5.4773 -5.3581 -5.3581 1.5903 1.5903 1.7542 1.7542 5.3003 5.3003 5.5884 5.5884 5.6852 5.6852 5.9558 5.9558 6.9895 6.9895 7.4185 7.4185 12.1468 12.1468 12.2914 12.2914 14.7600 14.7600 14.9771 14.9771 k = 0.0000 0.4750-0.0000 ( 2872 PWs) bands (ev): -9.4678 -9.4678 -9.4380 -9.4380 -8.4126 -8.4126 -8.4099 -8.4099 -7.9361 -7.9361 -7.8552 -7.8552 -5.9220 -5.9220 -5.9128 -5.9128 -5.8087 -5.8087 -5.8058 -5.8058 -5.4580 -5.4580 -5.3783 -5.3783 1.6137 1.6137 1.7236 1.7236 5.3521 5.3521 5.5534 5.5534 5.7172 5.7172 5.9066 5.9066 7.0523 7.0524 7.3397 7.3398 12.1683 12.1683 12.2653 12.2653 14.8067 14.8068 14.9520 14.9520 k = 0.0000 0.4875-0.0000 ( 2872 PWs) bands (ev): -9.4602 -9.4602 -9.4453 -9.4453 -8.4119 -8.4119 -8.4105 -8.4105 -7.9155 -7.9155 -7.8750 -7.8750 -5.9196 -5.9196 -5.9150 -5.9150 -5.8078 -5.8078 -5.8063 -5.8063 -5.4384 -5.4384 -5.3985 -5.3985 1.6390 1.6390 1.6941 1.6941 5.4040 5.4040 5.5061 5.5061 5.7615 5.7615 5.8575 5.8575 7.1192 7.1192 7.2633 7.2633 12.1911 12.1911 12.2398 12.2398 14.8495 14.8495 14.9223 14.9223 k = 0.0000 0.5000-0.0000 ( 2872 PWs) bands (ev): -9.4527 -9.4527 -9.4527 -9.4527 -8.4111 -8.4111 -8.4111 -8.4111 -7.8952 -7.8952 -7.8951 -7.8951 -5.9172 -5.9172 -5.9172 -5.9172 -5.8070 -5.8070 -5.8070 -5.8070 -5.4186 -5.4186 -5.4186 -5.4186 1.6658 1.6658 1.6658 1.6658 5.4556 5.4556 5.4556 5.4556 5.8089 5.8089 5.8089 5.8089 7.1897 7.1897 7.1897 7.1897 12.2150 12.2150 12.2150 12.2150 14.8881 14.8881 14.8881 14.8881 k = 0.0000 0.5000-0.0000 ( 2872 PWs) bands (ev): -9.4527 -9.4527 -9.4527 -9.4527 -8.4111 -8.4111 -8.4111 -8.4111 -7.8952 -7.8952 -7.8951 -7.8951 -5.9172 -5.9172 -5.9172 -5.9172 -5.8070 -5.8070 -5.8070 -5.8070 -5.4186 -5.4186 -5.4186 -5.4186 1.6658 1.6658 1.6658 1.6658 5.4556 5.4556 5.4556 5.4556 5.8089 5.8089 5.8089 5.8089 7.1897 7.1897 7.1897 7.1897 12.2150 12.2150 12.2150 12.2150 14.8881 14.8881 14.8881 14.8881 k = 0.0125 0.5000-0.0000 ( 2868 PWs) bands (ev): -9.4574 -9.4574 -9.4478 -9.4478 -8.4120 -8.4120 -8.4101 -8.4101 -7.9046 -7.9046 -7.8854 -7.8854 -5.9189 -5.9189 -5.9154 -5.9154 -5.8074 -5.8074 -5.8065 -5.8065 -5.4218 -5.4218 -5.4152 -5.4152 1.6638 1.6638 1.6644 1.6644 5.4350 5.4350 5.4696 5.4696 5.8078 5.8079 5.8197 5.8197 7.1847 7.1847 7.1960 7.1960 12.2078 12.2078 12.2192 12.2192 14.8111 14.8111 14.9630 14.9630 k = 0.0250 0.5000-0.0000 ( 2876 PWs) bands (ev): -9.4621 -9.4621 -9.4428 -9.4428 -8.4128 -8.4128 -8.4090 -8.4090 -7.9138 -7.9138 -7.8754 -7.8754 -5.9203 -5.9203 -5.9135 -5.9135 -5.8077 -5.8077 -5.8059 -5.8059 -5.4249 -5.4249 -5.4118 -5.4118 1.6584 1.6584 1.6596 1.6596 5.4098 5.4099 5.4756 5.4756 5.8177 5.8178 5.8382 5.8382 7.1811 7.1811 7.2036 7.2036 12.1978 12.1978 12.2204 12.2204 14.7326 14.7326 15.0354 15.0354 k = 0.0375 0.5000-0.0000 ( 2882 PWs) bands (ev): -9.4665 -9.4665 -9.4378 -9.4378 -8.4134 -8.4134 -8.4078 -8.4078 -7.9226 -7.9226 -7.8653 -7.8653 -5.9215 -5.9215 -5.9114 -5.9114 -5.8079 -5.8079 -5.8052 -5.8052 -5.4279 -5.4279 -5.4082 -5.4082 1.6496 1.6496 1.6516 1.6516 5.3822 5.3822 5.4739 5.4739 5.8384 5.8384 5.8626 5.8626 7.1788 7.1788 7.2124 7.2124 12.1850 12.1850 12.2183 12.2183 14.6532 14.6532 15.1049 15.1049 k = 0.0500 0.5000-0.0000 ( 2876 PWs) bands (ev): -9.4708 -9.4708 -9.4328 -9.4328 -8.4139 -8.4139 -8.4065 -8.4065 -7.9310 -7.9310 -7.8551 -7.8551 -5.9224 -5.9224 -5.9092 -5.9092 -5.8080 -5.8080 -5.8044 -5.8044 -5.4308 -5.4308 -5.4045 -5.4045 1.6375 1.6375 1.6402 1.6402 5.3536 5.3536 5.4660 5.4660 5.8682 5.8682 5.8912 5.8912 7.1779 7.1779 7.2223 7.2223 12.1693 12.1693 12.2125 12.2125 14.5738 14.5738 15.1711 15.1711 k = 0.0625 0.5000-0.0000 ( 2878 PWs) bands (ev): -9.4748 -9.4748 -9.4279 -9.4279 -8.4141 -8.4141 -8.4052 -8.4052 -7.9390 -7.9390 -7.8448 -7.8448 -5.9230 -5.9230 -5.9070 -5.9070 -5.8081 -5.8081 -5.8034 -5.8034 -5.4335 -5.4335 -5.4007 -5.4007 1.6222 1.6222 1.6257 1.6257 5.3251 5.3251 5.4538 5.4538 5.9050 5.9050 5.9231 5.9231 7.1784 7.1784 7.2333 7.2333 12.1506 12.1506 12.2027 12.2027 14.4952 14.4952 15.2334 15.2334 k = 0.0750 0.5000-0.0000 ( 2878 PWs) bands (ev): -9.4786 -9.4786 -9.4230 -9.4230 -8.4142 -8.4142 -8.4038 -8.4038 -7.9465 -7.9465 -7.8345 -7.8345 -5.9232 -5.9232 -5.9048 -5.9048 -5.8080 -5.8080 -5.8023 -5.8023 -5.4361 -5.4361 -5.3969 -5.3969 1.6037 1.6037 1.6081 1.6081 5.2975 5.2975 5.4390 5.4390 5.9471 5.9471 5.9575 5.9575 7.1802 7.1802 7.2453 7.2453 12.1288 12.1288 12.1883 12.1883 14.4183 14.4183 15.2905 15.2905 k = 0.0875 0.5000-0.0000 ( 2878 PWs) bands (ev): -9.4822 -9.4822 -9.4182 -9.4182 -8.4140 -8.4140 -8.4024 -8.4024 -7.9534 -7.9534 -7.8242 -7.8242 -5.9231 -5.9231 -5.9026 -5.9026 -5.8079 -5.8079 -5.8010 -5.8010 -5.4386 -5.4386 -5.3929 -5.3929 1.5821 1.5821 1.5876 1.5876 5.2713 5.2713 5.4231 5.4231 5.9931 5.9931 5.9939 5.9939 7.1833 7.1833 7.2581 7.2581 12.1036 12.1036 12.1689 12.1689 14.3442 14.3442 15.3396 15.3396 k = 0.1000 0.5000-0.0000 ( 2882 PWs) bands (ev): -9.4854 -9.4854 -9.4136 -9.4136 -8.4135 -8.4135 -8.4009 -8.4009 -7.9598 -7.9598 -7.8141 -7.8141 -5.9227 -5.9227 -5.9004 -5.9004 -5.8076 -5.8076 -5.7997 -5.7997 -5.4410 -5.4410 -5.3890 -5.3890 1.5576 1.5576 1.5642 1.5642 5.2470 5.2470 5.4069 5.4069 6.0320 6.0320 6.0419 6.0419 7.1876 7.1876 7.2716 7.2716 12.0749 12.0749 12.1438 12.1438 14.2740 14.2740 15.3736 15.3736 k = 0.1125 0.5000-0.0000 ( 2882 PWs) bands (ev): -9.4884 -9.4884 -9.4092 -9.4092 -8.4128 -8.4128 -8.3995 -8.3995 -7.9656 -7.9656 -7.8041 -7.8041 -5.9218 -5.9218 -5.8983 -5.8983 -5.8073 -5.8073 -5.7981 -5.7981 -5.4432 -5.4432 -5.3850 -5.3850 1.5304 1.5304 1.5382 1.5382 5.2247 5.2247 5.3909 5.3910 6.0715 6.0715 6.0928 6.0928 7.1931 7.1931 7.2857 7.2857 12.0424 12.0424 12.1126 12.1126 14.2084 14.2084 15.3789 15.3789 k = 0.1250 0.5000-0.0000 ( 2886 PWs) bands (ev): -9.4911 -9.4911 -9.4050 -9.4050 -8.4119 -8.4119 -8.3980 -8.3980 -7.9708 -7.9708 -7.7943 -7.7943 -5.9206 -5.9206 -5.8963 -5.8963 -5.8069 -5.8069 -5.7965 -5.7965 -5.4452 -5.4452 -5.3810 -5.3810 1.5005 1.5005 1.5096 1.5096 5.2047 5.2047 5.3758 5.3758 6.1122 6.1123 6.1454 6.1454 7.1996 7.1996 7.3003 7.3003 12.0059 12.0059 12.0749 12.0749 14.1485 14.1485 15.3483 15.3483 k = 0.1375 0.5000-0.0000 ( 2886 PWs) bands (ev): -9.4935 -9.4935 -9.4011 -9.4011 -8.4107 -8.4107 -8.3966 -8.3966 -7.9753 -7.9753 -7.7848 -7.7848 -5.9189 -5.9189 -5.8943 -5.8943 -5.8064 -5.8064 -5.7947 -5.7947 -5.4472 -5.4472 -5.3770 -5.3770 1.4683 1.4683 1.4788 1.4788 5.1869 5.1869 5.3616 5.3617 6.1541 6.1541 6.1992 6.1992 7.2071 7.2071 7.3153 7.3153 11.9652 11.9652 12.0302 12.0302 14.0950 14.0950 15.2947 15.2947 k = 0.1500 0.5000-0.0000 ( 2890 PWs) bands (ev): -9.4956 -9.4956 -9.3975 -9.3975 -8.4092 -8.4092 -8.3951 -8.3951 -7.9790 -7.9790 -7.7757 -7.7757 -5.9169 -5.9169 -5.8924 -5.8924 -5.8057 -5.8057 -5.7928 -5.7928 -5.4490 -5.4490 -5.3730 -5.3730 1.4339 1.4339 1.4458 1.4458 5.1715 5.1715 5.3487 5.3487 6.1969 6.1969 6.2539 6.2539 7.2155 7.2156 7.3305 7.3305 11.9202 11.9202 11.9785 11.9785 14.0483 14.0483 15.2316 15.2316 k = 0.1625 0.5000-0.0000 ( 2886 PWs) bands (ev): -9.4974 -9.4974 -9.3943 -9.3943 -8.4075 -8.4075 -8.3936 -8.3936 -7.9821 -7.9821 -7.7670 -7.7670 -5.9144 -5.9144 -5.8906 -5.8906 -5.8050 -5.8050 -5.7907 -5.7907 -5.4506 -5.4506 -5.3691 -5.3691 1.3976 1.3976 1.4110 1.4110 5.1585 5.1586 5.3371 5.3371 6.2407 6.2407 6.3093 6.3093 7.2248 7.2248 7.3459 7.3459 11.8708 11.8708 11.9199 11.9199 14.0087 14.0087 15.1660 15.1660 k = 0.1750 0.5000-0.0000 ( 2882 PWs) bands (ev): -9.4988 -9.4988 -9.3914 -9.3914 -8.4055 -8.4055 -8.3922 -8.3922 -7.9844 -7.9843 -7.7586 -7.7586 -5.9116 -5.9116 -5.8889 -5.8889 -5.8041 -5.8041 -5.7885 -5.7885 -5.4521 -5.4521 -5.3653 -5.3653 1.3596 1.3596 1.3744 1.3744 5.1479 5.1479 5.3269 5.3269 6.2852 6.2852 6.3653 6.3653 7.2348 7.2348 7.3613 7.3613 11.8169 11.8169 11.8544 11.8544 13.9762 13.9762 15.1008 15.1008 k = 0.1875 0.5000-0.0000 ( 2886 PWs) bands (ev): -9.4999 -9.4999 -9.3889 -9.3889 -8.4034 -8.4034 -8.3908 -8.3908 -7.9858 -7.9858 -7.7508 -7.7508 -5.9085 -5.9085 -5.8873 -5.8873 -5.8031 -5.8031 -5.7863 -5.7863 -5.4534 -5.4534 -5.3616 -5.3616 1.3202 1.3202 1.3364 1.3364 5.1395 5.1396 5.3181 5.3181 6.3305 6.3305 6.4215 6.4215 7.2455 7.2455 7.3767 7.3767 11.7586 11.7586 11.7827 11.7827 13.9507 13.9507 15.0375 15.0375 k = 0.2000 0.5000-0.0000 ( 2894 PWs) bands (ev): -9.5008 -9.5008 -9.3869 -9.3869 -8.4010 -8.4010 -8.3894 -8.3894 -7.9865 -7.9865 -7.7436 -7.7436 -5.9050 -5.9050 -5.8858 -5.8858 -5.8019 -5.8019 -5.7839 -5.7839 -5.4546 -5.4546 -5.3580 -5.3580 1.2796 1.2796 1.2972 1.2972 5.1334 5.1334 5.3106 5.3107 6.3765 6.3765 6.4779 6.4779 7.2568 7.2568 7.3920 7.3920 11.6960 11.6960 11.7053 11.7053 13.9317 13.9317 14.9770 14.9770 k = 0.2125 0.5000-0.0000 ( 2896 PWs) bands (ev): -9.5013 -9.5013 -9.3853 -9.3853 -8.3985 -8.3985 -8.3880 -8.3880 -7.9863 -7.9863 -7.7369 -7.7369 -5.9013 -5.9013 -5.8843 -5.8843 -5.8005 -5.8005 -5.7815 -5.7815 -5.4555 -5.4555 -5.3547 -5.3547 1.2382 1.2382 1.2570 1.2570 5.1294 5.1294 5.3046 5.3046 6.4230 6.4230 6.5344 6.5344 7.2687 7.2687 7.4071 7.4071 11.6229 11.6229 11.6293 11.6293 13.9187 13.9187 14.9197 14.9197 k = 0.2250 0.5000-0.0000 ( 2896 PWs) bands (ev): -9.5015 -9.5015 -9.3841 -9.3841 -8.3958 -8.3958 -8.3866 -8.3866 -7.9852 -7.9852 -7.7309 -7.7309 -5.8975 -5.8975 -5.8829 -5.8829 -5.7989 -5.7989 -5.7790 -5.7790 -5.4563 -5.4563 -5.3515 -5.3515 1.1961 1.1961 1.2160 1.2160 5.1274 5.1274 5.2998 5.2998 6.4701 6.4701 6.5906 6.5906 7.2812 7.2812 7.4220 7.4220 11.5363 11.5363 11.5587 11.5587 13.9111 13.9111 14.8658 14.8658 k = 0.2375 0.5000-0.0000 ( 2888 PWs) bands (ev): -9.5014 -9.5013 -9.3834 -9.3834 -8.3931 -8.3931 -8.3852 -8.3852 -7.9833 -7.9833 -7.7255 -7.7255 -5.8934 -5.8934 -5.8816 -5.8816 -5.7971 -5.7971 -5.7765 -5.7765 -5.4568 -5.4568 -5.3486 -5.3486 1.1536 1.1536 1.1746 1.1746 5.1272 5.1272 5.2962 5.2962 6.5176 6.5176 6.6464 6.6464 7.2942 7.2942 7.4366 7.4367 11.4464 11.4464 11.4845 11.4845 13.9082 13.9082 14.8152 14.8152 k = 0.2500 0.5000-0.0000 ( 2888 PWs) bands (ev): -9.5009 -9.5009 -9.3832 -9.3832 -8.3903 -8.3903 -8.3839 -8.3839 -7.9805 -7.9805 -7.7209 -7.7209 -5.8894 -5.8894 -5.8804 -5.8804 -5.7950 -5.7950 -5.7739 -5.7739 -5.4570 -5.4570 -5.3460 -5.3460 1.1111 1.1111 1.1329 1.1329 5.1288 5.1288 5.2937 5.2937 6.5653 6.5654 6.7016 6.7016 7.3079 7.3079 7.4511 7.4511 11.3539 11.3539 11.4072 11.4072 13.9095 13.9095 14.7680 14.7680 k = 0.2625 0.5000-0.0000 ( 2896 PWs) bands (ev): -9.5002 -9.5002 -9.3834 -9.3834 -8.3875 -8.3875 -8.3826 -8.3826 -7.9768 -7.9768 -7.7170 -7.7170 -5.8854 -5.8854 -5.8791 -5.8791 -5.7926 -5.7926 -5.7714 -5.7714 -5.4570 -5.4570 -5.3437 -5.3437 1.0688 1.0688 1.0913 1.0913 5.1319 5.1319 5.2922 5.2922 6.6132 6.6132 6.7559 6.7559 7.3223 7.3223 7.4653 7.4653 11.2596 11.2596 11.3273 11.3273 13.9142 13.9142 14.7239 14.7239 k = 0.2750 0.5000-0.0000 ( 2898 PWs) bands (ev): -9.4993 -9.4993 -9.3840 -9.3840 -8.3848 -8.3848 -8.3813 -8.3813 -7.9722 -7.9722 -7.7139 -7.7139 -5.8814 -5.8814 -5.8779 -5.8779 -5.7899 -5.7899 -5.7688 -5.7688 -5.4567 -5.4567 -5.3417 -5.3417 1.0270 1.0270 1.0499 1.0499 5.1365 5.1365 5.2916 5.2916 6.6611 6.6611 6.8090 6.8090 7.3376 7.3376 7.4793 7.4793 11.1644 11.1644 11.2451 11.2451 13.9219 13.9219 14.6827 14.6827 k = 0.2875 0.5000-0.0000 ( 2898 PWs) bands (ev): -9.4980 -9.4980 -9.3850 -9.3850 -8.3821 -8.3821 -8.3800 -8.3800 -7.9667 -7.9667 -7.7116 -7.7116 -5.8777 -5.8777 -5.8767 -5.8767 -5.7869 -5.7869 -5.7662 -5.7662 -5.4560 -5.4560 -5.3402 -5.3402 0.9859 0.9859 1.0091 1.0091 5.1423 5.1423 5.2918 5.2918 6.7088 6.7088 6.8604 6.8604 7.3540 7.3540 7.4933 7.4933 11.0690 11.0690 11.1612 11.1612 13.9318 13.9318 14.6443 14.6443 k = 0.3000 0.5000-0.0000 ( 2902 PWs) bands (ev): -9.4964 -9.4964 -9.3865 -9.3865 -8.3795 -8.3795 -8.3787 -8.3787 -7.9604 -7.9604 -7.7101 -7.7101 -5.8756 -5.8756 -5.8742 -5.8742 -5.7837 -5.7837 -5.7637 -5.7637 -5.4550 -5.4550 -5.3390 -5.3390 0.9457 0.9457 0.9690 0.9690 5.1493 5.1493 5.2926 5.2926 6.7559 6.7559 6.9096 6.9096 7.3717 7.3717 7.5073 7.5073 10.9740 10.9740 11.0761 11.0761 13.9437 13.9437 14.6082 14.6082 k = 0.3125 0.5000-0.0000 ( 2906 PWs) bands (ev): -9.4946 -9.4946 -9.3883 -9.3883 -8.3775 -8.3775 -8.3771 -8.3771 -7.9533 -7.9533 -7.7094 -7.7094 -5.8744 -5.8744 -5.8710 -5.8710 -5.7801 -5.7801 -5.7612 -5.7612 -5.4536 -5.4536 -5.3383 -5.3383 0.9068 0.9068 0.9299 0.9299 5.1572 5.1572 5.2939 5.2939 6.8023 6.8024 6.9562 6.9562 7.3911 7.3911 7.5213 7.5213 10.8802 10.8802 10.9904 10.9904 13.9571 13.9571 14.5744 14.5744 k = 0.3250 0.5000-0.0000 ( 2918 PWs) bands (ev): -9.4926 -9.4926 -9.3905 -9.3905 -8.3763 -8.3763 -8.3749 -8.3749 -7.9454 -7.9454 -7.7096 -7.7096 -5.8733 -5.8733 -5.8681 -5.8681 -5.7764 -5.7764 -5.7588 -5.7588 -5.4517 -5.4517 -5.3380 -5.3380 0.8693 0.8693 0.8921 0.8921 5.1658 5.1658 5.2955 5.2956 6.8477 6.8477 6.9995 6.9995 7.4125 7.4125 7.5356 7.5356 10.7882 10.7882 10.9047 10.9047 13.9715 13.9715 14.5424 14.5424 k = 0.3375 0.5000-0.0000 ( 2918 PWs) bands (ev): -9.4903 -9.4903 -9.3931 -9.3931 -8.3751 -8.3751 -8.3728 -8.3728 -7.9368 -7.9368 -7.7106 -7.7106 -5.8721 -5.8721 -5.8656 -5.8656 -5.7725 -5.7725 -5.7564 -5.7564 -5.4495 -5.4495 -5.3383 -5.3383 0.8335 0.8335 0.8557 0.8557 5.1751 5.1751 5.2974 5.2974 6.8917 6.8917 7.0390 7.0390 7.4361 7.4361 7.5503 7.5503 10.6987 10.6987 10.8196 10.8196 13.9869 13.9869 14.5123 14.5123 k = 0.3500 0.5000-0.0000 ( 2922 PWs) bands (ev): -9.4878 -9.4878 -9.3959 -9.3959 -8.3740 -8.3740 -8.3710 -8.3710 -7.9276 -7.9276 -7.7125 -7.7125 -5.8710 -5.8710 -5.8635 -5.8635 -5.7686 -5.7686 -5.7542 -5.7542 -5.4468 -5.4468 -5.3390 -5.3390 0.7996 0.7996 0.8210 0.8210 5.1849 5.1849 5.2994 5.2994 6.9339 6.9339 7.0742 7.0742 7.4621 7.4621 7.5655 7.5655 10.6124 10.6124 10.7356 10.7356 14.0029 14.0029 14.4836 14.4836 k = 0.3625 0.5000-0.0000 ( 2918 PWs) bands (ev): -9.4850 -9.4850 -9.3991 -9.3990 -8.3729 -8.3729 -8.3693 -8.3693 -7.9177 -7.9177 -7.7153 -7.7153 -5.8699 -5.8699 -5.8617 -5.8617 -5.7646 -5.7646 -5.7520 -5.7520 -5.4436 -5.4436 -5.3403 -5.3403 0.7678 0.7678 0.7881 0.7881 5.1950 5.1950 5.3013 5.3013 6.9739 6.9739 7.1049 7.1049 7.4903 7.4903 7.5814 7.5814 10.5299 10.5299 10.6534 10.6534 14.0193 14.0193 14.4562 14.4562 k = 0.3750 0.5000-0.0000 ( 2922 PWs) bands (ev): -9.4820 -9.4820 -9.4024 -9.4024 -8.3718 -8.3718 -8.3679 -8.3679 -7.9074 -7.9074 -7.7189 -7.7189 -5.8687 -5.8687 -5.8602 -5.8602 -5.7607 -5.7607 -5.7499 -5.7499 -5.4399 -5.4399 -5.3420 -5.3420 0.7382 0.7382 0.7573 0.7573 5.2052 5.2052 5.3030 5.3030 7.0114 7.0114 7.1311 7.1311 7.5203 7.5203 7.5979 7.5979 10.4519 10.4519 10.5737 10.5737 14.0361 14.0361 14.4301 14.4301 k = 0.3875 0.5000-0.0000 ( 2922 PWs) bands (ev): -9.4789 -9.4789 -9.4060 -9.4060 -8.3708 -8.3708 -8.3667 -8.3667 -7.8967 -7.8967 -7.7233 -7.7233 -5.8676 -5.8676 -5.8591 -5.8591 -5.7570 -5.7570 -5.7479 -5.7479 -5.4358 -5.4358 -5.3443 -5.3443 0.7110 0.7110 0.7288 0.7288 5.2155 5.2155 5.3045 5.3045 7.0460 7.0460 7.1529 7.1529 7.5514 7.5514 7.6151 7.6151 10.3791 10.3791 10.4972 10.4972 14.0530 14.0530 14.4050 14.4050 k = 0.4000 0.5000-0.0000 ( 2912 PWs) bands (ev): -9.4755 -9.4755 -9.4098 -9.4098 -8.3698 -8.3698 -8.3657 -8.3657 -7.8856 -7.8856 -7.7285 -7.7285 -5.8664 -5.8664 -5.8582 -5.8582 -5.7536 -5.7536 -5.7461 -5.7461 -5.4313 -5.4313 -5.3472 -5.3472 0.6864 0.6864 0.7026 0.7026 5.2257 5.2257 5.3055 5.3055 7.0773 7.0773 7.1707 7.1707 7.5827 7.5827 7.6329 7.6329 10.3122 10.3122 10.4245 10.4245 14.0702 14.0702 14.3809 14.3809 k = 0.4125 0.5000-0.0000 ( 2908 PWs) bands (ev): -9.4720 -9.4720 -9.4138 -9.4138 -8.3688 -8.3688 -8.3649 -8.3649 -7.8743 -7.8743 -7.7345 -7.7345 -5.8653 -5.8653 -5.8576 -5.8576 -5.7505 -5.7505 -5.7445 -5.7445 -5.4264 -5.4264 -5.3505 -5.3505 0.6645 0.6645 0.6791 0.6791 5.2356 5.2356 5.3061 5.3061 7.1053 7.1053 7.1849 7.1849 7.6133 7.6133 7.6509 7.6509 10.2521 10.2521 10.3564 10.3564 14.0874 14.0874 14.3576 14.3576 k = 0.4250 0.5000-0.0000 ( 2904 PWs) bands (ev): -9.4683 -9.4683 -9.4179 -9.4179 -8.3680 -8.3680 -8.3643 -8.3643 -7.8628 -7.8628 -7.7412 -7.7412 -5.8643 -5.8643 -5.8572 -5.8572 -5.7477 -5.7477 -5.7430 -5.7430 -5.4211 -5.4211 -5.3543 -5.3543 0.6454 0.6454 0.6582 0.6582 5.2451 5.2451 5.3060 5.3060 7.1298 7.1298 7.1959 7.1959 7.6421 7.6421 7.6688 7.6688 10.1994 10.1995 10.2938 10.2938 14.1048 14.1048 14.3351 14.3351 k = 0.4375 0.5000-0.0000 ( 2912 PWs) bands (ev): -9.4645 -9.4645 -9.4221 -9.4221 -8.3671 -8.3671 -8.3639 -8.3639 -7.8512 -7.8512 -7.7487 -7.7487 -5.8632 -5.8632 -5.8571 -5.8571 -5.7453 -5.7453 -5.7417 -5.7417 -5.4155 -5.4155 -5.3586 -5.3586 0.6293 0.6293 0.6401 0.6401 5.2542 5.2542 5.3053 5.3053 7.1508 7.1509 7.2041 7.2041 7.6681 7.6681 7.6858 7.6859 10.1550 10.1550 10.2373 10.2373 14.1223 14.1223 14.3133 14.3133 k = 0.4500 0.5000-0.0000 ( 2916 PWs) bands (ev): -9.4605 -9.4605 -9.4263 -9.4263 -8.3664 -8.3664 -8.3637 -8.3637 -7.8396 -7.8396 -7.7568 -7.7568 -5.8622 -5.8622 -5.8571 -5.8571 -5.7433 -5.7433 -5.7407 -5.7407 -5.4096 -5.4096 -5.3633 -5.3633 0.6162 0.6162 0.6250 0.6250 5.2628 5.2628 5.3038 5.3039 7.1685 7.1685 7.2097 7.2097 7.6906 7.6906 7.7014 7.7014 10.1194 10.1194 10.1878 10.1878 14.1399 14.1399 14.2921 14.2921 k = 0.4625 0.5000-0.0000 ( 2912 PWs) bands (ev): -9.4565 -9.4565 -9.4307 -9.4307 -8.3657 -8.3657 -8.3636 -8.3636 -7.8282 -7.8281 -7.7656 -7.7656 -5.8612 -5.8612 -5.8573 -5.8573 -5.7417 -5.7417 -5.7399 -5.7399 -5.4036 -5.4036 -5.3684 -5.3684 0.6062 0.6062 0.6128 0.6128 5.2707 5.2707 5.3016 5.3016 7.1829 7.1829 7.2130 7.2130 7.7087 7.7087 7.7147 7.7147 10.0932 10.0932 10.1461 10.1461 14.1578 14.1578 14.2715 14.2715 k = 0.4750 0.5000-0.0000 ( 2912 PWs) bands (ev): -9.4523 -9.4523 -9.4350 -9.4350 -8.3651 -8.3651 -8.3636 -8.3636 -7.8169 -7.8169 -7.7749 -7.7749 -5.8604 -5.8604 -5.8577 -5.8577 -5.7405 -5.7405 -5.7393 -5.7393 -5.3976 -5.3976 -5.3738 -5.3738 0.5993 0.5993 0.6038 0.6038 5.2778 5.2779 5.2985 5.2985 7.1943 7.1943 7.2139 7.2139 7.7220 7.7220 7.7249 7.7249 10.0769 10.0769 10.1130 10.1130 14.1758 14.1758 14.2515 14.2515 k = 0.4875 0.5000-0.0000 ( 2912 PWs) bands (ev): -9.4480 -9.4480 -9.4394 -9.4394 -8.3645 -8.3645 -8.3638 -8.3638 -7.8058 -7.8058 -7.7848 -7.7848 -5.8595 -5.8595 -5.8582 -5.8582 -5.7396 -5.7396 -5.7391 -5.7391 -5.3915 -5.3915 -5.3795 -5.3795 0.5956 0.5956 0.5979 0.5979 5.2843 5.2843 5.2946 5.2946 7.2030 7.2030 7.2126 7.2126 7.7301 7.7301 7.7313 7.7313 10.0708 10.0708 10.0891 10.0891 14.1942 14.1942 14.2320 14.2320 k = 0.5000 0.5000-0.0000 ( 2904 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3641 -8.3641 -8.3641 -8.3641 -7.7951 -7.7951 -7.7951 -7.7951 -5.8588 -5.8588 -5.8588 -5.8588 -5.7392 -5.7392 -5.7392 -5.7392 -5.3854 -5.3854 -5.3854 -5.3854 0.5952 0.5952 0.5952 0.5952 5.2899 5.2899 5.2899 5.2899 7.2090 7.2090 7.2090 7.2090 7.7332 7.7332 7.7332 7.7332 10.0749 10.0749 10.0749 10.0749 14.2129 14.2129 14.2129 14.2129 k = 0.5000 0.5000-0.0000 ( 2904 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3641 -8.3641 -8.3641 -8.3641 -7.7951 -7.7951 -7.7951 -7.7951 -5.8588 -5.8588 -5.8588 -5.8588 -5.7392 -5.7392 -5.7392 -5.7392 -5.3854 -5.3854 -5.3854 -5.3854 0.5952 0.5952 0.5952 0.5952 5.2899 5.2899 5.2899 5.2899 7.2090 7.2090 7.2090 7.2090 7.7332 7.7332 7.7332 7.7332 10.0749 10.0749 10.0749 10.0749 14.2129 14.2129 14.2129 14.2129 k = 0.4911 0.4911-0.0000 ( 2912 PWs) bands (ev): -9.4481 -9.4481 -9.4393 -9.4393 -8.3645 -8.3645 -8.3638 -8.3638 -7.8059 -7.8059 -7.7847 -7.7847 -5.8596 -5.8596 -5.8582 -5.8582 -5.7396 -5.7396 -5.7391 -5.7391 -5.3915 -5.3915 -5.3794 -5.3794 0.5954 0.5954 0.5982 0.5982 5.2840 5.2840 5.2949 5.2949 7.2017 7.2017 7.2139 7.2139 7.7284 7.7284 7.7329 7.7329 10.0708 10.0708 10.0893 10.0893 14.1940 14.1940 14.2322 14.2322 k = 0.4821 0.4821-0.0000 ( 2912 PWs) bands (ev): -9.4524 -9.4524 -9.4349 -9.4349 -8.3651 -8.3651 -8.3636 -8.3636 -7.8172 -7.8172 -7.7746 -7.7746 -5.8604 -5.8604 -5.8577 -5.8577 -5.7404 -5.7404 -5.7394 -5.7394 -5.3979 -5.3979 -5.3735 -5.3734 0.5977 0.5977 0.6056 0.6056 5.2762 5.2762 5.3001 5.3002 7.1866 7.1866 7.2217 7.2217 7.7145 7.7145 7.7318 7.7318 10.0769 10.0769 10.1138 10.1138 14.1751 14.1751 14.2523 14.2523 k = 0.4732 0.4732-0.0000 ( 2908 PWs) bands (ev): -9.4567 -9.4567 -9.4305 -9.4304 -8.3657 -8.3657 -8.3635 -8.3635 -7.8288 -7.8288 -7.7650 -7.7650 -5.8614 -5.8614 -5.8573 -5.8573 -5.7416 -5.7416 -5.7400 -5.7400 -5.4047 -5.4047 -5.3674 -5.3674 0.6018 0.6018 0.6178 0.6178 5.2657 5.2657 5.3065 5.3065 7.1627 7.1627 7.2339 7.2339 7.6916 7.6916 7.7301 7.7301 10.0929 10.0929 10.1480 10.1480 14.1559 14.1559 14.2734 14.2734 k = 0.4643 0.4643-0.0000 ( 2910 PWs) bands (ev): -9.4609 -9.4609 -9.4260 -9.4260 -8.3665 -8.3665 -8.3635 -8.3635 -7.8409 -7.8409 -7.7557 -7.7557 -5.8624 -5.8624 -5.8569 -5.8569 -5.7431 -5.7431 -5.7409 -5.7409 -5.4118 -5.4118 -5.3612 -5.3612 0.6076 0.6076 0.6347 0.6347 5.2522 5.2522 5.3144 5.3144 7.1304 7.1304 7.2507 7.2507 7.6602 7.6602 7.7276 7.7276 10.1182 10.1182 10.1913 10.1913 14.1362 14.1362 14.2957 14.2957 k = 0.4554 0.4554-0.0000 ( 2910 PWs) bands (ev): -9.4651 -9.4651 -9.4215 -9.4214 -8.3673 -8.3673 -8.3637 -8.3637 -7.8533 -7.8533 -7.7468 -7.7468 -5.8636 -5.8636 -5.8567 -5.8567 -5.7449 -5.7449 -5.7421 -5.7421 -5.4195 -5.4195 -5.3547 -5.3547 0.6149 0.6149 0.6562 0.6562 5.2357 5.2357 5.3241 5.3242 7.0905 7.0905 7.2717 7.2717 7.6208 7.6208 7.7245 7.7245 10.1521 10.1521 10.2430 10.2430 14.1157 14.1157 14.3195 14.3195 k = 0.4464 0.4464-0.0000 ( 2910 PWs) bands (ev): -9.4692 -9.4692 -9.4169 -9.4169 -8.3683 -8.3683 -8.3640 -8.3640 -7.8662 -7.8662 -7.7383 -7.7383 -5.8649 -5.8649 -5.8566 -5.8566 -5.7471 -5.7471 -5.7436 -5.7436 -5.4277 -5.4277 -5.3479 -5.3479 0.6239 0.6239 0.6823 0.6823 5.2163 5.2164 5.3357 5.3357 7.0441 7.0441 7.2967 7.2967 7.5744 7.5744 7.7207 7.7207 10.1938 10.1938 10.3023 10.3023 14.0941 14.0941 14.3446 14.3446 k = 0.4375 0.4375-0.0000 ( 2914 PWs) bands (ev): -9.4734 -9.4734 -9.4124 -9.4124 -8.3694 -8.3694 -8.3643 -8.3643 -7.8794 -7.8794 -7.7301 -7.7301 -5.8664 -5.8664 -5.8566 -5.8566 -5.7494 -5.7494 -5.7454 -5.7454 -5.4364 -5.4364 -5.3408 -5.3408 0.6344 0.6344 0.7127 0.7127 5.1943 5.1943 5.3493 5.3493 6.9921 6.9921 7.3252 7.3252 7.5217 7.5217 7.7163 7.7163 10.2424 10.2424 10.3685 10.3685 14.0714 14.0714 14.3711 14.3711 k = 0.4286 0.4286-0.0000 ( 2918 PWs) bands (ev): -9.4775 -9.4774 -9.4079 -9.4079 -8.3705 -8.3705 -8.3648 -8.3648 -7.8930 -7.8930 -7.7223 -7.7223 -5.8680 -5.8680 -5.8567 -5.8567 -5.7520 -5.7520 -5.7474 -5.7474 -5.4457 -5.4457 -5.3332 -5.3332 0.6466 0.6466 0.7473 0.7473 5.1698 5.1698 5.3647 5.3647 6.9356 6.9357 7.3555 7.3555 7.4650 7.4650 7.7113 7.7113 10.2969 10.2969 10.4408 10.4408 14.0475 14.0475 14.3988 14.3988 k = 0.4196 0.4196-0.0000 ( 2920 PWs) bands (ev): -9.4815 -9.4815 -9.4034 -9.4034 -8.3718 -8.3718 -8.3655 -8.3655 -7.9069 -7.9069 -7.7147 -7.7147 -5.8698 -5.8698 -5.8569 -5.8569 -5.7548 -5.7548 -5.7497 -5.7497 -5.4555 -5.4555 -5.3253 -5.3253 0.6602 0.6602 0.7859 0.7859 5.1432 5.1432 5.3820 5.3820 6.8757 6.8757 7.3715 7.3715 7.4206 7.4206 7.7057 7.7057 10.3565 10.3565 10.5184 10.5184 14.0223 14.0223 14.4272 14.4272 k = 0.4107 0.4107-0.0000 ( 2916 PWs) bands (ev): -9.4856 -9.4856 -9.3989 -9.3989 -8.3731 -8.3731 -8.3662 -8.3662 -7.9212 -7.9212 -7.7075 -7.7075 -5.8717 -5.8717 -5.8573 -5.8573 -5.7577 -5.7577 -5.7522 -5.7522 -5.4658 -5.4658 -5.3169 -5.3169 0.6754 0.6754 0.8283 0.8283 5.1147 5.1147 5.4013 5.4013 6.8131 6.8131 7.3204 7.3204 7.4419 7.4419 7.6996 7.6996 10.4205 10.4205 10.6005 10.6005 13.9958 13.9958 14.4558 14.4558 k = 0.4018 0.4018-0.0000 ( 2916 PWs) bands (ev): -9.4896 -9.4896 -9.3945 -9.3945 -8.3746 -8.3746 -8.3670 -8.3670 -7.9357 -7.9357 -7.7005 -7.7005 -5.8738 -5.8738 -5.8577 -5.8577 -5.7606 -5.7606 -5.7550 -5.7550 -5.4765 -5.4765 -5.3081 -5.3081 0.6920 0.6920 0.8743 0.8743 5.0847 5.0847 5.4223 5.4223 6.7487 6.7487 7.2501 7.2502 7.4812 7.4812 7.6932 7.6932 10.4881 10.4881 10.6865 10.6865 13.9680 13.9680 14.4840 14.4840 k = 0.3929 0.3929-0.0000 ( 2920 PWs) bands (ev): -9.4937 -9.4937 -9.3901 -9.3901 -8.3761 -8.3761 -8.3680 -8.3680 -7.9505 -7.9505 -7.6937 -7.6937 -5.8762 -5.8762 -5.8581 -5.8581 -5.7636 -5.7636 -5.7579 -5.7579 -5.4875 -5.4875 -5.2990 -5.2990 0.7101 0.7101 0.9235 0.9235 5.0534 5.0534 5.4452 5.4452 6.6832 6.6833 7.1751 7.1751 7.5240 7.5240 7.6867 7.6867 10.5590 10.5590 10.7756 10.7756 13.9389 13.9389 14.5110 14.5110 k = 0.3839 0.3839-0.0000 ( 2916 PWs) bands (ev): -9.4977 -9.4977 -9.3858 -9.3858 -8.3778 -8.3778 -8.3691 -8.3691 -7.9656 -7.9656 -7.6873 -7.6872 -5.8787 -5.8787 -5.8587 -5.8587 -5.7667 -5.7667 -5.7610 -5.7610 -5.4989 -5.4989 -5.2895 -5.2895 0.7296 0.7296 0.9756 0.9756 5.0211 5.0211 5.4698 5.4698 6.6175 6.6175 7.0970 7.0970 7.5683 7.5683 7.6810 7.6810 10.6325 10.6325 10.8672 10.8672 13.9085 13.9085 14.5358 14.5358 k = 0.3750 0.3750-0.0000 ( 2908 PWs) bands (ev): -9.5018 -9.5018 -9.3816 -9.3816 -8.3795 -8.3795 -8.3702 -8.3702 -7.9808 -7.9808 -7.6810 -7.6810 -5.8815 -5.8815 -5.8594 -5.8594 -5.7697 -5.7697 -5.7643 -5.7643 -5.5104 -5.5104 -5.2797 -5.2797 0.7504 0.7504 1.0305 1.0305 4.9880 4.9880 5.4960 5.4960 6.5520 6.5520 7.0166 7.0166 7.6101 7.6101 7.6793 7.6794 10.7082 10.7082 10.9608 10.9608 13.8768 13.8768 14.5573 14.5573 k = 0.3661 0.3661-0.0000 ( 2914 PWs) bands (ev): -9.5059 -9.5059 -9.3775 -9.3775 -8.3813 -8.3813 -8.3715 -8.3715 -7.9962 -7.9962 -7.6749 -7.6749 -5.8844 -5.8844 -5.8601 -5.8601 -5.7728 -5.7728 -5.7676 -5.7676 -5.5221 -5.5221 -5.2696 -5.2696 0.7725 0.7725 1.0877 1.0877 4.9544 4.9544 5.5239 5.5239 6.4874 6.4874 6.9346 6.9346 7.6353 7.6353 7.6957 7.6957 10.7859 10.7859 11.0558 11.0558 13.8438 13.8438 14.5745 14.5745 k = 0.3571 0.3571-0.0000 ( 2908 PWs) bands (ev): -9.5101 -9.5101 -9.3735 -9.3735 -8.3831 -8.3831 -8.3729 -8.3729 -8.0117 -8.0117 -7.6690 -7.6690 -5.8876 -5.8876 -5.8608 -5.8608 -5.7759 -5.7759 -5.7709 -5.7709 -5.5338 -5.5338 -5.2592 -5.2592 0.7958 0.7958 1.1469 1.1469 4.9204 4.9204 5.5532 5.5532 6.4240 6.4240 6.8515 6.8515 7.6366 7.6366 7.7370 7.7370 10.8653 10.8653 11.1518 11.1518 13.8096 13.8096 14.5863 14.5863 k = 0.3482 0.3482-0.0000 ( 2904 PWs) bands (ev): -9.5143 -9.5143 -9.3696 -9.3696 -8.3851 -8.3851 -8.3743 -8.3743 -8.0272 -8.0272 -7.6633 -7.6632 -5.8911 -5.8911 -5.8616 -5.8616 -5.7791 -5.7791 -5.7742 -5.7742 -5.5455 -5.5455 -5.2485 -5.2485 0.8204 0.8204 1.2078 1.2078 4.8864 4.8864 5.5840 5.5840 6.3623 6.3623 6.7678 6.7679 7.6298 7.6298 7.7872 7.7872 10.9461 10.9461 11.2482 11.2482 13.7741 13.7741 14.5920 14.5920 k = 0.3393 0.3393-0.0000 ( 2904 PWs) bands (ev): -9.5186 -9.5185 -9.3659 -9.3659 -8.3871 -8.3871 -8.3758 -8.3758 -8.0428 -8.0428 -7.6577 -7.6576 -5.8947 -5.8947 -5.8625 -5.8625 -5.7824 -5.7824 -5.7773 -5.7773 -5.5572 -5.5572 -5.2377 -5.2377 0.8460 0.8460 1.2700 1.2700 4.8524 4.8524 5.6160 5.6160 6.3027 6.3027 6.6841 6.6841 7.6207 7.6207 7.8404 7.8404 11.0282 11.0282 11.3448 11.3448 13.7373 13.7373 14.5909 14.5909 k = 0.3304 0.3304-0.0000 ( 2900 PWs) bands (ev): -9.5229 -9.5229 -9.3623 -9.3623 -8.3892 -8.3892 -8.3775 -8.3775 -8.0584 -8.0584 -7.6522 -7.6522 -5.8985 -5.8985 -5.8633 -5.8633 -5.7860 -5.7860 -5.7801 -5.7801 -5.5687 -5.5687 -5.2267 -5.2267 0.8727 0.8727 1.3331 1.3331 4.8187 4.8187 5.6491 5.6491 6.2454 6.2454 6.6010 6.6010 7.6105 7.6105 7.8951 7.8951 11.1113 11.1113 11.4410 11.4410 13.6992 13.6992 14.5828 14.5828 k = 0.3214 0.3214-0.0000 ( 2904 PWs) bands (ev): -9.5273 -9.5273 -9.3589 -9.3589 -8.3913 -8.3913 -8.3791 -8.3791 -8.0739 -8.0739 -7.6468 -7.6468 -5.9025 -5.9025 -5.8642 -5.8642 -5.7898 -5.7898 -5.7828 -5.7828 -5.5800 -5.5800 -5.2155 -5.2155 0.9004 0.9004 1.3968 1.3968 4.7854 4.7855 5.6832 5.6832 6.1905 6.1905 6.5191 6.5191 7.5995 7.5995 7.9508 7.9508 11.1953 11.1953 11.5365 11.5365 13.6597 13.6597 14.5679 14.5679 k = 0.3125 0.3125-0.0000 ( 2896 PWs) bands (ev): -9.5318 -9.5318 -9.3557 -9.3557 -8.3935 -8.3935 -8.3809 -8.3809 -8.0893 -8.0893 -7.6415 -7.6415 -5.9066 -5.9066 -5.8651 -5.8651 -5.7938 -5.7938 -5.7852 -5.7852 -5.5910 -5.5910 -5.2042 -5.2042 0.9290 0.9290 1.4606 1.4606 4.7528 4.7528 5.7177 5.7177 6.1379 6.1379 6.4395 6.4395 7.5881 7.5881 8.0071 8.0071 11.2800 11.2800 11.6311 11.6311 13.6190 13.6190 14.5468 14.5468 k = 0.3036 0.3036-0.0000 ( 2900 PWs) bands (ev): -9.5365 -9.5364 -9.3527 -9.3527 -8.3957 -8.3957 -8.3827 -8.3827 -8.1045 -8.1045 -7.6364 -7.6364 -5.9109 -5.9109 -5.8660 -5.8660 -5.7978 -5.7978 -5.7875 -5.7875 -5.6017 -5.6017 -5.1928 -5.1928 0.9583 0.9583 1.5241 1.5241 4.7208 4.7208 5.7524 5.7524 6.0874 6.0874 6.3635 6.3635 7.5763 7.5763 8.0636 8.0636 11.3652 11.3652 11.7242 11.7242 13.5768 13.5768 14.5204 14.5204 k = 0.2946 0.2946-0.0000 ( 2896 PWs) bands (ev): -9.5412 -9.5412 -9.3499 -9.3499 -8.3980 -8.3980 -8.3845 -8.3845 -8.1194 -8.1194 -7.6313 -7.6312 -5.9153 -5.9153 -5.8668 -5.8668 -5.8019 -5.8019 -5.7898 -5.7898 -5.6121 -5.6121 -5.1814 -5.1814 0.9885 0.9885 1.5868 1.5868 4.6898 4.6898 5.7861 5.7861 6.0385 6.0385 6.2931 6.2931 7.5641 7.5642 8.1202 8.1202 11.4507 11.4507 11.8156 11.8156 13.5334 13.5334 14.4899 14.4899 k = 0.2857 0.2857-0.0000 ( 2894 PWs) bands (ev): -9.5460 -9.5460 -9.3473 -9.3473 -8.4003 -8.4003 -8.3864 -8.3864 -8.1342 -8.1341 -7.6262 -7.6262 -5.9197 -5.9197 -5.8677 -5.8677 -5.8060 -5.8060 -5.7920 -5.7920 -5.6221 -5.6221 -5.1699 -5.1699 1.0192 1.0192 1.6485 1.6485 4.6597 4.6597 5.8168 5.8168 5.9910 5.9910 6.2310 6.2310 7.5517 7.5517 8.1765 8.1765 11.5363 11.5363 11.9049 11.9049 13.4887 13.4887 14.4568 14.4568 k = 0.2768 0.2768-0.0000 ( 2888 PWs) bands (ev): -9.5510 -9.5510 -9.3449 -9.3449 -8.4027 -8.4027 -8.3883 -8.3883 -8.1486 -8.1486 -7.6212 -7.6212 -5.9242 -5.9242 -5.8686 -5.8686 -5.8101 -5.8101 -5.7941 -5.7941 -5.6316 -5.6316 -5.1585 -5.1585 1.0505 1.0505 1.7087 1.7087 4.6308 4.6308 5.8371 5.8371 5.9492 5.9492 6.1806 6.1806 7.5390 7.5390 8.2323 8.2323 11.6217 11.6217 11.9916 11.9916 13.4430 13.4430 14.4224 14.4224 k = 0.2679 0.2679-0.0000 ( 2888 PWs) bands (ev): -9.5561 -9.5561 -9.3428 -9.3428 -8.4050 -8.4050 -8.3903 -8.3903 -8.1626 -8.1626 -7.6163 -7.6162 -5.9287 -5.9287 -5.8694 -5.8694 -5.8141 -5.8141 -5.7963 -5.7963 -5.6407 -5.6407 -5.1470 -5.1470 1.0822 1.0822 1.7669 1.7669 4.6030 4.6030 5.8261 5.8261 5.9312 5.9312 6.1455 6.1455 7.5261 7.5261 8.2873 8.2873 11.7064 11.7064 12.0754 12.0754 13.3965 13.3965 14.3882 14.3882 k = 0.2589 0.2589-0.0000 ( 2890 PWs) bands (ev): -9.5614 -9.5614 -9.3408 -9.3408 -8.4073 -8.4073 -8.3923 -8.3923 -8.1763 -8.1763 -7.6113 -7.6113 -5.9332 -5.9332 -5.8703 -5.8703 -5.8181 -5.8181 -5.7985 -5.7985 -5.6494 -5.6494 -5.1357 -5.1357 1.1143 1.1143 1.8229 1.8229 4.5766 4.5766 5.7786 5.7786 5.9395 5.9395 6.1282 6.1282 7.5130 7.5130 8.3413 8.3413 11.7899 11.7899 12.1557 12.1557 13.3497 13.3497 14.3559 14.3559 k = 0.2500 0.2500-0.0000 ( 2894 PWs) bands (ev): -9.5668 -9.5668 -9.3391 -9.3391 -8.4096 -8.4096 -8.3942 -8.3942 -8.1896 -8.1896 -7.6065 -7.6065 -5.9377 -5.9377 -5.8711 -5.8711 -5.8220 -5.8220 -5.8008 -5.8008 -5.6575 -5.6575 -5.1244 -5.1244 1.1466 1.1466 1.8762 1.8762 4.5515 4.5515 5.7164 5.7165 5.9520 5.9520 6.1296 6.1296 7.4998 7.4998 8.3940 8.3940 11.8712 11.8713 12.2321 12.2321 13.3034 13.3034 14.3266 14.3266 k = 0.2411 0.2411-0.0000 ( 2888 PWs) bands (ev): -9.5723 -9.5723 -9.3376 -9.3376 -8.4119 -8.4119 -8.3962 -8.3962 -8.2024 -8.2024 -7.6016 -7.6016 -5.9422 -5.9422 -5.8719 -5.8719 -5.8257 -5.8257 -5.8031 -5.8031 -5.6651 -5.6651 -5.1133 -5.1133 1.1790 1.1790 1.9265 1.9265 4.5279 4.5279 5.6490 5.6490 5.9621 5.9621 6.1471 6.1471 7.4865 7.4865 8.4452 8.4452 11.9494 11.9494 12.3040 12.3040 13.2588 13.2588 14.3018 14.3018 k = 0.2321 0.2321-0.0000 ( 2898 PWs) bands (ev): -9.5779 -9.5779 -9.3363 -9.3363 -8.4141 -8.4141 -8.3982 -8.3982 -8.2148 -8.2148 -7.5968 -7.5968 -5.9466 -5.9466 -5.8727 -5.8727 -5.8293 -5.8293 -5.8056 -5.8056 -5.6722 -5.6722 -5.1023 -5.1023 1.2114 1.2114 1.9736 1.9736 4.5058 4.5058 5.5796 5.5796 5.9717 5.9717 6.1757 6.1757 7.4730 7.4730 8.4946 8.4946 12.0225 12.0225 12.3710 12.3710 13.2177 13.2177 14.2825 14.2825 k = 0.2232 0.2232-0.0000 ( 2898 PWs) bands (ev): -9.5836 -9.5836 -9.3352 -9.3352 -8.4163 -8.4163 -8.4002 -8.4002 -8.2267 -8.2267 -7.5921 -7.5921 -5.9509 -5.9509 -5.8735 -5.8735 -5.8327 -5.8327 -5.8081 -5.8081 -5.6788 -5.6788 -5.0915 -5.0915 1.2436 1.2436 2.0172 2.0172 4.4852 4.4852 5.5097 5.5098 5.9837 5.9837 6.2109 6.2109 7.4596 7.4596 8.5419 8.5419 12.0882 12.0882 12.4331 12.4331 13.1823 13.1823 14.2697 14.2697 k = 0.2143 0.2143-0.0000 ( 2885 PWs) bands (ev): -9.5895 -9.5895 -9.3343 -9.3343 -8.4183 -8.4183 -8.4021 -8.4021 -8.2381 -8.2381 -7.5874 -7.5874 -5.9551 -5.9551 -5.8742 -5.8742 -5.8359 -5.8359 -5.8108 -5.8108 -5.6849 -5.6849 -5.0809 -5.0809 1.2757 1.2757 2.0573 2.0573 4.4661 4.4661 5.4405 5.4405 5.9999 5.9999 6.2500 6.2500 7.4460 7.4460 8.5869 8.5869 12.1428 12.1428 12.4906 12.4906 13.1556 13.1556 14.2641 14.2641 k = 0.2054 0.2054-0.0000 ( 2889 PWs) bands (ev): -9.5954 -9.5954 -9.3336 -9.3335 -8.4203 -8.4203 -8.4041 -8.4041 -8.2490 -8.2490 -7.5827 -7.5827 -5.9592 -5.9592 -5.8750 -5.8750 -5.8390 -5.8390 -5.8136 -5.8136 -5.6905 -5.6905 -5.0705 -5.0705 1.3074 1.3074 2.0936 2.0936 4.4486 4.4486 5.3725 5.3725 6.0213 6.0213 6.2915 6.2915 7.4325 7.4325 8.6293 8.6293 12.1821 12.1821 12.5447 12.5447 13.1407 13.1407 14.2660 14.2660 k = 0.1964 0.1964-0.0000 ( 2893 PWs) bands (ev): -9.6015 -9.6015 -9.3330 -9.3330 -8.4222 -8.4222 -8.4060 -8.4060 -8.2594 -8.2594 -7.5781 -7.5781 -5.9633 -5.9633 -5.8757 -5.8757 -5.8418 -5.8418 -5.8165 -5.8165 -5.6956 -5.6956 -5.0603 -5.0603 1.3386 1.3386 2.1262 2.1262 4.4325 4.4325 5.3062 5.3062 6.0480 6.0480 6.3343 6.3343 7.4189 7.4189 8.6690 8.6690 12.2022 12.2022 12.5968 12.5968 13.1404 13.1404 14.2756 14.2756 k = 0.1875 0.1875-0.0000 ( 2883 PWs) bands (ev): -9.6075 -9.6075 -9.3326 -9.3326 -8.4239 -8.4239 -8.4079 -8.4079 -8.2694 -8.2694 -7.5736 -7.5736 -5.9672 -5.9672 -5.8764 -5.8764 -5.8444 -5.8444 -5.8195 -5.8195 -5.7002 -5.7002 -5.0504 -5.0504 1.3692 1.3692 2.1551 2.1551 4.4178 4.4178 5.2420 5.2420 6.0802 6.0802 6.3780 6.3780 7.4054 7.4054 8.7057 8.7057 12.2012 12.2012 12.6478 12.6478 13.1560 13.1560 14.2925 14.2925 k = 0.1786 0.1786-0.0000 ( 2875 PWs) bands (ev): -9.6136 -9.6136 -9.3323 -9.3323 -8.4255 -8.4255 -8.4097 -8.4097 -8.2788 -8.2788 -7.5691 -7.5691 -5.9709 -5.9709 -5.8771 -5.8771 -5.8468 -5.8468 -5.8225 -5.8225 -5.7044 -5.7044 -5.0408 -5.0408 1.3991 1.3991 2.1804 2.1804 4.4045 4.4045 5.1801 5.1801 6.1176 6.1176 6.4221 6.4221 7.3919 7.3919 8.7392 8.7392 12.1803 12.1803 12.6975 12.6975 13.1873 13.1873 14.3162 14.3162 k = 0.1696 0.1696-0.0000 ( 2873 PWs) bands (ev): -9.6197 -9.6197 -9.3321 -9.3321 -8.4269 -8.4269 -8.4115 -8.4115 -8.2877 -8.2877 -7.5648 -7.5648 -5.9746 -5.9746 -5.8778 -5.8778 -5.8489 -5.8489 -5.8257 -5.8257 -5.7082 -5.7082 -5.0316 -5.0316 1.4282 1.4282 2.2022 2.2022 4.3924 4.3924 5.1209 5.1209 6.1598 6.1598 6.4664 6.4664 7.3784 7.3784 8.7695 8.7695 12.1424 12.1424 12.7452 12.7452 13.2326 13.2326 14.3457 14.3457 k = 0.1607 0.1607-0.0000 ( 2873 PWs) bands (ev): -9.6258 -9.6258 -9.3321 -9.3321 -8.4282 -8.4282 -8.4132 -8.4132 -8.2962 -8.2962 -7.5605 -7.5605 -5.9781 -5.9781 -5.8784 -5.8784 -5.8509 -5.8509 -5.8288 -5.8288 -5.7116 -5.7116 -5.0226 -5.0226 1.4564 1.4564 2.2207 2.2207 4.3814 4.3814 5.0646 5.0646 6.2063 6.2063 6.5107 6.5107 7.3649 7.3649 8.7965 8.7965 12.0915 12.0915 12.7900 12.7900 13.2897 13.2897 14.3797 14.3797 k = 0.1518 0.1518-0.0000 ( 2877 PWs) bands (ev): -9.6318 -9.6318 -9.3321 -9.3321 -8.4294 -8.4294 -8.4149 -8.4149 -8.3042 -8.3042 -7.5563 -7.5563 -5.9815 -5.9815 -5.8791 -5.8791 -5.8526 -5.8526 -5.8320 -5.8320 -5.7146 -5.7146 -5.0141 -5.0141 1.4835 1.4835 2.2361 2.2361 4.3714 4.3714 5.0114 5.0114 6.2566 6.2566 6.5549 6.5549 7.3515 7.3515 8.8200 8.8200 12.0311 12.0311 12.8318 12.8318 13.3560 13.3560 14.4168 14.4168 k = 0.1429 0.1429-0.0000 ( 2877 PWs) bands (ev): -9.6378 -9.6378 -9.3322 -9.3322 -8.4303 -8.4303 -8.4165 -8.4165 -8.3118 -8.3118 -7.5523 -7.5523 -5.9847 -5.9847 -5.8797 -5.8797 -5.8541 -5.8541 -5.8352 -5.8352 -5.7173 -5.7173 -5.0059 -5.0059 1.5095 1.5095 2.2488 2.2488 4.3622 4.3622 4.9616 4.9616 6.3100 6.3100 6.5987 6.5987 7.3381 7.3381 8.8402 8.8402 11.9640 11.9640 12.8709 12.8709 13.4292 13.4292 14.4556 14.4556 k = 0.1339 0.1339-0.0000 ( 2883 PWs) bands (ev): -9.6436 -9.6436 -9.3324 -9.3324 -8.4311 -8.4311 -8.4180 -8.4180 -8.3189 -8.3189 -7.5484 -7.5484 -5.9878 -5.9878 -5.8802 -5.8802 -5.8554 -5.8554 -5.8383 -5.8383 -5.7198 -5.7198 -4.9981 -4.9981 1.5343 1.5343 2.2589 2.2589 4.3536 4.3536 4.9152 4.9153 6.3658 6.3658 6.6422 6.6422 7.3247 7.3247 8.8572 8.8572 11.8925 11.8925 12.9078 12.9078 13.5070 13.5070 14.4944 14.4945 k = 0.1250 0.1250-0.0000 ( 2879 PWs) bands (ev): -9.6492 -9.6492 -9.3326 -9.3326 -8.4318 -8.4318 -8.4195 -8.4195 -8.3256 -8.3256 -7.5447 -7.5447 -5.9906 -5.9906 -5.8807 -5.8807 -5.8565 -5.8565 -5.8413 -5.8413 -5.7219 -5.7219 -4.9907 -4.9907 1.5578 1.5578 2.2668 2.2668 4.3454 4.3454 4.8726 4.8726 6.4232 6.4232 6.6853 6.6853 7.3113 7.3113 8.8709 8.8709 11.8184 11.8184 12.9431 12.9431 13.5873 13.5873 14.5324 14.5324 k = 0.1161 0.1161-0.0000 ( 2883 PWs) bands (ev): -9.6547 -9.6547 -9.3329 -9.3329 -8.4322 -8.4322 -8.4209 -8.4209 -8.3318 -8.3318 -7.5412 -7.5412 -5.9934 -5.9934 -5.8811 -5.8811 -5.8575 -5.8575 -5.8443 -5.8443 -5.7239 -5.7239 -4.9838 -4.9838 1.5800 1.5800 2.2727 2.2727 4.3375 4.3375 4.8339 4.8339 6.4813 6.4813 6.7280 6.7280 7.2979 7.2979 8.8818 8.8818 11.7432 11.7432 12.9774 12.9774 13.6683 13.6683 14.5687 14.5687 k = 0.1071 0.1071-0.0000 ( 2883 PWs) bands (ev): -9.6599 -9.6599 -9.3332 -9.3332 -8.4325 -8.4325 -8.4222 -8.4222 -8.3376 -8.3376 -7.5378 -7.5378 -5.9959 -5.9959 -5.8815 -5.8815 -5.8584 -5.8584 -5.8471 -5.8471 -5.7256 -5.7256 -4.9773 -4.9773 1.6007 1.6007 2.2769 2.2769 4.3296 4.3296 4.7991 4.7991 6.5392 6.5392 6.7702 6.7702 7.2845 7.2845 8.8899 8.8899 11.6681 11.6681 13.0109 13.0109 13.7481 13.7481 14.6035 14.6035 k = 0.0982 0.0982-0.0000 ( 2881 PWs) bands (ev): -9.6649 -9.6649 -9.3335 -9.3335 -8.4327 -8.4327 -8.4234 -8.4234 -8.3431 -8.3431 -7.5346 -7.5346 -5.9983 -5.9983 -5.8818 -5.8818 -5.8593 -5.8593 -5.8496 -5.8496 -5.7271 -5.7271 -4.9713 -4.9713 1.6199 1.6199 2.2797 2.2797 4.3217 4.3217 4.7683 4.7683 6.5959 6.5959 6.8119 6.8119 7.2711 7.2711 8.8956 8.8956 11.5941 11.5941 13.0439 13.0439 13.8249 13.8249 14.6374 14.6374 k = 0.0893 0.0893-0.0000 ( 2887 PWs) bands (ev): -9.6695 -9.6695 -9.3338 -9.3338 -8.4327 -8.4327 -8.4245 -8.4245 -8.3481 -8.3481 -7.5317 -7.5317 -6.0005 -6.0005 -5.8820 -5.8820 -5.8601 -5.8601 -5.8520 -5.8520 -5.7284 -5.7284 -4.9657 -4.9657 1.6376 1.6376 2.2814 2.2814 4.3137 4.3137 4.7416 4.7416 6.6506 6.6506 6.8531 6.8531 7.2577 7.2577 8.8992 8.8992 11.5224 11.5224 13.0762 13.0762 13.8969 13.8969 14.6716 14.6716 k = 0.0804 0.0804-0.0000 ( 2885 PWs) bands (ev): -9.6738 -9.6738 -9.3341 -9.3341 -8.4326 -8.4326 -8.4255 -8.4255 -8.3527 -8.3527 -7.5290 -7.5290 -6.0025 -6.0025 -5.8821 -5.8821 -5.8612 -5.8612 -5.8539 -5.8539 -5.7296 -5.7296 -4.9606 -4.9606 1.6537 1.6537 2.2822 2.2822 4.3055 4.3055 4.7187 4.7187 6.7024 6.7024 6.8935 6.8935 7.2444 7.2444 8.9010 8.9010 11.4538 11.4538 13.1078 13.1078 13.9623 13.9623 14.7075 14.7075 k = 0.0714 0.0714-0.0000 ( 2881 PWs) bands (ev): -9.6778 -9.6778 -9.3344 -9.3344 -8.4324 -8.4324 -8.4265 -8.4265 -8.3569 -8.3569 -7.5265 -7.5265 -6.0043 -6.0043 -5.8821 -5.8821 -5.8624 -5.8624 -5.8554 -5.8554 -5.7306 -5.7306 -4.9561 -4.9561 1.6681 1.6681 2.2823 2.2823 4.2974 4.2974 4.6995 4.6995 6.7505 6.7505 6.9328 6.9328 7.2311 7.2311 8.9015 8.9015 11.3892 11.3892 13.1382 13.1382 14.0197 14.0197 14.7461 14.7461 k = 0.0625 0.0625-0.0000 ( 2889 PWs) bands (ev): -9.6814 -9.6813 -9.3347 -9.3347 -8.4321 -8.4321 -8.4273 -8.4273 -8.3607 -8.3607 -7.5243 -7.5243 -6.0059 -6.0059 -5.8820 -5.8820 -5.8639 -5.8639 -5.8564 -5.8564 -5.7315 -5.7315 -4.9520 -4.9520 1.6810 1.6810 2.2819 2.2819 4.2894 4.2894 4.6838 4.6838 6.7947 6.7947 6.9703 6.9703 7.2181 7.2181 8.9008 8.9008 11.3296 11.3296 13.1671 13.1671 14.0683 14.0683 14.7879 14.7879 k = 0.0536 0.0536-0.0000 ( 2889 PWs) bands (ev): -9.6845 -9.6845 -9.3349 -9.3349 -8.4317 -8.4317 -8.4280 -8.4280 -8.3640 -8.3640 -7.5224 -7.5224 -6.0073 -6.0073 -5.8818 -5.8818 -5.8655 -5.8655 -5.8571 -5.8571 -5.7323 -5.7323 -4.9485 -4.9485 1.6921 1.6921 2.2812 2.2812 4.2817 4.2817 4.6711 4.6711 6.8344 6.8344 7.0048 7.0048 7.2056 7.2056 8.8995 8.8995 11.2758 11.2758 13.1938 13.1938 14.1077 14.1077 14.8323 14.8323 k = 0.0446 0.0446-0.0000 ( 2885 PWs) bands (ev): -9.6872 -9.6872 -9.3351 -9.3351 -8.4314 -8.4314 -8.4286 -8.4286 -8.3669 -8.3669 -7.5207 -7.5207 -6.0085 -6.0085 -5.8815 -5.8815 -5.8671 -5.8671 -5.8576 -5.8576 -5.7329 -5.7329 -4.9455 -4.9455 1.7016 1.7016 2.2804 2.2804 4.2746 4.2746 4.6611 4.6611 6.8698 6.8698 7.0352 7.0352 7.1941 7.1941 8.8977 8.8977 11.2286 11.2286 13.2178 13.2178 14.1385 14.1385 14.8775 14.8775 k = 0.0357 0.0357-0.0000 ( 2881 PWs) bands (ev): -9.6894 -9.6894 -9.3353 -9.3353 -8.4310 -8.4310 -8.4291 -8.4291 -8.3693 -8.3693 -7.5194 -7.5194 -6.0094 -6.0094 -5.8811 -5.8811 -5.8686 -5.8686 -5.8578 -5.8578 -5.7334 -5.7334 -4.9430 -4.9430 1.7093 1.7093 2.2795 2.2795 4.2684 4.2684 4.6536 4.6536 6.9005 6.9005 7.0598 7.0598 7.1846 7.1846 8.8958 8.8958 11.1888 11.1888 13.2385 13.2385 14.1615 14.1615 14.9211 14.9211 k = 0.0268 0.0268-0.0000 ( 2869 PWs) bands (ev): -9.6912 -9.6912 -9.3354 -9.3354 -8.4307 -8.4307 -8.4295 -8.4295 -8.3712 -8.3712 -7.5183 -7.5183 -6.0102 -6.0102 -5.8807 -5.8807 -5.8699 -5.8699 -5.8580 -5.8580 -5.7338 -5.7338 -4.9411 -4.9411 1.7154 1.7154 2.2788 2.2788 4.2634 4.2634 4.6481 4.6481 6.9263 6.9263 7.0770 7.0770 7.1781 7.1781 8.8941 8.8941 11.1570 11.1570 13.2554 13.2554 14.1780 14.1780 14.9597 14.9597 k = 0.0179 0.0179-0.0000 ( 2873 PWs) bands (ev): -9.6925 -9.6925 -9.3355 -9.3355 -8.4304 -8.4304 -8.4298 -8.4298 -8.3726 -8.3726 -7.5175 -7.5175 -6.0108 -6.0108 -5.8803 -5.8803 -5.8710 -5.8710 -5.8581 -5.8581 -5.7341 -5.7341 -4.9397 -4.9397 1.7197 1.7197 2.2781 2.2781 4.2596 4.2596 4.6444 4.6444 6.9464 6.9464 7.0861 7.0861 7.1754 7.1754 8.8927 8.8927 11.1339 11.1339 13.2678 13.2678 14.1889 14.1889 14.9903 14.9903 k = 0.0089 0.0089-0.0000 ( 2877 PWs) bands (ev): -9.6932 -9.6932 -9.3356 -9.3356 -8.4302 -8.4302 -8.4300 -8.4300 -8.3735 -8.3735 -7.5171 -7.5171 -6.0111 -6.0111 -5.8800 -5.8800 -5.8717 -5.8717 -5.8582 -5.8582 -5.7343 -5.7343 -4.9389 -4.9389 1.7223 1.7223 2.2777 2.2777 4.2572 4.2572 4.6422 4.6422 6.9595 6.9595 7.0892 7.0892 7.1753 7.1753 8.8918 8.8918 11.1199 11.1199 13.2754 13.2754 14.1950 14.1950 15.0100 15.0100 k = 0.0000 0.0000 0.0000 ( 2873 PWs) bands (ev): -9.6935 -9.6935 -9.3356 -9.3356 -8.4302 -8.4302 -8.4300 -8.4300 -8.3738 -8.3738 -7.5169 -7.5169 -6.0112 -6.0112 -5.8799 -5.8799 -5.8720 -5.8720 -5.8582 -5.8582 -5.7343 -5.7343 -4.9386 -4.9386 1.7232 1.7232 2.2776 2.2776 4.2565 4.2565 4.6415 4.6415 6.9642 6.9642 7.0897 7.0897 7.1757 7.1757 8.8916 8.8916 11.1151 11.1151 13.2780 13.2780 14.1971 14.1971 15.0168 15.0168 k = 0.0000 0.0000 0.0000 ( 2873 PWs) bands (ev): -9.6935 -9.6935 -9.3356 -9.3356 -8.4302 -8.4302 -8.4300 -8.4300 -8.3738 -8.3738 -7.5169 -7.5169 -6.0112 -6.0112 -5.8799 -5.8799 -5.8720 -5.8720 -5.8582 -5.8582 -5.7343 -5.7343 -4.9386 -4.9386 1.7232 1.7232 2.2776 2.2776 4.2565 4.2565 4.6415 4.6415 6.9642 6.9642 7.0897 7.0897 7.1757 7.1757 8.8916 8.8916 11.1151 11.1151 13.2780 13.2780 14.1971 14.1971 15.0168 15.0168 k = 0.0000 0.0000 0.0124 ( 2877 PWs) bands (ev): -9.6934 -9.6934 -9.3356 -9.3356 -8.4301 -8.4301 -8.4300 -8.4300 -8.3738 -8.3738 -7.5170 -7.5170 -6.0111 -6.0111 -5.8799 -5.8799 -5.8720 -5.8720 -5.8582 -5.8582 -5.7344 -5.7344 -4.9386 -4.9386 1.7083 1.7083 2.2941 2.2941 4.2569 4.2569 4.6418 4.6418 6.9641 6.9641 7.0896 7.0896 7.1756 7.1756 8.8902 8.8902 11.1125 11.1125 13.2763 13.2763 14.1927 14.1927 15.0080 15.0080 k = 0.0000 0.0000 0.0248 ( 2885 PWs) bands (ev): -9.6933 -9.6933 -9.3355 -9.3355 -8.4300 -8.4300 -8.4300 -8.4300 -8.3738 -8.3738 -7.5172 -7.5172 -6.0109 -6.0109 -5.8799 -5.8799 -5.8720 -5.8720 -5.8581 -5.8581 -5.7348 -5.7348 -4.9386 -4.9386 1.6680 1.6680 2.3392 2.3392 4.2581 4.2581 4.6429 4.6429 6.9637 6.9637 7.0893 7.0893 7.1755 7.1755 8.8863 8.8863 11.1048 11.1048 13.2710 13.2710 14.1800 14.1800 14.9825 14.9825 k = 0.0000 0.0000 0.0373 ( 2885 PWs) bands (ev): -9.6930 -9.6930 -9.3354 -9.3354 -8.4298 -8.4298 -8.4298 -8.4298 -8.3739 -8.3739 -7.5175 -7.5175 -6.0105 -6.0105 -5.8798 -5.8798 -5.8719 -5.8719 -5.8581 -5.8581 -5.7354 -5.7354 -4.9385 -4.9385 1.6112 1.6112 2.4040 2.4040 4.2601 4.2601 4.6446 4.6446 6.9632 6.9632 7.0888 7.0888 7.1753 7.1753 8.8796 8.8796 11.0922 11.0922 13.2620 13.2620 14.1603 14.1603 14.9425 14.9425 k = 0.0000 0.0000 0.0497 ( 2869 PWs) bands (ev): -9.6926 -9.6926 -9.3352 -9.3352 -8.4297 -8.4297 -8.4295 -8.4295 -8.3740 -8.3740 -7.5180 -7.5180 -6.0100 -6.0100 -5.8798 -5.8798 -5.8719 -5.8719 -5.8579 -5.8579 -5.7362 -5.7362 -4.9384 -4.9384 1.5451 1.5451 2.4813 2.4813 4.2628 4.2628 4.6471 4.6471 6.9624 6.9624 7.0882 7.0882 7.1751 7.1751 8.8703 8.8703 11.0752 11.0752 13.2488 13.2488 14.1351 14.1351 14.8907 14.8907 k = 0.0000 0.0000 0.0621 ( 2869 PWs) bands (ev): -9.6922 -9.6922 -9.3350 -9.3350 -8.4295 -8.4295 -8.4290 -8.4290 -8.3742 -8.3742 -7.5185 -7.5185 -6.0093 -6.0093 -5.8797 -5.8797 -5.8718 -5.8718 -5.8578 -5.8578 -5.7373 -5.7373 -4.9382 -4.9382 1.4742 1.4742 2.5665 2.5665 4.2664 4.2664 4.6501 4.6501 6.9615 6.9615 7.0874 7.0874 7.1747 7.1747 8.8581 8.8581 11.0542 11.0542 13.2311 13.2311 14.1060 14.1060 14.8300 14.8300 k = 0.0000 0.0000 0.0745 ( 2869 PWs) bands (ev): -9.6916 -9.6916 -9.3347 -9.3347 -8.4293 -8.4293 -8.4286 -8.4286 -8.3744 -8.3744 -7.5192 -7.5192 -6.0084 -6.0084 -5.8796 -5.8796 -5.8717 -5.8717 -5.8576 -5.8576 -5.7385 -5.7385 -4.9380 -4.9380 1.4012 1.4012 2.6569 2.6569 4.2706 4.2706 4.6538 4.6538 6.9603 6.9603 7.0865 7.0865 7.1743 7.1743 8.8429 8.8429 11.0300 11.0300 13.2087 13.2087 14.0740 14.0740 14.7628 14.7628 k = 0.0000 0.0000 0.0869 ( 2893 PWs) bands (ev): -9.6909 -9.6909 -9.3344 -9.3344 -8.4290 -8.4290 -8.4280 -8.4280 -8.3746 -8.3746 -7.5201 -7.5201 -6.0075 -6.0075 -5.8795 -5.8795 -5.8716 -5.8716 -5.8575 -5.8575 -5.7400 -5.7400 -4.9378 -4.9378 1.3277 1.3277 2.7508 2.7508 4.2756 4.2756 4.6581 4.6581 6.9589 6.9589 7.0853 7.0853 7.1738 7.1738 8.8248 8.8248 11.0031 11.0031 13.1816 13.1816 14.0401 14.0401 14.6913 14.6913 k = 0.0000 0.0000 0.0993 ( 2901 PWs) bands (ev): -9.6902 -9.6902 -9.3341 -9.3341 -8.4287 -8.4287 -8.4273 -8.4273 -8.3748 -8.3748 -7.5210 -7.5210 -6.0064 -6.0064 -5.8794 -5.8794 -5.8715 -5.8715 -5.8573 -5.8573 -5.7418 -5.7418 -4.9376 -4.9376 1.2547 1.2547 2.8473 2.8473 4.2812 4.2812 4.6629 4.6629 6.9573 6.9573 7.0840 7.0840 7.1733 7.1733 8.8035 8.8035 10.9744 10.9744 13.1499 13.1499 14.0043 14.0043 14.6171 14.6171 k = 0.0000 0.0000 0.1118 ( 2905 PWs) bands (ev): -9.6894 -9.6894 -9.3337 -9.3337 -8.4284 -8.4284 -8.4266 -8.4266 -8.3751 -8.3751 -7.5220 -7.5220 -6.0052 -6.0052 -5.8792 -5.8792 -5.8713 -5.8713 -5.8570 -5.8570 -5.7437 -5.7437 -4.9373 -4.9373 1.1828 1.1828 2.9455 2.9455 4.2874 4.2874 4.6683 4.6683 6.9555 6.9555 7.0826 7.0826 7.1727 7.1727 8.7789 8.7789 10.9446 10.9446 13.1142 13.1142 13.9666 13.9666 14.5415 14.5415 k = 0.0000 0.0000 0.1242 ( 2889 PWs) bands (ev): -9.6885 -9.6885 -9.3333 -9.3333 -8.4281 -8.4281 -8.4258 -8.4258 -8.3755 -8.3755 -7.5231 -7.5231 -6.0039 -6.0039 -5.8790 -5.8790 -5.8712 -5.8712 -5.8568 -5.8568 -5.7458 -5.7458 -4.9370 -4.9370 1.1124 1.1124 3.0449 3.0449 4.2942 4.2942 4.6741 4.6741 6.9535 6.9535 7.0811 7.0811 7.1720 7.1720 8.7511 8.7511 10.9143 10.9143 13.0750 13.0750 13.9266 13.9266 14.4655 14.4655 k = 0.0000 0.0000 0.1366 ( 2889 PWs) bands (ev): -9.6876 -9.6876 -9.3328 -9.3328 -8.4277 -8.4277 -8.4249 -8.4249 -8.3758 -8.3758 -7.5242 -7.5242 -6.0024 -6.0024 -5.8788 -5.8788 -5.8710 -5.8710 -5.8565 -5.8565 -5.7480 -5.7480 -4.9367 -4.9367 1.0440 1.0440 3.1450 3.1450 4.3015 4.3015 4.6804 4.6804 6.9513 6.9513 7.0795 7.0795 7.1713 7.1713 8.7199 8.7199 10.8842 10.8842 13.0332 13.0332 13.8837 13.8837 14.3898 14.3898 k = 0.0000 0.0000 0.1490 ( 2877 PWs) bands (ev): -9.6866 -9.6866 -9.3323 -9.3323 -8.4273 -8.4273 -8.4239 -8.4239 -8.3762 -8.3762 -7.5255 -7.5255 -6.0009 -6.0009 -5.8785 -5.8785 -5.8709 -5.8709 -5.8562 -5.8562 -5.7505 -5.7505 -4.9364 -4.9364 0.9777 0.9777 3.2455 3.2455 4.3092 4.3092 4.6870 4.6870 6.9489 6.9489 7.0778 7.0778 7.1705 7.1705 8.6853 8.6853 10.8549 10.8549 12.9896 12.9896 13.8377 13.8377 14.3151 14.3151 k = 0.0000 0.0000 0.1614 ( 2881 PWs) bands (ev): -9.6856 -9.6856 -9.3318 -9.3318 -8.4269 -8.4269 -8.4229 -8.4229 -8.3767 -8.3767 -7.5267 -7.5267 -5.9993 -5.9993 -5.8782 -5.8782 -5.8707 -5.8707 -5.8559 -5.8559 -5.7531 -5.7531 -4.9361 -4.9361 0.9138 0.9138 3.3460 3.3460 4.3173 4.3173 4.6939 4.6939 6.9464 6.9464 7.0760 7.0760 7.1697 7.1697 8.6475 8.6475 10.8269 10.8269 12.9451 12.9451 13.7884 13.7884 14.2420 14.2420 k = 0.0000 0.0000 0.1738 ( 2877 PWs) bands (ev): -9.6845 -9.6845 -9.3313 -9.3313 -8.4264 -8.4264 -8.4218 -8.4218 -8.3772 -8.3772 -7.5281 -7.5281 -5.9976 -5.9976 -5.8778 -5.8778 -5.8705 -5.8705 -5.8556 -5.8556 -5.7558 -5.7558 -4.9357 -4.9357 0.8524 0.8524 3.4461 3.4461 4.3258 4.3258 4.7011 4.7011 6.9436 6.9436 7.0742 7.0742 7.1688 7.1688 8.6065 8.6065 10.8005 10.8005 12.9003 12.9003 13.7357 13.7357 14.1708 14.1708 k = 0.0000 0.0000 0.1863 ( 2869 PWs) bands (ev): -9.6834 -9.6834 -9.3308 -9.3308 -8.4260 -8.4260 -8.4207 -8.4207 -8.3777 -8.3777 -7.5294 -7.5294 -5.9959 -5.9959 -5.8773 -5.8773 -5.8703 -5.8703 -5.8553 -5.8553 -5.7587 -5.7587 -4.9354 -4.9354 0.7937 0.7937 3.5455 3.5455 4.3345 4.3345 4.7084 4.7084 6.9407 6.9407 7.0724 7.0724 7.1679 7.1679 8.5625 8.5625 10.7762 10.7762 12.8560 12.8560 13.6800 13.6800 14.1019 14.1019 k = 0.0000 0.0000 0.1987 ( 2869 PWs) bands (ev): -9.6823 -9.6823 -9.3303 -9.3303 -8.4255 -8.4255 -8.4195 -8.4195 -8.3783 -8.3783 -7.5308 -7.5308 -5.9941 -5.9941 -5.8769 -5.8769 -5.8701 -5.8701 -5.8550 -5.8550 -5.7617 -5.7617 -4.9350 -4.9350 0.7377 0.7377 3.6437 3.6437 4.3434 4.3434 4.7158 4.7158 6.9377 6.9377 7.0705 7.0705 7.1669 7.1669 8.5158 8.5158 10.7540 10.7540 12.8129 12.8129 13.6217 13.6217 14.0357 14.0357 k = 0.0000 0.0000 0.2111 ( 2893 PWs) bands (ev): -9.6812 -9.6812 -9.3298 -9.3298 -8.4251 -8.4251 -8.4183 -8.4183 -8.3789 -8.3789 -7.5322 -7.5322 -5.9924 -5.9924 -5.8763 -5.8763 -5.8700 -5.8700 -5.8546 -5.8546 -5.7647 -5.7647 -4.9347 -4.9347 0.6847 0.6847 3.7404 3.7404 4.3525 4.3525 4.7232 4.7232 6.9345 6.9345 7.0687 7.0687 7.1660 7.1660 8.4668 8.4668 10.7343 10.7343 12.7715 12.7715 13.5614 13.5614 13.9723 13.9723 k = 0.0000 0.0000 0.2235 ( 2893 PWs) bands (ev): -9.6802 -9.6802 -9.3293 -9.3293 -8.4246 -8.4246 -8.4171 -8.4171 -8.3795 -8.3795 -7.5335 -7.5335 -5.9906 -5.9906 -5.8757 -5.8757 -5.8698 -5.8698 -5.8543 -5.8543 -5.7679 -5.7679 -4.9344 -4.9344 0.6347 0.6347 3.8351 3.8351 4.3617 4.3617 4.7306 4.7306 6.9312 6.9312 7.0668 7.0668 7.1650 7.1650 8.4159 8.4159 10.7169 10.7169 12.7323 12.7323 13.4997 13.4997 13.9121 13.9121 k = 0.0000 0.0000 0.2359 ( 2892 PWs) bands (ev): -9.6791 -9.6791 -9.3288 -9.3288 -8.4242 -8.4242 -8.4158 -8.4158 -8.3802 -8.3802 -7.5348 -7.5348 -5.9888 -5.9888 -5.8750 -5.8750 -5.8696 -5.8696 -5.8540 -5.8540 -5.7710 -5.7710 -4.9340 -4.9340 0.5877 0.5877 3.9273 3.9273 4.3710 4.3710 4.7379 4.7379 6.9277 6.9277 7.0650 7.0650 7.1641 7.1641 8.3637 8.3637 10.7018 10.7018 12.6957 12.6957 13.4374 13.4374 13.8553 13.8553 k = 0.0000 0.0000 0.2483 ( 2900 PWs) bands (ev): -9.6781 -9.6781 -9.3283 -9.3283 -8.4238 -8.4238 -8.4145 -8.4145 -8.3809 -8.3809 -7.5361 -7.5361 -5.9871 -5.9871 -5.8742 -5.8742 -5.8694 -5.8694 -5.8537 -5.8537 -5.7742 -5.7742 -4.9337 -4.9337 0.5439 0.5439 4.0162 4.0162 4.3805 4.3805 4.7450 4.7450 6.9242 6.9242 7.0633 7.0633 7.1631 7.1631 8.3107 8.3107 10.6891 10.6891 12.6621 12.6621 13.3751 13.3751 13.8019 13.8019 k = 0.0000 0.0000 0.2608 ( 2896 PWs) bands (ev): -9.6771 -9.6771 -9.3278 -9.3278 -8.4234 -8.4234 -8.4132 -8.4132 -8.3817 -8.3817 -7.5374 -7.5374 -5.9854 -5.9854 -5.8734 -5.8734 -5.8693 -5.8693 -5.8534 -5.8534 -5.7773 -5.7773 -4.9334 -4.9334 0.5034 0.5034 4.1012 4.1012 4.3903 4.3903 4.7519 4.7519 6.9206 6.9206 7.0616 7.0616 7.1622 7.1622 8.2575 8.2575 10.6784 10.6784 12.6317 12.6317 13.3137 13.3137 13.7523 13.7523 k = 0.0000 0.0000 0.2732 ( 2900 PWs) bands (ev): -9.6761 -9.6761 -9.3273 -9.3273 -8.4230 -8.4230 -8.4119 -8.4119 -8.3825 -8.3825 -7.5386 -7.5386 -5.9838 -5.9838 -5.8725 -5.8725 -5.8691 -5.8691 -5.8531 -5.8531 -5.7804 -5.7804 -4.9331 -4.9331 0.4662 0.4662 4.1811 4.1811 4.4009 4.4009 4.7584 4.7584 6.9170 6.9170 7.0600 7.0600 7.1613 7.1613 8.2050 8.2050 10.6698 10.6698 12.6048 12.6048 13.2537 13.2537 13.7065 13.7065 k = 0.0000 0.0000 0.2856 ( 2900 PWs) bands (ev): -9.6753 -9.6753 -9.3269 -9.3269 -8.4226 -8.4226 -8.4106 -8.4106 -8.3833 -8.3833 -7.5397 -7.5397 -5.9822 -5.9822 -5.8716 -5.8716 -5.8689 -5.8689 -5.8528 -5.8528 -5.7835 -5.7835 -4.9328 -4.9328 0.4323 0.4323 4.2540 4.2540 4.4136 4.4136 4.7645 4.7645 6.9133 6.9133 7.0586 7.0586 7.1604 7.1604 8.1538 8.1538 10.6628 10.6628 12.5815 12.5815 13.1960 13.1960 13.6647 13.6647 k = 0.0000 0.0000 0.2980 ( 2900 PWs) bands (ev): -9.6744 -9.6744 -9.3265 -9.3265 -8.4222 -8.4222 -8.4093 -8.4093 -8.3841 -8.3841 -7.5407 -7.5407 -5.9808 -5.9808 -5.8706 -5.8706 -5.8688 -5.8688 -5.8525 -5.8525 -5.7864 -5.7864 -4.9325 -4.9325 0.4019 0.4019 4.3160 4.3160 4.4313 4.4313 4.7702 4.7702 6.9097 6.9097 7.0572 7.0572 7.1596 7.1596 8.1049 8.1049 10.6574 10.6574 12.5618 12.5618 13.1412 13.1412 13.6270 13.6270 k = 0.0000 0.0000 0.3104 ( 2908 PWs) bands (ev): -9.6737 -9.6737 -9.3262 -9.3262 -8.4219 -8.4219 -8.4081 -8.4081 -8.3849 -8.3849 -7.5416 -7.5416 -5.9795 -5.9795 -5.8697 -5.8697 -5.8687 -5.8687 -5.8523 -5.8523 -5.7891 -5.7891 -4.9323 -4.9323 0.3749 0.3749 4.3604 4.3604 4.4601 4.4601 4.7754 4.7754 6.9062 6.9062 7.0560 7.0560 7.1589 7.1589 8.0590 8.0590 10.6532 10.6532 12.5457 12.5457 13.0899 13.0899 13.5934 13.5934 k = 0.0000 0.0000 0.3228 ( 2900 PWs) bands (ev): -9.6731 -9.6731 -9.3259 -9.3259 -8.4217 -8.4217 -8.4069 -8.4069 -8.3858 -8.3858 -7.5425 -7.5425 -5.9784 -5.9784 -5.8687 -5.8687 -5.8685 -5.8685 -5.8521 -5.8521 -5.7916 -5.7916 -4.9321 -4.9321 0.3514 0.3514 4.3854 4.3854 4.5007 4.5007 4.7800 4.7800 6.9029 6.9029 7.0549 7.0549 7.1582 7.1582 8.0170 8.0170 10.6501 10.6501 12.5331 12.5331 13.0430 13.0430 13.5642 13.5642 k = 0.0000 0.0000 0.3353 ( 2900 PWs) bands (ev): -9.6725 -9.6725 -9.3256 -9.3256 -8.4214 -8.4214 -8.4057 -8.4057 -8.3866 -8.3866 -7.5432 -7.5432 -5.9774 -5.9774 -5.8684 -5.8684 -5.8678 -5.8678 -5.8519 -5.8519 -5.7939 -5.7939 -4.9319 -4.9319 0.3315 0.3315 4.3989 4.3989 4.5446 4.5446 4.7839 4.7839 6.8998 6.8998 7.0539 7.0539 7.1577 7.1577 7.9797 7.9797 10.6479 10.6479 12.5237 12.5237 13.0012 13.0012 13.5393 13.5393 k = 0.0000 0.0000 0.3477 ( 2900 PWs) bands (ev): -9.6720 -9.6720 -9.3254 -9.3254 -8.4212 -8.4212 -8.4047 -8.4047 -8.3873 -8.3873 -7.5438 -7.5438 -5.9765 -5.9765 -5.8684 -5.8684 -5.8670 -5.8670 -5.8518 -5.8518 -5.7958 -5.7958 -4.9318 -4.9318 0.3152 0.3152 4.4072 4.4072 4.5847 4.5847 4.7872 4.7872 6.8971 6.8971 7.0531 7.0531 7.1572 7.1572 7.9479 7.9479 10.6464 10.6464 12.5172 12.5172 12.9653 12.9653 13.5188 13.5188 k = 0.0000 0.0000 0.3601 ( 2900 PWs) bands (ev): -9.6717 -9.6717 -9.3252 -9.3252 -8.4211 -8.4211 -8.4039 -8.4039 -8.3880 -8.3880 -7.5442 -7.5442 -5.9759 -5.9759 -5.8683 -5.8683 -5.8663 -5.8663 -5.8516 -5.8516 -5.7974 -5.7974 -4.9316 -4.9316 0.3025 0.3025 4.4126 4.4126 4.6178 4.6178 4.7898 4.7898 6.8948 6.8948 7.0525 7.0525 7.1568 7.1568 7.9224 7.9224 10.6454 10.6454 12.5130 12.5130 12.9361 12.9361 13.5029 13.5029 k = 0.0000 0.0000 0.3725 ( 2900 PWs) bands (ev): -9.6714 -9.6714 -9.3251 -9.3251 -8.4209 -8.4209 -8.4032 -8.4032 -8.3885 -8.3885 -7.5446 -7.5446 -5.9754 -5.9754 -5.8682 -5.8682 -5.8658 -5.8658 -5.8516 -5.8516 -5.7986 -5.7986 -4.9316 -4.9316 0.2934 0.2934 4.4162 4.4162 4.6423 4.6423 4.7917 4.7917 6.8931 6.8931 7.0521 7.0521 7.1565 7.1565 7.9037 7.9037 10.6447 10.6447 12.5106 12.5106 12.9145 12.9145 13.4915 13.4915 k = 0.0000 0.0000 0.3849 ( 2908 PWs) bands (ev): -9.6712 -9.6712 -9.3250 -9.3250 -8.4209 -8.4209 -8.4028 -8.4028 -8.3888 -8.3888 -7.5448 -7.5448 -5.9751 -5.9751 -5.8682 -5.8682 -5.8655 -5.8655 -5.8515 -5.8515 -5.7993 -5.7993 -4.9315 -4.9315 0.2879 0.2879 4.4182 4.4182 4.6573 4.6573 4.7929 4.7929 6.8920 6.8920 7.0518 7.0518 7.1563 7.1563 7.8923 7.8923 10.6444 10.6444 12.5095 12.5095 12.9011 12.9011 13.4846 13.4846 k = 0.0000 0.0000 0.3973 ( 2900 PWs) bands (ev): -9.6712 -9.6712 -9.3250 -9.3250 -8.4209 -8.4209 -8.4026 -8.4026 -8.3889 -8.3889 -7.5448 -7.5448 -5.9750 -5.9750 -5.8682 -5.8682 -5.8654 -5.8654 -5.8515 -5.8515 -5.7996 -5.7996 -4.9315 -4.9315 0.2861 0.2861 4.4188 4.4188 4.6624 4.6624 4.7933 4.7933 6.8917 6.8917 7.0517 7.0517 7.1563 7.1563 7.8885 7.8885 10.6443 10.6443 12.5091 12.5091 12.8966 12.8966 13.4823 13.4823 k = 0.0000 0.0000 0.3973 ( 2900 PWs) bands (ev): -9.6712 -9.6712 -9.3250 -9.3250 -8.4209 -8.4209 -8.4026 -8.4026 -8.3889 -8.3889 -7.5448 -7.5448 -5.9750 -5.9750 -5.8682 -5.8682 -5.8654 -5.8654 -5.8515 -5.8515 -5.7996 -5.7996 -4.9315 -4.9315 0.2861 0.2861 4.4188 4.4188 4.6624 4.6624 4.7933 4.7933 6.8917 6.8917 7.0517 7.0517 7.1563 7.1563 7.8885 7.8885 10.6443 10.6443 12.5091 12.5091 12.8966 12.8966 13.4823 13.4823 k = 0.0000 0.0125 0.3973 ( 2900 PWs) bands (ev): -9.6710 -9.6710 -9.3249 -9.3249 -8.4208 -8.4208 -8.4030 -8.4030 -8.3883 -8.3883 -7.5449 -7.5449 -5.9749 -5.9749 -5.8696 -5.8696 -5.8639 -5.8639 -5.8516 -5.8516 -5.7992 -5.7992 -4.9317 -4.9317 0.2869 0.2869 4.4187 4.4187 4.6574 4.6574 4.7930 4.7930 6.8900 6.8900 7.0512 7.0512 7.1596 7.1596 7.8886 7.8886 10.6474 10.6474 12.4916 12.4916 12.9024 12.9024 13.4964 13.4964 k = 0.0000 0.0250 0.3973 ( 2900 PWs) bands (ev): -9.6705 -9.6705 -9.3249 -9.3249 -8.4208 -8.4208 -8.4040 -8.4040 -8.3867 -8.3867 -7.5449 -7.5449 -5.9748 -5.9748 -5.8718 -5.8718 -5.8616 -5.8616 -5.8520 -5.8520 -5.7980 -5.7980 -4.9325 -4.9325 0.2892 0.2892 4.4183 4.4183 4.6425 4.6425 4.7921 4.7921 6.8851 6.8851 7.0493 7.0493 7.1696 7.1696 7.8888 7.8888 10.6567 10.6567 12.4440 12.4440 12.9168 12.9168 13.5368 13.5368 k = 0.0000 0.0375 0.3973 ( 2892 PWs) bands (ev): -9.6696 -9.6696 -9.3248 -9.3248 -8.4207 -8.4207 -8.4053 -8.4053 -8.3842 -8.3842 -7.5451 -7.5451 -5.9745 -5.9745 -5.8740 -5.8740 -5.8596 -5.8596 -5.8523 -5.8523 -5.7962 -5.7962 -4.9338 -4.9338 0.2931 0.2931 4.4175 4.4175 4.6180 4.6180 4.7909 4.7909 6.8775 6.8775 7.0458 7.0458 7.1857 7.1857 7.8892 7.8892 10.6720 10.6720 12.3761 12.3761 12.9353 12.9353 13.5984 13.5984 k = 0.0000 0.0500 0.3973 ( 2896 PWs) bands (ev): -9.6683 -9.6683 -9.3246 -9.3246 -8.4207 -8.4207 -8.4068 -8.4068 -8.3812 -8.3812 -7.5453 -7.5453 -5.9741 -5.9741 -5.8761 -5.8761 -5.8586 -5.8586 -5.8516 -5.8516 -5.7938 -5.7938 -4.9356 -4.9356 0.2986 0.2986 4.4162 4.4162 4.5844 4.5844 4.7895 4.7895 6.8676 6.8676 7.0402 7.0402 7.2073 7.2073 7.8897 7.8897 10.6929 10.6929 12.2964 12.2964 12.9555 12.9555 13.6752 13.6752 k = 0.0000 0.0625 0.3973 ( 2888 PWs) bands (ev): -9.6667 -9.6667 -9.3245 -9.3245 -8.4206 -8.4206 -8.4082 -8.4082 -8.3776 -8.3776 -7.5456 -7.5456 -5.9735 -5.9735 -5.8781 -5.8781 -5.8589 -5.8589 -5.8497 -5.8497 -5.7908 -5.7908 -4.9379 -4.9379 0.3057 0.3057 4.4141 4.4141 4.5425 4.5425 4.7883 4.7883 6.8558 6.8558 7.0326 7.0326 7.2334 7.2334 7.8903 7.8903 10.7190 10.7190 12.2112 12.2112 12.9769 12.9769 13.7619 13.7619 k = 0.0000 0.0750 0.3973 ( 2890 PWs) bands (ev): -9.6648 -9.6648 -9.3243 -9.3243 -8.4205 -8.4205 -8.4096 -8.4096 -8.3736 -8.3736 -7.5460 -7.5460 -5.9729 -5.9729 -5.8800 -5.8800 -5.8599 -5.8599 -5.8470 -5.8470 -5.7873 -5.7873 -4.9407 -4.9407 0.3143 0.3143 4.4104 4.4104 4.4935 4.4935 4.7877 4.7877 6.8424 6.8424 7.0229 7.0229 7.2630 7.2630 7.8910 7.8910 10.7496 10.7496 12.1247 12.1247 12.9998 12.9998 13.8545 13.8545 k = 0.0000 0.0875 0.3973 ( 2896 PWs) bands (ev): -9.6625 -9.6625 -9.3242 -9.3242 -8.4204 -8.4204 -8.4110 -8.4110 -8.3691 -8.3691 -7.5466 -7.5466 -5.9722 -5.9722 -5.8819 -5.8819 -5.8611 -5.8611 -5.8440 -5.8440 -5.7835 -5.7835 -4.9441 -4.9441 0.3244 0.3244 4.4010 4.4010 4.4422 4.4422 4.7880 4.7880 6.8273 6.8273 7.0111 7.0111 7.2953 7.2953 7.8918 7.8918 10.7839 10.7839 12.0401 12.0401 13.0246 13.0246 13.9501 13.9501 k = 0.0000 0.1000 0.3973 ( 2898 PWs) bands (ev): -9.6599 -9.6599 -9.3242 -9.3242 -8.4203 -8.4203 -8.4122 -8.4122 -8.3641 -8.3641 -7.5474 -7.5474 -5.9713 -5.9713 -5.8838 -5.8838 -5.8622 -5.8622 -5.8408 -5.8408 -5.7792 -5.7792 -4.9481 -4.9481 0.3361 0.3361 4.3604 4.3604 4.4148 4.4148 4.7896 4.7896 6.8105 6.8105 6.9973 6.9973 7.3293 7.3293 7.8926 7.8926 10.8206 10.8206 11.9602 11.9602 13.0516 13.0516 14.0466 14.0466 k = 0.0000 0.1125 0.3973 ( 2894 PWs) bands (ev): -9.6570 -9.6570 -9.3243 -9.3243 -8.4202 -8.4202 -8.4133 -8.4133 -8.3585 -8.3585 -7.5483 -7.5483 -5.9704 -5.9704 -5.8857 -5.8857 -5.8630 -5.8630 -5.8376 -5.8376 -5.7747 -5.7747 -4.9526 -4.9526 0.3493 0.3493 4.2942 4.2942 4.4064 4.4064 4.7929 4.7929 6.7918 6.7918 6.9815 6.9815 7.3643 7.3643 7.8935 7.8935 10.8584 10.8584 11.8875 11.8875 13.0812 13.0812 14.1425 14.1425 k = 0.0000 0.1250 0.3973 ( 2890 PWs) bands (ev): -9.6538 -9.6538 -9.3244 -9.3244 -8.4201 -8.4201 -8.4143 -8.4143 -8.3524 -8.3524 -7.5496 -7.5496 -5.9694 -5.9694 -5.8877 -5.8877 -5.8635 -5.8635 -5.8343 -5.8343 -5.7698 -5.7698 -4.9578 -4.9578 0.3639 0.3639 4.2202 4.2202 4.3998 4.3998 4.7981 4.7981 6.7712 6.7712 6.9637 6.9637 7.3996 7.3996 7.8943 7.8943 10.8954 10.8954 11.8246 11.8246 13.1133 13.1133 14.2365 14.2365 k = 0.0000 0.1375 0.3973 ( 2894 PWs) bands (ev): -9.6503 -9.6503 -9.3248 -9.3248 -8.4201 -8.4201 -8.4151 -8.4151 -8.3456 -8.3456 -7.5511 -7.5511 -5.9683 -5.9683 -5.8899 -5.8899 -5.8634 -5.8634 -5.8310 -5.8310 -5.7647 -5.7647 -4.9635 -4.9635 0.3801 0.3801 4.1412 4.1412 4.3931 4.3931 4.8055 4.8055 6.7484 6.7484 6.9440 6.9440 7.4346 7.4346 7.8951 7.8951 10.9293 10.9293 11.7742 11.7742 13.1481 13.1481 14.3278 14.3278 k = 0.0000 0.1500 0.3973 ( 2898 PWs) bands (ev): -9.6464 -9.6464 -9.3253 -9.3253 -8.4202 -8.4202 -8.4158 -8.4158 -8.3382 -8.3382 -7.5529 -7.5529 -5.9671 -5.9671 -5.8921 -5.8921 -5.8629 -5.8629 -5.8277 -5.8277 -5.7592 -5.7592 -4.9699 -4.9699 0.3978 0.3978 4.0581 4.0581 4.3862 4.3862 4.8152 4.8152 6.7232 6.7232 6.9224 6.9224 7.4688 7.4688 7.8959 7.8959 10.9578 10.9578 11.7389 11.7389 13.1857 13.1857 14.4156 14.4156 k = 0.0000 0.1625 0.3973 ( 2900 PWs) bands (ev): -9.6423 -9.6423 -9.3260 -9.3260 -8.4203 -8.4203 -8.4164 -8.4164 -8.3300 -8.3300 -7.5552 -7.5552 -5.9659 -5.9659 -5.8944 -5.8944 -5.8618 -5.8618 -5.8244 -5.8244 -5.7535 -5.7535 -4.9769 -4.9769 0.4170 0.4170 3.9717 3.9717 4.3791 4.3791 4.8273 4.8273 6.6955 6.6955 6.8988 6.8988 7.5016 7.5016 7.8965 7.8965 10.9788 10.9788 11.7208 11.7208 13.2260 13.2260 14.4992 14.4992 k = 0.0000 0.1750 0.3973 ( 2894 PWs) bands (ev): -9.6379 -9.6379 -9.3270 -9.3270 -8.4206 -8.4206 -8.4168 -8.4168 -8.3211 -8.3211 -7.5579 -7.5579 -5.9648 -5.9648 -5.8968 -5.8968 -5.8601 -5.8601 -5.8211 -5.8211 -5.7474 -5.7474 -4.9846 -4.9846 0.4377 0.4377 3.8825 3.8825 4.3723 4.3723 4.8417 4.8417 6.6652 6.6652 6.8733 6.8733 7.5329 7.5329 7.8971 7.8971 10.9914 10.9914 11.7209 11.7209 13.2689 13.2689 14.5780 14.5780 k = 0.0000 0.1875 0.3973 ( 2898 PWs) bands (ev): -9.6333 -9.6333 -9.3283 -9.3283 -8.4209 -8.4209 -8.4170 -8.4170 -8.3114 -8.3114 -7.5610 -7.5610 -5.9636 -5.9636 -5.8993 -5.8993 -5.8578 -5.8578 -5.8179 -5.8179 -5.7411 -5.7411 -4.9930 -4.9930 0.4598 0.4598 3.7909 3.7909 4.3659 4.3659 4.8583 4.8583 6.6319 6.6319 6.8458 6.8458 7.5623 7.5623 7.8976 7.8976 10.9962 10.9962 11.7382 11.7382 13.3144 13.3144 14.6513 14.6513 k = 0.0000 0.2000 0.3973 ( 2890 PWs) bands (ev): -9.6284 -9.6284 -9.3299 -9.3299 -8.4213 -8.4213 -8.4172 -8.4172 -8.3009 -8.3009 -7.5646 -7.5646 -5.9625 -5.9625 -5.9018 -5.9018 -5.8551 -5.8551 -5.8148 -5.8148 -5.7344 -5.7344 -5.0021 -5.0021 0.4834 0.4834 3.6975 3.6975 4.3605 4.3605 4.8772 4.8772 6.5957 6.5957 6.8165 6.8165 7.5896 7.5896 7.8980 7.8980 10.9954 10.9954 11.7701 11.7701 13.3624 13.3624 14.7184 14.7184 k = 0.0000 0.2125 0.3973 ( 2890 PWs) bands (ev): -9.6232 -9.6232 -9.3318 -9.3318 -8.4217 -8.4217 -8.4174 -8.4174 -8.2895 -8.2895 -7.5689 -7.5689 -5.9614 -5.9614 -5.9043 -5.9043 -5.8518 -5.8518 -5.8117 -5.8117 -5.7273 -5.7273 -5.0118 -5.0118 0.5085 0.5085 3.6026 3.6026 4.3563 4.3563 4.8982 4.8982 6.5564 6.5564 6.7853 6.7853 7.6147 7.6147 7.8982 7.8982 10.9918 10.9918 11.8134 11.8134 13.4126 13.4126 14.7787 14.7787 k = 0.0000 0.2250 0.3973 ( 2886 PWs) bands (ev): -9.6179 -9.6179 -9.3340 -9.3340 -8.4221 -8.4221 -8.4175 -8.4175 -8.2773 -8.2773 -7.5737 -7.5737 -5.9604 -5.9604 -5.9068 -5.9068 -5.8480 -5.8480 -5.8086 -5.8086 -5.7198 -5.7198 -5.0223 -5.0223 0.5351 0.5351 3.5066 3.5066 4.3537 4.3537 4.9211 4.9211 6.5139 6.5139 6.7524 6.7524 7.6376 7.6376 7.8984 7.8984 10.9882 10.9882 11.8645 11.8645 13.4650 13.4650 14.8317 14.8317 k = 0.0000 0.2375 0.3973 ( 2878 PWs) bands (ev): -9.6123 -9.6123 -9.3366 -9.3366 -8.4225 -8.4225 -8.4175 -8.4175 -8.2643 -8.2643 -7.5791 -7.5791 -5.9595 -5.9595 -5.9093 -5.9093 -5.8438 -5.8438 -5.8056 -5.8056 -5.7118 -5.7118 -5.0335 -5.0335 0.5632 0.5632 3.4098 3.4098 4.3530 4.3530 4.9460 4.9460 6.4682 6.4682 6.7177 6.7177 7.6584 7.6584 7.8984 7.8984 10.9866 10.9866 11.9205 11.9205 13.5193 13.5193 14.8770 14.8770 k = 0.0000 0.2500 0.3973 ( 2878 PWs) bands (ev): -9.6065 -9.6065 -9.3396 -9.3396 -8.4229 -8.4229 -8.4177 -8.4177 -8.2504 -8.2504 -7.5852 -7.5852 -5.9586 -5.9586 -5.9117 -5.9117 -5.8393 -5.8393 -5.8028 -5.8028 -5.7034 -5.7034 -5.0453 -5.0453 0.5928 0.5928 3.3125 3.3125 4.3545 4.3545 4.9726 4.9726 6.4192 6.4192 6.6815 6.6815 7.6771 7.6771 7.8982 7.8982 10.9886 10.9886 11.9787 11.9787 13.5752 13.5752 14.9144 14.9144 k = 0.0000 0.2625 0.3973 ( 2878 PWs) bands (ev): -9.6005 -9.6005 -9.3429 -9.3429 -8.4232 -8.4232 -8.4178 -8.4178 -8.2357 -8.2357 -7.5920 -7.5920 -5.9579 -5.9579 -5.9141 -5.9141 -5.8346 -5.8346 -5.7999 -5.7999 -5.6944 -5.6944 -5.0579 -5.0579 0.6240 0.6240 3.2150 3.2150 4.3586 4.3586 5.0008 5.0008 6.3670 6.3670 6.6438 6.6438 7.6938 7.6939 7.8979 7.8979 10.9951 10.9951 12.0371 12.0371 13.6325 13.6325 14.9443 14.9443 k = 0.0000 0.2750 0.3973 ( 2874 PWs) bands (ev): -9.5943 -9.5943 -9.3466 -9.3466 -8.4235 -8.4235 -8.4179 -8.4179 -8.2201 -8.2201 -7.5995 -7.5995 -5.9572 -5.9572 -5.9164 -5.9164 -5.8296 -5.8296 -5.7972 -5.7972 -5.6849 -5.6849 -5.0712 -5.0712 0.6567 0.6567 3.1176 3.1176 4.3653 4.3653 5.0306 5.0306 6.3117 6.3118 6.6047 6.6047 7.7089 7.7089 7.8974 7.8974 11.0069 11.0069 12.0937 12.0937 13.6909 13.6909 14.9674 14.9674 k = 0.0000 0.2875 0.3973 ( 2878 PWs) bands (ev): -9.5879 -9.5879 -9.3507 -9.3507 -8.4237 -8.4237 -8.4181 -8.4181 -8.2038 -8.2038 -7.6077 -7.6077 -5.9565 -5.9565 -5.9187 -5.9187 -5.8245 -5.8245 -5.7946 -5.7946 -5.6747 -5.6747 -5.0852 -5.0852 0.6911 0.6911 3.0203 3.0203 4.3750 4.3750 5.0618 5.0618 6.2535 6.2535 6.5644 6.5644 7.7224 7.7224 7.8968 7.8968 11.0240 11.0240 12.1468 12.1468 13.7501 13.7501 14.9849 14.9849 k = 0.0000 0.3000 0.3973 ( 2874 PWs) bands (ev): -9.5814 -9.5814 -9.3552 -9.3552 -8.4239 -8.4239 -8.4183 -8.4183 -8.1868 -8.1868 -7.6167 -7.6167 -5.9560 -5.9560 -5.9208 -5.9208 -5.8194 -5.8194 -5.7921 -5.7921 -5.6638 -5.6638 -5.0999 -5.0999 0.7271 0.7271 2.9236 2.9236 4.3878 4.3878 5.0942 5.0942 6.1926 6.1926 6.5230 6.5230 7.7345 7.7345 7.8960 7.8960 11.0467 11.0467 12.1951 12.1951 13.8099 13.8099 14.9983 14.9983 k = 0.0000 0.3125 0.3973 ( 2872 PWs) bands (ev): -9.5747 -9.5747 -9.3600 -9.3600 -8.4241 -8.4241 -8.4185 -8.4185 -8.1690 -8.1690 -7.6265 -7.6265 -5.9554 -5.9554 -5.9230 -5.9230 -5.8144 -5.8144 -5.7897 -5.7897 -5.6521 -5.6521 -5.1152 -5.1152 0.7648 0.7648 2.8276 2.8276 4.4038 4.4038 5.1279 5.1279 6.1292 6.1292 6.4806 6.4806 7.7455 7.7455 7.8949 7.8949 11.0747 11.0747 12.2371 12.2371 13.8701 13.8701 15.0091 15.0091 k = 0.0000 0.3250 0.3973 ( 2876 PWs) bands (ev): -9.5678 -9.5678 -9.3651 -9.3651 -8.4242 -8.4242 -8.4187 -8.4187 -8.1506 -8.1506 -7.6371 -7.6371 -5.9549 -5.9549 -5.9250 -5.9250 -5.8095 -5.8095 -5.7873 -5.7873 -5.6398 -5.6398 -5.1311 -5.1311 0.8042 0.8042 2.7324 2.7324 4.4231 4.4231 5.1626 5.1626 6.0638 6.0638 6.4374 6.4374 7.7554 7.7554 7.8936 7.8936 11.1079 11.1079 12.2717 12.2717 13.9306 13.9306 15.0187 15.0187 k = 0.0000 0.3375 0.3973 ( 2876 PWs) bands (ev): -9.5608 -9.5608 -9.3706 -9.3706 -8.4243 -8.4243 -8.4190 -8.4190 -8.1316 -8.1316 -7.6485 -7.6485 -5.9544 -5.9544 -5.9270 -5.9270 -5.8048 -5.8048 -5.7852 -5.7852 -5.6266 -5.6266 -5.1477 -5.1477 0.8454 0.8454 2.6382 2.6382 4.4459 4.4459 5.1981 5.1981 5.9967 5.9967 6.3934 6.3934 7.7646 7.7646 7.8921 7.8921 11.1459 11.1459 12.2979 12.2979 13.9915 13.9915 15.0280 15.0280 k = 0.0000 0.3500 0.3973 ( 2874 PWs) bands (ev): -9.5537 -9.5537 -9.3764 -9.3764 -8.4244 -8.4244 -8.4192 -8.4192 -8.1121 -8.1121 -7.6606 -7.6606 -5.9539 -5.9539 -5.9289 -5.9289 -5.8004 -5.8004 -5.7831 -5.7831 -5.6127 -5.6127 -5.1648 -5.1648 0.8884 0.8884 2.5452 2.5452 4.4721 4.4721 5.2342 5.2342 5.9284 5.9284 6.3486 6.3486 7.7731 7.7731 7.8903 7.8903 11.1884 11.1884 12.3151 12.3151 14.0528 14.0528 15.0374 15.0374 k = 0.0000 0.3625 0.3973 ( 2876 PWs) bands (ev): -9.5465 -9.5465 -9.3825 -9.3825 -8.4244 -8.4244 -8.4195 -8.4195 -8.0921 -8.0921 -7.6735 -7.6735 -5.9535 -5.9535 -5.9307 -5.9307 -5.7962 -5.7962 -5.7812 -5.7812 -5.5980 -5.5980 -5.1825 -5.1825 0.9333 0.9333 2.4536 2.4536 4.5017 4.5017 5.2705 5.2705 5.8597 5.8597 6.3033 6.3033 7.7810 7.7810 7.8883 7.8883 11.2351 11.2351 12.3228 12.3228 14.1148 14.1148 15.0467 15.0467 k = 0.0000 0.3750 0.3973 ( 2876 PWs) bands (ev): -9.5391 -9.5391 -9.3888 -9.3888 -8.4244 -8.4244 -8.4198 -8.4198 -8.0717 -8.0717 -7.6873 -7.6873 -5.9530 -5.9530 -5.9324 -5.9324 -5.7924 -5.7924 -5.7794 -5.7794 -5.5826 -5.5826 -5.2006 -5.2006 0.9802 0.9802 2.3635 2.3635 4.5348 4.5348 5.3062 5.3062 5.7915 5.7915 6.2575 6.2575 7.7884 7.7884 7.8860 7.8860 11.2855 11.2855 12.3209 12.3209 14.1776 14.1776 15.0551 15.0551 k = 0.0000 0.3875 0.3973 ( 2882 PWs) bands (ev): -9.5317 -9.5317 -9.3954 -9.3954 -8.4244 -8.4244 -8.4201 -8.4201 -8.0510 -8.0509 -7.7017 -7.7017 -5.9524 -5.9524 -5.9341 -5.9341 -5.7889 -5.7889 -5.7778 -5.7778 -5.5665 -5.5665 -5.2192 -5.2192 1.0290 1.0290 2.2749 2.2749 4.5714 4.5714 5.3400 5.3400 5.7254 5.7254 6.2113 6.2113 7.7955 7.7955 7.8834 7.8834 11.3392 11.3392 12.3096 12.3096 14.2415 14.2415 15.0613 15.0613 k = 0.0000 0.4000 0.3973 ( 2880 PWs) bands (ev): -9.5241 -9.5241 -9.4022 -9.4022 -8.4243 -8.4243 -8.4204 -8.4204 -8.0300 -8.0300 -7.7170 -7.7170 -5.9519 -5.9519 -5.9356 -5.9356 -5.7857 -5.7857 -5.7763 -5.7763 -5.5497 -5.5497 -5.2382 -5.2382 1.0799 1.0799 2.1880 2.1880 4.6113 4.6113 5.3689 5.3689 5.6648 5.6648 6.1648 6.1648 7.8023 7.8023 7.8806 7.8806 11.3959 11.3959 12.2893 12.2893 14.3064 14.3064 15.0637 15.0637 k = 0.0000 0.4125 0.3973 ( 2888 PWs) bands (ev): -9.5165 -9.5165 -9.4092 -9.4092 -8.4242 -8.4242 -8.4207 -8.4207 -8.0088 -8.0088 -7.7329 -7.7329 -5.9513 -5.9513 -5.9372 -5.9372 -5.7829 -5.7829 -5.7751 -5.7751 -5.5323 -5.5323 -5.2575 -5.2575 1.1328 1.1328 2.1030 2.1030 4.6545 4.6545 5.3858 5.3858 5.6171 5.6171 6.1181 6.1181 7.8088 7.8088 7.8774 7.8775 11.4551 11.4551 12.2607 12.2607 14.3723 14.3723 15.0606 15.0606 k = 0.0000 0.4250 0.3973 ( 2888 PWs) bands (ev): -9.5088 -9.5088 -9.4164 -9.4164 -8.4241 -8.4241 -8.4210 -8.4210 -7.9876 -7.9876 -7.7496 -7.7496 -5.9507 -5.9507 -5.9386 -5.9386 -5.7804 -5.7804 -5.7740 -5.7740 -5.5144 -5.5144 -5.2772 -5.2772 1.1878 1.1878 2.0198 2.0198 4.7008 4.7008 5.3782 5.3782 5.5949 5.5949 6.0712 6.0712 7.8150 7.8150 7.8741 7.8741 11.5163 11.5163 12.2246 12.2246 14.4390 14.4390 15.0507 15.0507 k = 0.0000 0.4375 0.3973 ( 2876 PWs) bands (ev): -9.5010 -9.5010 -9.4237 -9.4237 -8.4239 -8.4239 -8.4213 -8.4213 -7.9663 -7.9663 -7.7669 -7.7669 -5.9500 -5.9500 -5.9400 -5.9400 -5.7783 -5.7783 -5.7731 -5.7731 -5.4959 -5.4959 -5.2971 -5.2971 1.2450 1.2450 1.9386 1.9386 4.7502 4.7502 5.3419 5.3419 5.6028 5.6028 6.0242 6.0242 7.8211 7.8211 7.8704 7.8704 11.5793 11.5793 12.1820 12.1820 14.5062 14.5062 15.0328 15.0328 k = 0.0000 0.4500 0.3973 ( 2876 PWs) bands (ev): -9.4932 -9.4932 -9.4312 -9.4312 -8.4238 -8.4238 -8.4217 -8.4217 -7.9451 -7.9451 -7.7848 -7.7848 -5.9493 -5.9493 -5.9413 -5.9413 -5.7765 -5.7765 -5.7725 -5.7725 -5.4770 -5.4770 -5.3172 -5.3172 1.3044 1.3044 1.8595 1.8595 4.8025 4.8025 5.2881 5.2881 5.6297 5.6297 5.9774 5.9774 7.8269 7.8269 7.8665 7.8665 11.6434 11.6434 12.1337 12.1337 14.5733 14.5733 15.0065 15.0065 k = 0.0000 0.4625 0.3973 ( 2876 PWs) bands (ev): -9.4854 -9.4854 -9.4387 -9.4387 -8.4236 -8.4236 -8.4220 -8.4220 -7.9239 -7.9239 -7.8034 -7.8033 -5.9485 -5.9485 -5.9425 -5.9425 -5.7750 -5.7750 -5.7721 -5.7721 -5.4577 -5.4577 -5.3374 -5.3373 1.3660 1.3660 1.7824 1.7824 4.8576 4.8576 5.2270 5.2270 5.6656 5.6656 5.9306 5.9306 7.8326 7.8326 7.8623 7.8623 11.7082 11.7082 12.0806 12.0806 14.6397 14.6397 14.9720 14.9720 k = 0.0000 0.4750 0.3973 ( 2880 PWs) bands (ev): -9.4776 -9.4776 -9.4464 -9.4464 -8.4233 -8.4233 -8.4223 -8.4223 -7.9030 -7.9030 -7.8224 -7.8224 -5.9476 -5.9476 -5.9437 -5.9437 -5.7738 -5.7738 -5.7719 -5.7719 -5.4380 -5.4380 -5.3576 -5.3576 1.4299 1.4299 1.7075 1.7075 4.9151 4.9151 5.1634 5.1634 5.7059 5.7059 5.8842 5.8842 7.8381 7.8381 7.8579 7.8579 11.7732 11.7732 12.0237 12.0237 14.7046 14.7046 14.9298 14.9298 k = 0.0000 0.4875 0.3973 ( 2888 PWs) bands (ev): -9.4698 -9.4698 -9.4541 -9.4541 -8.4231 -8.4231 -8.4226 -8.4226 -7.8823 -7.8823 -7.8420 -7.8420 -5.9467 -5.9467 -5.9447 -5.9447 -5.7729 -5.7729 -5.7720 -5.7720 -5.4182 -5.4182 -5.3779 -5.3779 1.4959 1.4959 1.6348 1.6348 4.9748 4.9748 5.0995 5.0995 5.7487 5.7487 5.8383 5.8383 7.8433 7.8433 7.8533 7.8533 11.8379 11.8379 11.9638 11.9638 14.7672 14.7672 14.8809 14.8809 k = 0.0000 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.4619 -9.4619 -9.4619 -9.4619 -8.4228 -8.4228 -8.4228 -8.4228 -7.8620 -7.8620 -7.8620 -7.8620 -5.9458 -5.9458 -5.9458 -5.9458 -5.7723 -5.7723 -5.7723 -5.7723 -5.3981 -5.3981 -5.3981 -5.3981 1.5642 1.5642 1.5642 1.5642 5.0364 5.0364 5.0364 5.0364 5.7930 5.7930 5.7930 5.7930 7.8484 7.8484 7.8484 7.8484 11.9016 11.9016 11.9016 11.9016 14.8263 14.8263 14.8263 14.8263 k = 0.0000 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.4619 -9.4619 -9.4619 -9.4619 -8.4228 -8.4228 -8.4228 -8.4228 -7.8620 -7.8620 -7.8620 -7.8620 -5.9458 -5.9458 -5.9458 -5.9458 -5.7723 -5.7723 -5.7723 -5.7723 -5.3981 -5.3981 -5.3981 -5.3981 1.5642 1.5642 1.5642 1.5642 5.0364 5.0364 5.0364 5.0364 5.7930 5.7930 5.7930 5.7930 7.8484 7.8484 7.8484 7.8484 11.9016 11.9016 11.9016 11.9016 14.8263 14.8263 14.8263 14.8263 k = 0.0125 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4665 -9.4665 -9.4572 -9.4572 -8.4232 -8.4232 -8.4224 -8.4224 -7.8719 -7.8719 -7.8519 -7.8519 -5.9463 -5.9463 -5.9450 -5.9450 -5.7728 -5.7728 -5.7719 -5.7719 -5.4033 -5.4033 -5.3925 -5.3925 1.5629 1.5629 1.5634 1.5634 5.0072 5.0072 5.0547 5.0547 5.7825 5.7826 5.8182 5.8183 7.8430 7.8430 7.8514 7.8514 11.8994 11.8994 11.9056 11.9056 14.7947 14.7947 14.8461 14.8461 k = 0.0250 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4709 -9.4709 -9.4524 -9.4524 -8.4233 -8.4233 -8.4217 -8.4217 -7.8817 -7.8817 -7.8417 -7.8417 -5.9465 -5.9465 -5.9440 -5.9440 -5.7733 -5.7733 -5.7716 -5.7716 -5.4082 -5.4082 -5.3867 -5.3867 1.5593 1.5593 1.5604 1.5604 4.9697 4.9697 5.0604 5.0604 5.7886 5.7886 5.8558 5.8558 7.8352 7.8352 7.8519 7.8519 11.8989 11.8989 11.9114 11.9114 14.7522 14.7522 14.8536 14.8536 k = 0.0375 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4751 -9.4751 -9.4476 -9.4475 -8.4233 -8.4233 -8.4210 -8.4210 -7.8912 -7.8912 -7.8315 -7.8315 -5.9465 -5.9465 -5.9428 -5.9428 -5.7739 -5.7739 -5.7714 -5.7714 -5.4128 -5.4128 -5.3806 -5.3806 1.5536 1.5536 1.5551 1.5551 4.9266 4.9266 5.0537 5.0537 5.8109 5.8109 5.9029 5.9029 7.8250 7.8250 7.8501 7.8501 11.9003 11.9003 11.9189 11.9189 14.6998 14.6998 14.8484 14.8484 k = 0.0500 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4791 -9.4791 -9.4426 -9.4426 -8.4231 -8.4231 -8.4201 -8.4201 -7.9004 -7.9004 -7.8213 -7.8213 -5.9462 -5.9462 -5.9414 -5.9414 -5.7745 -5.7745 -5.7712 -5.7712 -5.4170 -5.4170 -5.3743 -5.3743 1.5456 1.5456 1.5478 1.5478 4.8803 4.8803 5.0363 5.0363 5.8477 5.8477 5.9571 5.9571 7.8123 7.8123 7.8457 7.8457 11.9034 11.9034 11.9280 11.9280 14.6385 14.6385 14.8304 14.8304 k = 0.0625 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4828 -9.4828 -9.4377 -9.4377 -8.4226 -8.4226 -8.4192 -8.4192 -7.9094 -7.9093 -7.8112 -7.8112 -5.9455 -5.9455 -5.9399 -5.9399 -5.7752 -5.7752 -5.7712 -5.7712 -5.4208 -5.4208 -5.3678 -5.3678 1.5353 1.5353 1.5382 1.5382 4.8328 4.8328 5.0110 5.0110 5.8962 5.8962 6.0167 6.0167 7.7973 7.7973 7.8390 7.8390 11.9083 11.9083 11.9389 11.9389 14.5695 14.5695 14.7998 14.7998 k = 0.0750 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4863 -9.4863 -9.4329 -9.4329 -8.4220 -8.4220 -8.4181 -8.4181 -7.9179 -7.9179 -7.8013 -7.8013 -5.9445 -5.9445 -5.9381 -5.9381 -5.7759 -5.7759 -5.7712 -5.7712 -5.4242 -5.4242 -5.3611 -5.3611 1.5229 1.5229 1.5265 1.5265 4.7853 4.7853 4.9806 4.9806 5.9536 5.9536 6.0803 6.0803 7.7799 7.7799 7.8298 7.8298 11.9150 11.9150 11.9513 11.9513 14.4941 14.4941 14.7574 14.7574 k = 0.0875 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4896 -9.4896 -9.4281 -9.4281 -8.4211 -8.4211 -8.4170 -8.4170 -7.9260 -7.9260 -7.7915 -7.7915 -5.9432 -5.9432 -5.9363 -5.9363 -5.7766 -5.7766 -5.7714 -5.7714 -5.4272 -5.4272 -5.3543 -5.3543 1.5081 1.5081 1.5127 1.5127 4.7390 4.7390 4.9474 4.9474 6.0176 6.0176 6.1467 6.1467 7.7601 7.7601 7.8182 7.8182 11.9235 11.9235 11.9653 11.9653 14.4135 14.4135 14.7041 14.7041 k = 0.1000 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4925 -9.4925 -9.4234 -9.4234 -8.4199 -8.4199 -8.4158 -8.4158 -7.9336 -7.9336 -7.7819 -7.7819 -5.9415 -5.9415 -5.9343 -5.9343 -5.7774 -5.7774 -5.7716 -5.7716 -5.4298 -5.4298 -5.3473 -5.3473 1.4911 1.4911 1.4967 1.4967 4.6947 4.6947 4.9130 4.9130 6.0863 6.0863 6.2151 6.2151 7.7380 7.7380 7.8041 7.8041 11.9337 11.9337 11.9808 11.9808 14.3289 14.3290 14.6414 14.6414 k = 0.1125 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4952 -9.4952 -9.4189 -9.4189 -8.4185 -8.4185 -8.4145 -8.4145 -7.9407 -7.9407 -7.7727 -7.7727 -5.9395 -5.9395 -5.9321 -5.9321 -5.7782 -5.7782 -5.7719 -5.7719 -5.4320 -5.4320 -5.3403 -5.3403 1.4718 1.4718 1.4785 1.4785 4.6531 4.6531 4.8790 4.8790 6.1583 6.1583 6.2849 6.2849 7.7135 7.7136 7.7876 7.7876 11.9456 11.9456 11.9977 11.9977 14.2416 14.2416 14.5708 14.5708 k = 0.1250 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4975 -9.4975 -9.4146 -9.4146 -8.4169 -8.4169 -8.4132 -8.4132 -7.9472 -7.9472 -7.7637 -7.7637 -5.9370 -5.9370 -5.9299 -5.9299 -5.7790 -5.7790 -5.7723 -5.7723 -5.4338 -5.4338 -5.3333 -5.3333 1.4504 1.4504 1.4583 1.4583 4.6145 4.6145 4.8462 4.8462 6.2326 6.2326 6.3556 6.3556 7.6868 7.6868 7.7687 7.7687 11.9591 11.9591 12.0160 12.0160 14.1526 14.1526 14.4941 14.4941 k = 0.1375 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4996 -9.4996 -9.4105 -9.4105 -8.4150 -8.4150 -8.4118 -8.4118 -7.9532 -7.9532 -7.7552 -7.7552 -5.9342 -5.9342 -5.9276 -5.9276 -5.7798 -5.7798 -5.7728 -5.7728 -5.4351 -5.4351 -5.3263 -5.3263 1.4268 1.4268 1.4361 1.4361 4.5794 4.5794 4.8155 4.8155 6.3082 6.3082 6.4267 6.4267 7.6579 7.6579 7.7475 7.7475 11.9743 11.9743 12.0354 12.0354 14.0628 14.0628 14.4131 14.4131 k = 0.1500 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.5013 -9.5013 -9.4067 -9.4067 -8.4129 -8.4129 -8.4104 -8.4104 -7.9585 -7.9585 -7.7471 -7.7471 -5.9311 -5.9311 -5.9252 -5.9252 -5.7805 -5.7805 -5.7734 -5.7734 -5.4360 -5.4360 -5.3193 -5.3193 1.4012 1.4012 1.4119 1.4119 4.5481 4.5481 4.7872 4.7872 6.3847 6.3847 6.4979 6.4979 7.6268 7.6268 7.7239 7.7239 11.9910 11.9910 12.0559 12.0559 13.9733 13.9734 14.3292 14.3292 k = 0.1625 0.5000 0.3973 ( 2888 PWs) bands (ev): -9.5027 -9.5027 -9.4032 -9.4032 -8.4106 -8.4106 -8.4090 -8.4090 -7.9631 -7.9630 -7.7395 -7.7395 -5.9276 -5.9276 -5.9227 -5.9227 -5.7813 -5.7813 -5.7740 -5.7740 -5.4364 -5.4364 -5.3124 -5.3124 1.3736 1.3736 1.3858 1.3858 4.5208 4.5208 4.7618 4.7619 6.4613 6.4614 6.5687 6.5687 7.5936 7.5936 7.6980 7.6980 12.0091 12.0091 12.0774 12.0774 13.8850 13.8850 14.2442 14.2442 k = 0.1750 0.5000 0.3973 ( 2888 PWs) bands (ev): -9.5038 -9.5038 -9.4001 -9.4001 -8.4081 -8.4081 -8.4075 -8.4075 -7.9669 -7.9669 -7.7324 -7.7324 -5.9237 -5.9237 -5.9201 -5.9201 -5.7821 -5.7821 -5.7748 -5.7748 -5.4364 -5.4364 -5.3056 -5.3056 1.3442 1.3442 1.3579 1.3579 4.4975 4.4975 4.7397 4.7397 6.5378 6.5378 6.6389 6.6389 7.5584 7.5584 7.6699 7.6699 12.0286 12.0286 12.0995 12.0995 13.7985 13.7985 14.1593 14.1593 k = 0.1875 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.5046 -9.5046 -9.3973 -9.3973 -8.4060 -8.4060 -8.4054 -8.4054 -7.9700 -7.9700 -7.7259 -7.7259 -5.9195 -5.9195 -5.9174 -5.9174 -5.7828 -5.7828 -5.7756 -5.7756 -5.4359 -5.4359 -5.2991 -5.2991 1.3132 1.3132 1.3284 1.3284 4.4784 4.4784 4.7208 4.7208 6.6135 6.6135 6.7081 6.7081 7.5213 7.5213 7.6396 7.6396 12.0492 12.0492 12.1222 12.1222 13.7147 13.7147 14.0757 14.0757 k = 0.2000 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.5050 -9.5050 -9.3949 -9.3949 -8.4045 -8.4045 -8.4025 -8.4025 -7.9723 -7.9723 -7.7200 -7.7200 -5.9150 -5.9150 -5.9147 -5.9147 -5.7835 -5.7835 -5.7766 -5.7766 -5.4349 -5.4349 -5.2927 -5.2927 1.2807 1.2807 1.2974 1.2974 4.4635 4.4635 4.7055 4.7055 6.6882 6.6882 6.7762 6.7762 7.4825 7.4825 7.6073 7.6073 12.0708 12.0708 12.1451 12.1451 13.6341 13.6341 13.9947 13.9947 k = 0.2125 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.5052 -9.5052 -9.3929 -9.3929 -8.4030 -8.4030 -8.3996 -8.3996 -7.9737 -7.9737 -7.7148 -7.7148 -5.9119 -5.9119 -5.9103 -5.9103 -5.7842 -5.7842 -5.7776 -5.7776 -5.4335 -5.4335 -5.2866 -5.2866 1.2469 1.2469 1.2650 1.2650 4.4527 4.4527 4.6936 4.6936 6.7614 6.7614 6.8427 6.8427 7.4422 7.4422 7.5732 7.5732 12.0931 12.0931 12.1680 12.1680 13.5575 13.5575 13.9171 13.9171 k = 0.2250 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.5050 -9.5050 -9.3913 -9.3913 -8.4015 -8.4015 -8.3965 -8.3965 -7.9742 -7.9742 -7.7103 -7.7103 -5.9091 -5.9091 -5.9053 -5.9053 -5.7848 -5.7848 -5.7786 -5.7786 -5.4316 -5.4316 -5.2808 -5.2808 1.2121 1.2121 1.2316 1.2316 4.4461 4.4461 4.6852 4.6852 6.8328 6.8328 6.9074 6.9074 7.4008 7.4008 7.5375 7.5375 12.1159 12.1159 12.1904 12.1904 13.4855 13.4855 13.8440 13.8440 k = 0.2375 0.5000 0.3973 ( 2904 PWs) bands (ev): -9.5046 -9.5046 -9.3902 -9.3901 -8.3999 -8.3999 -8.3935 -8.3935 -7.9739 -7.9739 -7.7064 -7.7064 -5.9062 -5.9062 -5.9001 -5.9001 -5.7854 -5.7854 -5.7798 -5.7798 -5.4291 -5.4291 -5.2754 -5.2754 1.1765 1.1765 1.1972 1.1972 4.4434 4.4434 4.6802 4.6802 6.9017 6.9017 6.9697 6.9697 7.3585 7.3586 7.5006 7.5006 12.1388 12.1388 12.2120 12.2120 13.4187 13.4187 13.7762 13.7762 k = 0.2500 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.5038 -9.5038 -9.3894 -9.3894 -8.3983 -8.3983 -8.3904 -8.3904 -7.9726 -7.9726 -7.7034 -7.7034 -5.9033 -5.9033 -5.8948 -5.8948 -5.7860 -5.7860 -5.7810 -5.7810 -5.4262 -5.4262 -5.2704 -5.2704 1.1403 1.1403 1.1621 1.1621 4.4445 4.4445 4.6785 4.6785 6.9674 6.9674 7.0291 7.0291 7.3165 7.3165 7.4630 7.4630 12.1614 12.1614 12.2324 12.2324 13.3578 13.3578 13.7145 13.7145 k = 0.2625 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.5028 -9.5028 -9.3892 -9.3891 -8.3968 -8.3968 -8.3874 -8.3874 -7.9704 -7.9704 -7.7010 -7.7010 -5.9003 -5.9003 -5.8894 -5.8894 -5.7865 -5.7865 -5.7822 -5.7822 -5.4228 -5.4228 -5.2657 -5.2657 1.1039 1.1039 1.1266 1.1266 4.4493 4.4493 4.6800 4.6800 7.0278 7.0278 7.0844 7.0844 7.2764 7.2764 7.4259 7.4259 12.1831 12.1831 12.2509 12.2509 13.3034 13.3034 13.6596 13.6596 k = 0.2750 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.5015 -9.5015 -9.3893 -9.3893 -8.3952 -8.3952 -8.3846 -8.3846 -7.9672 -7.9672 -7.6995 -7.6995 -5.8972 -5.8972 -5.8839 -5.8839 -5.7871 -5.7871 -5.7835 -5.7835 -5.4189 -5.4189 -5.2616 -5.2616 1.0674 1.0674 1.0908 1.0908 4.4576 4.4576 4.6843 4.6843 7.0772 7.0772 7.1331 7.1331 7.2443 7.2443 7.3917 7.3917 12.2033 12.2033 12.2671 12.2671 13.2564 13.2564 13.6122 13.6122 k = 0.2875 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.4999 -9.4999 -9.3899 -9.3899 -8.3936 -8.3936 -8.3818 -8.3818 -7.9631 -7.9631 -7.6987 -7.6987 -5.8942 -5.8942 -5.8785 -5.8785 -5.7875 -5.7875 -5.7849 -5.7849 -5.4145 -5.4145 -5.2580 -5.2579 1.0312 1.0312 1.0551 1.0551 4.4691 4.4692 4.6913 4.6913 7.0988 7.0988 7.1696 7.1696 7.2369 7.2369 7.3662 7.3662 12.2215 12.2215 12.2806 12.2806 13.2173 13.2173 13.5729 13.5729 k = 0.3000 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.4981 -9.4980 -9.3908 -9.3908 -8.3920 -8.3920 -8.3793 -8.3793 -7.9581 -7.9581 -7.6988 -7.6988 -5.8910 -5.8910 -5.8731 -5.8731 -5.7880 -5.7880 -5.7863 -5.7863 -5.4095 -5.4095 -5.2548 -5.2548 0.9955 0.9955 1.0197 1.0197 4.4837 4.4837 4.7008 4.7008 7.0815 7.0815 7.1832 7.1832 7.2655 7.2655 7.3602 7.3602 12.2369 12.2369 12.2910 12.2910 13.1868 13.1868 13.5420 13.5420 k = 0.3125 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.4960 -9.4960 -9.3922 -9.3922 -8.3905 -8.3905 -8.3769 -8.3769 -7.9522 -7.9522 -7.6997 -7.6997 -5.8879 -5.8879 -5.8679 -5.8679 -5.7884 -5.7884 -5.7878 -5.7878 -5.4041 -5.4041 -5.2523 -5.2523 0.9606 0.9606 0.9848 0.9848 4.5010 4.5010 4.7123 4.7123 7.0450 7.0450 7.1690 7.1690 7.3105 7.3105 7.3786 7.3786 12.2491 12.2491 12.2978 12.2979 13.1655 13.1655 13.5199 13.5199 k = 0.3250 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.4936 -9.4936 -9.3940 -9.3939 -8.3889 -8.3889 -8.3748 -8.3748 -7.9455 -7.9455 -7.7014 -7.7014 -5.8847 -5.8847 -5.8629 -5.8629 -5.7892 -5.7892 -5.7889 -5.7889 -5.3982 -5.3982 -5.2504 -5.2504 0.9267 0.9267 0.9507 0.9507 4.5207 4.5207 4.7255 4.7255 7.0028 7.0028 7.1371 7.1371 7.3588 7.3588 7.4115 7.4115 12.2577 12.2577 12.3012 12.3012 13.1537 13.1537 13.5064 13.5064 k = 0.3375 0.5000 0.3973 ( 2900 PWs) bands (ev): -9.4911 -9.4911 -9.3960 -9.3960 -8.3873 -8.3873 -8.3730 -8.3730 -7.9379 -7.9379 -7.7039 -7.7039 -5.8815 -5.8815 -5.8581 -5.8581 -5.7907 -5.7907 -5.7893 -5.7893 -5.3919 -5.3919 -5.2491 -5.2491 0.8942 0.8942 0.9176 0.9176 4.5425 4.5425 4.7402 4.7402 6.9590 6.9590 7.0972 7.0972 7.4063 7.4063 7.4492 7.4492 12.2624 12.2624 12.3011 12.3011 13.1514 13.1514 13.5012 13.5012 k = 0.3500 0.5000 0.3973 ( 2892 PWs) bands (ev): -9.4883 -9.4883 -9.3985 -9.3984 -8.3858 -8.3858 -8.3713 -8.3713 -7.9296 -7.9296 -7.7072 -7.7072 -5.8783 -5.8783 -5.8536 -5.8536 -5.7922 -5.7922 -5.7897 -5.7897 -5.3852 -5.3852 -5.2484 -5.2484 0.8631 0.8631 0.8859 0.8859 4.5662 4.5662 4.7557 4.7557 6.9154 6.9154 7.0540 7.0540 7.4517 7.4517 7.4875 7.4875 12.2634 12.2634 12.2979 12.2979 13.1584 13.1584 13.5036 13.5036 k = 0.3625 0.5000 0.3973 ( 2888 PWs) bands (ev): -9.4853 -9.4853 -9.4012 -9.4012 -8.3843 -8.3843 -8.3700 -8.3700 -7.9206 -7.9206 -7.7113 -7.7112 -5.8750 -5.8750 -5.8496 -5.8496 -5.7936 -5.7936 -5.7901 -5.7901 -5.3781 -5.3780 -5.2484 -5.2484 0.8338 0.8338 0.8556 0.8556 4.5913 4.5913 4.7718 4.7718 6.8730 6.8730 7.0095 7.0095 7.4943 7.4943 7.5245 7.5245 12.2613 12.2613 12.2920 12.2920 13.1740 13.1740 13.5127 13.5127 k = 0.3750 0.5000 0.3973 ( 2884 PWs) bands (ev): -9.4822 -9.4822 -9.4042 -9.4042 -8.3827 -8.3827 -8.3689 -8.3689 -7.9111 -7.9110 -7.7161 -7.7161 -5.8718 -5.8718 -5.8459 -5.8459 -5.7949 -5.7949 -5.7905 -5.7905 -5.3706 -5.3706 -5.2491 -5.2491 0.8065 0.8065 0.8271 0.8271 4.6175 4.6176 4.7879 4.7879 6.8324 6.8324 6.9648 6.9648 7.5338 7.5338 7.5593 7.5593 12.2566 12.2566 12.2840 12.2840 13.1972 13.1972 13.5273 13.5273 k = 0.3875 0.5000 0.3973 ( 2872 PWs) bands (ev): -9.4788 -9.4788 -9.4074 -9.4074 -8.3813 -8.3813 -8.3681 -8.3681 -7.9009 -7.9009 -7.7217 -7.7217 -5.8685 -5.8685 -5.8428 -5.8428 -5.7961 -5.7961 -5.7909 -5.7909 -5.3629 -5.3629 -5.2505 -5.2505 0.7813 0.7813 0.8005 0.8005 4.6444 4.6445 4.8035 4.8035 6.7944 6.7944 6.9208 6.9208 7.5700 7.5700 7.5915 7.5915 12.2500 12.2500 12.2745 12.2745 13.2270 13.2270 13.5459 13.5459 k = 0.4000 0.5000 0.3973 ( 2868 PWs) bands (ev): -9.4753 -9.4753 -9.4109 -9.4108 -8.3798 -8.3798 -8.3675 -8.3675 -7.8904 -7.8904 -7.7281 -7.7281 -5.8653 -5.8653 -5.8403 -5.8403 -5.7971 -5.7971 -5.7914 -5.7914 -5.3549 -5.3549 -5.2525 -5.2525 0.7584 0.7584 0.7760 0.7760 4.6716 4.6716 4.8181 4.8181 6.7595 6.7595 6.8781 6.8781 7.6028 7.6028 7.6207 7.6207 12.2424 12.2424 12.2641 12.2642 13.2623 13.2623 13.5669 13.5669 k = 0.4125 0.5000 0.3973 ( 2872 PWs) bands (ev): -9.4717 -9.4717 -9.4145 -9.4145 -8.3784 -8.3784 -8.3672 -8.3672 -7.8795 -7.8795 -7.7351 -7.7351 -5.8621 -5.8621 -5.8383 -5.8383 -5.7978 -5.7978 -5.7918 -5.7918 -5.3468 -5.3468 -5.2552 -5.2552 0.7380 0.7380 0.7538 0.7538 4.6986 4.6986 4.8311 4.8311 6.7283 6.7283 6.8373 6.8373 7.6319 7.6319 7.6468 7.6468 12.2343 12.2344 12.2535 12.2535 13.3018 13.3018 13.5884 13.5884 k = 0.4250 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4679 -9.4679 -9.4183 -9.4183 -8.3770 -8.3770 -8.3671 -8.3671 -7.8683 -7.8683 -7.7428 -7.7428 -5.8589 -5.8589 -5.8371 -5.8371 -5.7983 -5.7983 -5.7924 -5.7924 -5.3386 -5.3386 -5.2586 -5.2586 0.7202 0.7202 0.7341 0.7341 4.7249 4.7249 4.8420 4.8421 6.7014 6.7014 6.7990 6.7991 7.6574 7.6574 7.6695 7.6695 12.2265 12.2265 12.2431 12.2431 13.3444 13.3444 13.6082 13.6082 k = 0.4375 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4640 -9.4639 -9.4223 -9.4223 -8.3756 -8.3756 -8.3671 -8.3671 -7.8570 -7.8570 -7.7511 -7.7511 -5.8558 -5.8558 -5.8365 -5.8365 -5.7985 -5.7985 -5.7929 -5.7929 -5.3304 -5.3304 -5.2627 -5.2627 0.7052 0.7052 0.7169 0.7169 4.7501 4.7501 4.8505 4.8505 6.6792 6.6792 6.7638 6.7638 7.6792 7.6792 7.6888 7.6888 12.2194 12.2194 12.2333 12.2333 13.3889 13.3889 13.6242 13.6242 k = 0.4500 0.5000 0.3973 ( 2876 PWs) bands (ev): -9.4599 -9.4599 -9.4263 -9.4263 -8.3744 -8.3744 -8.3674 -8.3674 -7.8455 -7.8455 -7.7600 -7.7600 -5.8528 -5.8528 -5.8366 -5.8366 -5.7985 -5.7985 -5.7935 -5.7935 -5.3222 -5.3222 -5.2674 -5.2674 0.6929 0.6929 0.7025 0.7025 4.7736 4.7737 4.8559 4.8559 6.6623 6.6623 6.7322 6.7322 7.6972 7.6972 7.7046 7.7046 12.2134 12.2134 12.2246 12.2246 13.4339 13.4339 13.6343 13.6343 k = 0.4625 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4558 -9.4558 -9.4305 -9.4305 -8.3731 -8.3731 -8.3678 -8.3678 -7.8341 -7.8341 -7.7695 -7.7695 -5.8499 -5.8499 -5.8374 -5.8374 -5.7981 -5.7981 -5.7942 -5.7942 -5.3142 -5.3142 -5.2726 -5.2726 0.6836 0.6836 0.6909 0.6909 4.7951 4.7951 4.8580 4.8580 6.6510 6.6510 6.7048 6.7048 7.7114 7.7114 7.7168 7.7168 12.2087 12.2087 12.2172 12.2172 13.4780 13.4780 13.6366 13.6366 k = 0.4750 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4517 -9.4517 -9.4347 -9.4347 -8.3720 -8.3720 -8.3684 -8.3684 -7.8227 -7.8227 -7.7794 -7.7794 -5.8472 -5.8472 -5.8386 -5.8386 -5.7976 -5.7976 -5.7948 -5.7948 -5.3064 -5.3064 -5.2785 -5.2785 0.6773 0.6773 0.6822 0.6822 4.8139 4.8139 4.8564 4.8565 6.6455 6.6455 6.6820 6.6820 7.7218 7.7218 7.7253 7.7253 12.2057 12.2057 12.2114 12.2114 13.5198 13.5198 13.6300 13.6300 k = 0.4875 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4474 -9.4474 -9.4389 -9.4389 -8.3710 -8.3710 -8.3691 -8.3691 -7.8115 -7.8115 -7.7898 -7.7898 -5.8446 -5.8446 -5.8403 -5.8403 -5.7970 -5.7970 -5.7956 -5.7956 -5.2988 -5.2988 -5.2848 -5.2848 0.6740 0.6740 0.6764 0.6764 4.8298 4.8298 4.8512 4.8512 6.6459 6.6459 6.6644 6.6644 7.7283 7.7283 7.7301 7.7301 12.2044 12.2044 12.2072 12.2072 13.5575 13.5575 13.6141 13.6141 k = 0.5000 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3700 -8.3700 -8.3700 -8.3700 -7.8005 -7.8005 -7.8005 -7.8005 -5.8423 -5.8423 -5.8423 -5.8423 -5.7963 -5.7963 -5.7963 -5.7963 -5.2916 -5.2916 -5.2916 -5.2916 0.6737 0.6737 0.6737 0.6737 4.8423 4.8423 4.8423 4.8423 6.6523 6.6523 6.6523 6.6523 7.7311 7.7311 7.7311 7.7311 12.2049 12.2049 12.2049 12.2049 13.5895 13.5895 13.5895 13.5895 k = 0.5000 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3700 -8.3700 -8.3700 -8.3700 -7.8005 -7.8005 -7.8005 -7.8005 -5.8423 -5.8423 -5.8423 -5.8423 -5.7963 -5.7963 -5.7963 -5.7963 -5.2916 -5.2916 -5.2916 -5.2916 0.6737 0.6737 0.6737 0.6737 4.8423 4.8423 4.8423 4.8423 6.6523 6.6523 6.6523 6.6523 7.7311 7.7311 7.7311 7.7311 12.2049 12.2049 12.2049 12.2049 13.5895 13.5895 13.5895 13.5895 k = 0.4911 0.4911 0.3973 ( 2880 PWs) bands (ev): -9.4475 -9.4475 -9.4389 -9.4389 -8.3710 -8.3710 -8.3691 -8.3691 -7.8116 -7.8116 -7.7896 -7.7896 -5.8447 -5.8447 -5.8402 -5.8402 -5.7970 -5.7970 -5.7955 -5.7955 -5.2989 -5.2989 -5.2847 -5.2847 0.6735 0.6735 0.6769 0.6769 4.8292 4.8292 4.8517 4.8517 6.6457 6.6457 6.6648 6.6648 7.7274 7.7274 7.7310 7.7310 12.2039 12.2039 12.2078 12.2078 13.5562 13.5562 13.6153 13.6153 k = 0.4821 0.4821 0.3973 ( 2882 PWs) bands (ev): -9.4518 -9.4518 -9.4346 -9.4346 -8.3720 -8.3720 -8.3684 -8.3684 -7.8230 -7.8230 -7.7791 -7.7791 -5.8473 -5.8473 -5.8385 -5.8385 -5.7977 -5.7977 -5.7948 -5.7948 -5.3067 -5.3067 -5.2782 -5.2782 0.6746 0.6746 0.6851 0.6851 4.8103 4.8103 4.8599 4.8599 6.6439 6.6439 6.6840 6.6840 7.7168 7.7168 7.7300 7.7300 12.2025 12.2025 12.2147 12.2147 13.5121 13.5121 13.6382 13.6382 k = 0.4732 0.4732 0.3973 ( 2878 PWs) bands (ev): -9.4561 -9.4561 -9.4302 -9.4302 -8.3732 -8.3732 -8.3678 -8.3678 -7.8348 -7.8348 -7.7689 -7.7689 -5.8501 -5.8501 -5.8372 -5.8372 -5.7983 -5.7983 -5.7940 -5.7940 -5.3150 -5.3150 -5.2719 -5.2719 0.6765 0.6765 0.6986 0.6986 4.7845 4.7845 4.8685 4.8685 6.6460 6.6460 6.7102 6.7102 7.6994 7.6994 7.7282 7.7282 12.2003 12.2003 12.2261 12.2261 13.4566 13.4566 13.6620 13.6620 k = 0.4643 0.4643 0.3973 ( 2878 PWs) bands (ev): -9.4603 -9.4603 -9.4259 -9.4259 -8.3745 -8.3745 -8.3673 -8.3673 -7.8468 -7.8468 -7.7589 -7.7589 -5.8531 -5.8531 -5.8362 -5.8362 -5.7990 -5.7990 -5.7932 -5.7932 -5.3239 -5.3239 -5.2658 -5.2658 0.6791 0.6791 0.7174 0.7174 4.7517 4.7517 4.8784 4.8784 6.6513 6.6513 6.7433 6.7433 7.6753 7.6753 7.7258 7.7258 12.1969 12.1969 12.2418 12.2418 13.3913 13.3913 13.6890 13.6890 k = 0.4554 0.4554 0.3973 ( 2878 PWs) bands (ev): -9.4646 -9.4646 -9.4216 -9.4216 -8.3759 -8.3759 -8.3669 -8.3669 -7.8592 -7.8592 -7.7492 -7.7492 -5.8562 -5.8562 -5.8357 -5.8357 -5.7996 -5.7996 -5.7924 -5.7924 -5.3334 -5.3334 -5.2598 -5.2598 0.6824 0.6824 0.7414 0.7414 4.7125 4.7125 4.8903 4.8903 6.6593 6.6593 6.7826 6.7826 7.6447 7.6447 7.7227 7.7227 12.1921 12.1921 12.2618 12.2618 13.3190 13.3190 13.7203 13.7203 k = 0.4464 0.4464 0.3973 ( 2874 PWs) bands (ev): -9.4689 -9.4689 -9.4172 -9.4172 -8.3773 -8.3773 -8.3666 -8.3666 -7.8719 -7.8719 -7.7398 -7.7398 -5.8595 -5.8595 -5.8356 -5.8356 -5.8002 -5.8002 -5.7916 -5.7916 -5.3435 -5.3435 -5.2539 -5.2539 0.6863 0.6863 0.7706 0.7706 4.6678 4.6678 4.9043 4.9043 6.6697 6.6697 6.8270 6.8270 7.6079 7.6079 7.7190 7.7190 12.1855 12.1855 12.2860 12.2860 13.2426 13.2426 13.7563 13.7563 k = 0.4375 0.4375 0.3973 ( 2872 PWs) bands (ev): -9.4732 -9.4732 -9.4129 -9.4129 -8.3788 -8.3788 -8.3665 -8.3665 -7.8849 -7.8849 -7.7306 -7.7306 -5.8629 -5.8629 -5.8359 -5.8359 -5.8009 -5.8009 -5.7907 -5.7907 -5.3542 -5.3542 -5.2480 -5.2480 0.6908 0.6908 0.8049 0.8049 4.6187 4.6187 4.9205 4.9206 6.6822 6.6822 6.8757 6.8757 7.5654 7.5654 7.7146 7.7146 12.1765 12.1765 12.3141 12.3141 13.1648 13.1648 13.7969 13.7969 k = 0.4286 0.4286 0.3973 ( 2880 PWs) bands (ev): -9.4775 -9.4775 -9.4085 -9.4085 -8.3804 -8.3804 -8.3665 -8.3665 -7.8982 -7.8982 -7.7217 -7.7217 -5.8663 -5.8663 -5.8367 -5.8367 -5.8017 -5.8017 -5.7898 -5.7898 -5.3655 -5.3655 -5.2421 -5.2421 0.6957 0.6957 0.8441 0.8441 4.5663 4.5663 4.9390 4.9391 6.6967 6.6967 6.9275 6.9275 7.5174 7.5174 7.7096 7.7096 12.1644 12.1644 12.3457 12.3457 13.0881 13.0881 13.8417 13.8417 k = 0.4196 0.4196 0.3973 ( 2880 PWs) bands (ev): -9.4818 -9.4818 -9.4042 -9.4042 -8.3821 -8.3821 -8.3667 -8.3667 -7.9118 -7.9118 -7.7130 -7.7130 -5.8697 -5.8697 -5.8377 -5.8377 -5.8026 -5.8026 -5.7889 -5.7889 -5.3774 -5.3774 -5.2360 -5.2360 0.7010 0.7010 0.8882 0.8882 4.5116 4.5116 4.9598 4.9598 6.7131 6.7131 6.9815 6.9815 7.4645 7.4645 7.7040 7.7040 12.1485 12.1485 12.3803 12.3803 13.0148 13.0148 13.8900 13.8900 k = 0.4107 0.4107 0.3973 ( 2880 PWs) bands (ev): -9.4862 -9.4861 -9.3999 -9.3999 -8.3838 -8.3838 -8.3669 -8.3669 -7.9256 -7.9256 -7.7045 -7.7045 -5.8733 -5.8733 -5.8391 -5.8391 -5.8036 -5.8036 -5.7880 -5.7880 -5.3897 -5.3897 -5.2299 -5.2299 0.7065 0.7065 0.9369 0.9369 4.4554 4.4554 4.9829 4.9829 6.7310 6.7310 7.0368 7.0368 7.4071 7.4071 7.6978 7.6978 12.1276 12.1276 12.4173 12.4173 12.9475 12.9475 13.9411 13.9411 k = 0.4018 0.4018 0.3973 ( 2876 PWs) bands (ev): -9.4905 -9.4905 -9.3956 -9.3956 -8.3855 -8.3855 -8.3673 -8.3673 -7.9397 -7.9397 -7.6963 -7.6963 -5.8768 -5.8768 -5.8407 -5.8407 -5.8047 -5.8047 -5.7871 -5.7871 -5.4026 -5.4026 -5.2235 -5.2235 0.7121 0.7121 0.9901 0.9901 4.3987 4.3987 5.0082 5.0082 6.7503 6.7503 7.0926 7.0926 7.3460 7.3460 7.6911 7.6911 12.1009 12.1009 12.4554 12.4554 12.8887 12.8887 13.9936 13.9936 k = 0.3929 0.3929 0.3973 ( 2880 PWs) bands (ev): -9.4949 -9.4949 -9.3913 -9.3913 -8.3873 -8.3873 -8.3679 -8.3679 -7.9541 -7.9541 -7.6883 -7.6883 -5.8803 -5.8803 -5.8425 -5.8425 -5.8060 -5.8060 -5.7863 -5.7863 -5.4158 -5.4158 -5.2170 -5.2170 0.7177 0.7177 1.0477 1.0477 4.3423 4.3423 5.0356 5.0356 6.7706 6.7706 7.1480 7.1480 7.2817 7.2817 7.6839 7.6839 12.0674 12.0674 12.4928 12.4928 12.8411 12.8411 14.0459 14.0459 k = 0.3839 0.3839 0.3973 ( 2874 PWs) bands (ev): -9.4993 -9.4993 -9.3871 -9.3871 -8.3891 -8.3891 -8.3685 -8.3685 -7.9686 -7.9686 -7.6805 -7.6805 -5.8838 -5.8838 -5.8445 -5.8445 -5.8075 -5.8075 -5.7856 -5.7856 -5.4294 -5.4294 -5.2103 -5.2103 0.7232 0.7232 1.1096 1.1096 4.2867 4.2867 5.0653 5.0653 6.7912 6.7912 7.2007 7.2007 7.2172 7.2172 7.6762 7.6762 12.0268 12.0268 12.5265 12.5265 12.8081 12.8081 14.0962 14.0962 k = 0.3750 0.3750 0.3973 ( 2874 PWs) bands (ev): -9.5037 -9.5037 -9.3829 -9.3829 -8.3909 -8.3909 -8.3693 -8.3693 -7.9834 -7.9834 -7.6729 -7.6729 -5.8873 -5.8873 -5.8466 -5.8466 -5.8092 -5.8092 -5.7849 -5.7849 -5.4432 -5.4432 -5.2034 -5.2034 0.7284 0.7284 1.1754 1.1754 4.2326 4.2326 5.0970 5.0970 6.8107 6.8107 7.1476 7.1476 7.2568 7.2568 7.6681 7.6681 11.9791 11.9791 12.5522 12.5522 12.7936 12.7936 14.1420 14.1420 k = 0.3661 0.3661 0.3973 ( 2878 PWs) bands (ev): -9.5082 -9.5082 -9.3788 -9.3788 -8.3928 -8.3928 -8.3701 -8.3701 -7.9983 -7.9983 -7.6655 -7.6655 -5.8908 -5.8908 -5.8489 -5.8489 -5.8111 -5.8111 -5.7844 -5.7844 -5.4572 -5.4572 -5.1964 -5.1964 0.7331 0.7331 1.2451 1.2451 4.1805 4.1805 5.1308 5.1308 6.8260 6.8260 7.0836 7.0836 7.3083 7.3083 7.6597 7.6597 11.9250 11.9250 12.5668 12.5668 12.7993 12.7993 14.1814 14.1814 k = 0.3571 0.3571 0.3973 ( 2882 PWs) bands (ev): -9.5127 -9.5127 -9.3747 -9.3747 -8.3946 -8.3946 -8.3711 -8.3711 -8.0133 -8.0133 -7.6584 -7.6584 -5.8942 -5.8942 -5.8512 -5.8512 -5.8131 -5.8131 -5.7841 -5.7841 -5.4713 -5.4713 -5.1891 -5.1891 0.7372 0.7372 1.3184 1.3184 4.1310 4.1310 5.1665 5.1666 6.8295 6.8295 7.0302 7.0303 7.3576 7.3576 7.6511 7.6511 11.8657 11.8657 12.5715 12.5715 12.8221 12.8221 14.2131 14.2131 k = 0.3482 0.3482 0.3973 ( 2886 PWs) bands (ev): -9.5173 -9.5173 -9.3708 -9.3708 -8.3965 -8.3965 -8.3722 -8.3722 -8.0284 -8.0284 -7.6514 -7.6514 -5.8976 -5.8976 -5.8536 -5.8536 -5.8153 -5.8153 -5.7839 -5.7839 -5.4855 -5.4855 -5.1816 -5.1816 0.7405 0.7405 1.3952 1.3952 4.0844 4.0844 5.2042 5.2042 6.8073 6.8073 7.0018 7.0018 7.4043 7.4043 7.6425 7.6425 11.8025 11.8025 12.5707 12.5707 12.8549 12.8549 14.2378 14.2378 k = 0.3393 0.3393 0.3973 ( 2890 PWs) bands (ev): -9.5219 -9.5219 -9.3669 -9.3669 -8.3983 -8.3983 -8.3734 -8.3734 -8.0436 -8.0436 -7.6447 -7.6447 -5.9010 -5.9010 -5.8560 -5.8560 -5.8177 -5.8177 -5.7838 -5.7838 -5.4996 -5.4996 -5.1739 -5.1739 0.7429 0.7429 1.4753 1.4753 4.0412 4.0412 5.2438 5.2438 6.7555 6.7555 7.0023 7.0023 7.4478 7.4478 7.6343 7.6343 11.7370 11.7370 12.5682 12.5682 12.8914 12.8914 14.2575 14.2575 k = 0.3304 0.3304 0.3973 ( 2894 PWs) bands (ev): -9.5266 -9.5266 -9.3631 -9.3631 -8.4001 -8.4001 -8.3747 -8.3747 -8.0587 -8.0587 -7.6382 -7.6382 -5.9043 -5.9043 -5.8584 -5.8584 -5.8202 -5.8202 -5.7839 -5.7839 -5.5136 -5.5136 -5.1661 -5.1661 0.7441 0.7441 1.5585 1.5585 4.0017 4.0017 5.2851 5.2851 6.6864 6.6864 7.0197 7.0197 7.4872 7.4872 7.6272 7.6272 11.6702 11.6702 12.5657 12.5657 12.9271 12.9271 14.2753 14.2753 k = 0.3214 0.3214 0.3973 ( 2890 PWs) bands (ev): -9.5313 -9.5313 -9.3594 -9.3594 -8.4019 -8.4019 -8.3761 -8.3761 -8.0739 -8.0739 -7.6319 -7.6319 -5.9076 -5.9076 -5.8608 -5.8608 -5.8229 -5.8229 -5.7842 -5.7842 -5.5274 -5.5274 -5.1580 -5.1580 0.7442 0.7442 1.6445 1.6445 3.9661 3.9661 5.3281 5.3281 6.6095 6.6095 7.0445 7.0446 7.5206 7.5206 7.6231 7.6231 11.6033 11.6033 12.5638 12.5638 12.9585 12.9585 14.2943 14.2943 k = 0.3125 0.3125 0.3973 ( 2886 PWs) bands (ev): -9.5360 -9.5360 -9.3559 -9.3559 -8.4036 -8.4036 -8.3776 -8.3776 -8.0889 -8.0889 -7.6258 -7.6258 -5.9108 -5.9108 -5.8631 -5.8631 -5.8256 -5.8256 -5.7847 -5.7847 -5.5411 -5.5411 -5.1499 -5.1499 0.7429 0.7429 1.7333 1.7333 3.9348 3.9348 5.3727 5.3727 6.5287 6.5287 7.0730 7.0730 7.5437 7.5437 7.6263 7.6263 11.5372 11.5372 12.5623 12.5623 12.9834 12.9834 14.3172 14.3172 k = 0.3036 0.3036 0.3973 ( 2886 PWs) bands (ev): -9.5408 -9.5408 -9.3525 -9.3525 -8.4053 -8.4053 -8.3791 -8.3791 -8.1039 -8.1039 -7.6200 -7.6200 -5.9140 -5.9140 -5.8654 -5.8654 -5.8285 -5.8285 -5.7854 -5.7854 -5.5544 -5.5544 -5.1415 -5.1415 0.7401 0.7401 1.8246 1.8246 3.9079 3.9080 5.4189 5.4189 6.4459 6.4459 7.1033 7.1033 7.5524 7.5524 7.6408 7.6408 11.4728 11.4728 12.5608 12.5608 13.0000 13.0001 14.3461 14.3461 k = 0.2946 0.2946 0.3973 ( 2882 PWs) bands (ev): -9.5457 -9.5457 -9.3493 -9.3493 -8.4069 -8.4069 -8.3807 -8.3807 -8.1187 -8.1187 -7.6144 -7.6144 -5.9171 -5.9171 -5.8677 -5.8677 -5.8314 -5.8314 -5.7862 -5.7862 -5.5675 -5.5675 -5.1331 -5.1331 0.7358 0.7358 1.9182 1.9182 3.8857 3.8857 5.4664 5.4664 6.3621 6.3621 7.1344 7.1344 7.5501 7.5502 7.6632 7.6632 11.4105 11.4105 12.5589 12.5589 13.0075 13.0075 14.3822 14.3822 k = 0.2857 0.2857 0.3973 ( 2878 PWs) bands (ev): -9.5506 -9.5506 -9.3462 -9.3462 -8.4085 -8.4085 -8.3824 -8.3824 -8.1333 -8.1333 -7.6090 -7.6090 -5.9202 -5.9202 -5.8699 -5.8699 -5.8343 -5.8343 -5.7872 -5.7872 -5.5802 -5.5802 -5.1246 -5.1246 0.7298 0.7298 2.0139 2.0139 3.8682 3.8682 5.5153 5.5153 6.2779 6.2779 7.1658 7.1658 7.5427 7.5427 7.6879 7.6879 11.3511 11.3511 12.5557 12.5557 13.0058 13.0058 14.4260 14.4260 k = 0.2768 0.2768 0.3973 ( 2880 PWs) bands (ev): -9.5555 -9.5555 -9.3433 -9.3433 -8.4100 -8.4100 -8.3841 -8.3841 -8.1477 -8.1477 -7.6038 -7.6038 -5.9232 -5.9232 -5.8719 -5.8719 -5.8373 -5.8373 -5.7883 -5.7883 -5.5925 -5.5925 -5.1160 -5.1160 0.7222 0.7222 2.1115 2.1115 3.8554 3.8554 5.5653 5.5653 6.1937 6.1937 7.1969 7.1969 7.5329 7.5329 7.7121 7.7121 11.2950 11.2950 12.5503 12.5503 12.9958 12.9958 14.4772 14.4772 k = 0.2679 0.2679 0.3973 ( 2872 PWs) bands (ev): -9.5605 -9.5605 -9.3406 -9.3406 -8.4114 -8.4114 -8.3858 -8.3858 -8.1618 -8.1618 -7.5989 -7.5989 -5.9262 -5.9262 -5.8739 -5.8739 -5.8402 -5.8402 -5.7897 -5.7897 -5.6045 -5.6045 -5.1073 -5.1073 0.7130 0.7130 2.2109 2.2109 3.8474 3.8474 5.6165 5.6165 6.1100 6.1100 7.2273 7.2273 7.5219 7.5219 7.7349 7.7349 11.2426 11.2426 12.5414 12.5414 12.9792 12.9792 14.5345 14.5345 k = 0.2589 0.2589 0.3973 ( 2874 PWs) bands (ev): -9.5655 -9.5655 -9.3381 -9.3380 -8.4128 -8.4128 -8.3876 -8.3876 -8.1755 -8.1755 -7.5942 -7.5942 -5.9291 -5.9291 -5.8758 -5.8758 -5.8432 -5.8432 -5.7912 -5.7912 -5.6160 -5.6160 -5.0986 -5.0986 0.7022 0.7022 2.3117 2.3117 3.8442 3.8442 5.6685 5.6685 6.0270 6.0270 7.2565 7.2565 7.5102 7.5102 7.7558 7.7558 11.1944 11.1944 12.5277 12.5277 12.9585 12.9585 14.5965 14.5965 k = 0.2500 0.2500 0.3973 ( 2878 PWs) bands (ev): -9.5706 -9.5705 -9.3357 -9.3357 -8.4141 -8.4141 -8.3894 -8.3894 -8.1890 -8.1890 -7.5898 -7.5898 -5.9320 -5.9320 -5.8776 -5.8776 -5.8460 -5.8460 -5.7928 -5.7928 -5.6272 -5.6272 -5.0898 -5.0898 0.6898 0.6898 2.4139 2.4139 3.8456 3.8456 5.7212 5.7213 5.9451 5.9451 7.2842 7.2842 7.4980 7.4980 7.7747 7.7747 11.1508 11.1508 12.5075 12.5075 12.9363 12.9363 14.6615 14.6615 k = 0.2411 0.2411 0.3973 ( 2882 PWs) bands (ev): -9.5756 -9.5756 -9.3336 -9.3336 -8.4152 -8.4152 -8.3912 -8.3912 -8.2020 -8.2020 -7.5856 -7.5856 -5.9348 -5.9348 -5.8793 -5.8793 -5.8487 -5.8487 -5.7946 -5.7946 -5.6379 -5.6379 -5.0811 -5.0811 0.6759 0.6759 2.5172 2.5172 3.8516 3.8516 5.7737 5.7737 5.8654 5.8654 7.3099 7.3099 7.4855 7.4855 7.7918 7.7918 11.1120 11.1120 12.4794 12.4794 12.9153 12.9153 14.7274 14.7274 k = 0.2321 0.2321 0.3973 ( 2882 PWs) bands (ev): -9.5807 -9.5807 -9.3316 -9.3316 -8.4163 -8.4163 -8.3930 -8.3930 -8.2147 -8.2147 -7.5816 -7.5816 -5.9375 -5.9375 -5.8809 -5.8809 -5.8513 -5.8513 -5.7966 -5.7966 -5.6482 -5.6482 -5.0724 -5.0724 0.6606 0.6606 2.6214 2.6214 3.8618 3.8618 5.7798 5.7798 5.8342 5.8342 7.3333 7.3333 7.4728 7.4728 7.8070 7.8070 11.0783 11.0783 12.4423 12.4423 12.8975 12.8975 14.7921 14.7921 k = 0.2232 0.2232 0.3973 ( 2888 PWs) bands (ev): -9.5858 -9.5858 -9.3299 -9.3299 -8.4173 -8.4173 -8.3948 -8.3948 -8.2269 -8.2269 -7.5779 -7.5779 -5.9401 -5.9401 -5.8824 -5.8824 -5.8537 -5.8537 -5.7986 -5.7986 -5.6582 -5.6582 -5.0638 -5.0638 0.6442 0.6442 2.7263 2.7263 3.8762 3.8762 5.7046 5.7046 5.8863 5.8863 7.3538 7.3538 7.4601 7.4601 7.8204 7.8204 11.0499 11.0499 12.3963 12.3963 12.8842 12.8842 14.8536 14.8536 k = 0.2143 0.2143 0.3973 ( 2882 PWs) bands (ev): -9.5909 -9.5909 -9.3284 -9.3284 -8.4182 -8.4182 -8.3965 -8.3965 -8.2387 -8.2387 -7.5744 -7.5744 -5.9427 -5.9427 -5.8837 -5.8837 -5.8559 -5.8559 -5.8008 -5.8008 -5.6677 -5.6677 -5.0552 -5.0552 0.6266 0.6266 2.8317 2.8317 3.8944 3.8944 5.6289 5.6289 5.9411 5.9411 7.3709 7.3709 7.4476 7.4476 7.8323 7.8323 11.0270 11.0270 12.3424 12.3424 12.8755 12.8755 14.9096 14.9096 k = 0.2054 0.2054 0.3973 ( 2878 PWs) bands (ev): -9.5960 -9.5960 -9.3270 -9.3270 -8.4190 -8.4190 -8.3983 -8.3983 -8.2501 -8.2501 -7.5712 -7.5712 -5.9452 -5.9452 -5.8849 -5.8849 -5.8578 -5.8578 -5.8031 -5.8031 -5.6769 -5.6769 -5.0467 -5.0467 0.6082 0.6082 2.9374 2.9374 3.9162 3.9162 5.5550 5.5550 5.9963 5.9963 7.3836 7.3836 7.4359 7.4359 7.8427 7.8427 11.0096 11.0096 12.2820 12.2820 12.8709 12.8709 14.9577 14.9577 k = 0.1964 0.1964 0.3973 ( 2880 PWs) bands (ev): -9.6011 -9.6011 -9.3259 -9.3259 -8.4196 -8.4196 -8.3999 -8.3999 -8.2609 -8.2609 -7.5682 -7.5682 -5.9476 -5.9476 -5.8860 -5.8860 -5.8596 -5.8596 -5.8055 -5.8055 -5.6857 -5.6857 -5.0384 -5.0384 0.5890 0.5890 3.0431 3.0431 3.9412 3.9412 5.4832 5.4832 6.0516 6.0516 7.3902 7.3902 7.4268 7.4268 7.8517 7.8517 10.9977 10.9977 12.2169 12.2169 12.8699 12.8699 14.9955 14.9955 k = 0.1875 0.1875 0.3973 ( 2876 PWs) bands (ev): -9.6061 -9.6061 -9.3249 -9.3249 -8.4202 -8.4202 -8.4016 -8.4016 -8.2713 -8.2713 -7.5654 -7.5654 -5.9500 -5.9500 -5.8870 -5.8870 -5.8610 -5.8610 -5.8080 -5.8080 -5.6942 -5.6942 -5.0301 -5.0301 0.5692 0.5692 3.1485 3.1485 3.9691 3.9691 5.4137 5.4137 6.1068 6.1068 7.3878 7.3878 7.4225 7.4225 7.8596 7.8596 10.9908 10.9908 12.1493 12.1493 12.8715 12.8715 15.0206 15.0206 k = 0.1786 0.1786 0.3973 ( 2876 PWs) bands (ev): -9.6111 -9.6111 -9.3241 -9.3241 -8.4206 -8.4206 -8.4031 -8.4031 -8.2812 -8.2812 -7.5629 -7.5629 -5.9522 -5.9522 -5.8879 -5.8879 -5.8623 -5.8623 -5.8106 -5.8106 -5.7024 -5.7024 -5.0221 -5.0221 0.5490 0.5490 3.2535 3.2535 3.9994 3.9994 5.3468 5.3468 6.1618 6.1618 7.3782 7.3782 7.4214 7.4214 7.8663 7.8663 10.9886 10.9886 12.0809 12.0809 12.8751 12.8751 15.0309 15.0309 k = 0.1696 0.1696 0.3973 ( 2876 PWs) bands (ev): -9.6160 -9.6160 -9.3235 -9.3235 -8.4210 -8.4210 -8.4046 -8.4046 -8.2906 -8.2906 -7.5606 -7.5605 -5.9544 -5.9544 -5.8885 -5.8885 -5.8632 -5.8632 -5.8132 -5.8132 -5.7102 -5.7102 -5.0143 -5.0143 0.5287 0.5287 3.3578 3.3578 4.0318 4.0318 5.2827 5.2827 6.2164 6.2164 7.3651 7.3651 7.4196 7.4196 7.8721 7.8721 10.9903 10.9903 12.0138 12.0138 12.8801 12.8801 15.0248 15.0248 k = 0.1607 0.1607 0.3973 ( 2880 PWs) bands (ev): -9.6208 -9.6208 -9.3230 -9.3230 -8.4212 -8.4212 -8.4060 -8.4060 -8.2996 -8.2996 -7.5584 -7.5584 -5.9565 -5.9565 -5.8891 -5.8891 -5.8639 -5.8639 -5.8160 -5.8160 -5.7178 -5.7178 -5.0066 -5.0066 0.5083 0.5083 3.4611 3.4611 4.0658 4.0658 5.2215 5.2215 6.2703 6.2703 7.3504 7.3504 7.4152 7.4152 7.8770 7.8770 10.9946 10.9946 11.9502 11.9502 12.8862 12.8862 15.0016 15.0016 k = 0.1518 0.1518 0.3973 ( 2884 PWs) bands (ev): -9.6255 -9.6255 -9.3227 -9.3227 -8.4214 -8.4214 -8.4072 -8.4072 -8.3081 -8.3081 -7.5565 -7.5565 -5.9584 -5.9584 -5.8894 -5.8894 -5.8643 -5.8643 -5.8187 -5.8187 -5.7250 -5.7250 -4.9993 -4.9993 0.4880 0.4880 3.5631 3.5631 4.1010 4.1010 5.1634 5.1634 6.3235 6.3235 7.3346 7.3346 7.4079 7.4079 7.8810 7.8810 10.9999 10.9999 11.8927 11.8927 12.8930 12.8930 14.9615 14.9615 k = 0.1429 0.1429 0.3973 ( 2884 PWs) bands (ev): -9.6301 -9.6301 -9.3225 -9.3225 -8.4214 -8.4214 -8.4084 -8.4084 -8.3161 -8.3161 -7.5548 -7.5548 -5.9603 -5.9603 -5.8896 -5.8896 -5.8645 -5.8645 -5.8215 -5.8215 -5.7320 -5.7320 -4.9922 -4.9922 0.4681 0.4681 3.6634 3.6634 4.1368 4.1368 5.1087 5.1087 6.3758 6.3758 7.3177 7.3177 7.3979 7.3979 7.8843 7.8843 11.0041 11.0041 11.8440 11.8440 12.9002 12.9002 14.9056 14.9056 k = 0.1339 0.1339 0.3973 ( 2884 PWs) bands (ev): -9.6345 -9.6345 -9.3224 -9.3224 -8.4213 -8.4213 -8.4094 -8.4094 -8.3237 -8.3237 -7.5533 -7.5533 -5.9620 -5.9620 -5.8896 -5.8896 -5.8645 -5.8645 -5.8244 -5.8244 -5.7388 -5.7388 -4.9853 -4.9853 0.4486 0.4486 3.7618 3.7618 4.1727 4.1727 5.0575 5.0575 6.4269 6.4269 7.2997 7.2997 7.3853 7.3853 7.8870 7.8870 11.0047 11.0047 11.8072 11.8072 12.9076 12.9076 14.8355 14.8355 k = 0.1250 0.1250 0.3973 ( 2880 PWs) bands (ev): -9.6388 -9.6388 -9.3224 -9.3224 -8.4212 -8.4212 -8.4103 -8.4103 -8.3308 -8.3308 -7.5519 -7.5519 -5.9637 -5.9637 -5.8894 -5.8894 -5.8642 -5.8642 -5.8272 -5.8272 -5.7452 -5.7452 -4.9788 -4.9788 0.4297 0.4297 3.8578 3.8578 4.2083 4.2083 5.0102 5.0102 6.4768 6.4768 7.2804 7.2804 7.3706 7.3706 7.8890 7.8890 10.9990 10.9990 11.7852 11.7852 12.9149 12.9149 14.7533 14.7533 k = 0.1161 0.1161 0.3973 ( 2884 PWs) bands (ev): -9.6429 -9.6429 -9.3225 -9.3225 -8.4210 -8.4210 -8.4110 -8.4110 -8.3375 -8.3375 -7.5507 -7.5507 -5.9652 -5.9652 -5.8890 -5.8890 -5.8638 -5.8638 -5.8301 -5.8301 -5.7514 -5.7514 -4.9727 -4.9727 0.4116 0.4116 3.9511 3.9511 4.2427 4.2427 4.9669 4.9669 6.5253 6.5253 7.2597 7.2597 7.3545 7.3545 7.8905 7.8905 10.9855 10.9855 11.7800 11.7800 12.9220 12.9220 14.6610 14.6610 k = 0.1071 0.1071 0.3973 ( 2882 PWs) bands (ev): -9.6468 -9.6468 -9.3227 -9.3227 -8.4208 -8.4208 -8.4115 -8.4115 -8.3439 -8.3439 -7.5496 -7.5496 -5.9667 -5.9667 -5.8883 -5.8883 -5.8632 -5.8632 -5.8330 -5.8330 -5.7574 -5.7574 -4.9669 -4.9669 0.3943 0.3943 4.0412 4.0412 4.2756 4.2756 4.9280 4.9280 6.5721 6.5721 7.2376 7.2376 7.3373 7.3373 7.8914 7.8914 10.9636 10.9636 11.7924 11.7924 12.9288 12.9288 14.5606 14.5606 k = 0.0982 0.0982 0.3973 ( 2886 PWs) bands (ev): -9.6504 -9.6504 -9.3229 -9.3229 -8.4207 -8.4207 -8.4118 -8.4118 -8.3498 -8.3498 -7.5487 -7.5487 -5.9680 -5.9680 -5.8875 -5.8875 -5.8624 -5.8624 -5.8359 -5.8359 -5.7631 -5.7631 -4.9614 -4.9614 0.3780 0.3780 4.1275 4.1275 4.3062 4.3062 4.8938 4.8938 6.6171 6.6171 7.2141 7.2141 7.3196 7.3196 7.8920 7.8920 10.9343 10.9343 11.8214 11.8214 12.9350 12.9350 14.4541 14.4541 k = 0.0893 0.0893 0.3973 ( 2890 PWs) bands (ev): -9.6538 -9.6538 -9.3231 -9.3231 -8.4205 -8.4205 -8.4118 -8.4118 -8.3553 -8.3553 -7.5479 -7.5479 -5.9692 -5.9692 -5.8864 -5.8864 -5.8614 -5.8614 -5.8388 -5.8388 -5.7685 -5.7685 -4.9564 -4.9564 0.3628 0.3628 4.2094 4.2094 4.3340 4.3340 4.8645 4.8645 6.6601 6.6601 7.1896 7.1897 7.3017 7.3017 7.8922 7.8922 10.8998 10.8998 11.8651 11.8651 12.9404 12.9404 14.3431 14.3431 k = 0.0804 0.0804 0.3973 ( 2890 PWs) bands (ev): -9.6570 -9.6570 -9.3234 -9.3234 -8.4204 -8.4204 -8.4116 -8.4116 -8.3605 -8.3605 -7.5473 -7.5473 -5.9703 -5.9703 -5.8852 -5.8852 -5.8604 -5.8604 -5.8416 -5.8416 -5.7736 -5.7736 -4.9518 -4.9518 0.3488 0.3488 4.2859 4.2859 4.3588 4.3588 4.8405 4.8405 6.7008 6.7008 7.1647 7.1647 7.2837 7.2837 7.8921 7.8921 10.8622 10.8622 11.9209 11.9209 12.9448 12.9448 14.2294 14.2294 k = 0.0714 0.0714 0.3973 ( 2894 PWs) bands (ev): -9.6599 -9.6599 -9.3236 -9.3236 -8.4204 -8.4204 -8.4110 -8.4110 -8.3654 -8.3654 -7.5467 -7.5467 -5.9713 -5.9713 -5.8837 -5.8837 -5.8592 -5.8592 -5.8445 -5.8445 -5.7784 -5.7784 -4.9476 -4.9476 0.3360 0.3360 4.3527 4.3527 4.3838 4.3838 4.8217 4.8217 6.7389 6.7389 7.1399 7.1399 7.2658 7.2658 7.8918 7.8918 10.8238 10.8238 11.9865 11.9865 12.9480 12.9480 14.1147 14.1148 k = 0.0625 0.0625 0.3973 ( 2890 PWs) bands (ev): -9.6625 -9.6625 -9.3239 -9.3239 -8.4204 -8.4204 -8.4103 -8.4103 -8.3699 -8.3699 -7.5462 -7.5462 -5.9721 -5.9721 -5.8821 -5.8821 -5.8581 -5.8581 -5.8473 -5.8473 -5.7828 -5.7828 -4.9439 -4.9439 0.3245 0.3245 4.3868 4.3868 4.4313 4.4313 4.8080 4.8080 6.7741 6.7741 7.1162 7.1162 7.2481 7.2481 7.8913 7.8913 10.7865 10.7865 12.0596 12.0596 12.9496 12.9496 14.0009 14.0009 k = 0.0536 0.0536 0.3973 ( 2894 PWs) bands (ev): -9.6647 -9.6647 -9.3242 -9.3241 -8.4205 -8.4205 -8.4092 -8.4092 -8.3740 -8.3740 -7.5458 -7.5458 -5.9729 -5.9729 -5.8803 -5.8803 -5.8569 -5.8569 -5.8500 -5.8500 -5.7869 -5.7869 -4.9406 -4.9406 0.3145 0.3145 4.4006 4.4006 4.4882 4.4882 4.7990 4.7990 6.8058 6.8058 7.0947 7.0947 7.2305 7.2305 7.8908 7.8908 10.7516 10.7516 12.1379 12.1379 12.9491 12.9491 13.8899 13.8899 k = 0.0446 0.0446 0.3973 ( 2894 PWs) bands (ev): -9.6667 -9.6667 -9.3244 -9.3244 -8.4206 -8.4206 -8.4080 -8.4080 -8.3778 -8.3778 -7.5455 -7.5455 -5.9735 -5.9735 -5.8784 -5.8784 -5.8561 -5.8561 -5.8524 -5.8524 -5.7905 -5.7905 -4.9379 -4.9379 0.3059 0.3059 4.4090 4.4090 4.5393 4.5393 4.7940 4.7940 6.8334 6.8334 7.0765 7.0765 7.2134 7.2134 7.8902 7.8902 10.7205 10.7205 12.2190 12.2190 12.9459 12.9459 13.7845 13.7845 k = 0.0357 0.0357 0.3973 ( 2888 PWs) bands (ev): -9.6683 -9.6683 -9.3246 -9.3246 -8.4207 -8.4207 -8.4067 -8.4067 -8.3812 -8.3812 -7.5453 -7.5453 -5.9740 -5.9740 -5.8763 -5.8763 -5.8567 -5.8567 -5.8533 -5.8533 -5.7936 -5.7936 -4.9356 -4.9356 0.2988 0.2988 4.4140 4.4140 4.5825 4.5825 4.7919 4.7919 6.8560 6.8560 7.0629 7.0629 7.1969 7.1969 7.8897 7.8897 10.6939 10.6939 12.3000 12.3000 12.9393 12.9393 13.6878 13.6878 k = 0.0268 0.0268 0.3973 ( 2900 PWs) bands (ev): -9.6695 -9.6695 -9.3247 -9.3247 -8.4207 -8.4207 -8.4053 -8.4053 -8.3842 -8.3842 -7.5451 -7.5451 -5.9745 -5.9745 -5.8741 -5.8741 -5.8590 -5.8590 -5.8528 -5.8528 -5.7961 -5.7961 -4.9338 -4.9338 0.2933 0.2933 4.4168 4.4168 4.6170 4.6170 4.7916 4.7916 6.8729 6.8730 7.0546 7.0547 7.1817 7.1817 7.8892 7.8892 10.6725 10.6725 12.3768 12.3768 12.9289 12.9289 13.6042 13.6042 k = 0.0179 0.0179 0.3973 ( 2900 PWs) bands (ev): -9.6704 -9.6704 -9.3249 -9.3249 -8.4208 -8.4208 -8.4040 -8.4040 -8.3866 -8.3866 -7.5449 -7.5449 -5.9748 -5.9748 -5.8719 -5.8719 -5.8615 -5.8615 -5.8521 -5.8521 -5.7980 -5.7980 -4.9325 -4.9325 0.2893 0.2893 4.4182 4.4182 4.6421 4.6421 4.7922 4.7922 6.8840 6.8840 7.0514 7.0514 7.1687 7.1687 7.8888 7.8888 10.6570 10.6570 12.4436 12.4436 12.9153 12.9153 13.5388 13.5388 k = 0.0089 0.0089 0.3973 ( 2900 PWs) bands (ev): -9.6710 -9.6710 -9.3249 -9.3249 -8.4208 -8.4208 -8.4030 -8.4030 -8.3883 -8.3883 -7.5449 -7.5449 -5.9749 -5.9749 -5.8696 -5.8696 -5.8639 -5.8639 -5.8517 -5.8517 -5.7992 -5.7992 -4.9317 -4.9317 0.2869 0.2869 4.4187 4.4187 4.6573 4.6573 4.7930 4.7930 6.8899 6.8899 7.0513 7.0513 7.1596 7.1596 7.8886 7.8886 10.6475 10.6475 12.4914 12.4914 12.9023 12.9023 13.4968 13.4968 k = 0.0000 0.0000 0.3973 ( 2900 PWs) bands (ev): -9.6712 -9.6712 -9.3250 -9.3250 -8.4209 -8.4209 -8.4026 -8.4026 -8.3889 -8.3889 -7.5448 -7.5448 -5.9750 -5.9750 -5.8682 -5.8682 -5.8654 -5.8654 -5.8515 -5.8515 -5.7996 -5.7996 -4.9315 -4.9315 0.2861 0.2861 4.4188 4.4188 4.6624 4.6624 4.7933 4.7933 6.8917 6.8917 7.0517 7.0517 7.1563 7.1563 7.8885 7.8885 10.6443 10.6443 12.5091 12.5091 12.8966 12.8966 13.4823 13.4823 k = 0.0000 0.5000-0.0000 ( 2872 PWs) bands (ev): -9.4527 -9.4527 -9.4527 -9.4527 -8.4111 -8.4111 -8.4111 -8.4111 -7.8952 -7.8952 -7.8951 -7.8951 -5.9172 -5.9172 -5.9172 -5.9172 -5.8070 -5.8070 -5.8070 -5.8070 -5.4186 -5.4186 -5.4186 -5.4186 1.6658 1.6658 1.6658 1.6658 5.4556 5.4556 5.4556 5.4556 5.8089 5.8089 5.8089 5.8089 7.1897 7.1897 7.1897 7.1897 12.2150 12.2150 12.2150 12.2150 14.8881 14.8881 14.8881 14.8881 k = 0.0000 0.5000 0.0124 ( 2876 PWs) bands (ev): -9.4527 -9.4527 -9.4527 -9.4527 -8.4112 -8.4112 -8.4112 -8.4112 -7.8951 -7.8951 -7.8951 -7.8951 -5.9173 -5.9173 -5.9173 -5.9173 -5.8069 -5.8069 -5.8069 -5.8069 -5.4185 -5.4185 -5.4185 -5.4185 1.6655 1.6655 1.6655 1.6655 5.4544 5.4544 5.4544 5.4544 5.8086 5.8086 5.8086 5.8086 7.1918 7.1918 7.1918 7.1918 12.2142 12.2142 12.2142 12.2142 14.8880 14.8880 14.8880 14.8880 k = 0.0000 0.5000 0.0248 ( 2876 PWs) bands (ev): -9.4528 -9.4528 -9.4527 -9.4527 -8.4113 -8.4113 -8.4113 -8.4113 -7.8948 -7.8948 -7.8948 -7.8948 -5.9176 -5.9176 -5.9176 -5.9176 -5.8066 -5.8066 -5.8066 -5.8066 -5.4184 -5.4184 -5.4184 -5.4184 1.6648 1.6648 1.6648 1.6648 5.4507 5.4507 5.4507 5.4507 5.8076 5.8076 5.8077 5.8077 7.1980 7.1980 7.1980 7.1980 12.2118 12.2118 12.2118 12.2118 14.8877 14.8877 14.8877 14.8877 k = 0.0000 0.5000 0.0373 ( 2888 PWs) bands (ev): -9.4529 -9.4529 -9.4529 -9.4529 -8.4114 -8.4114 -8.4114 -8.4114 -7.8944 -7.8944 -7.8944 -7.8944 -5.9180 -5.9180 -5.9180 -5.9180 -5.8061 -5.8061 -5.8061 -5.8061 -5.4182 -5.4182 -5.4181 -5.4181 1.6636 1.6636 1.6636 1.6636 5.4447 5.4447 5.4447 5.4447 5.8061 5.8061 5.8062 5.8062 7.2082 7.2082 7.2082 7.2082 12.2078 12.2078 12.2078 12.2078 14.8871 14.8871 14.8871 14.8871 k = 0.0000 0.5000 0.0497 ( 2884 PWs) bands (ev): -9.4530 -9.4530 -9.4530 -9.4530 -8.4116 -8.4116 -8.4116 -8.4116 -7.8939 -7.8939 -7.8939 -7.8939 -5.9186 -5.9186 -5.9186 -5.9186 -5.8054 -5.8054 -5.8054 -5.8054 -5.4178 -5.4178 -5.4178 -5.4178 1.6620 1.6620 1.6620 1.6620 5.4363 5.4363 5.4363 5.4363 5.8042 5.8042 5.8042 5.8042 7.2223 7.2223 7.2223 7.2223 12.2023 12.2023 12.2023 12.2023 14.8865 14.8865 14.8865 14.8865 k = 0.0000 0.5000 0.0621 ( 2888 PWs) bands (ev): -9.4532 -9.4532 -9.4532 -9.4532 -8.4119 -8.4119 -8.4119 -8.4119 -7.8932 -7.8932 -7.8931 -7.8931 -5.9194 -5.9194 -5.9194 -5.9194 -5.8045 -5.8045 -5.8045 -5.8045 -5.4174 -5.4174 -5.4174 -5.4174 1.6599 1.6599 1.6599 1.6599 5.4258 5.4258 5.4258 5.4258 5.8020 5.8020 5.8020 5.8020 7.2398 7.2398 7.2398 7.2398 12.1953 12.1953 12.1953 12.1953 14.8856 14.8856 14.8856 14.8856 k = 0.0000 0.5000 0.0745 ( 2892 PWs) bands (ev): -9.4535 -9.4535 -9.4535 -9.4535 -8.4122 -8.4122 -8.4122 -8.4122 -7.8923 -7.8923 -7.8923 -7.8923 -5.9203 -5.9203 -5.9203 -5.9203 -5.8035 -5.8035 -5.8035 -5.8035 -5.4169 -5.4169 -5.4169 -5.4169 1.6574 1.6574 1.6574 1.6574 5.4132 5.4132 5.4132 5.4132 5.7997 5.7997 5.7997 5.7997 7.2605 7.2605 7.2605 7.2605 12.1869 12.1869 12.1870 12.1870 14.8847 14.8847 14.8847 14.8847 k = 0.0000 0.5000 0.0869 ( 2892 PWs) bands (ev): -9.4537 -9.4537 -9.4537 -9.4537 -8.4126 -8.4126 -8.4126 -8.4126 -7.8913 -7.8913 -7.8913 -7.8913 -5.9213 -5.9213 -5.9213 -5.9213 -5.8023 -5.8023 -5.8023 -5.8023 -5.4163 -5.4163 -5.4163 -5.4163 1.6545 1.6545 1.6545 1.6545 5.3987 5.3987 5.3987 5.3987 5.7974 5.7974 5.7974 5.7974 7.2840 7.2840 7.2840 7.2840 12.1773 12.1773 12.1773 12.1773 14.8836 14.8836 14.8836 14.8836 k = 0.0000 0.5000 0.0993 ( 2876 PWs) bands (ev): -9.4540 -9.4540 -9.4540 -9.4540 -8.4130 -8.4130 -8.4130 -8.4130 -7.8902 -7.8902 -7.8902 -7.8902 -5.9224 -5.9224 -5.9224 -5.9224 -5.8010 -5.8010 -5.8010 -5.8010 -5.4156 -5.4156 -5.4156 -5.4156 1.6512 1.6512 1.6512 1.6512 5.3825 5.3825 5.3825 5.3825 5.7951 5.7951 5.7951 5.7951 7.3099 7.3099 7.3099 7.3099 12.1665 12.1665 12.1665 12.1665 14.8824 14.8824 14.8824 14.8824 k = 0.0000 0.5000 0.1118 ( 2876 PWs) bands (ev): -9.4544 -9.4544 -9.4544 -9.4544 -8.4134 -8.4134 -8.4134 -8.4134 -7.8890 -7.8890 -7.8890 -7.8890 -5.9236 -5.9236 -5.9236 -5.9236 -5.7995 -5.7995 -5.7995 -5.7995 -5.4149 -5.4149 -5.4149 -5.4149 1.6476 1.6476 1.6476 1.6476 5.3648 5.3648 5.3648 5.3648 5.7931 5.7931 5.7931 5.7931 7.3378 7.3378 7.3378 7.3378 12.1546 12.1546 12.1546 12.1546 14.8811 14.8811 14.8811 14.8811 k = 0.0000 0.5000 0.1242 ( 2884 PWs) bands (ev): -9.4547 -9.4547 -9.4547 -9.4547 -8.4139 -8.4139 -8.4139 -8.4139 -7.8876 -7.8876 -7.8876 -7.8876 -5.9249 -5.9249 -5.9249 -5.9249 -5.7980 -5.7980 -5.7980 -5.7980 -5.4141 -5.4141 -5.4141 -5.4141 1.6436 1.6436 1.6436 1.6436 5.3460 5.3460 5.3460 5.3460 5.7913 5.7913 5.7913 5.7913 7.3673 7.3673 7.3673 7.3673 12.1417 12.1417 12.1417 12.1417 14.8797 14.8797 14.8797 14.8797 k = 0.0000 0.5000 0.1366 ( 2884 PWs) bands (ev): -9.4551 -9.4551 -9.4551 -9.4551 -8.4144 -8.4144 -8.4144 -8.4144 -7.8862 -7.8862 -7.8862 -7.8862 -5.9262 -5.9262 -5.9262 -5.9262 -5.7964 -5.7964 -5.7964 -5.7964 -5.4132 -5.4132 -5.4132 -5.4132 1.6394 1.6394 1.6394 1.6394 5.3262 5.3262 5.3262 5.3262 5.7898 5.7898 5.7899 5.7899 7.3981 7.3981 7.3981 7.3981 12.1281 12.1281 12.1281 12.1281 14.8782 14.8782 14.8782 14.8782 k = 0.0000 0.5000 0.1490 ( 2888 PWs) bands (ev): -9.4555 -9.4555 -9.4555 -9.4555 -8.4149 -8.4149 -8.4149 -8.4149 -7.8847 -7.8847 -7.8847 -7.8847 -5.9276 -5.9276 -5.9276 -5.9276 -5.7948 -5.7948 -5.7948 -5.7948 -5.4123 -5.4123 -5.4123 -5.4123 1.6350 1.6350 1.6350 1.6350 5.3058 5.3058 5.3058 5.3058 5.7887 5.7887 5.7887 5.7887 7.4297 7.4297 7.4297 7.4297 12.1137 12.1137 12.1138 12.1138 14.8765 14.8765 14.8765 14.8765 k = 0.0000 0.5000 0.1614 ( 2886 PWs) bands (ev): -9.4560 -9.4560 -9.4560 -9.4560 -8.4155 -8.4155 -8.4155 -8.4155 -7.8832 -7.8832 -7.8832 -7.8832 -5.9290 -5.9290 -5.9290 -5.9290 -5.7931 -5.7931 -5.7931 -5.7931 -5.4114 -5.4114 -5.4114 -5.4114 1.6303 1.6303 1.6303 1.6303 5.2850 5.2850 5.2850 5.2850 5.7878 5.7878 5.7878 5.7878 7.4618 7.4618 7.4618 7.4618 12.0989 12.0989 12.0989 12.0989 14.8747 14.8747 14.8747 14.8747 k = 0.0000 0.5000 0.1738 ( 2882 PWs) bands (ev): -9.4564 -9.4564 -9.4564 -9.4564 -8.4160 -8.4160 -8.4160 -8.4160 -7.8816 -7.8816 -7.8816 -7.8816 -5.9304 -5.9304 -5.9304 -5.9304 -5.7914 -5.7914 -5.7914 -5.7914 -5.4104 -5.4104 -5.4104 -5.4104 1.6255 1.6255 1.6255 1.6255 5.2640 5.2640 5.2640 5.2640 5.7872 5.7872 5.7872 5.7872 7.4941 7.4941 7.4941 7.4941 12.0838 12.0838 12.0838 12.0838 14.8727 14.8727 14.8727 14.8727 k = 0.0000 0.5000 0.1863 ( 2882 PWs) bands (ev): -9.4569 -9.4569 -9.4569 -9.4569 -8.4166 -8.4166 -8.4166 -8.4166 -7.8800 -7.8800 -7.8800 -7.8800 -5.9318 -5.9318 -5.9318 -5.9318 -5.7897 -5.7897 -5.7897 -5.7897 -5.4094 -5.4094 -5.4094 -5.4094 1.6206 1.6206 1.6206 1.6206 5.2431 5.2431 5.2431 5.2431 5.7868 5.7868 5.7868 5.7868 7.5263 7.5263 7.5263 7.5263 12.0684 12.0684 12.0684 12.0684 14.8705 14.8705 14.8705 14.8705 k = 0.0000 0.5000 0.1987 ( 2872 PWs) bands (ev): -9.4573 -9.4573 -9.4573 -9.4573 -8.4172 -8.4172 -8.4172 -8.4172 -7.8784 -7.8784 -7.8784 -7.8784 -5.9332 -5.9332 -5.9332 -5.9332 -5.7880 -5.7880 -5.7880 -5.7880 -5.4084 -5.4084 -5.4084 -5.4084 1.6156 1.6156 1.6156 1.6156 5.2225 5.2225 5.2225 5.2225 5.7867 5.7867 5.7867 5.7867 7.5580 7.5580 7.5580 7.5580 12.0530 12.0530 12.0530 12.0530 14.8680 14.8680 14.8680 14.8680 k = 0.0000 0.5000 0.2111 ( 2876 PWs) bands (ev): -9.4578 -9.4578 -9.4578 -9.4578 -8.4177 -8.4177 -8.4177 -8.4177 -7.8767 -7.8767 -7.8767 -7.8767 -5.9345 -5.9345 -5.9345 -5.9345 -5.7864 -5.7864 -5.7864 -5.7864 -5.4074 -5.4074 -5.4074 -5.4074 1.6106 1.6106 1.6106 1.6106 5.2024 5.2024 5.2024 5.2024 5.7868 5.7868 5.7868 5.7868 7.5890 7.5890 7.5890 7.5890 12.0377 12.0377 12.0377 12.0377 14.8653 14.8653 14.8653 14.8653 k = 0.0000 0.5000 0.2235 ( 2890 PWs) bands (ev): -9.4582 -9.4582 -9.4582 -9.4582 -8.4183 -8.4183 -8.4183 -8.4183 -7.8751 -7.8751 -7.8751 -7.8751 -5.9358 -5.9358 -5.9358 -5.9358 -5.7848 -5.7848 -5.7848 -5.7848 -5.4064 -5.4064 -5.4064 -5.4064 1.6057 1.6057 1.6057 1.6057 5.1829 5.1829 5.1829 5.1829 5.7870 5.7870 5.7870 5.7870 7.6191 7.6191 7.6191 7.6191 12.0226 12.0226 12.0226 12.0226 14.8623 14.8623 14.8623 14.8623 k = 0.0000 0.5000 0.2359 ( 2890 PWs) bands (ev): -9.4587 -9.4587 -9.4587 -9.4587 -8.4189 -8.4189 -8.4189 -8.4189 -7.8736 -7.8736 -7.8736 -7.8736 -5.9371 -5.9371 -5.9371 -5.9371 -5.7832 -5.7832 -5.7832 -5.7832 -5.4054 -5.4054 -5.4054 -5.4054 1.6008 1.6008 1.6008 1.6008 5.1642 5.1642 5.1642 5.1642 5.7874 5.7874 5.7874 5.7874 7.6481 7.6481 7.6481 7.6481 12.0079 12.0079 12.0079 12.0079 14.8592 14.8592 14.8592 14.8592 k = 0.0000 0.5000 0.2483 ( 2880 PWs) bands (ev): -9.4591 -9.4591 -9.4591 -9.4591 -8.4194 -8.4194 -8.4194 -8.4194 -7.8720 -7.8720 -7.8720 -7.8720 -5.9383 -5.9383 -5.9383 -5.9383 -5.7817 -5.7817 -5.7817 -5.7817 -5.4045 -5.4045 -5.4045 -5.4045 1.5961 1.5961 1.5961 1.5961 5.1464 5.1464 5.1464 5.1464 5.7878 5.7878 5.7878 5.7878 7.6756 7.6756 7.6756 7.6756 11.9938 11.9938 11.9938 11.9938 14.8558 14.8558 14.8558 14.8558 k = 0.0000 0.5000 0.2608 ( 2880 PWs) bands (ev): -9.4595 -9.4595 -9.4595 -9.4595 -8.4199 -8.4199 -8.4199 -8.4199 -7.8706 -7.8706 -7.8706 -7.8706 -5.9394 -5.9394 -5.9394 -5.9394 -5.7803 -5.7803 -5.7803 -5.7803 -5.4036 -5.4036 -5.4036 -5.4036 1.5915 1.5915 1.5915 1.5915 5.1297 5.1297 5.1297 5.1297 5.7884 5.7884 5.7884 5.7884 7.7016 7.7016 7.7016 7.7016 11.9803 11.9803 11.9803 11.9803 14.8524 14.8524 14.8524 14.8524 k = 0.0000 0.5000 0.2732 ( 2880 PWs) bands (ev): -9.4599 -9.4599 -9.4599 -9.4599 -8.4204 -8.4204 -8.4204 -8.4204 -7.8692 -7.8692 -7.8692 -7.8692 -5.9405 -5.9405 -5.9405 -5.9405 -5.7790 -5.7790 -5.7790 -5.7790 -5.4027 -5.4027 -5.4027 -5.4027 1.5872 1.5872 1.5872 1.5872 5.1141 5.1141 5.1141 5.1141 5.7890 5.7890 5.7890 5.7890 7.7259 7.7259 7.7259 7.7259 11.9675 11.9675 11.9675 11.9675 14.8488 14.8488 14.8488 14.8488 k = 0.0000 0.5000 0.2856 ( 2880 PWs) bands (ev): -9.4603 -9.4603 -9.4602 -9.4602 -8.4208 -8.4208 -8.4208 -8.4208 -7.8679 -7.8679 -7.8679 -7.8679 -5.9414 -5.9414 -5.9414 -5.9414 -5.7778 -5.7778 -5.7778 -5.7778 -5.4019 -5.4019 -5.4019 -5.4019 1.5831 1.5831 1.5831 1.5831 5.0998 5.0998 5.0998 5.0998 5.7896 5.7896 5.7896 5.7896 7.7483 7.7483 7.7483 7.7483 11.9557 11.9557 11.9557 11.9557 14.8453 14.8453 14.8453 14.8453 k = 0.0000 0.5000 0.2980 ( 2880 PWs) bands (ev): -9.4606 -9.4606 -9.4606 -9.4606 -8.4212 -8.4212 -8.4212 -8.4212 -7.8667 -7.8667 -7.8667 -7.8667 -5.9423 -5.9423 -5.9423 -5.9423 -5.7767 -5.7767 -5.7767 -5.7767 -5.4011 -5.4011 -5.4011 -5.4011 1.5794 1.5794 1.5794 1.5794 5.0868 5.0868 5.0868 5.0868 5.7902 5.7902 5.7902 5.7902 7.7687 7.7687 7.7687 7.7687 11.9448 11.9448 11.9448 11.9448 14.8419 14.8419 14.8419 14.8419 k = 0.0000 0.5000 0.3104 ( 2886 PWs) bands (ev): -9.4609 -9.4609 -9.4609 -9.4609 -8.4216 -8.4216 -8.4216 -8.4216 -7.8657 -7.8657 -7.8656 -7.8656 -5.9431 -5.9431 -5.9431 -5.9431 -5.7757 -5.7757 -5.7757 -5.7757 -5.4004 -5.4004 -5.4004 -5.4004 1.5760 1.5760 1.5760 1.5760 5.0752 5.0752 5.0752 5.0752 5.7907 5.7907 5.7908 5.7908 7.7870 7.7870 7.7870 7.7870 11.9350 11.9350 11.9350 11.9350 14.8386 14.8386 14.8386 14.8386 k = 0.0000 0.5000 0.3228 ( 2888 PWs) bands (ev): -9.4612 -9.4612 -9.4612 -9.4612 -8.4219 -8.4219 -8.4219 -8.4219 -7.8647 -7.8647 -7.8647 -7.8647 -5.9438 -5.9438 -5.9438 -5.9438 -5.7748 -5.7748 -5.7748 -5.7748 -5.3998 -5.3998 -5.3998 -5.3998 1.5730 1.5730 1.5730 1.5730 5.0651 5.0651 5.0651 5.0651 5.7913 5.7913 5.7913 5.7913 7.8030 7.8030 7.8030 7.8030 11.9264 11.9264 11.9264 11.9264 14.8356 14.8356 14.8356 14.8356 k = 0.0000 0.5000 0.3353 ( 2884 PWs) bands (ev): -9.4614 -9.4614 -9.4614 -9.4614 -8.4222 -8.4222 -8.4222 -8.4222 -7.8639 -7.8639 -7.8639 -7.8639 -5.9444 -5.9444 -5.9444 -5.9444 -5.7740 -5.7740 -5.7740 -5.7740 -5.3993 -5.3993 -5.3993 -5.3993 1.5704 1.5704 1.5704 1.5704 5.0564 5.0564 5.0564 5.0564 5.7918 5.7918 5.7918 5.7918 7.8167 7.8167 7.8168 7.8168 11.9189 11.9189 11.9189 11.9189 14.8329 14.8329 14.8329 14.8329 k = 0.0000 0.5000 0.3477 ( 2880 PWs) bands (ev): -9.4616 -9.4616 -9.4616 -9.4616 -8.4224 -8.4224 -8.4224 -8.4224 -7.8632 -7.8632 -7.8632 -7.8632 -5.9449 -5.9449 -5.9449 -5.9449 -5.7734 -5.7734 -5.7734 -5.7734 -5.3989 -5.3989 -5.3989 -5.3989 1.5682 1.5682 1.5682 1.5682 5.0492 5.0492 5.0492 5.0492 5.7922 5.7922 5.7922 5.7922 7.8281 7.8281 7.8281 7.8281 11.9128 11.9128 11.9128 11.9128 14.8306 14.8306 14.8306 14.8306 k = 0.0000 0.5000 0.3601 ( 2884 PWs) bands (ev): -9.4617 -9.4617 -9.4617 -9.4617 -8.4226 -8.4226 -8.4226 -8.4226 -7.8627 -7.8627 -7.8627 -7.8627 -5.9453 -5.9453 -5.9453 -5.9453 -5.7729 -5.7729 -5.7729 -5.7729 -5.3985 -5.3985 -5.3985 -5.3985 1.5665 1.5665 1.5665 1.5665 5.0437 5.0437 5.0437 5.0437 5.7925 5.7925 5.7925 5.7925 7.8369 7.8369 7.8369 7.8369 11.9079 11.9079 11.9079 11.9079 14.8288 14.8288 14.8288 14.8288 k = 0.0000 0.5000 0.3725 ( 2884 PWs) bands (ev): -9.4618 -9.4618 -9.4618 -9.4618 -8.4227 -8.4227 -8.4227 -8.4227 -7.8623 -7.8623 -7.8623 -7.8623 -5.9456 -5.9456 -5.9456 -5.9456 -5.7726 -5.7726 -5.7726 -5.7726 -5.3983 -5.3983 -5.3983 -5.3983 1.5652 1.5652 1.5652 1.5652 5.0397 5.0397 5.0397 5.0397 5.7928 5.7928 5.7928 5.7928 7.8433 7.8433 7.8433 7.8433 11.9044 11.9044 11.9044 11.9044 14.8274 14.8274 14.8274 14.8274 k = 0.0000 0.5000 0.3849 ( 2880 PWs) bands (ev): -9.4619 -9.4619 -9.4619 -9.4619 -8.4228 -8.4228 -8.4228 -8.4228 -7.8620 -7.8620 -7.8620 -7.8620 -5.9457 -5.9457 -5.9457 -5.9457 -5.7724 -5.7724 -5.7724 -5.7724 -5.3981 -5.3981 -5.3981 -5.3981 1.5645 1.5645 1.5645 1.5645 5.0373 5.0373 5.0373 5.0373 5.7929 5.7929 5.7929 5.7929 7.8471 7.8471 7.8471 7.8471 11.9023 11.9023 11.9023 11.9023 14.8266 14.8266 14.8266 14.8266 k = 0.0000 0.5000 0.3973 ( 2896 PWs) bands (ev): -9.4619 -9.4619 -9.4619 -9.4619 -8.4228 -8.4228 -8.4228 -8.4228 -7.8620 -7.8620 -7.8620 -7.8620 -5.9458 -5.9458 -5.9458 -5.9458 -5.7723 -5.7723 -5.7723 -5.7723 -5.3981 -5.3981 -5.3981 -5.3981 1.5642 1.5642 1.5642 1.5642 5.0364 5.0364 5.0364 5.0364 5.7930 5.7930 5.7930 5.7930 7.8484 7.8484 7.8484 7.8484 11.9016 11.9016 11.9016 11.9016 14.8263 14.8263 14.8263 14.8263 k = 0.5000 0.5000-0.0000 ( 2904 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3641 -8.3641 -8.3641 -8.3641 -7.7951 -7.7951 -7.7951 -7.7951 -5.8588 -5.8588 -5.8588 -5.8588 -5.7392 -5.7392 -5.7392 -5.7392 -5.3854 -5.3854 -5.3854 -5.3854 0.5952 0.5952 0.5952 0.5952 5.2899 5.2899 5.2899 5.2899 7.2090 7.2090 7.2090 7.2090 7.7332 7.7332 7.7332 7.7332 10.0749 10.0749 10.0749 10.0749 14.2129 14.2129 14.2129 14.2129 k = 0.5000 0.5000 0.0124 ( 2912 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3641 -8.3641 -8.3641 -8.3641 -7.7951 -7.7951 -7.7951 -7.7951 -5.8588 -5.8588 -5.8588 -5.8588 -5.7394 -5.7394 -5.7394 -5.7394 -5.3852 -5.3852 -5.3852 -5.3852 0.5953 0.5953 0.5954 0.5954 5.2886 5.2886 5.2886 5.2886 7.2076 7.2076 7.2076 7.2076 7.7332 7.7332 7.7332 7.7332 10.0784 10.0784 10.0784 10.0784 14.2142 14.2142 14.2142 14.2142 k = 0.5000 0.5000 0.0248 ( 2912 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3642 -8.3642 -8.3642 -8.3642 -7.7952 -7.7952 -7.7952 -7.7952 -5.8587 -5.8587 -5.8587 -5.8587 -5.7398 -5.7398 -5.7398 -5.7398 -5.3844 -5.3844 -5.3844 -5.3844 0.5959 0.5959 0.5959 0.5959 5.2848 5.2848 5.2849 5.2849 7.2033 7.2033 7.2033 7.2033 7.7332 7.7332 7.7332 7.7332 10.0887 10.0887 10.0887 10.0887 14.2179 14.2179 14.2179 14.2179 k = 0.5000 0.5000 0.0373 ( 2920 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3642 -8.3642 -8.3642 -8.3642 -7.7952 -7.7952 -7.7952 -7.7952 -5.8586 -5.8586 -5.8586 -5.8586 -5.7405 -5.7405 -5.7405 -5.7405 -5.3831 -5.3831 -5.3831 -5.3831 0.5968 0.5968 0.5968 0.5968 5.2787 5.2787 5.2787 5.2787 7.1962 7.1962 7.1962 7.1962 7.7331 7.7331 7.7331 7.7331 10.1058 10.1058 10.1058 10.1058 14.2241 14.2241 14.2241 14.2241 k = 0.5000 0.5000 0.0497 ( 2924 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3643 -8.3643 -8.3643 -8.3643 -7.7953 -7.7953 -7.7953 -7.7953 -5.8585 -5.8585 -5.8585 -5.8585 -5.7415 -5.7415 -5.7415 -5.7415 -5.3814 -5.3814 -5.3814 -5.3814 0.5980 0.5980 0.5980 0.5980 5.2701 5.2701 5.2701 5.2701 7.1863 7.1863 7.1863 7.1863 7.7331 7.7331 7.7331 7.7331 10.1296 10.1296 10.1296 10.1296 14.2326 14.2326 14.2326 14.2326 k = 0.5000 0.5000 0.0621 ( 2924 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3645 -8.3645 -8.3645 -8.3645 -7.7954 -7.7954 -7.7954 -7.7954 -5.8583 -5.8583 -5.8583 -5.8583 -5.7428 -5.7428 -5.7428 -5.7428 -5.3792 -5.3792 -5.3792 -5.3792 0.5996 0.5996 0.5996 0.5996 5.2594 5.2594 5.2594 5.2594 7.1739 7.1739 7.1739 7.1739 7.7331 7.7331 7.7331 7.7331 10.1601 10.1601 10.1601 10.1601 14.2431 14.2431 14.2431 14.2431 k = 0.5000 0.5000 0.0745 ( 2924 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3646 -8.3646 -8.3646 -8.3646 -7.7956 -7.7956 -7.7956 -7.7956 -5.8580 -5.8580 -5.8580 -5.8580 -5.7443 -5.7443 -5.7443 -5.7443 -5.3766 -5.3766 -5.3766 -5.3766 0.6015 0.6015 0.6015 0.6015 5.2465 5.2465 5.2465 5.2465 7.1589 7.1589 7.1589 7.1589 7.7330 7.7330 7.7330 7.7330 10.1970 10.1970 10.1970 10.1970 14.2555 14.2555 14.2555 14.2555 k = 0.5000 0.5000 0.0869 ( 2908 PWs) bands (ev): -9.4437 -9.4437 -9.4437 -9.4437 -8.3648 -8.3648 -8.3648 -8.3648 -7.7957 -7.7957 -7.7957 -7.7957 -5.8577 -5.8577 -5.8577 -5.8577 -5.7461 -5.7461 -5.7461 -5.7461 -5.3736 -5.3736 -5.3736 -5.3736 0.6037 0.6037 0.6037 0.6037 5.2318 5.2318 5.2318 5.2318 7.1417 7.1417 7.1417 7.1417 7.7330 7.7330 7.7330 7.7330 10.2401 10.2401 10.2401 10.2401 14.2693 14.2693 14.2693 14.2693 k = 0.5000 0.5000 0.0993 ( 2900 PWs) bands (ev): -9.4437 -9.4437 -9.4436 -9.4436 -8.3650 -8.3650 -8.3650 -8.3650 -7.7959 -7.7959 -7.7959 -7.7959 -5.8574 -5.8574 -5.8574 -5.8574 -5.7480 -5.7480 -5.7480 -5.7480 -5.3703 -5.3703 -5.3703 -5.3703 0.6062 0.6062 0.6062 0.6062 5.2154 5.2154 5.2154 5.2154 7.1224 7.1224 7.1224 7.1224 7.7329 7.7329 7.7329 7.7329 10.2893 10.2893 10.2893 10.2893 14.2844 14.2844 14.2844 14.2844 k = 0.5000 0.5000 0.1118 ( 2900 PWs) bands (ev): -9.4436 -9.4436 -9.4436 -9.4436 -8.3652 -8.3652 -8.3652 -8.3652 -7.7961 -7.7961 -7.7961 -7.7961 -5.8570 -5.8570 -5.8570 -5.8570 -5.7501 -5.7501 -5.7501 -5.7501 -5.3666 -5.3666 -5.3666 -5.3666 0.6090 0.6090 0.6090 0.6090 5.1975 5.1975 5.1975 5.1975 7.1012 7.1012 7.1012 7.1012 7.7328 7.7328 7.7328 7.7328 10.3444 10.3444 10.3444 10.3444 14.3002 14.3002 14.3002 14.3002 k = 0.5000 0.5000 0.1242 ( 2900 PWs) bands (ev): -9.4436 -9.4436 -9.4436 -9.4436 -8.3654 -8.3654 -8.3654 -8.3654 -7.7963 -7.7963 -7.7963 -7.7963 -5.8565 -5.8565 -5.8565 -5.8565 -5.7524 -5.7524 -5.7524 -5.7524 -5.3627 -5.3627 -5.3627 -5.3627 0.6120 0.6120 0.6120 0.6120 5.1784 5.1784 5.1784 5.1784 7.0783 7.0783 7.0783 7.0783 7.7328 7.7328 7.7328 7.7328 10.4050 10.4050 10.4050 10.4050 14.3165 14.3165 14.3165 14.3165 k = 0.5000 0.5000 0.1366 ( 2900 PWs) bands (ev): -9.4436 -9.4436 -9.4436 -9.4436 -8.3656 -8.3656 -8.3656 -8.3656 -7.7966 -7.7966 -7.7966 -7.7966 -5.8561 -5.8561 -5.8561 -5.8561 -5.7548 -5.7548 -5.7548 -5.7548 -5.3586 -5.3586 -5.3586 -5.3586 0.6153 0.6153 0.6153 0.6153 5.1582 5.1582 5.1582 5.1582 7.0540 7.0540 7.0540 7.0540 7.7327 7.7327 7.7327 7.7327 10.4709 10.4709 10.4709 10.4709 14.3327 14.3327 14.3327 14.3327 k = 0.5000 0.5000 0.1490 ( 2900 PWs) bands (ev): -9.4436 -9.4436 -9.4436 -9.4436 -8.3659 -8.3659 -8.3659 -8.3659 -7.7968 -7.7968 -7.7968 -7.7968 -5.8555 -5.8555 -5.8555 -5.8555 -5.7573 -5.7573 -5.7573 -5.7573 -5.3542 -5.3542 -5.3542 -5.3542 0.6187 0.6187 0.6187 0.6187 5.1372 5.1372 5.1372 5.1372 7.0286 7.0286 7.0286 7.0286 7.7326 7.7326 7.7326 7.7326 10.5418 10.5418 10.5418 10.5418 14.3485 14.3485 14.3485 14.3485 k = 0.5000 0.5000 0.1614 ( 2892 PWs) bands (ev): -9.4435 -9.4435 -9.4435 -9.4435 -8.3662 -8.3662 -8.3662 -8.3662 -7.7971 -7.7971 -7.7971 -7.7971 -5.8550 -5.8550 -5.8550 -5.8550 -5.7599 -5.7599 -5.7599 -5.7599 -5.3498 -5.3498 -5.3498 -5.3498 0.6222 0.6222 0.6222 0.6222 5.1157 5.1157 5.1157 5.1157 7.0023 7.0023 7.0023 7.0023 7.7325 7.7325 7.7325 7.7325 10.6175 10.6175 10.6175 10.6175 14.3632 14.3632 14.3632 14.3632 k = 0.5000 0.5000 0.1738 ( 2876 PWs) bands (ev): -9.4435 -9.4435 -9.4435 -9.4435 -8.3664 -8.3664 -8.3664 -8.3664 -7.7973 -7.7973 -7.7973 -7.7973 -5.8543 -5.8543 -5.8543 -5.8543 -5.7625 -5.7625 -5.7625 -5.7625 -5.3452 -5.3452 -5.3452 -5.3452 0.6259 0.6259 0.6259 0.6259 5.0938 5.0938 5.0938 5.0938 6.9753 6.9753 6.9754 6.9754 7.7324 7.7324 7.7324 7.7324 10.6976 10.6976 10.6976 10.6976 14.3762 14.3762 14.3762 14.3762 k = 0.5000 0.5000 0.1863 ( 2884 PWs) bands (ev): -9.4435 -9.4435 -9.4435 -9.4435 -8.3667 -8.3667 -8.3667 -8.3667 -7.7976 -7.7976 -7.7976 -7.7976 -5.8537 -5.8537 -5.8537 -5.8537 -5.7652 -5.7652 -5.7652 -5.7652 -5.3406 -5.3406 -5.3406 -5.3406 0.6297 0.6297 0.6297 0.6297 5.0718 5.0718 5.0718 5.0718 6.9481 6.9481 6.9481 6.9481 7.7323 7.7323 7.7323 7.7323 10.7818 10.7818 10.7818 10.7818 14.3868 14.3868 14.3868 14.3868 k = 0.5000 0.5000 0.1987 ( 2892 PWs) bands (ev): -9.4435 -9.4435 -9.4435 -9.4435 -8.3670 -8.3670 -8.3670 -8.3670 -7.7979 -7.7979 -7.7979 -7.7979 -5.8530 -5.8530 -5.8530 -5.8530 -5.7678 -5.7678 -5.7678 -5.7678 -5.3361 -5.3361 -5.3361 -5.3361 0.6336 0.6336 0.6336 0.6336 5.0499 5.0499 5.0499 5.0499 6.9208 6.9208 6.9208 6.9208 7.7322 7.7322 7.7322 7.7322 10.8698 10.8698 10.8698 10.8698 14.3940 14.3940 14.3940 14.3940 k = 0.5000 0.5000 0.2111 ( 2888 PWs) bands (ev): -9.4434 -9.4434 -9.4434 -9.4434 -8.3673 -8.3673 -8.3673 -8.3673 -7.7981 -7.7981 -7.7981 -7.7981 -5.8522 -5.8522 -5.8522 -5.8522 -5.7705 -5.7705 -5.7705 -5.7705 -5.3315 -5.3315 -5.3315 -5.3315 0.6374 0.6374 0.6374 0.6374 5.0283 5.0283 5.0284 5.0284 6.8936 6.8936 6.8936 6.8936 7.7321 7.7321 7.7321 7.7321 10.9611 10.9611 10.9611 10.9611 14.3965 14.3965 14.3965 14.3965 k = 0.5000 0.5000 0.2235 ( 2888 PWs) bands (ev): -9.4434 -9.4434 -9.4434 -9.4434 -8.3676 -8.3676 -8.3676 -8.3676 -7.7984 -7.7984 -7.7984 -7.7984 -5.8514 -5.8514 -5.8514 -5.8514 -5.7731 -5.7731 -5.7731 -5.7731 -5.3271 -5.3271 -5.3271 -5.3271 0.6412 0.6412 0.6412 0.6412 5.0073 5.0073 5.0073 5.0073 6.8669 6.8669 6.8669 6.8669 7.7320 7.7320 7.7320 7.7320 11.0555 11.0555 11.0555 11.0555 14.3928 14.3928 14.3928 14.3928 k = 0.5000 0.5000 0.2359 ( 2876 PWs) bands (ev): -9.4434 -9.4434 -9.4434 -9.4434 -8.3679 -8.3679 -8.3679 -8.3679 -7.7986 -7.7986 -7.7986 -7.7986 -5.8506 -5.8506 -5.8506 -5.8506 -5.7757 -5.7757 -5.7757 -5.7757 -5.3228 -5.3228 -5.3228 -5.3228 0.6450 0.6450 0.6450 0.6450 4.9869 4.9869 4.9869 4.9869 6.8409 6.8409 6.8409 6.8409 7.7319 7.7319 7.7319 7.7319 11.1526 11.1526 11.1526 11.1526 14.3804 14.3804 14.3804 14.3804 k = 0.5000 0.5000 0.2483 ( 2876 PWs) bands (ev): -9.4434 -9.4434 -9.4434 -9.4434 -8.3681 -8.3681 -8.3681 -8.3681 -7.7989 -7.7989 -7.7989 -7.7989 -5.8498 -5.8498 -5.8498 -5.8498 -5.7783 -5.7783 -5.7783 -5.7783 -5.3186 -5.3186 -5.3186 -5.3186 0.6487 0.6487 0.6487 0.6487 4.9673 4.9673 4.9673 4.9673 6.8158 6.8158 6.8158 6.8158 7.7318 7.7318 7.7318 7.7318 11.2517 11.2517 11.2518 11.2518 14.3566 14.3566 14.3566 14.3566 k = 0.5000 0.5000 0.2608 ( 2876 PWs) bands (ev): -9.4433 -9.4433 -9.4433 -9.4433 -8.3684 -8.3684 -8.3684 -8.3684 -7.7991 -7.7991 -7.7991 -7.7991 -5.8489 -5.8489 -5.8489 -5.8489 -5.7807 -5.7807 -5.7807 -5.7807 -5.3146 -5.3146 -5.3146 -5.3146 0.6522 0.6522 0.6522 0.6522 4.9487 4.9487 4.9488 4.9488 6.7919 6.7919 6.7919 6.7919 7.7317 7.7317 7.7317 7.7317 11.3526 11.3526 11.3526 11.3526 14.3188 14.3188 14.3188 14.3188 k = 0.5000 0.5000 0.2732 ( 2876 PWs) bands (ev): -9.4433 -9.4433 -9.4433 -9.4433 -8.3687 -8.3687 -8.3687 -8.3687 -7.7993 -7.7993 -7.7993 -7.7993 -5.8481 -5.8481 -5.8481 -5.8481 -5.7831 -5.7831 -5.7831 -5.7831 -5.3109 -5.3109 -5.3109 -5.3109 0.6556 0.6556 0.6556 0.6556 4.9313 4.9313 4.9313 4.9313 6.7694 6.7694 6.7694 6.7694 7.7316 7.7316 7.7316 7.7316 11.4544 11.4544 11.4544 11.4544 14.2653 14.2653 14.2653 14.2653 k = 0.5000 0.5000 0.2856 ( 2900 PWs) bands (ev): -9.4433 -9.4433 -9.4433 -9.4433 -8.3689 -8.3689 -8.3689 -8.3689 -7.7995 -7.7995 -7.7995 -7.7995 -5.8472 -5.8472 -5.8472 -5.8472 -5.7853 -5.7853 -5.7853 -5.7853 -5.3074 -5.3074 -5.3074 -5.3074 0.6588 0.6588 0.6588 0.6588 4.9152 4.9152 4.9152 4.9152 6.7483 6.7483 6.7483 6.7483 7.7315 7.7315 7.7315 7.7315 11.5566 11.5566 11.5566 11.5566 14.1970 14.1970 14.1970 14.1970 k = 0.5000 0.5000 0.2980 ( 2900 PWs) bands (ev): -9.4433 -9.4433 -9.4433 -9.4433 -8.3691 -8.3691 -8.3691 -8.3691 -7.7997 -7.7997 -7.7997 -7.7997 -5.8464 -5.8464 -5.8464 -5.8464 -5.7874 -5.7874 -5.7874 -5.7874 -5.3043 -5.3043 -5.3043 -5.3043 0.6617 0.6617 0.6617 0.6617 4.9004 4.9004 4.9004 4.9004 6.7290 6.7290 6.7290 6.7290 7.7314 7.7314 7.7314 7.7314 11.6581 11.6581 11.6581 11.6581 14.1170 14.1170 14.1170 14.1170 k = 0.5000 0.5000 0.3104 ( 2884 PWs) bands (ev): -9.4433 -9.4433 -9.4432 -9.4432 -8.3693 -8.3693 -8.3693 -8.3693 -7.7999 -7.7999 -7.7999 -7.7999 -5.8456 -5.8456 -5.8456 -5.8456 -5.7893 -5.7893 -5.7893 -5.7893 -5.3014 -5.3014 -5.3014 -5.3014 0.6644 0.6644 0.6644 0.6644 4.8872 4.8872 4.8872 4.8872 6.7116 6.7116 6.7116 6.7116 7.7314 7.7314 7.7314 7.7314 11.7578 11.7578 11.7578 11.7578 14.0297 14.0297 14.0297 14.0297 k = 0.5000 0.5000 0.3228 ( 2884 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3695 -8.3695 -8.3695 -8.3695 -7.8000 -7.8000 -7.8000 -7.8000 -5.8448 -5.8448 -5.8448 -5.8448 -5.7910 -5.7910 -5.7910 -5.7910 -5.2989 -5.2989 -5.2989 -5.2989 0.6668 0.6668 0.6668 0.6668 4.8755 4.8755 4.8755 4.8755 6.6963 6.6963 6.6963 6.6963 7.7313 7.7313 7.7313 7.7313 11.8542 11.8542 11.8542 11.8542 13.9396 13.9396 13.9396 13.9396 k = 0.5000 0.5000 0.3353 ( 2884 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3696 -8.3696 -8.3696 -8.3696 -7.8002 -7.8002 -7.8002 -7.8002 -5.8441 -5.8441 -5.8441 -5.8441 -5.7926 -5.7926 -5.7926 -5.7926 -5.2967 -5.2967 -5.2967 -5.2967 0.6688 0.6688 0.6688 0.6688 4.8655 4.8655 4.8655 4.8655 6.6830 6.6830 6.6830 6.6830 7.7312 7.7312 7.7312 7.7312 11.9454 11.9454 11.9454 11.9454 13.8510 13.8510 13.8510 13.8510 k = 0.5000 0.5000 0.3477 ( 2884 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3698 -8.3698 -8.3698 -8.3698 -7.8003 -7.8003 -7.8003 -7.8003 -5.8435 -5.8435 -5.8435 -5.8435 -5.7939 -5.7939 -5.7939 -5.7939 -5.2949 -5.2949 -5.2949 -5.2949 0.6706 0.6706 0.6706 0.6706 4.8572 4.8572 4.8572 4.8572 6.6721 6.6721 6.6721 6.6721 7.7312 7.7312 7.7312 7.7312 12.0285 12.0285 12.0285 12.0285 13.7683 13.7683 13.7683 13.7683 k = 0.5000 0.5000 0.3601 ( 2884 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3699 -8.3699 -8.3699 -8.3699 -7.8004 -7.8004 -7.8004 -7.8004 -5.8430 -5.8430 -5.8430 -5.8430 -5.7949 -5.7949 -5.7949 -5.7949 -5.2935 -5.2935 -5.2935 -5.2935 0.6719 0.6719 0.6719 0.6719 4.8507 4.8507 4.8507 4.8507 6.6635 6.6635 6.6635 6.6635 7.7312 7.7312 7.7312 7.7312 12.1002 12.1002 12.1002 12.1002 13.6960 13.6960 13.6960 13.6960 k = 0.5000 0.5000 0.3725 ( 2880 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3699 -8.3699 -8.3699 -8.3699 -7.8004 -7.8004 -7.8004 -7.8004 -5.8426 -5.8426 -5.8426 -5.8426 -5.7957 -5.7957 -5.7957 -5.7957 -5.2925 -5.2925 -5.2925 -5.2925 0.6729 0.6729 0.6729 0.6729 4.8460 4.8460 4.8461 4.8461 6.6573 6.6573 6.6573 6.6573 7.7311 7.7311 7.7311 7.7311 12.1563 12.1563 12.1563 12.1563 13.6390 13.6390 13.6390 13.6390 k = 0.5000 0.5000 0.3849 ( 2880 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3700 -8.3700 -8.3700 -8.3700 -7.8005 -7.8005 -7.8004 -7.8004 -5.8424 -5.8424 -5.8424 -5.8424 -5.7961 -5.7961 -5.7961 -5.7961 -5.2918 -5.2918 -5.2918 -5.2918 0.6735 0.6735 0.6735 0.6735 4.8432 4.8432 4.8432 4.8432 6.6535 6.6535 6.6535 6.6535 7.7311 7.7311 7.7311 7.7311 12.1924 12.1924 12.1924 12.1924 13.6022 13.6022 13.6022 13.6022 k = 0.5000 0.5000 0.3973 ( 2880 PWs) bands (ev): -9.4432 -9.4432 -9.4432 -9.4432 -8.3700 -8.3700 -8.3700 -8.3700 -7.8005 -7.8005 -7.8005 -7.8005 -5.8423 -5.8423 -5.8423 -5.8423 -5.7963 -5.7963 -5.7963 -5.7963 -5.2916 -5.2916 -5.2916 -5.2916 0.6737 0.6737 0.6737 0.6737 4.8423 4.8423 4.8423 4.8423 6.6523 6.6523 6.6523 6.6523 7.7311 7.7311 7.7311 7.7311 12.2049 12.2049 12.2049 12.2049 13.5895 13.5895 13.5895 13.5895 Writing output data file PbO.save init_run : 3.50s CPU 12.96s WALL ( 1 calls) electrons : 433.84s CPU 440.09s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.28s CPU 1.43s WALL ( 1 calls) Called by electrons: c_bands : 433.80s CPU 439.78s WALL ( 1 calls) v_of_rho : 0.08s CPU 0.90s WALL ( 1 calls) v_h : 0.03s CPU 0.03s WALL ( 1 calls) v_xc : 0.05s CPU 0.55s WALL ( 1 calls) newd : 0.30s CPU 0.40s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.13s WALL ( 377 calls) cegterg : 392.54s CPU 395.81s WALL ( 727 calls) Called by sum_band: Called by *egterg: h_psi : 160.16s CPU 166.02s WALL ( 10421 calls) s_psi : 16.46s CPU 17.24s WALL ( 10421 calls) g_psi : 0.47s CPU 0.50s WALL ( 9317 calls) cdiaghg : 156.09s CPU 154.39s WALL ( 9694 calls) cegterg:over : 38.97s CPU 36.24s WALL ( 9317 calls) cegterg:upda : 6.30s CPU 8.86s WALL ( 9317 calls) cegterg:last : 6.08s CPU 6.78s WALL ( 1858 calls) Called by h_psi: h_psi:vloc : 126.58s CPU 131.60s WALL ( 10421 calls) h_psi:vnl : 33.42s CPU 33.91s WALL ( 10421 calls) add_vuspsi : 9.85s CPU 12.99s WALL ( 10421 calls) General routines calbec : 23.53s CPU 20.82s WALL ( 10421 calls) fft : 0.44s CPU 1.10s WALL ( 19 calls) ffts : 0.00s CPU 0.06s WALL ( 4 calls) fftw : 119.46s CPU 123.26s WALL ( 1089920 calls) interpolate : 0.03s CPU 0.11s WALL ( 4 calls) davcio : 0.05s CPU 1.46s WALL ( 754 calls) Parallel routines fft_scatter : 82.92s CPU 85.95s WALL ( 1089943 calls) PWSCF : 8m 9.03s CPU 9m51.98s WALL This run was terminated on: 11:19:29 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=