Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:17: 0 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./YTiSi.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 41 41 11 2221 2221 335 Max 42 42 12 2225 2225 344 Sum 1481 1481 421 80009 80009 12223 bravais-lattice index = 14 lattice parameter (alat) = 7.6099 a.u. unit-cell volume = 826.5693 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.609927 celldm(2)= 1.000000 celldm(3)= 1.875590 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 1.875590 ) 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 0.533166 ) PseudoPot. # 1 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 PseudoPot. # 2 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 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 Ti 12.00 47.86700 Ti( 1.00) Si 4.00 28.08550 Si( 1.00) Y 11.00 88.90590 Y( 1.00) 4 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 2) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,1,0] 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 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,1,0] -C2 -2 180 deg rotation - cart. axis [1,1,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,1,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,1,0] E Cartesian axes number of k points= 344 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029070 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0029070 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0029070 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0029070 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0029070 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0029070 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0029070 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0029070 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0029070 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0029070 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0029070 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0029070 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0029070 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0029070 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0029070 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0029070 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0029070 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0029070 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029070 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0029070 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0029070 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0029070 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0029070 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0029070 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0029070 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0029070 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0029070 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0029070 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0029070 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0029070 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0029070 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0029070 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029070 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0029070 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029070 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0029070 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0029070 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0029070 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0029070 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0029070 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0029070 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0029070 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0029070 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0029070 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0029070 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0029070 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0029070 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029070 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029070 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029070 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029070 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029070 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0029070 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029070 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029070 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029070 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0029070 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0029070 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0029070 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029070 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0029070 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0029070 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0029070 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0029070 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029070 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029070 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029070 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029070 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0029070 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0029070 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0029070 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0029070 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0029070 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029070 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0029070 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0029070 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0029070 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0029070 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0029070 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029070 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 141) = ( 0.0000000 0.0000000 0.0126944), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0253888), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0380833), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0507777), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.0634721), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.0761665), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.0888609), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.1015554), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.1142498), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.1269442), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.1396386), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.1523330), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.1650275), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.1777219), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.1904163), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.2031107), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.2158051), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.2284996), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.2411940), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.2538884), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.2665828), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.2665828), wk = 0.0029070 k( 163) = ( 0.0000000 0.0125000 0.2665828), wk = 0.0029070 k( 164) = ( 0.0000000 0.0250000 0.2665828), wk = 0.0029070 k( 165) = ( 0.0000000 0.0375000 0.2665828), wk = 0.0029070 k( 166) = ( 0.0000000 0.0500000 0.2665828), wk = 0.0029070 k( 167) = ( 0.0000000 0.0625000 0.2665828), wk = 0.0029070 k( 168) = ( 0.0000000 0.0750000 0.2665828), wk = 0.0029070 k( 169) = ( 0.0000000 0.0875000 0.2665828), wk = 0.0029070 k( 170) = ( 0.0000000 0.1000000 0.2665828), wk = 0.0029070 k( 171) = ( 0.0000000 0.1125000 0.2665828), wk = 0.0029070 k( 172) = ( 0.0000000 0.1250000 0.2665828), wk = 0.0029070 k( 173) = ( 0.0000000 0.1375000 0.2665828), wk = 0.0029070 k( 174) = ( 0.0000000 0.1500000 0.2665828), wk = 0.0029070 k( 175) = ( 0.0000000 0.1625000 0.2665828), wk = 0.0029070 k( 176) = ( 0.0000000 0.1750000 0.2665828), wk = 0.0029070 k( 177) = ( 0.0000000 0.1875000 0.2665828), wk = 0.0029070 k( 178) = ( 0.0000000 0.2000000 0.2665828), wk = 0.0029070 k( 179) = ( 0.0000000 0.2125000 0.2665828), wk = 0.0029070 k( 180) = ( 0.0000000 0.2250000 0.2665828), wk = 0.0029070 k( 181) = ( 0.0000000 0.2375000 0.2665828), wk = 0.0029070 k( 182) = ( 0.0000000 0.2500000 0.2665828), wk = 0.0029070 k( 183) = ( 0.0000000 0.2625000 0.2665828), wk = 0.0029070 k( 184) = ( 0.0000000 0.2750000 0.2665828), wk = 0.0029070 k( 185) = ( 0.0000000 0.2875000 0.2665828), wk = 0.0029070 k( 186) = ( 0.0000000 0.3000000 0.2665828), wk = 0.0029070 k( 187) = ( 0.0000000 0.3125000 0.2665828), wk = 0.0029070 k( 188) = ( 0.0000000 0.3250000 0.2665828), wk = 0.0029070 k( 189) = ( 0.0000000 0.3375000 0.2665828), wk = 0.0029070 k( 190) = ( 0.0000000 0.3500000 0.2665828), wk = 0.0029070 k( 191) = ( 0.0000000 0.3625000 0.2665828), wk = 0.0029070 k( 192) = ( 0.0000000 0.3750000 0.2665828), wk = 0.0029070 k( 193) = ( 0.0000000 0.3875000 0.2665828), wk = 0.0029070 k( 194) = ( 0.0000000 0.4000000 0.2665828), wk = 0.0029070 k( 195) = ( 0.0000000 0.4125000 0.2665828), wk = 0.0029070 k( 196) = ( 0.0000000 0.4250000 0.2665828), wk = 0.0029070 k( 197) = ( 0.0000000 0.4375000 0.2665828), wk = 0.0029070 k( 198) = ( 0.0000000 0.4500000 0.2665828), wk = 0.0029070 k( 199) = ( 0.0000000 0.4625000 0.2665828), wk = 0.0029070 k( 200) = ( 0.0000000 0.4750000 0.2665828), wk = 0.0029070 k( 201) = ( 0.0000000 0.4875000 0.2665828), wk = 0.0029070 k( 202) = ( 0.0000000 0.5000000 0.2665828), wk = 0.0029070 k( 203) = ( 0.0000000 0.5000000 0.2665828), wk = 0.0029070 k( 204) = ( 0.0125000 0.5000000 0.2665828), wk = 0.0029070 k( 205) = ( 0.0250000 0.5000000 0.2665828), wk = 0.0029070 k( 206) = ( 0.0375000 0.5000000 0.2665828), wk = 0.0029070 k( 207) = ( 0.0500000 0.5000000 0.2665828), wk = 0.0029070 k( 208) = ( 0.0625000 0.5000000 0.2665828), wk = 0.0029070 k( 209) = ( 0.0750000 0.5000000 0.2665828), wk = 0.0029070 k( 210) = ( 0.0875000 0.5000000 0.2665828), wk = 0.0029070 k( 211) = ( 0.1000000 0.5000000 0.2665828), wk = 0.0029070 k( 212) = ( 0.1125000 0.5000000 0.2665828), wk = 0.0029070 k( 213) = ( 0.1250000 0.5000000 0.2665828), wk = 0.0029070 k( 214) = ( 0.1375000 0.5000000 0.2665828), wk = 0.0029070 k( 215) = ( 0.1500000 0.5000000 0.2665828), wk = 0.0029070 k( 216) = ( 0.1625000 0.5000000 0.2665828), wk = 0.0029070 k( 217) = ( 0.1750000 0.5000000 0.2665828), wk = 0.0029070 k( 218) = ( 0.1875000 0.5000000 0.2665828), wk = 0.0029070 k( 219) = ( 0.2000000 0.5000000 0.2665828), wk = 0.0029070 k( 220) = ( 0.2125000 0.5000000 0.2665828), wk = 0.0029070 k( 221) = ( 0.2250000 0.5000000 0.2665828), wk = 0.0029070 k( 222) = ( 0.2375000 0.5000000 0.2665828), wk = 0.0029070 k( 223) = ( 0.2500000 0.5000000 0.2665828), wk = 0.0029070 k( 224) = ( 0.2625000 0.5000000 0.2665828), wk = 0.0029070 k( 225) = ( 0.2750000 0.5000000 0.2665828), wk = 0.0029070 k( 226) = ( 0.2875000 0.5000000 0.2665828), wk = 0.0029070 k( 227) = ( 0.3000000 0.5000000 0.2665828), wk = 0.0029070 k( 228) = ( 0.3125000 0.5000000 0.2665828), wk = 0.0029070 k( 229) = ( 0.3250000 0.5000000 0.2665828), wk = 0.0029070 k( 230) = ( 0.3375000 0.5000000 0.2665828), wk = 0.0029070 k( 231) = ( 0.3500000 0.5000000 0.2665828), wk = 0.0029070 k( 232) = ( 0.3625000 0.5000000 0.2665828), wk = 0.0029070 k( 233) = ( 0.3750000 0.5000000 0.2665828), wk = 0.0029070 k( 234) = ( 0.3875000 0.5000000 0.2665828), wk = 0.0029070 k( 235) = ( 0.4000000 0.5000000 0.2665828), wk = 0.0029070 k( 236) = ( 0.4125000 0.5000000 0.2665828), wk = 0.0029070 k( 237) = ( 0.4250000 0.5000000 0.2665828), wk = 0.0029070 k( 238) = ( 0.4375000 0.5000000 0.2665828), wk = 0.0029070 k( 239) = ( 0.4500000 0.5000000 0.2665828), wk = 0.0029070 k( 240) = ( 0.4625000 0.5000000 0.2665828), wk = 0.0029070 k( 241) = ( 0.4750000 0.5000000 0.2665828), wk = 0.0029070 k( 242) = ( 0.4875000 0.5000000 0.2665828), wk = 0.0029070 k( 243) = ( 0.5000000 0.5000000 0.2665828), wk = 0.0029070 k( 244) = ( 0.5000000 0.5000000 0.2665828), wk = 0.0029070 k( 245) = ( 0.4910714 0.4910714 0.2665828), wk = 0.0029070 k( 246) = ( 0.4821429 0.4821429 0.2665828), wk = 0.0029070 k( 247) = ( 0.4732143 0.4732143 0.2665828), wk = 0.0029070 k( 248) = ( 0.4642857 0.4642857 0.2665828), wk = 0.0029070 k( 249) = ( 0.4553571 0.4553571 0.2665828), wk = 0.0029070 k( 250) = ( 0.4464286 0.4464286 0.2665828), wk = 0.0029070 k( 251) = ( 0.4375000 0.4375000 0.2665828), wk = 0.0029070 k( 252) = ( 0.4285714 0.4285714 0.2665828), wk = 0.0029070 k( 253) = ( 0.4196429 0.4196429 0.2665828), wk = 0.0029070 k( 254) = ( 0.4107143 0.4107143 0.2665828), wk = 0.0029070 k( 255) = ( 0.4017857 0.4017857 0.2665828), wk = 0.0029070 k( 256) = ( 0.3928571 0.3928571 0.2665828), wk = 0.0029070 k( 257) = ( 0.3839286 0.3839286 0.2665828), wk = 0.0029070 k( 258) = ( 0.3750000 0.3750000 0.2665828), wk = 0.0029070 k( 259) = ( 0.3660714 0.3660714 0.2665828), wk = 0.0029070 k( 260) = ( 0.3571429 0.3571429 0.2665828), wk = 0.0029070 k( 261) = ( 0.3482143 0.3482143 0.2665828), wk = 0.0029070 k( 262) = ( 0.3392857 0.3392857 0.2665828), wk = 0.0029070 k( 263) = ( 0.3303571 0.3303571 0.2665828), wk = 0.0029070 k( 264) = ( 0.3214286 0.3214286 0.2665828), wk = 0.0029070 k( 265) = ( 0.3125000 0.3125000 0.2665828), wk = 0.0029070 k( 266) = ( 0.3035714 0.3035714 0.2665828), wk = 0.0029070 k( 267) = ( 0.2946429 0.2946429 0.2665828), wk = 0.0029070 k( 268) = ( 0.2857143 0.2857143 0.2665828), wk = 0.0029070 k( 269) = ( 0.2767857 0.2767857 0.2665828), wk = 0.0029070 k( 270) = ( 0.2678571 0.2678571 0.2665828), wk = 0.0029070 k( 271) = ( 0.2589286 0.2589286 0.2665828), wk = 0.0029070 k( 272) = ( 0.2500000 0.2500000 0.2665828), wk = 0.0029070 k( 273) = ( 0.2410714 0.2410714 0.2665828), wk = 0.0029070 k( 274) = ( 0.2321429 0.2321429 0.2665828), wk = 0.0029070 k( 275) = ( 0.2232143 0.2232143 0.2665828), wk = 0.0029070 k( 276) = ( 0.2142857 0.2142857 0.2665828), wk = 0.0029070 k( 277) = ( 0.2053571 0.2053571 0.2665828), wk = 0.0029070 k( 278) = ( 0.1964286 0.1964286 0.2665828), wk = 0.0029070 k( 279) = ( 0.1875000 0.1875000 0.2665828), wk = 0.0029070 k( 280) = ( 0.1785714 0.1785714 0.2665828), wk = 0.0029070 k( 281) = ( 0.1696429 0.1696429 0.2665828), wk = 0.0029070 k( 282) = ( 0.1607143 0.1607143 0.2665828), wk = 0.0029070 k( 283) = ( 0.1517857 0.1517857 0.2665828), wk = 0.0029070 k( 284) = ( 0.1428571 0.1428571 0.2665828), wk = 0.0029070 k( 285) = ( 0.1339286 0.1339286 0.2665828), wk = 0.0029070 k( 286) = ( 0.1250000 0.1250000 0.2665828), wk = 0.0029070 k( 287) = ( 0.1160714 0.1160714 0.2665828), wk = 0.0029070 k( 288) = ( 0.1071429 0.1071429 0.2665828), wk = 0.0029070 k( 289) = ( 0.0982143 0.0982143 0.2665828), wk = 0.0029070 k( 290) = ( 0.0892857 0.0892857 0.2665828), wk = 0.0029070 k( 291) = ( 0.0803571 0.0803571 0.2665828), wk = 0.0029070 k( 292) = ( 0.0714286 0.0714286 0.2665828), wk = 0.0029070 k( 293) = ( 0.0625000 0.0625000 0.2665828), wk = 0.0029070 k( 294) = ( 0.0535714 0.0535714 0.2665828), wk = 0.0029070 k( 295) = ( 0.0446429 0.0446429 0.2665828), wk = 0.0029070 k( 296) = ( 0.0357143 0.0357143 0.2665828), wk = 0.0029070 k( 297) = ( 0.0267857 0.0267857 0.2665828), wk = 0.0029070 k( 298) = ( 0.0178571 0.0178571 0.2665828), wk = 0.0029070 k( 299) = ( 0.0089286 0.0089286 0.2665828), wk = 0.0029070 k( 300) = ( 0.0000000 0.0000000 0.2665828), wk = 0.0029070 k( 301) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029070 k( 302) = ( 0.0000000 0.5000000 0.0126944), wk = 0.0029070 k( 303) = ( 0.0000000 0.5000000 0.0253888), wk = 0.0029070 k( 304) = ( 0.0000000 0.5000000 0.0380833), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 0.0507777), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.0634721), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.0761665), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.0888609), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.1015554), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.1142498), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.1269442), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.1396386), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.1523330), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.1650275), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.1777219), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.1904163), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.2031107), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.2158051), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.2284996), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.2411940), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.2538884), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.2665828), wk = 0.0029070 k( 323) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029070 k( 324) = ( 0.5000000 0.5000000 0.0126944), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 0.0253888), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0380833), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0507777), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.0634721), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.0761665), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.0888609), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.1015554), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.1142498), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.1269442), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.1396386), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.1523330), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.1650275), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.1777219), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.1904163), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.2031107), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.2158051), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.2284996), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.2411940), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.2538884), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.2665828), wk = 0.0029070 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 2) = ( 0.0000000 0.0125000 0.0000000), wk = 0.0029070 k( 3) = ( 0.0000000 0.0250000 0.0000000), wk = 0.0029070 k( 4) = ( 0.0000000 0.0375000 0.0000000), wk = 0.0029070 k( 5) = ( 0.0000000 0.0500000 0.0000000), wk = 0.0029070 k( 6) = ( 0.0000000 0.0625000 0.0000000), wk = 0.0029070 k( 7) = ( 0.0000000 0.0750000 0.0000000), wk = 0.0029070 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0029070 k( 9) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0029070 k( 10) = ( 0.0000000 0.1125000 0.0000000), wk = 0.0029070 k( 11) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0029070 k( 12) = ( 0.0000000 0.1375000 0.0000000), wk = 0.0029070 k( 13) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0029070 k( 14) = ( 0.0000000 0.1625000 0.0000000), wk = 0.0029070 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0029070 k( 16) = ( 0.0000000 0.1875000 0.0000000), wk = 0.0029070 k( 17) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0029070 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0029070 k( 19) = ( 0.0000000 0.2250000 0.0000000), wk = 0.0029070 k( 20) = ( 0.0000000 0.2375000 0.0000000), wk = 0.0029070 k( 21) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0029070 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0029070 k( 23) = ( 0.0000000 0.2750000 0.0000000), wk = 0.0029070 k( 24) = ( 0.0000000 0.2875000 0.0000000), wk = 0.0029070 k( 25) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0029070 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0029070 k( 27) = ( 0.0000000 0.3250000 0.0000000), wk = 0.0029070 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0029070 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0029070 k( 30) = ( 0.0000000 0.3625000 0.0000000), wk = 0.0029070 k( 31) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0029070 k( 32) = ( 0.0000000 0.3875000 0.0000000), wk = 0.0029070 k( 33) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0029070 k( 34) = ( 0.0000000 0.4125000 0.0000000), wk = 0.0029070 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0029070 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0029070 k( 37) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0029070 k( 38) = ( 0.0000000 0.4625000 0.0000000), wk = 0.0029070 k( 39) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0029070 k( 40) = ( 0.0000000 0.4875000 0.0000000), wk = 0.0029070 k( 41) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 42) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0029070 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0029070 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0029070 k( 46) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0029070 k( 47) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0029070 k( 48) = ( 0.0750000 0.5000000 0.0000000), wk = 0.0029070 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0029070 k( 50) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0029070 k( 51) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0029070 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0029070 k( 53) = ( 0.1375000 0.5000000 0.0000000), wk = 0.0029070 k( 54) = ( 0.1500000 0.5000000 0.0000000), wk = 0.0029070 k( 55) = ( 0.1625000 0.5000000 0.0000000), wk = 0.0029070 k( 56) = ( 0.1750000 0.5000000 0.0000000), wk = 0.0029070 k( 57) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0029070 k( 58) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0029070 k( 59) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0029070 k( 60) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0029070 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0029070 k( 62) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0029070 k( 63) = ( 0.2625000 0.5000000 0.0000000), wk = 0.0029070 k( 64) = ( 0.2750000 0.5000000 0.0000000), wk = 0.0029070 k( 65) = ( 0.2875000 0.5000000 0.0000000), wk = 0.0029070 k( 66) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0029070 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0029070 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0029070 k( 69) = ( 0.3375000 0.5000000 0.0000000), wk = 0.0029070 k( 70) = ( 0.3500000 0.5000000 0.0000000), wk = 0.0029070 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0029070 k( 72) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0029070 k( 73) = ( 0.3875000 0.5000000 0.0000000), wk = 0.0029070 k( 74) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0029070 k( 75) = ( 0.4125000 0.5000000 0.0000000), wk = 0.0029070 k( 76) = ( 0.4250000 0.5000000 0.0000000), wk = 0.0029070 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0029070 k( 78) = ( 0.4500000 0.5000000 0.0000000), wk = 0.0029070 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0029070 k( 80) = ( 0.4750000 0.5000000 0.0000000), wk = 0.0029070 k( 81) = ( 0.4875000 0.5000000 0.0000000), wk = 0.0029070 k( 82) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 83) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 84) = ( 0.4910714 0.4910714 0.0000000), wk = 0.0029070 k( 85) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0029070 k( 86) = ( 0.4732143 0.4732143 0.0000000), wk = 0.0029070 k( 87) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0029070 k( 88) = ( 0.4553571 0.4553571 0.0000000), wk = 0.0029070 k( 89) = ( 0.4464286 0.4464286 0.0000000), wk = 0.0029070 k( 90) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0029070 k( 91) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0029070 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0029070 k( 93) = ( 0.4107143 0.4107143 0.0000000), wk = 0.0029070 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0029070 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0029070 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0029070 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0029070 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0029070 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0029070 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0029070 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0029070 k( 102) = ( 0.3303571 0.3303571 0.0000000), wk = 0.0029070 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0029070 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0029070 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0029070 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0029070 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0029070 k( 108) = ( 0.2767857 0.2767857 0.0000000), wk = 0.0029070 k( 109) = ( 0.2678571 0.2678571 0.0000000), wk = 0.0029070 k( 110) = ( 0.2589286 0.2589286 0.0000000), wk = 0.0029070 k( 111) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0029070 k( 112) = ( 0.2410714 0.2410714 0.0000000), wk = 0.0029070 k( 113) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0029070 k( 114) = ( 0.2232143 0.2232143 0.0000000), wk = 0.0029070 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0029070 k( 116) = ( 0.2053571 0.2053571 0.0000000), wk = 0.0029070 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0029070 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0029070 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0029070 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0029070 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0029070 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0029070 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0029070 k( 124) = ( 0.1339286 0.1339286 0.0000000), wk = 0.0029070 k( 125) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0029070 k( 126) = ( 0.1160714 0.1160714 0.0000000), wk = 0.0029070 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0029070 k( 128) = ( 0.0982143 0.0982143 0.0000000), wk = 0.0029070 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0029070 k( 130) = ( 0.0803571 0.0803571 0.0000000), wk = 0.0029070 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0029070 k( 132) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0029070 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0029070 k( 134) = ( 0.0446429 0.0446429 0.0000000), wk = 0.0029070 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0029070 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0029070 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0029070 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0029070 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029070 k( 141) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0029070 k( 142) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0029070 k( 143) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0029070 k( 144) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0029070 k( 145) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0029070 k( 146) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0029070 k( 147) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0029070 k( 148) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0029070 k( 149) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0029070 k( 150) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0029070 k( 151) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0029070 k( 152) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0029070 k( 153) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0029070 k( 154) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0029070 k( 155) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0029070 k( 156) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0029070 k( 157) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0029070 k( 158) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0029070 k( 159) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0029070 k( 160) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0029070 k( 161) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 162) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 163) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0029070 k( 164) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0029070 k( 165) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0029070 k( 166) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0029070 k( 167) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0029070 k( 168) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0029070 k( 169) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0029070 k( 170) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0029070 k( 171) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0029070 k( 172) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0029070 k( 173) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0029070 k( 174) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0029070 k( 175) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0029070 k( 176) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0029070 k( 177) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0029070 k( 178) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0029070 k( 179) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0029070 k( 180) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0029070 k( 181) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0029070 k( 182) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0029070 k( 183) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0029070 k( 184) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0029070 k( 185) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0029070 k( 186) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0029070 k( 187) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0029070 k( 188) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0029070 k( 189) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0029070 k( 190) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0029070 k( 191) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0029070 k( 192) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0029070 k( 193) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0029070 k( 194) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0029070 k( 195) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0029070 k( 196) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0029070 k( 197) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0029070 k( 198) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0029070 k( 199) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0029070 k( 200) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0029070 k( 201) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0029070 k( 202) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 203) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 204) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0029070 k( 205) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0029070 k( 206) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0029070 k( 207) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0029070 k( 208) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0029070 k( 209) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0029070 k( 210) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0029070 k( 211) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0029070 k( 212) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0029070 k( 213) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0029070 k( 214) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0029070 k( 215) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0029070 k( 216) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0029070 k( 217) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0029070 k( 218) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0029070 k( 219) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0029070 k( 220) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0029070 k( 221) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0029070 k( 222) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0029070 k( 223) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0029070 k( 224) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0029070 k( 225) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0029070 k( 226) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0029070 k( 227) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0029070 k( 228) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0029070 k( 229) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0029070 k( 230) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0029070 k( 231) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0029070 k( 232) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0029070 k( 233) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0029070 k( 234) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0029070 k( 235) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0029070 k( 236) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0029070 k( 237) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0029070 k( 238) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0029070 k( 239) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0029070 k( 240) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0029070 k( 241) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0029070 k( 242) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0029070 k( 243) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 244) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 k( 245) = ( 0.4910714 0.4910714 0.5000000), wk = 0.0029070 k( 246) = ( 0.4821429 0.4821429 0.5000000), wk = 0.0029070 k( 247) = ( 0.4732143 0.4732143 0.5000000), wk = 0.0029070 k( 248) = ( 0.4642857 0.4642857 0.5000000), wk = 0.0029070 k( 249) = ( 0.4553571 0.4553571 0.5000000), wk = 0.0029070 k( 250) = ( 0.4464286 0.4464286 0.5000000), wk = 0.0029070 k( 251) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0029070 k( 252) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0029070 k( 253) = ( 0.4196429 0.4196429 0.5000000), wk = 0.0029070 k( 254) = ( 0.4107143 0.4107143 0.5000000), wk = 0.0029070 k( 255) = ( 0.4017857 0.4017857 0.5000000), wk = 0.0029070 k( 256) = ( 0.3928571 0.3928571 0.5000000), wk = 0.0029070 k( 257) = ( 0.3839286 0.3839286 0.5000000), wk = 0.0029070 k( 258) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0029070 k( 259) = ( 0.3660714 0.3660714 0.5000000), wk = 0.0029070 k( 260) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0029070 k( 261) = ( 0.3482143 0.3482143 0.5000000), wk = 0.0029070 k( 262) = ( 0.3392857 0.3392857 0.5000000), wk = 0.0029070 k( 263) = ( 0.3303571 0.3303571 0.5000000), wk = 0.0029070 k( 264) = ( 0.3214286 0.3214286 0.5000000), wk = 0.0029070 k( 265) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0029070 k( 266) = ( 0.3035714 0.3035714 0.5000000), wk = 0.0029070 k( 267) = ( 0.2946429 0.2946429 0.5000000), wk = 0.0029070 k( 268) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0029070 k( 269) = ( 0.2767857 0.2767857 0.5000000), wk = 0.0029070 k( 270) = ( 0.2678571 0.2678571 0.5000000), wk = 0.0029070 k( 271) = ( 0.2589286 0.2589286 0.5000000), wk = 0.0029070 k( 272) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0029070 k( 273) = ( 0.2410714 0.2410714 0.5000000), wk = 0.0029070 k( 274) = ( 0.2321429 0.2321429 0.5000000), wk = 0.0029070 k( 275) = ( 0.2232143 0.2232143 0.5000000), wk = 0.0029070 k( 276) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0029070 k( 277) = ( 0.2053571 0.2053571 0.5000000), wk = 0.0029070 k( 278) = ( 0.1964286 0.1964286 0.5000000), wk = 0.0029070 k( 279) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0029070 k( 280) = ( 0.1785714 0.1785714 0.5000000), wk = 0.0029070 k( 281) = ( 0.1696429 0.1696429 0.5000000), wk = 0.0029070 k( 282) = ( 0.1607143 0.1607143 0.5000000), wk = 0.0029070 k( 283) = ( 0.1517857 0.1517857 0.5000000), wk = 0.0029070 k( 284) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0029070 k( 285) = ( 0.1339286 0.1339286 0.5000000), wk = 0.0029070 k( 286) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0029070 k( 287) = ( 0.1160714 0.1160714 0.5000000), wk = 0.0029070 k( 288) = ( 0.1071429 0.1071429 0.5000000), wk = 0.0029070 k( 289) = ( 0.0982143 0.0982143 0.5000000), wk = 0.0029070 k( 290) = ( 0.0892857 0.0892857 0.5000000), wk = 0.0029070 k( 291) = ( 0.0803571 0.0803571 0.5000000), wk = 0.0029070 k( 292) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0029070 k( 293) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0029070 k( 294) = ( 0.0535714 0.0535714 0.5000000), wk = 0.0029070 k( 295) = ( 0.0446429 0.0446429 0.5000000), wk = 0.0029070 k( 296) = ( 0.0357143 0.0357143 0.5000000), wk = 0.0029070 k( 297) = ( 0.0267857 0.0267857 0.5000000), wk = 0.0029070 k( 298) = ( 0.0178571 0.0178571 0.5000000), wk = 0.0029070 k( 299) = ( 0.0089286 0.0089286 0.5000000), wk = 0.0029070 k( 300) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029070 k( 301) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029070 k( 302) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0029070 k( 303) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0029070 k( 304) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0029070 k( 305) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0029070 k( 306) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0029070 k( 307) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0029070 k( 308) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0029070 k( 309) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0029070 k( 310) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0029070 k( 311) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0029070 k( 312) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0029070 k( 313) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0029070 k( 314) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0029070 k( 315) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0029070 k( 316) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0029070 k( 317) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0029070 k( 318) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0029070 k( 319) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0029070 k( 320) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0029070 k( 321) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0029070 k( 322) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029070 k( 323) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029070 k( 324) = ( 0.5000000 0.5000000 0.0238095), wk = 0.0029070 k( 325) = ( 0.5000000 0.5000000 0.0476191), wk = 0.0029070 k( 326) = ( 0.5000000 0.5000000 0.0714286), wk = 0.0029070 k( 327) = ( 0.5000000 0.5000000 0.0952381), wk = 0.0029070 k( 328) = ( 0.5000000 0.5000000 0.1190476), wk = 0.0029070 k( 329) = ( 0.5000000 0.5000000 0.1428571), wk = 0.0029070 k( 330) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0029070 k( 331) = ( 0.5000000 0.5000000 0.1904762), wk = 0.0029070 k( 332) = ( 0.5000000 0.5000000 0.2142857), wk = 0.0029070 k( 333) = ( 0.5000000 0.5000000 0.2380952), wk = 0.0029070 k( 334) = ( 0.5000000 0.5000000 0.2619048), wk = 0.0029070 k( 335) = ( 0.5000000 0.5000000 0.2857143), wk = 0.0029070 k( 336) = ( 0.5000000 0.5000000 0.3095238), wk = 0.0029070 k( 337) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0029070 k( 338) = ( 0.5000000 0.5000000 0.3571429), wk = 0.0029070 k( 339) = ( 0.5000000 0.5000000 0.3809524), wk = 0.0029070 k( 340) = ( 0.5000000 0.5000000 0.4047619), wk = 0.0029070 k( 341) = ( 0.5000000 0.5000000 0.4285714), wk = 0.0029070 k( 342) = ( 0.5000000 0.5000000 0.4523810), wk = 0.0029070 k( 343) = ( 0.5000000 0.5000000 0.4761905), wk = 0.0029070 k( 344) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029070 Dense grid: 80009 G-vectors FFT dimensions: ( 45, 45, 81) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 564, 64) NL pseudopotentials 0.88 Mb ( 282, 204) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2221) G-vector shells 0.01 Mb ( 1118) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.20 Mb ( 564, 256) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each matrix 0.40 Mb ( 204, 2, 64) The potential is recalculated from file : ./YTiSi.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 8.2 secs Computing kpt #: 2 total cpu time spent up to now is 10.0 secs Computing kpt #: 3 total cpu time spent up to now is 11.8 secs Computing kpt #: 4 total cpu time spent up to now is 14.3 secs Computing kpt #: 5 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 17.2 secs Computing kpt #: 6 total cpu time spent up to now is 19.4 secs Computing kpt #: 7 total cpu time spent up to now is 21.4 secs Computing kpt #: 8 total cpu time spent up to now is 23.1 secs Computing kpt #: 9 total cpu time spent up to now is 24.6 secs Computing kpt #: 10 total cpu time spent up to now is 26.1 secs Computing kpt #: 11 total cpu time spent up to now is 27.5 secs Computing kpt #: 12 total cpu time spent up to now is 28.9 secs Computing kpt #: 13 total cpu time spent up to now is 30.4 secs Computing kpt #: 14 total cpu time spent up to now is 31.8 secs Computing kpt #: 15 total cpu time spent up to now is 33.1 secs Computing kpt #: 16 total cpu time spent up to now is 34.5 secs Computing kpt #: 17 total cpu time spent up to now is 35.9 secs Computing kpt #: 18 total cpu time spent up to now is 37.4 secs Computing kpt #: 19 total cpu time spent up to now is 38.8 secs Computing kpt #: 20 total cpu time spent up to now is 40.2 secs Computing kpt #: 21 total cpu time spent up to now is 41.7 secs Computing kpt #: 22 total cpu time spent up to now is 43.1 secs Computing kpt #: 23 total cpu time spent up to now is 44.6 secs Computing kpt #: 24 total cpu time spent up to now is 46.0 secs Computing kpt #: 25 total cpu time spent up to now is 47.5 secs Computing kpt #: 26 total cpu time spent up to now is 49.0 secs Computing kpt #: 27 total cpu time spent up to now is 50.5 secs Computing kpt #: 28 total cpu time spent up to now is 52.0 secs Computing kpt #: 29 total cpu time spent up to now is 53.5 secs Computing kpt #: 30 total cpu time spent up to now is 55.0 secs Computing kpt #: 31 total cpu time spent up to now is 56.5 secs Computing kpt #: 32 total cpu time spent up to now is 58.1 secs Computing kpt #: 33 total cpu time spent up to now is 59.8 secs Computing kpt #: 34 total cpu time spent up to now is 61.3 secs Computing kpt #: 35 total cpu time spent up to now is 62.9 secs Computing kpt #: 36 total cpu time spent up to now is 64.6 secs Computing kpt #: 37 total cpu time spent up to now is 66.3 secs Computing kpt #: 38 total cpu time spent up to now is 68.1 secs Computing kpt #: 39 total cpu time spent up to now is 69.9 secs Computing kpt #: 40 total cpu time spent up to now is 71.5 secs Computing kpt #: 41 total cpu time spent up to now is 73.1 secs Computing kpt #: 42 total cpu time spent up to now is 74.8 secs Computing kpt #: 43 total cpu time spent up to now is 76.4 secs Computing kpt #: 44 total cpu time spent up to now is 78.0 secs Computing kpt #: 45 total cpu time spent up to now is 79.6 secs Computing kpt #: 46 total cpu time spent up to now is 81.2 secs Computing kpt #: 47 total cpu time spent up to now is 82.8 secs Computing kpt #: 48 total cpu time spent up to now is 84.4 secs Computing kpt #: 49 total cpu time spent up to now is 85.9 secs Computing kpt #: 50 total cpu time spent up to now is 87.5 secs Computing kpt #: 51 total cpu time spent up to now is 89.1 secs Computing kpt #: 52 total cpu time spent up to now is 90.7 secs Computing kpt #: 53 total cpu time spent up to now is 92.2 secs Computing kpt #: 54 total cpu time spent up to now is 93.8 secs Computing kpt #: 55 total cpu time spent up to now is 95.4 secs Computing kpt #: 56 total cpu time spent up to now is 97.0 secs Computing kpt #: 57 total cpu time spent up to now is 98.5 secs Computing kpt #: 58 total cpu time spent up to now is 100.1 secs Computing kpt #: 59 total cpu time spent up to now is 101.8 secs Computing kpt #: 60 total cpu time spent up to now is 103.4 secs Computing kpt #: 61 total cpu time spent up to now is 105.0 secs Computing kpt #: 62 total cpu time spent up to now is 106.6 secs Computing kpt #: 63 total cpu time spent up to now is 108.3 secs Computing kpt #: 64 total cpu time spent up to now is 110.0 secs Computing kpt #: 65 total cpu time spent up to now is 111.7 secs Computing kpt #: 66 total cpu time spent up to now is 113.4 secs Computing kpt #: 67 total cpu time spent up to now is 115.1 secs Computing kpt #: 68 total cpu time spent up to now is 116.9 secs Computing kpt #: 69 total cpu time spent up to now is 118.5 secs Computing kpt #: 70 total cpu time spent up to now is 120.3 secs Computing kpt #: 71 total cpu time spent up to now is 122.1 secs Computing kpt #: 72 total cpu time spent up to now is 123.9 secs Computing kpt #: 73 total cpu time spent up to now is 125.5 secs Computing kpt #: 74 total cpu time spent up to now is 127.1 secs Computing kpt #: 75 total cpu time spent up to now is 128.7 secs Computing kpt #: 76 total cpu time spent up to now is 130.3 secs Computing kpt #: 77 total cpu time spent up to now is 131.9 secs Computing kpt #: 78 total cpu time spent up to now is 133.4 secs Computing kpt #: 79 total cpu time spent up to now is 135.0 secs Computing kpt #: 80 total cpu time spent up to now is 136.4 secs Computing kpt #: 81 total cpu time spent up to now is 137.8 secs Computing kpt #: 82 total cpu time spent up to now is 139.2 secs Computing kpt #: 83 total cpu time spent up to now is 140.6 secs Computing kpt #: 84 total cpu time spent up to now is 142.0 secs Computing kpt #: 85 total cpu time spent up to now is 143.4 secs Computing kpt #: 86 total cpu time spent up to now is 144.8 secs Computing kpt #: 87 total cpu time spent up to now is 146.4 secs Computing kpt #: 88 total cpu time spent up to now is 147.9 secs Computing kpt #: 89 total cpu time spent up to now is 149.5 secs Computing kpt #: 90 total cpu time spent up to now is 151.0 secs Computing kpt #: 91 total cpu time spent up to now is 152.6 secs Computing kpt #: 92 total cpu time spent up to now is 154.2 secs Computing kpt #: 93 total cpu time spent up to now is 155.7 secs Computing kpt #: 94 total cpu time spent up to now is 157.3 secs Computing kpt #: 95 total cpu time spent up to now is 159.1 secs Computing kpt #: 96 total cpu time spent up to now is 160.6 secs Computing kpt #: 97 total cpu time spent up to now is 162.2 secs Computing kpt #: 98 total cpu time spent up to now is 164.3 secs Computing kpt #: 99 total cpu time spent up to now is 166.2 secs Computing kpt #: 100 total cpu time spent up to now is 168.0 secs Computing kpt #: 101 total cpu time spent up to now is 169.4 secs Computing kpt #: 102 total cpu time spent up to now is 170.8 secs Computing kpt #: 103 total cpu time spent up to now is 172.3 secs Computing kpt #: 104 total cpu time spent up to now is 173.8 secs Computing kpt #: 105 total cpu time spent up to now is 175.2 secs Computing kpt #: 106 total cpu time spent up to now is 176.6 secs Computing kpt #: 107 total cpu time spent up to now is 177.9 secs Computing kpt #: 108 total cpu time spent up to now is 179.3 secs Computing kpt #: 109 total cpu time spent up to now is 180.6 secs Computing kpt #: 110 total cpu time spent up to now is 181.9 secs Computing kpt #: 111 total cpu time spent up to now is 183.3 secs Computing kpt #: 112 total cpu time spent up to now is 184.6 secs Computing kpt #: 113 total cpu time spent up to now is 185.9 secs Computing kpt #: 114 total cpu time spent up to now is 187.2 secs Computing kpt #: 115 total cpu time spent up to now is 188.5 secs Computing kpt #: 116 total cpu time spent up to now is 189.8 secs Computing kpt #: 117 total cpu time spent up to now is 191.2 secs Computing kpt #: 118 total cpu time spent up to now is 192.6 secs Computing kpt #: 119 total cpu time spent up to now is 193.9 secs Computing kpt #: 120 total cpu time spent up to now is 195.3 secs Computing kpt #: 121 total cpu time spent up to now is 196.7 secs Computing kpt #: 122 total cpu time spent up to now is 198.1 secs Computing kpt #: 123 total cpu time spent up to now is 199.5 secs Computing kpt #: 124 total cpu time spent up to now is 200.8 secs Computing kpt #: 125 total cpu time spent up to now is 202.2 secs Computing kpt #: 126 total cpu time spent up to now is 203.6 secs Computing kpt #: 127 total cpu time spent up to now is 204.9 secs Computing kpt #: 128 total cpu time spent up to now is 206.2 secs Computing kpt #: 129 total cpu time spent up to now is 207.7 secs Computing kpt #: 130 total cpu time spent up to now is 209.1 secs Computing kpt #: 131 total cpu time spent up to now is 210.6 secs Computing kpt #: 132 total cpu time spent up to now is 212.1 secs Computing kpt #: 133 total cpu time spent up to now is 213.9 secs Computing kpt #: 134 total cpu time spent up to now is 215.8 secs Computing kpt #: 135 total cpu time spent up to now is 218.8 secs Computing kpt #: 136 total cpu time spent up to now is 221.2 secs Computing kpt #: 137 total cpu time spent up to now is 223.1 secs Computing kpt #: 138 total cpu time spent up to now is 224.8 secs Computing kpt #: 139 total cpu time spent up to now is 226.6 secs Computing kpt #: 140 total cpu time spent up to now is 228.3 secs Computing kpt #: 141 total cpu time spent up to now is 230.1 secs Computing kpt #: 142 total cpu time spent up to now is 231.9 secs Computing kpt #: 143 total cpu time spent up to now is 233.4 secs Computing kpt #: 144 total cpu time spent up to now is 235.0 secs Computing kpt #: 145 total cpu time spent up to now is 236.6 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 240.0 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 243.0 secs Computing kpt #: 148 total cpu time spent up to now is 245.2 secs Computing kpt #: 149 total cpu time spent up to now is 247.7 secs Computing kpt #: 150 total cpu time spent up to now is 249.9 secs Computing kpt #: 151 total cpu time spent up to now is 252.0 secs Computing kpt #: 152 total cpu time spent up to now is 254.4 secs Computing kpt #: 153 total cpu time spent up to now is 256.5 secs Computing kpt #: 154 total cpu time spent up to now is 258.7 secs Computing kpt #: 155 total cpu time spent up to now is 260.8 secs Computing kpt #: 156 total cpu time spent up to now is 262.3 secs Computing kpt #: 157 total cpu time spent up to now is 263.7 secs Computing kpt #: 158 total cpu time spent up to now is 265.2 secs Computing kpt #: 159 total cpu time spent up to now is 267.3 secs Computing kpt #: 160 total cpu time spent up to now is 268.7 secs Computing kpt #: 161 total cpu time spent up to now is 270.1 secs Computing kpt #: 162 total cpu time spent up to now is 271.6 secs Computing kpt #: 163 total cpu time spent up to now is 273.0 secs Computing kpt #: 164 total cpu time spent up to now is 274.4 secs Computing kpt #: 165 total cpu time spent up to now is 276.5 secs Computing kpt #: 166 total cpu time spent up to now is 277.9 secs Computing kpt #: 167 total cpu time spent up to now is 280.0 secs Computing kpt #: 168 total cpu time spent up to now is 282.6 secs Computing kpt #: 169 total cpu time spent up to now is 285.2 secs Computing kpt #: 170 total cpu time spent up to now is 287.1 secs Computing kpt #: 171 total cpu time spent up to now is 289.0 secs Computing kpt #: 172 total cpu time spent up to now is 290.9 secs Computing kpt #: 173 total cpu time spent up to now is 292.8 secs Computing kpt #: 174 total cpu time spent up to now is 294.7 secs Computing kpt #: 175 total cpu time spent up to now is 296.6 secs Computing kpt #: 176 total cpu time spent up to now is 298.4 secs Computing kpt #: 177 total cpu time spent up to now is 300.1 secs Computing kpt #: 178 total cpu time spent up to now is 301.6 secs Computing kpt #: 179 total cpu time spent up to now is 303.2 secs Computing kpt #: 180 total cpu time spent up to now is 304.8 secs Computing kpt #: 181 total cpu time spent up to now is 306.3 secs Computing kpt #: 182 total cpu time spent up to now is 307.8 secs Computing kpt #: 183 total cpu time spent up to now is 309.2 secs Computing kpt #: 184 total cpu time spent up to now is 310.7 secs Computing kpt #: 185 total cpu time spent up to now is 312.2 secs Computing kpt #: 186 total cpu time spent up to now is 313.8 secs Computing kpt #: 187 total cpu time spent up to now is 315.3 secs Computing kpt #: 188 total cpu time spent up to now is 316.8 secs Computing kpt #: 189 total cpu time spent up to now is 318.3 secs Computing kpt #: 190 total cpu time spent up to now is 319.7 secs Computing kpt #: 191 total cpu time spent up to now is 321.2 secs Computing kpt #: 192 total cpu time spent up to now is 322.7 secs Computing kpt #: 193 total cpu time spent up to now is 324.3 secs Computing kpt #: 194 total cpu time spent up to now is 326.1 secs Computing kpt #: 195 total cpu time spent up to now is 328.8 secs Computing kpt #: 196 total cpu time spent up to now is 330.7 secs Computing kpt #: 197 total cpu time spent up to now is 332.2 secs Computing kpt #: 198 total cpu time spent up to now is 333.7 secs Computing kpt #: 199 total cpu time spent up to now is 335.2 secs Computing kpt #: 200 total cpu time spent up to now is 336.5 secs Computing kpt #: 201 total cpu time spent up to now is 338.0 secs Computing kpt #: 202 total cpu time spent up to now is 339.5 secs Computing kpt #: 203 total cpu time spent up to now is 341.0 secs Computing kpt #: 204 total cpu time spent up to now is 342.5 secs Computing kpt #: 205 total cpu time spent up to now is 344.0 secs Computing kpt #: 206 total cpu time spent up to now is 345.4 secs Computing kpt #: 207 total cpu time spent up to now is 346.9 secs Computing kpt #: 208 total cpu time spent up to now is 348.4 secs Computing kpt #: 209 total cpu time spent up to now is 349.8 secs Computing kpt #: 210 total cpu time spent up to now is 350.9 secs Computing kpt #: 211 total cpu time spent up to now is 352.3 secs Computing kpt #: 212 total cpu time spent up to now is 353.8 secs Computing kpt #: 213 total cpu time spent up to now is 355.3 secs Computing kpt #: 214 total cpu time spent up to now is 356.7 secs Computing kpt #: 215 total cpu time spent up to now is 358.0 secs Computing kpt #: 216 total cpu time spent up to now is 359.4 secs Computing kpt #: 217 total cpu time spent up to now is 360.7 secs Computing kpt #: 218 total cpu time spent up to now is 362.0 secs Computing kpt #: 219 total cpu time spent up to now is 363.3 secs Computing kpt #: 220 total cpu time spent up to now is 364.7 secs Computing kpt #: 221 total cpu time spent up to now is 366.0 secs Computing kpt #: 222 total cpu time spent up to now is 367.3 secs Computing kpt #: 223 total cpu time spent up to now is 368.6 secs Computing kpt #: 224 total cpu time spent up to now is 370.0 secs Computing kpt #: 225 total cpu time spent up to now is 371.4 secs Computing kpt #: 226 total cpu time spent up to now is 372.9 secs Computing kpt #: 227 total cpu time spent up to now is 374.3 secs Computing kpt #: 228 total cpu time spent up to now is 375.9 secs Computing kpt #: 229 total cpu time spent up to now is 377.6 secs Computing kpt #: 230 total cpu time spent up to now is 379.2 secs Computing kpt #: 231 total cpu time spent up to now is 380.7 secs Computing kpt #: 232 total cpu time spent up to now is 382.2 secs Computing kpt #: 233 total cpu time spent up to now is 383.6 secs Computing kpt #: 234 total cpu time spent up to now is 385.2 secs Computing kpt #: 235 total cpu time spent up to now is 386.6 secs Computing kpt #: 236 total cpu time spent up to now is 388.2 secs Computing kpt #: 237 total cpu time spent up to now is 389.6 secs Computing kpt #: 238 total cpu time spent up to now is 391.0 secs Computing kpt #: 239 total cpu time spent up to now is 392.3 secs Computing kpt #: 240 total cpu time spent up to now is 393.7 secs Computing kpt #: 241 total cpu time spent up to now is 394.9 secs Computing kpt #: 242 total cpu time spent up to now is 396.2 secs Computing kpt #: 243 total cpu time spent up to now is 397.6 secs Computing kpt #: 244 total cpu time spent up to now is 398.9 secs Computing kpt #: 245 total cpu time spent up to now is 400.3 secs Computing kpt #: 246 total cpu time spent up to now is 401.6 secs Computing kpt #: 247 total cpu time spent up to now is 403.0 secs Computing kpt #: 248 total cpu time spent up to now is 404.4 secs Computing kpt #: 249 total cpu time spent up to now is 405.8 secs Computing kpt #: 250 total cpu time spent up to now is 407.2 secs Computing kpt #: 251 total cpu time spent up to now is 408.6 secs Computing kpt #: 252 total cpu time spent up to now is 410.1 secs Computing kpt #: 253 total cpu time spent up to now is 411.6 secs Computing kpt #: 254 total cpu time spent up to now is 413.1 secs Computing kpt #: 255 total cpu time spent up to now is 414.7 secs Computing kpt #: 256 total cpu time spent up to now is 416.2 secs Computing kpt #: 257 total cpu time spent up to now is 418.0 secs Computing kpt #: 258 total cpu time spent up to now is 419.8 secs Computing kpt #: 259 total cpu time spent up to now is 421.3 secs Computing kpt #: 260 total cpu time spent up to now is 423.1 secs Computing kpt #: 261 total cpu time spent up to now is 425.0 secs Computing kpt #: 262 total cpu time spent up to now is 427.5 secs Computing kpt #: 263 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 430.5 secs Computing kpt #: 264 total cpu time spent up to now is 432.5 secs Computing kpt #: 265 total cpu time spent up to now is 434.2 secs Computing kpt #: 266 total cpu time spent up to now is 435.9 secs Computing kpt #: 267 total cpu time spent up to now is 437.8 secs Computing kpt #: 268 total cpu time spent up to now is 439.7 secs Computing kpt #: 269 total cpu time spent up to now is 441.8 secs Computing kpt #: 270 total cpu time spent up to now is 443.9 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 446.9 secs Computing kpt #: 272 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 449.8 secs Computing kpt #: 273 total cpu time spent up to now is 452.4 secs Computing kpt #: 274 total cpu time spent up to now is 454.8 secs Computing kpt #: 275 total cpu time spent up to now is 456.8 secs Computing kpt #: 276 total cpu time spent up to now is 458.5 secs Computing kpt #: 277 total cpu time spent up to now is 460.5 secs Computing kpt #: 278 total cpu time spent up to now is 462.2 secs Computing kpt #: 279 total cpu time spent up to now is 463.9 secs Computing kpt #: 280 total cpu time spent up to now is 466.0 secs Computing kpt #: 281 total cpu time spent up to now is 468.1 secs Computing kpt #: 282 total cpu time spent up to now is 470.6 secs Computing kpt #: 283 total cpu time spent up to now is 472.6 secs Computing kpt #: 284 total cpu time spent up to now is 474.0 secs Computing kpt #: 285 total cpu time spent up to now is 475.4 secs Computing kpt #: 286 total cpu time spent up to now is 476.8 secs Computing kpt #: 287 total cpu time spent up to now is 478.2 secs Computing kpt #: 288 total cpu time spent up to now is 479.6 secs Computing kpt #: 289 total cpu time spent up to now is 481.0 secs Computing kpt #: 290 total cpu time spent up to now is 482.5 secs Computing kpt #: 291 total cpu time spent up to now is 484.2 secs Computing kpt #: 292 total cpu time spent up to now is 486.0 secs Computing kpt #: 293 total cpu time spent up to now is 488.0 secs Computing kpt #: 294 total cpu time spent up to now is 489.7 secs Computing kpt #: 295 total cpu time spent up to now is 491.1 secs Computing kpt #: 296 total cpu time spent up to now is 492.9 secs Computing kpt #: 297 total cpu time spent up to now is 494.3 secs Computing kpt #: 298 total cpu time spent up to now is 495.8 secs Computing kpt #: 299 total cpu time spent up to now is 497.2 secs Computing kpt #: 300 total cpu time spent up to now is 498.7 secs Computing kpt #: 301 total cpu time spent up to now is 500.3 secs Computing kpt #: 302 total cpu time spent up to now is 501.9 secs Computing kpt #: 303 total cpu time spent up to now is 503.4 secs Computing kpt #: 304 total cpu time spent up to now is 505.0 secs Computing kpt #: 305 total cpu time spent up to now is 506.6 secs Computing kpt #: 306 total cpu time spent up to now is 508.1 secs Computing kpt #: 307 total cpu time spent up to now is 509.7 secs Computing kpt #: 308 total cpu time spent up to now is 511.2 secs Computing kpt #: 309 total cpu time spent up to now is 512.7 secs Computing kpt #: 310 total cpu time spent up to now is 514.3 secs Computing kpt #: 311 total cpu time spent up to now is 515.8 secs Computing kpt #: 312 total cpu time spent up to now is 517.4 secs Computing kpt #: 313 total cpu time spent up to now is 518.9 secs Computing kpt #: 314 total cpu time spent up to now is 520.5 secs Computing kpt #: 315 total cpu time spent up to now is 522.0 secs Computing kpt #: 316 total cpu time spent up to now is 523.5 secs Computing kpt #: 317 total cpu time spent up to now is 524.9 secs Computing kpt #: 318 total cpu time spent up to now is 526.4 secs Computing kpt #: 319 total cpu time spent up to now is 527.9 secs Computing kpt #: 320 total cpu time spent up to now is 529.4 secs Computing kpt #: 321 total cpu time spent up to now is 530.9 secs Computing kpt #: 322 total cpu time spent up to now is 532.4 secs Computing kpt #: 323 total cpu time spent up to now is 533.8 secs Computing kpt #: 324 total cpu time spent up to now is 535.1 secs Computing kpt #: 325 total cpu time spent up to now is 536.9 secs Computing kpt #: 326 total cpu time spent up to now is 538.5 secs Computing kpt #: 327 total cpu time spent up to now is 539.8 secs Computing kpt #: 328 total cpu time spent up to now is 541.2 secs Computing kpt #: 329 total cpu time spent up to now is 542.6 secs Computing kpt #: 330 total cpu time spent up to now is 543.9 secs Computing kpt #: 331 total cpu time spent up to now is 545.3 secs Computing kpt #: 332 total cpu time spent up to now is 546.7 secs Computing kpt #: 333 total cpu time spent up to now is 548.0 secs Computing kpt #: 334 total cpu time spent up to now is 549.4 secs Computing kpt #: 335 total cpu time spent up to now is 550.7 secs Computing kpt #: 336 total cpu time spent up to now is 552.1 secs Computing kpt #: 337 total cpu time spent up to now is 553.5 secs Computing kpt #: 338 total cpu time spent up to now is 554.8 secs Computing kpt #: 339 total cpu time spent up to now is 556.2 secs Computing kpt #: 340 total cpu time spent up to now is 557.6 secs Computing kpt #: 341 total cpu time spent up to now is 558.9 secs Computing kpt #: 342 total cpu time spent up to now is 560.3 secs Computing kpt #: 343 total cpu time spent up to now is 561.6 secs Computing kpt #: 344 total cpu time spent up to now is 563.0 secs ethr = 1.85E-08, avg # of iterations = 39.0 total cpu time spent up to now is 563.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9091 -11.9091 -11.7921 -11.7921 -10.5105 -10.5105 -10.4737 -10.4737 -10.3523 -10.3523 -10.3521 -10.3521 2.4462 2.4462 3.5451 3.5451 7.0614 7.0614 8.8579 8.8579 9.5654 9.5654 9.5886 9.5886 9.9870 9.9870 10.0620 10.0620 10.3540 10.3540 10.7731 10.7731 11.2084 11.2084 11.2525 11.2525 11.8566 11.8566 12.6166 12.6166 12.6445 12.6445 13.4171 13.4171 k = 0.0000 0.0125-0.0000 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8154 -21.8154 -21.6998 -21.6998 -21.6145 -21.6145 -21.4387 -21.4387 -11.9091 -11.9091 -11.7922 -11.7922 -10.5104 -10.5104 -10.4739 -10.4739 -10.3523 -10.3523 -10.3522 -10.3522 2.4477 2.4477 3.5461 3.5461 7.0628 7.0628 8.8586 8.8586 9.5632 9.5632 9.5866 9.5866 9.9830 9.9830 10.0615 10.0615 10.3550 10.3550 10.7743 10.7743 11.2085 11.2085 11.2526 11.2526 11.8572 11.8572 12.6132 12.6132 12.6410 12.6410 13.4176 13.4176 k = 0.0000 0.0250-0.0000 ( 9989 PWs) bands (ev): -45.6702 -45.6702 -45.5686 -45.5686 -30.8447 -30.8447 -30.8110 -30.8110 -22.4178 -22.4178 -22.2418 -22.2418 -21.8150 -21.8150 -21.6998 -21.6998 -21.6148 -21.6148 -21.4392 -21.4392 -11.9091 -11.9091 -11.7925 -11.7925 -10.5104 -10.5104 -10.4742 -10.4742 -10.3527 -10.3527 -10.3521 -10.3521 2.4522 2.4522 3.5490 3.5490 7.0670 7.0670 8.8605 8.8605 9.5549 9.5549 9.5824 9.5824 9.9707 9.9707 10.0604 10.0604 10.3578 10.3578 10.7778 10.7778 11.2069 11.2069 11.2547 11.2547 11.8592 11.8592 12.6028 12.6028 12.6310 12.6310 13.4192 13.4192 k = 0.0000 0.0375-0.0000 ( 9983 PWs) bands (ev): -45.6700 -45.6700 -45.5688 -45.5688 -30.8446 -30.8446 -30.8110 -30.8110 -22.4174 -22.4174 -22.2420 -22.2420 -21.8143 -21.8143 -21.6998 -21.6998 -21.6151 -21.6151 -21.4400 -21.4400 -11.9091 -11.9091 -11.7930 -11.7930 -10.5104 -10.5104 -10.4747 -10.4747 -10.3535 -10.3535 -10.3520 -10.3520 2.4597 2.4597 3.5539 3.5539 7.0740 7.0740 8.8636 8.8636 9.5382 9.5382 9.5787 9.5787 9.9501 9.9501 10.0589 10.0589 10.3625 10.3625 10.7834 10.7834 11.2000 11.2000 11.2622 11.2622 11.8622 11.8622 12.5852 12.5852 12.6159 12.6159 13.4216 13.4216 k = 0.0000 0.0500-0.0000 ( 9985 PWs) bands (ev): -45.6698 -45.6698 -45.5691 -45.5691 -30.8445 -30.8445 -30.8110 -30.8110 -22.4168 -22.4168 -22.2422 -22.2422 -21.8134 -21.8134 -21.6998 -21.6998 -21.6156 -21.6156 -21.4411 -21.4411 -11.9091 -11.9091 -11.7937 -11.7937 -10.5103 -10.5103 -10.4754 -10.4754 -10.3545 -10.3545 -10.3518 -10.3518 2.4702 2.4702 3.5607 3.5607 7.0837 7.0837 8.8677 8.8677 9.5130 9.5130 9.5759 9.5759 9.9214 9.9214 10.0574 10.0574 10.3690 10.3690 10.7906 10.7906 11.1864 11.1864 11.2765 11.2765 11.8662 11.8662 12.5602 12.5602 12.5974 12.5974 13.3901 13.3901 k = 0.0000 0.0625-0.0000 ( 9977 PWs) bands (ev): -45.6694 -45.6694 -45.5695 -45.5695 -30.8443 -30.8443 -30.8111 -30.8111 -22.4160 -22.4160 -22.2426 -22.2426 -21.8122 -21.8122 -21.6998 -21.6998 -21.6162 -21.6162 -21.4425 -21.4425 -11.9092 -11.9092 -11.7946 -11.7946 -10.5102 -10.5102 -10.4763 -10.4763 -10.3557 -10.3557 -10.3516 -10.3516 2.4835 2.4835 3.5693 3.5693 7.0962 7.0962 8.8728 8.8728 9.4807 9.4807 9.5734 9.5734 9.8851 9.8851 10.0561 10.0561 10.3774 10.3774 10.7990 10.7990 11.1665 11.1665 11.2969 11.2969 11.8709 11.8709 12.5283 12.5283 12.5768 12.5768 13.3207 13.3208 k = 0.0000 0.0750-0.0000 ( 9985 PWs) bands (ev): -45.6690 -45.6690 -45.5699 -45.5699 -30.8441 -30.8441 -30.8111 -30.8111 -22.4150 -22.4150 -22.2431 -22.2431 -21.8108 -21.8108 -21.6997 -21.6997 -21.6170 -21.6170 -21.4442 -21.4442 -11.9092 -11.9092 -11.7957 -11.7957 -10.5102 -10.5102 -10.4773 -10.4773 -10.3573 -10.3573 -10.3514 -10.3514 2.4999 2.4999 3.5799 3.5799 7.1113 7.1113 8.8784 8.8784 9.4422 9.4422 9.5708 9.5708 9.8419 9.8419 10.0550 10.0550 10.3877 10.3877 10.8080 10.8080 11.1411 11.1411 11.3224 11.3224 11.8758 11.8758 12.4908 12.4908 12.5548 12.5548 13.2504 13.2504 k = 0.0000 0.0875-0.0000 ( 9981 PWs) bands (ev): -45.6685 -45.6685 -45.5704 -45.5704 -30.8438 -30.8438 -30.8112 -30.8112 -22.4139 -22.4139 -22.2436 -22.2436 -21.8090 -21.8090 -21.6997 -21.6997 -21.6179 -21.6179 -21.4463 -21.4463 -11.9093 -11.9093 -11.7969 -11.7969 -10.5102 -10.5102 -10.4784 -10.4784 -10.3591 -10.3591 -10.3512 -10.3512 2.5190 2.5190 3.5922 3.5922 7.1291 7.1291 8.8844 8.8844 9.3983 9.3983 9.5681 9.5681 9.7929 9.7929 10.0540 10.0540 10.3997 10.3997 10.8173 10.8173 11.1109 11.1109 11.3522 11.3522 11.8806 11.8806 12.4490 12.4490 12.5322 12.5322 13.1807 13.1807 k = 0.0000 0.1000-0.0000 ( 9987 PWs) bands (ev): -45.6679 -45.6679 -45.5710 -45.5710 -30.8435 -30.8435 -30.8113 -30.8113 -22.4126 -22.4126 -22.2442 -22.2442 -21.8071 -21.8071 -21.6996 -21.6996 -21.6189 -21.6189 -21.4486 -21.4486 -11.9093 -11.9093 -11.7984 -11.7984 -10.5103 -10.5103 -10.4796 -10.4796 -10.3611 -10.3611 -10.3510 -10.3510 2.5411 2.5411 3.6063 3.6063 7.1494 7.1494 8.8901 8.8901 9.3498 9.3498 9.5651 9.5651 9.7389 9.7389 10.0534 10.0534 10.4135 10.4135 10.8261 10.8261 11.0761 11.0761 11.3860 11.3860 11.8849 11.8849 12.4038 12.4038 12.5094 12.5094 13.1126 13.1126 k = 0.0000 0.1125-0.0000 ( 9977 PWs) bands (ev): -45.6672 -45.6672 -45.5716 -45.5716 -30.8431 -30.8431 -30.8113 -30.8113 -22.4112 -22.4112 -22.2449 -22.2449 -21.8048 -21.8048 -21.6995 -21.6995 -21.6201 -21.6201 -21.4512 -21.4512 -11.9094 -11.9094 -11.8000 -11.8000 -10.5105 -10.5105 -10.4809 -10.4809 -10.3633 -10.3633 -10.3507 -10.3507 2.5659 2.5659 3.6220 3.6220 7.1721 7.1721 8.8950 8.8950 9.2973 9.2973 9.5619 9.5619 9.6811 9.6811 10.0531 10.0531 10.4290 10.4290 10.8343 10.8343 11.0373 11.0373 11.4234 11.4234 11.8880 11.8880 12.3564 12.3564 12.4871 12.4871 13.0468 13.0468 k = 0.0000 0.1250-0.0000 ( 9969 PWs) bands (ev): -45.6665 -45.6665 -45.5723 -45.5723 -30.8427 -30.8427 -30.8114 -30.8114 -22.4096 -22.4096 -22.2457 -22.2457 -21.8024 -21.8024 -21.6995 -21.6995 -21.6214 -21.6214 -21.4542 -21.4542 -11.9094 -11.9094 -11.8017 -11.8017 -10.5108 -10.5108 -10.4821 -10.4821 -10.3656 -10.3656 -10.3505 -10.3505 2.5934 2.5934 3.6394 3.6394 7.1973 7.1973 8.8981 8.8981 9.2416 9.2416 9.5585 9.5585 9.6208 9.6208 10.0533 10.0533 10.4463 10.4463 10.8412 10.8412 10.9948 10.9948 11.4638 11.4638 11.8897 11.8897 12.3076 12.3076 12.4655 12.4655 12.9835 12.9835 k = 0.0000 0.1375-0.0000 ( 9961 PWs) bands (ev): -45.6657 -45.6657 -45.5731 -45.5731 -30.8423 -30.8423 -30.8115 -30.8115 -22.4078 -22.4078 -22.2466 -22.2466 -21.7996 -21.7996 -21.6994 -21.6994 -21.6228 -21.6228 -21.4574 -21.4574 -11.9094 -11.9094 -11.8037 -11.8037 -10.5113 -10.5113 -10.4833 -10.4833 -10.3681 -10.3681 -10.3503 -10.3503 2.6236 2.6236 3.6583 3.6583 7.2247 7.2247 8.8982 8.8982 9.1831 9.1831 9.5548 9.5548 9.5597 9.5597 10.0541 10.0541 10.4652 10.4652 10.8466 10.8466 10.9492 10.9492 11.5069 11.5069 11.8894 11.8894 12.2583 12.2583 12.4448 12.4448 12.9232 12.9232 k = 0.0000 0.1500-0.0000 ( 9979 PWs) bands (ev): -45.6648 -45.6648 -45.5740 -45.5740 -30.8418 -30.8418 -30.8117 -30.8117 -22.4059 -22.4059 -22.2476 -22.2476 -21.7967 -21.7967 -21.6992 -21.6992 -21.6243 -21.6243 -21.4609 -21.4609 -11.9095 -11.9095 -11.8058 -11.8058 -10.5119 -10.5119 -10.4844 -10.4844 -10.3708 -10.3708 -10.3502 -10.3502 2.6564 2.6564 3.6786 3.6786 7.2542 7.2542 8.8938 8.8938 9.1225 9.1225 9.4997 9.4997 9.5510 9.5510 10.0556 10.0556 10.4858 10.4858 10.8496 10.8496 10.9014 10.9014 11.5520 11.5520 11.8869 11.8869 12.2094 12.2094 12.4251 12.4251 12.8661 12.8661 k = 0.0000 0.1625-0.0000 ( 9989 PWs) bands (ev): -45.6638 -45.6638 -45.5749 -45.5749 -30.8413 -30.8413 -30.8118 -30.8118 -22.4038 -22.4038 -22.2486 -22.2486 -21.7934 -21.7934 -21.6991 -21.6991 -21.6258 -21.6258 -21.4646 -21.4646 -11.9095 -11.9095 -11.8080 -11.8080 -10.5128 -10.5128 -10.4854 -10.4854 -10.3735 -10.3735 -10.3501 -10.3501 2.6918 2.6918 3.7003 3.7003 7.2858 7.2858 8.8827 8.8827 9.0602 9.0602 9.4432 9.4432 9.5470 9.5470 10.0580 10.0580 10.5079 10.5079 10.8402 10.8402 10.8619 10.8619 11.5984 11.5984 11.8820 11.8820 12.1620 12.1620 12.4065 12.4065 12.8123 12.8123 k = 0.0000 0.1750-0.0000 ( 9986 PWs) bands (ev): -45.6628 -45.6628 -45.5759 -45.5759 -30.8408 -30.8408 -30.8119 -30.8119 -22.4016 -22.4016 -22.2498 -22.2498 -21.7900 -21.7900 -21.6990 -21.6990 -21.6275 -21.6275 -21.4687 -21.4687 -11.9095 -11.9095 -11.8104 -11.8104 -10.5138 -10.5138 -10.4863 -10.4863 -10.3762 -10.3762 -10.3501 -10.3501 2.7295 2.7295 3.7232 3.7232 7.3191 7.3191 8.8626 8.8626 8.9968 8.9968 9.3929 9.3929 9.5429 9.5429 10.0616 10.0616 10.5316 10.5316 10.7930 10.7930 10.8562 10.8562 11.6445 11.6445 11.8745 11.8745 12.1177 12.1177 12.3886 12.3886 12.7619 12.7619 k = 0.0000 0.1875-0.0000 ( 9992 PWs) bands (ev): -45.6617 -45.6617 -45.5770 -45.5770 -30.8403 -30.8403 -30.8121 -30.8121 -22.3992 -22.3992 -22.2510 -22.2510 -21.7863 -21.7863 -21.6988 -21.6988 -21.6293 -21.6293 -21.4729 -21.4729 -11.9095 -11.9095 -11.8130 -11.8130 -10.5151 -10.5151 -10.4872 -10.4872 -10.3789 -10.3789 -10.3501 -10.3501 2.7696 2.7696 3.7471 3.7471 7.3539 7.3539 8.8313 8.8313 8.9328 8.9328 9.3509 9.3509 9.5388 9.5388 10.0665 10.0665 10.5569 10.5569 10.7390 10.7390 10.8537 10.8537 11.6881 11.6881 11.8646 11.8646 12.0791 12.0791 12.3713 12.3713 12.7152 12.7152 k = 0.0000 0.2000-0.0000 ( 9984 PWs) bands (ev): -45.6606 -45.6606 -45.5781 -45.5781 -30.8397 -30.8397 -30.8123 -30.8123 -22.3967 -22.3967 -22.2524 -22.2524 -21.7824 -21.7824 -21.6986 -21.6986 -21.6312 -21.6312 -21.4775 -21.4775 -11.9094 -11.9094 -11.8156 -11.8156 -10.5166 -10.5166 -10.4879 -10.4879 -10.3816 -10.3816 -10.3502 -10.3502 2.8120 2.8120 3.7720 3.7720 7.3901 7.3901 8.7878 8.7878 8.8686 8.8686 9.3187 9.3187 9.5346 9.5346 10.0729 10.0729 10.5837 10.5837 10.6835 10.6835 10.8496 10.8496 11.7247 11.7247 11.8524 11.8524 12.0506 12.0506 12.3543 12.3543 12.6720 12.6720 k = 0.0000 0.2125-0.0000 ( 9972 PWs) bands (ev): -45.6593 -45.6593 -45.5793 -45.5793 -30.8391 -30.8391 -30.8125 -30.8125 -22.3941 -22.3941 -22.2538 -22.2538 -21.7782 -21.7782 -21.6983 -21.6983 -21.6331 -21.6331 -21.4823 -21.4823 -11.9093 -11.9093 -11.8184 -11.8184 -10.5182 -10.5182 -10.4886 -10.4886 -10.3842 -10.3842 -10.3504 -10.3504 2.8564 2.8564 3.7977 3.7977 7.4271 7.4271 8.7326 8.7326 8.8049 8.8049 9.2958 9.2958 9.5305 9.5305 10.0810 10.0810 10.6118 10.6118 10.6272 10.6272 10.8436 10.8436 11.7475 11.7475 11.8383 11.8383 12.0387 12.0388 12.3374 12.3374 12.6325 12.6325 k = 0.0000 0.2250-0.0000 ( 9976 PWs) bands (ev): -45.6581 -45.6581 -45.5806 -45.5806 -30.8384 -30.8384 -30.8127 -30.8127 -22.3914 -22.3914 -22.2554 -22.2554 -21.7738 -21.7738 -21.6981 -21.6981 -21.6351 -21.6351 -21.4873 -21.4873 -11.9092 -11.9092 -11.8212 -11.8212 -10.5198 -10.5198 -10.4893 -10.4893 -10.3866 -10.3866 -10.3506 -10.3506 2.9029 2.9029 3.8240 3.8240 7.4647 7.4647 8.6679 8.6679 8.7420 8.7420 9.2805 9.2805 9.5264 9.5264 10.0910 10.0910 10.5702 10.5702 10.6416 10.6416 10.8356 10.8356 11.7507 11.7507 11.8227 11.8227 12.0493 12.0493 12.3202 12.3202 12.5967 12.5967 k = 0.0000 0.2375-0.0000 ( 9980 PWs) bands (ev): -45.6567 -45.6567 -45.5819 -45.5819 -30.8378 -30.8378 -30.8129 -30.8129 -22.3885 -22.3885 -22.2570 -22.2570 -21.7693 -21.7693 -21.6978 -21.6978 -21.6371 -21.6371 -21.4925 -21.4925 -11.9091 -11.9091 -11.8242 -11.8242 -10.5216 -10.5216 -10.4901 -10.4901 -10.3889 -10.3889 -10.3510 -10.3510 2.9513 2.9513 3.8507 3.8507 7.5023 7.5023 8.5958 8.5958 8.6806 8.6806 9.2707 9.2707 9.5226 9.5226 10.1030 10.1030 10.5134 10.5134 10.6726 10.6726 10.8257 10.8257 11.7355 11.7355 11.8061 11.8061 12.0806 12.0806 12.3023 12.3023 12.5646 12.5646 k = 0.0000 0.2500-0.0000 ( 9984 PWs) bands (ev): -45.6553 -45.6553 -45.5833 -45.5833 -30.8371 -30.8371 -30.8131 -30.8131 -22.3856 -22.3856 -22.2588 -22.2588 -21.7645 -21.7645 -21.6974 -21.6974 -21.6392 -21.6392 -21.4980 -21.4980 -11.9089 -11.9089 -11.8272 -11.8272 -10.5234 -10.5234 -10.4910 -10.4910 -10.3909 -10.3909 -10.3514 -10.3514 3.0013 3.0013 3.8777 3.8777 7.5393 7.5393 8.5187 8.5187 8.6217 8.6217 9.2643 9.2643 9.5190 9.5190 10.1171 10.1171 10.4569 10.4569 10.7050 10.7050 10.8140 10.8140 11.7090 11.7090 11.7887 11.7887 12.1255 12.1255 12.2836 12.2836 12.5362 12.5362 k = 0.0000 0.2625-0.0000 ( 9974 PWs) bands (ev): -45.6539 -45.6539 -45.5847 -45.5847 -30.8364 -30.8364 -30.8134 -30.8134 -22.3825 -22.3825 -22.2606 -22.2606 -21.7595 -21.7595 -21.6971 -21.6971 -21.6414 -21.6414 -21.5036 -21.5036 -11.9086 -11.9086 -11.8303 -11.8303 -10.5252 -10.5252 -10.4920 -10.4920 -10.3927 -10.3927 -10.3520 -10.3520 3.0530 3.0530 3.9046 3.9046 7.5747 7.5747 8.4382 8.4382 8.5661 8.5661 9.2595 9.2595 9.5157 9.5157 10.1333 10.1333 10.4009 10.4009 10.7386 10.7386 10.8006 10.8006 11.6770 11.6770 11.7710 11.7710 12.1773 12.1773 12.2640 12.2640 12.5114 12.5114 k = 0.0000 0.2750-0.0000 ( 9980 PWs) bands (ev): -45.6524 -45.6524 -45.5862 -45.5862 -30.8357 -30.8357 -30.8137 -30.8137 -22.3793 -22.3793 -22.2626 -22.2626 -21.7543 -21.7543 -21.6966 -21.6966 -21.6435 -21.6435 -21.5095 -21.5095 -11.9083 -11.9083 -11.8334 -11.8334 -10.5269 -10.5269 -10.4932 -10.4932 -10.3942 -10.3942 -10.3526 -10.3526 3.1061 3.1061 3.9313 3.9313 7.6074 7.6074 8.3560 8.3560 8.5153 8.5153 9.2552 9.2552 9.5129 9.5129 10.1516 10.1516 10.3458 10.3458 10.7735 10.7735 10.7859 10.7859 11.6431 11.6431 11.7531 11.7531 12.2273 12.2273 12.2478 12.2478 12.4902 12.4902 k = 0.0000 0.2875-0.0000 ( 9966 PWs) bands (ev): -45.6508 -45.6508 -45.5877 -45.5877 -30.8349 -30.8349 -30.8140 -30.8140 -22.3761 -22.3761 -22.2647 -22.2647 -21.7489 -21.7489 -21.6962 -21.6962 -21.6457 -21.6457 -21.5155 -21.5155 -11.9079 -11.9079 -11.8366 -11.8366 -10.5286 -10.5286 -10.4946 -10.4946 -10.3954 -10.3954 -10.3533 -10.3533 3.1605 3.1605 3.9575 3.9575 7.6362 7.6362 8.2732 8.2732 8.4706 8.4706 9.2504 9.2504 9.5105 9.5105 10.1719 10.1719 10.2917 10.2917 10.7696 10.7696 10.8098 10.8098 11.6093 11.6093 11.7355 11.7355 12.2169 12.2169 12.2908 12.2908 12.4725 12.4725 k = 0.0000 0.3000-0.0000 ( 9976 PWs) bands (ev): -45.6492 -45.6492 -45.5893 -45.5893 -30.8342 -30.8342 -30.8143 -30.8143 -22.3727 -22.3727 -22.2668 -22.2668 -21.7433 -21.7433 -21.6956 -21.6956 -21.6479 -21.6479 -21.5217 -21.5217 -11.9075 -11.9075 -11.8398 -11.8398 -10.5302 -10.5302 -10.4962 -10.4962 -10.3963 -10.3963 -10.3542 -10.3542 3.2158 3.2158 3.9829 3.9829 7.6593 7.6593 8.1908 8.1908 8.4338 8.4338 9.2445 9.2445 9.5087 9.5087 10.1940 10.1940 10.2388 10.2388 10.7526 10.7526 10.8472 10.8472 11.5766 11.5766 11.7183 11.7183 12.1924 12.1924 12.3444 12.3444 12.4584 12.4584 k = 0.0000 0.3125-0.0000 ( 9956 PWs) bands (ev): -45.6476 -45.6476 -45.5909 -45.5909 -30.8334 -30.8334 -30.8146 -30.8146 -22.3693 -22.3693 -22.2691 -22.2691 -21.7376 -21.7376 -21.6951 -21.6951 -21.6501 -21.6501 -21.5281 -21.5281 -11.9070 -11.9070 -11.8431 -11.8431 -10.5317 -10.5317 -10.4980 -10.4980 -10.3968 -10.3968 -10.3551 -10.3551 3.2721 3.2721 4.0072 4.0072 7.6751 7.6751 8.1096 8.1096 8.4066 8.4066 9.2371 9.2371 9.5077 9.5077 10.1871 10.1871 10.2177 10.2177 10.7348 10.7348 10.8856 10.8856 11.5459 11.5459 11.7017 11.7017 12.1656 12.1656 12.3953 12.3953 12.4479 12.4479 k = 0.0000 0.3250-0.0000 ( 9958 PWs) bands (ev): -45.6459 -45.6459 -45.5926 -45.5926 -30.8327 -30.8327 -30.8150 -30.8150 -22.3658 -22.3658 -22.2715 -22.2715 -21.7317 -21.7317 -21.6944 -21.6944 -21.6524 -21.6524 -21.5346 -21.5346 -11.9064 -11.9064 -11.8463 -11.8463 -10.5330 -10.5330 -10.4999 -10.4999 -10.3970 -10.3970 -10.3561 -10.3561 3.3289 3.3289 4.0301 4.0301 7.6823 7.6823 8.0304 8.0304 8.3906 8.3906 9.2277 9.2277 9.5074 9.5074 10.1372 10.1372 10.2424 10.2424 10.7166 10.7166 10.9252 10.9252 11.5177 11.5177 11.6856 11.6856 12.1365 12.1365 12.4364 12.4364 12.4463 12.4463 k = 0.0000 0.3375-0.0000 ( 9960 PWs) bands (ev): -45.6441 -45.6441 -45.5943 -45.5943 -30.8319 -30.8319 -30.8154 -30.8154 -22.3623 -22.3623 -22.2739 -22.2739 -21.7256 -21.7256 -21.6937 -21.6937 -21.6546 -21.6546 -21.5413 -21.5413 -11.9057 -11.9057 -11.8496 -11.8496 -10.5342 -10.5342 -10.5021 -10.5021 -10.3970 -10.3970 -10.3572 -10.3572 3.3861 3.3861 4.0513 4.0513 7.6801 7.6801 7.9539 7.9539 8.3865 8.3865 9.2163 9.2163 9.5080 9.5080 10.0888 10.0888 10.2678 10.2678 10.6981 10.6981 10.9658 10.9658 11.4924 11.4924 11.6702 11.6702 12.1054 12.1054 12.4353 12.4353 12.4848 12.4848 k = 0.0000 0.3500-0.0000 ( 9966 PWs) bands (ev): -45.6423 -45.6423 -45.5961 -45.5961 -30.8311 -30.8311 -30.8158 -30.8158 -22.3587 -22.3587 -22.2765 -22.2765 -21.7195 -21.7195 -21.6930 -21.6930 -21.6568 -21.6568 -21.5481 -21.5481 -11.9049 -11.9049 -11.8528 -11.8528 -10.5352 -10.5352 -10.5043 -10.5043 -10.3966 -10.3966 -10.3585 -10.3585 3.4435 3.4435 4.0704 4.0704 7.6690 7.6690 7.8806 7.8806 8.3940 8.3940 9.2026 9.2026 9.5095 9.5095 10.0422 10.0422 10.2935 10.2935 10.6797 10.6797 11.0074 11.0074 11.4704 11.4704 11.6553 11.6553 12.0723 12.0723 12.4344 12.4344 12.5204 12.5204 k = 0.0000 0.3625-0.0000 ( 9956 PWs) bands (ev): -45.6405 -45.6405 -45.5979 -45.5979 -30.8304 -30.8304 -30.8162 -30.8162 -22.3550 -22.3550 -22.2792 -22.2792 -21.7132 -21.7132 -21.6921 -21.6921 -21.6589 -21.6589 -21.5550 -21.5550 -11.9040 -11.9040 -11.8560 -11.8560 -10.5360 -10.5360 -10.5067 -10.5067 -10.3959 -10.3959 -10.3598 -10.3598 3.5006 3.5006 4.0870 4.0870 7.6502 7.6502 7.8112 7.8112 8.4119 8.4119 9.1867 9.1867 9.5122 9.5122 9.9975 9.9975 10.3190 10.3190 10.6616 10.6616 11.0500 11.0500 11.4519 11.4519 11.6409 11.6409 12.0371 12.0371 12.4363 12.4363 12.5501 12.5501 k = 0.0000 0.3750-0.0000 ( 9960 PWs) bands (ev): -45.6387 -45.6387 -45.5997 -45.5997 -30.8296 -30.8296 -30.8166 -30.8166 -22.3514 -22.3514 -22.2820 -22.2820 -21.7068 -21.7068 -21.6911 -21.6911 -21.6611 -21.6611 -21.5620 -21.5620 -11.9030 -11.9030 -11.8592 -11.8592 -10.5366 -10.5366 -10.5092 -10.5092 -10.3951 -10.3951 -10.3612 -10.3612 3.5573 3.5573 4.1008 4.1008 7.6259 7.6259 7.7461 7.7461 8.4383 8.4383 9.1684 9.1684 9.5160 9.5160 9.9546 9.9546 10.3439 10.3439 10.6440 10.6440 11.0934 11.0934 11.4373 11.4373 11.6269 11.6269 12.0001 12.0001 12.4411 12.4411 12.5739 12.5739 k = 0.0000 0.3875-0.0000 ( 9962 PWs) bands (ev): -45.6368 -45.6368 -45.6015 -45.6015 -30.8288 -30.8288 -30.8171 -30.8171 -22.3477 -22.3477 -22.2848 -22.2848 -21.7006 -21.7006 -21.6898 -21.6898 -21.6632 -21.6632 -21.5691 -21.5691 -11.9019 -11.9019 -11.8623 -11.8623 -10.5371 -10.5371 -10.5117 -10.5117 -10.3940 -10.3940 -10.3626 -10.3626 3.6132 3.6132 4.1114 4.1114 7.5979 7.5979 7.6859 7.6859 8.4714 8.4714 9.1477 9.1477 9.5211 9.5211 9.9137 9.9137 10.3677 10.3677 10.6271 10.6271 11.1376 11.1376 11.4266 11.4266 11.6132 11.6132 11.9613 11.9613 12.4487 12.4487 12.5924 12.5924 k = 0.0000 0.4000-0.0000 ( 9964 PWs) bands (ev): -45.6349 -45.6349 -45.6034 -45.6034 -30.8281 -30.8281 -30.8176 -30.8176 -22.3439 -22.3439 -22.2878 -22.2878 -21.6949 -21.6949 -21.6877 -21.6877 -21.6653 -21.6653 -21.5763 -21.5763 -11.9007 -11.9007 -11.8653 -11.8653 -10.5373 -10.5373 -10.5142 -10.5142 -10.3927 -10.3927 -10.3642 -10.3642 3.6680 3.6680 4.1185 4.1185 7.5683 7.5683 7.6311 7.6311 8.5092 8.5092 9.1246 9.1246 9.5276 9.5276 9.8748 9.8748 10.3901 10.3901 10.6109 10.6109 11.1825 11.1825 11.4199 11.4199 11.5995 11.5995 11.9208 11.9208 12.4589 12.4589 12.6066 12.6066 k = 0.0000 0.4125-0.0000 ( 9974 PWs) bands (ev): -45.6330 -45.6330 -45.6053 -45.6053 -30.8273 -30.8273 -30.8181 -30.8181 -22.3402 -22.3402 -22.2908 -22.2908 -21.6910 -21.6910 -21.6837 -21.6837 -21.6673 -21.6673 -21.5835 -21.5835 -11.8994 -11.8994 -11.8683 -11.8683 -10.5373 -10.5373 -10.5167 -10.5167 -10.3912 -10.3912 -10.3658 -10.3658 3.7213 3.7213 4.1218 4.1218 7.5386 7.5386 7.5820 7.5820 8.5504 8.5504 9.0992 9.0992 9.5355 9.5355 9.8380 9.8380 10.4109 10.4109 10.5957 10.5957 11.2281 11.2281 11.4172 11.4172 11.5858 11.5858 11.8790 11.8790 12.4716 12.4716 12.6176 12.6176 k = 0.0000 0.4250-0.0000 ( 9978 PWs) bands (ev): -45.6311 -45.6311 -45.6073 -45.6073 -30.8266 -30.8266 -30.8186 -30.8186 -22.3365 -22.3365 -22.2940 -22.2940 -21.6889 -21.6889 -21.6778 -21.6778 -21.6692 -21.6692 -21.5908 -21.5908 -11.8979 -11.8979 -11.8712 -11.8712 -10.5371 -10.5371 -10.5191 -10.5191 -10.3897 -10.3897 -10.3675 -10.3675 3.7727 3.7727 4.1209 4.1209 7.5102 7.5102 7.5389 7.5389 8.5938 8.5938 9.0714 9.0714 9.5450 9.5450 9.8033 9.8033 10.4298 10.4298 10.5814 10.5814 11.2742 11.2742 11.4184 11.4184 11.5718 11.5718 11.8358 11.8358 12.4868 12.4868 12.6265 12.6265 k = 0.0000 0.4375-0.0000 ( 9976 PWs) bands (ev): -45.6291 -45.6291 -45.6092 -45.6092 -30.8258 -30.8258 -30.8192 -30.8192 -22.3327 -22.3327 -22.2972 -22.2972 -21.6874 -21.6874 -21.6719 -21.6719 -21.6703 -21.6703 -21.5981 -21.5981 -11.8964 -11.8964 -11.8741 -11.8741 -10.5367 -10.5367 -10.5215 -10.5215 -10.3880 -10.3880 -10.3693 -10.3693 3.8218 3.8218 4.1157 4.1157 7.4843 7.4843 7.5023 7.5023 8.6384 8.6384 9.0413 9.0413 9.5561 9.5561 9.7706 9.7706 10.4468 10.4468 10.5680 10.5680 11.3208 11.3208 11.4231 11.4231 11.5576 11.5576 11.7915 11.7915 12.5042 12.5042 12.6347 12.6347 k = 0.0000 0.4500-0.0000 ( 9984 PWs) bands (ev): -45.6271 -45.6271 -45.6112 -45.6112 -30.8251 -30.8251 -30.8198 -30.8198 -22.3290 -22.3290 -22.3005 -22.3005 -21.6859 -21.6859 -21.6732 -21.6732 -21.6639 -21.6639 -21.6055 -21.6055 -11.8947 -11.8947 -11.8768 -11.8768 -10.5360 -10.5360 -10.5237 -10.5237 -10.3862 -10.3862 -10.3711 -10.3711 3.8684 3.8684 4.1060 4.1060 7.4616 7.4616 7.4722 7.4722 8.6835 8.6835 9.0089 9.0089 9.5690 9.5690 9.7401 9.7401 10.4622 10.4622 10.5554 10.5554 11.3676 11.3676 11.4311 11.4311 11.5429 11.5429 11.7463 11.7463 12.5237 12.5237 12.6431 12.6431 k = 0.0000 0.4625-0.0000 ( 9988 PWs) bands (ev): -45.6251 -45.6251 -45.6132 -45.6132 -30.8244 -30.8244 -30.8204 -30.8204 -22.3253 -22.3253 -22.3039 -22.3039 -21.6845 -21.6845 -21.6749 -21.6749 -21.6569 -21.6569 -21.6129 -21.6129 -11.8929 -11.8929 -11.8794 -11.8794 -10.5352 -10.5352 -10.5259 -10.5259 -10.3844 -10.3844 -10.3730 -10.3730 3.9119 3.9119 4.0916 4.0916 7.4431 7.4431 7.4488 7.4488 8.7285 8.7285 8.9743 8.9743 9.5836 9.5836 9.7116 9.7116 10.4759 10.4759 10.5437 10.5437 11.4141 11.4141 11.4424 11.4424 11.5279 11.5279 11.7003 11.7003 12.5451 12.5451 12.6526 12.6527 k = 0.0000 0.4750-0.0000 ( 9992 PWs) bands (ev): -45.6231 -45.6231 -45.6152 -45.6152 -30.8237 -30.8237 -30.8210 -30.8210 -22.3216 -22.3216 -22.3073 -22.3073 -21.6831 -21.6831 -21.6767 -21.6767 -21.6497 -21.6497 -21.6203 -21.6203 -11.8909 -11.8909 -11.8820 -11.8820 -10.5341 -10.5341 -10.5278 -10.5278 -10.3825 -10.3825 -10.3748 -10.3748 3.9520 3.9520 4.0726 4.0726 7.4294 7.4294 7.4322 7.4322 8.7729 8.7729 8.9376 8.9376 9.6000 9.6000 9.6853 9.6853 10.4884 10.4884 10.5325 10.5325 11.4498 11.4498 11.4667 11.4667 11.5125 11.5125 11.6536 11.6536 12.5685 12.5685 12.6631 12.6631 k = 0.0000 0.4875-0.0000 ( 9992 PWs) bands (ev): -45.6211 -45.6211 -45.6171 -45.6171 -30.8230 -30.8230 -30.8216 -30.8216 -22.3180 -22.3180 -22.3108 -22.3108 -21.6816 -21.6816 -21.6784 -21.6784 -21.6424 -21.6424 -21.6277 -21.6277 -11.8889 -11.8889 -11.8844 -11.8844 -10.5328 -10.5328 -10.5297 -10.5297 -10.3806 -10.3806 -10.3768 -10.3768 3.9885 3.9885 4.0490 4.0490 7.4210 7.4210 7.4221 7.4221 8.8163 8.8163 8.8989 8.8989 9.6184 9.6184 9.6609 9.6609 10.5000 10.5000 10.5217 10.5217 11.4661 11.4661 11.4969 11.4969 11.5121 11.5121 11.6066 11.6066 12.5935 12.5935 12.6476 12.6476 k = 0.0000 0.5000-0.0000 ( 10006 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5313 -10.5313 -10.5313 -10.5313 -10.3787 -10.3787 -10.3787 -10.3787 4.0208 4.0208 4.0208 4.0208 7.4185 7.4185 7.4185 7.4185 8.8584 8.8584 8.8584 8.8584 9.6387 9.6387 9.6387 9.6387 10.5110 10.5110 10.5110 10.5110 11.4813 11.4813 11.4813 11.4813 11.5593 11.5593 11.5593 11.5593 12.6200 12.6200 12.6200 12.6200 k = 0.0000 0.5000-0.0000 ( 10006 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5313 -10.5313 -10.5313 -10.5313 -10.3787 -10.3787 -10.3787 -10.3787 4.0208 4.0208 4.0208 4.0208 7.4185 7.4185 7.4185 7.4185 8.8584 8.8584 8.8584 8.8584 9.6387 9.6387 9.6387 9.6387 10.5110 10.5110 10.5110 10.5110 11.4813 11.4813 11.4813 11.4813 11.5593 11.5593 11.5593 11.5593 12.6200 12.6200 12.6200 12.6200 k = 0.0125 0.5000-0.0000 ( 9990 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3145 -22.3145 -22.3144 -22.3144 -21.6809 -21.6809 -21.6805 -21.6805 -21.6344 -21.6344 -21.6341 -21.6341 -11.8868 -11.8868 -11.8866 -11.8866 -10.5332 -10.5332 -10.5295 -10.5295 -10.3806 -10.3806 -10.3770 -10.3770 4.0209 4.0209 4.0210 4.0210 7.4194 7.4194 7.4206 7.4206 8.8574 8.8574 8.8577 8.8577 9.6382 9.6382 9.6384 9.6384 10.5104 10.5104 10.5107 10.5107 11.4762 11.4762 11.4798 11.4798 11.5581 11.5581 11.5637 11.5637 12.6148 12.6148 12.6180 12.6180 k = 0.0250 0.5000-0.0000 ( 9994 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3147 -22.3147 -22.3146 -22.3146 -21.6831 -21.6831 -21.6824 -21.6824 -21.6323 -21.6323 -21.6317 -21.6317 -11.8869 -11.8869 -11.8867 -11.8867 -10.5350 -10.5350 -10.5276 -10.5276 -10.3828 -10.3828 -10.3755 -10.3755 4.0212 4.0212 4.0213 4.0213 7.4234 7.4234 7.4259 7.4259 8.8548 8.8548 8.8553 8.8553 9.6369 9.6369 9.6373 9.6373 10.5091 10.5091 10.5096 10.5096 11.4656 11.4656 11.4715 11.4715 11.5602 11.5602 11.5699 11.5699 12.6057 12.6057 12.6107 12.6107 k = 0.0375 0.5000-0.0000 ( 9986 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8222 -30.8222 -30.8222 -30.8222 -22.3151 -22.3151 -22.3150 -22.3150 -21.6863 -21.6863 -21.6853 -21.6853 -21.6290 -21.6290 -21.6282 -21.6282 -11.8871 -11.8871 -11.8867 -11.8867 -10.5368 -10.5368 -10.5258 -10.5258 -10.3851 -10.3851 -10.3742 -10.3742 4.0217 4.0217 4.0219 4.0219 7.4304 7.4304 7.4341 7.4341 8.8506 8.8506 8.8512 8.8512 9.6350 9.6350 9.6355 9.6355 10.5070 10.5070 10.5079 10.5079 11.4509 11.4509 11.4578 11.4578 11.5642 11.5642 11.5767 11.5767 12.5964 12.5964 12.6024 12.6024 k = 0.0500 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8222 -30.8222 -30.8222 -30.8222 -22.3157 -22.3157 -22.3155 -22.3155 -21.6901 -21.6901 -21.6889 -21.6889 -21.6249 -21.6249 -21.6240 -21.6240 -11.8874 -11.8874 -11.8869 -11.8869 -10.5386 -10.5386 -10.5239 -10.5239 -10.3876 -10.3876 -10.3731 -10.3731 4.0223 4.0223 4.0226 4.0226 7.4405 7.4405 7.4455 7.4455 8.8448 8.8448 8.8456 8.8456 9.6324 9.6324 9.6330 9.6330 10.5041 10.5041 10.5054 10.5054 11.4330 11.4330 11.4400 11.4400 11.5689 11.5689 11.5832 11.5832 12.5892 12.5892 12.5955 12.5955 k = 0.0625 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8221 -30.8221 -30.8221 -30.8221 -22.3164 -22.3164 -22.3161 -22.3161 -21.6942 -21.6942 -21.6929 -21.6929 -21.6203 -21.6203 -21.6192 -21.6192 -11.8877 -11.8877 -11.8871 -11.8871 -10.5404 -10.5404 -10.5220 -10.5220 -10.3904 -10.3904 -10.3723 -10.3723 4.0232 4.0232 4.0236 4.0236 7.4535 7.4535 7.4597 7.4597 8.8374 8.8374 8.8384 8.8384 9.6292 9.6292 9.6299 9.6299 10.5007 10.5007 10.5024 10.5024 11.4122 11.4122 11.4191 11.4191 11.5733 11.5733 11.5889 11.5889 12.5848 12.5848 12.5912 12.5912 k = 0.0750 0.5000-0.0000 ( 9986 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8220 -30.8220 -30.8220 -30.8220 -22.3172 -22.3172 -22.3169 -22.3169 -21.6986 -21.6986 -21.6972 -21.6972 -21.6152 -21.6152 -21.6141 -21.6141 -11.8881 -11.8881 -11.8873 -11.8873 -10.5421 -10.5421 -10.5202 -10.5202 -10.3933 -10.3933 -10.3717 -10.3717 4.0242 4.0242 4.0247 4.0247 7.4694 7.4694 7.4768 7.4768 8.8287 8.8287 8.8297 8.8297 9.6256 9.6256 9.6263 9.6263 10.4967 10.4967 10.4988 10.4988 11.3890 11.3890 11.3954 11.3954 11.5770 11.5770 11.5935 11.5935 12.5838 12.5838 12.5901 12.5901 k = 0.0875 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8219 -30.8219 -30.8219 -30.8219 -22.3182 -22.3182 -22.3178 -22.3178 -21.7031 -21.7031 -21.7016 -21.7016 -21.6099 -21.6099 -21.6088 -21.6088 -11.8885 -11.8885 -11.8877 -11.8877 -10.5438 -10.5438 -10.5184 -10.5184 -10.3963 -10.3963 -10.3712 -10.3712 4.0255 4.0255 4.0259 4.0259 7.4880 7.4880 7.4967 7.4967 8.8186 8.8186 8.8196 8.8196 9.6216 9.6216 9.6223 9.6223 10.4922 10.4922 10.4950 10.4950 11.3636 11.3636 11.3695 11.3695 11.5798 11.5798 11.5969 11.5969 12.5864 12.5864 12.5923 12.5923 k = 0.1000 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8218 -30.8218 -30.8218 -30.8218 -22.3193 -22.3193 -22.3189 -22.3189 -21.7076 -21.7076 -21.7061 -21.7061 -21.6044 -21.6044 -21.6033 -21.6033 -11.8890 -11.8890 -11.8880 -11.8880 -10.5454 -10.5454 -10.5166 -10.5166 -10.3995 -10.3995 -10.3710 -10.3710 4.0268 4.0268 4.0274 4.0274 7.5093 7.5093 7.5193 7.5193 8.8074 8.8074 8.8083 8.8083 9.6172 9.6172 9.6179 9.6179 10.4875 10.4875 10.4909 10.4909 11.3361 11.3361 11.3415 11.3415 11.5814 11.5814 11.5988 11.5988 12.5924 12.5924 12.5980 12.5980 k = 0.1125 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8217 -30.8217 -30.8217 -30.8217 -22.3205 -22.3205 -22.3201 -22.3201 -21.7121 -21.7121 -21.7105 -21.7105 -21.5988 -21.5988 -21.5977 -21.5977 -11.8895 -11.8895 -11.8884 -11.8884 -10.5471 -10.5471 -10.5148 -10.5148 -10.4029 -10.4029 -10.3710 -10.3710 4.0283 4.0283 4.0289 4.0289 7.5330 7.5330 7.5444 7.5444 8.7952 8.7952 8.7959 8.7959 9.6126 9.6126 9.6131 9.6131 10.4825 10.4825 10.4867 10.4867 11.3068 11.3068 11.3118 11.3118 11.5817 11.5817 11.5993 11.5993 12.6019 12.6019 12.6069 12.6069 k = 0.1250 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8215 -30.8215 -30.8215 -30.8215 -22.3218 -22.3218 -22.3214 -22.3214 -21.7165 -21.7165 -21.7150 -21.7150 -21.5932 -21.5932 -21.5921 -21.5921 -11.8901 -11.8901 -11.8889 -11.8889 -10.5486 -10.5486 -10.5130 -10.5130 -10.4063 -10.4063 -10.3712 -10.3712 4.0300 4.0300 4.0306 4.0306 7.5591 7.5591 7.5718 7.5718 8.7821 8.7821 8.7826 8.7826 9.6079 9.6079 9.6081 9.6081 10.4776 10.4776 10.4826 10.4826 11.2760 11.2760 11.2806 11.2806 11.5805 11.5805 11.5982 11.5982 12.6146 12.6146 12.6189 12.6189 k = 0.1375 0.5000-0.0000 ( 9982 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8214 -30.8214 -30.8214 -30.8214 -22.3233 -22.3233 -22.3228 -22.3228 -21.7209 -21.7209 -21.7193 -21.7193 -21.5875 -21.5875 -21.5865 -21.5865 -11.8907 -11.8907 -11.8894 -11.8894 -10.5501 -10.5501 -10.5114 -10.5114 -10.4098 -10.4098 -10.3716 -10.3716 4.0317 4.0317 4.0324 4.0324 7.5873 7.5873 7.6013 7.6013 8.7686 8.7686 8.7686 8.7686 9.6029 9.6029 9.6029 9.6029 10.4728 10.4728 10.4788 10.4788 11.2440 11.2440 11.2483 11.2483 11.5779 11.5779 11.5956 11.5956 12.6301 12.6301 12.6337 12.6337 k = 0.1500 0.5000-0.0000 ( 9988 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8212 -30.8212 -30.8212 -30.8212 -22.3248 -22.3248 -22.3243 -22.3243 -21.7251 -21.7251 -21.7235 -21.7235 -21.5819 -21.5819 -21.5809 -21.5809 -11.8914 -11.8914 -11.8900 -11.8900 -10.5516 -10.5516 -10.5098 -10.5098 -10.4134 -10.4134 -10.3721 -10.3721 4.0335 4.0335 4.0343 4.0343 7.6174 7.6174 7.6328 7.6328 8.7542 8.7542 8.7547 8.7547 9.5975 9.5975 9.5978 9.5978 10.4683 10.4683 10.4753 10.4753 11.2109 11.2109 11.2150 11.2150 11.5738 11.5738 11.5913 11.5913 12.6481 12.6481 12.6509 12.6509 k = 0.1625 0.5000-0.0000 ( 9996 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8210 -30.8210 -30.8210 -30.8210 -22.3264 -22.3264 -22.3259 -22.3259 -21.7292 -21.7292 -21.7277 -21.7277 -21.5762 -21.5762 -21.5753 -21.5753 -11.8921 -11.8921 -11.8906 -11.8906 -10.5530 -10.5530 -10.5082 -10.5082 -10.4170 -10.4170 -10.3728 -10.3728 4.0354 4.0354 4.0362 4.0362 7.6491 7.6491 7.6659 7.6659 8.7397 8.7397 8.7408 8.7408 9.5917 9.5917 9.5925 9.5925 10.4643 10.4643 10.4724 10.4724 11.1771 11.1771 11.1812 11.1812 11.5682 11.5682 11.5855 11.5855 12.6682 12.6682 12.6701 12.6701 k = 0.1750 0.5000-0.0000 ( 9992 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8208 -30.8208 -30.8208 -30.8208 -22.3281 -22.3281 -22.3275 -22.3275 -21.7332 -21.7332 -21.7317 -21.7317 -21.5707 -21.5707 -21.5697 -21.5697 -11.8928 -11.8928 -11.8913 -11.8913 -10.5543 -10.5543 -10.5068 -10.5068 -10.4206 -10.4206 -10.3737 -10.3737 4.0374 4.0374 4.0382 4.0382 7.6822 7.6822 7.7004 7.7004 8.7254 8.7254 8.7272 8.7272 9.5857 9.5857 9.5870 9.5870 10.4608 10.4608 10.4701 10.4701 11.1430 11.1430 11.1470 11.1470 11.5610 11.5610 11.5780 11.5780 12.6898 12.6898 12.6907 12.6907 k = 0.1875 0.5000-0.0000 ( 9988 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8206 -30.8206 -30.8206 -30.8206 -22.3299 -22.3299 -22.3293 -22.3293 -21.7371 -21.7371 -21.7356 -21.7356 -21.5652 -21.5652 -21.5643 -21.5643 -11.8936 -11.8936 -11.8920 -11.8920 -10.5556 -10.5556 -10.5055 -10.5055 -10.4242 -10.4242 -10.3747 -10.3747 4.0394 4.0394 4.0402 4.0402 7.7163 7.7163 7.7359 7.7359 8.7117 8.7117 8.7144 8.7144 9.5794 9.5794 9.5812 9.5812 10.4581 10.4581 10.4686 10.4686 11.1086 11.1086 11.1127 11.1127 11.5525 11.5525 11.5691 11.5691 12.7124 12.7124 12.7124 12.7124 k = 0.2000 0.5000-0.0000 ( 9980 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8204 -30.8204 -30.8204 -30.8204 -22.3317 -22.3317 -22.3311 -22.3311 -21.7408 -21.7408 -21.7393 -21.7393 -21.5598 -21.5598 -21.5589 -21.5589 -11.8943 -11.8943 -11.8927 -11.8927 -10.5568 -10.5568 -10.5043 -10.5043 -10.4276 -10.4276 -10.3758 -10.3758 4.0414 4.0414 4.0422 4.0422 7.7510 7.7510 7.7721 7.7721 8.6990 8.6990 8.7026 8.7026 9.5727 9.5727 9.5750 9.5750 10.4561 10.4561 10.4680 10.4680 11.0744 11.0744 11.0787 11.0787 11.5425 11.5425 11.5588 11.5588 12.7343 12.7343 12.7353 12.7353 k = 0.2125 0.5000-0.0000 ( 9994 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8202 -30.8202 -30.8202 -30.8202 -22.3336 -22.3336 -22.3329 -22.3329 -21.7444 -21.7444 -21.7429 -21.7429 -21.5545 -21.5545 -21.5537 -21.5537 -11.8951 -11.8951 -11.8935 -11.8935 -10.5578 -10.5578 -10.5034 -10.5034 -10.4309 -10.4309 -10.3771 -10.3771 4.0434 4.0434 4.0442 4.0442 7.7859 7.7859 7.8084 7.8084 8.6876 8.6876 8.6923 8.6923 9.5656 9.5656 9.5685 9.5685 10.4551 10.4551 10.4683 10.4683 11.0405 11.0405 11.0451 11.0451 11.5313 11.5313 11.5471 11.5471 12.7559 12.7559 12.7579 12.7579 k = 0.2250 0.5000-0.0000 ( 9990 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8200 -30.8200 -30.8200 -30.8200 -22.3354 -22.3354 -22.3348 -22.3348 -21.7478 -21.7478 -21.7464 -21.7464 -21.5493 -21.5493 -21.5485 -21.5485 -11.8960 -11.8960 -11.8943 -11.8943 -10.5588 -10.5588 -10.5027 -10.5027 -10.4340 -10.4340 -10.3785 -10.3785 4.0453 4.0453 4.0461 4.0461 7.8205 7.8205 7.8443 7.8443 8.6781 8.6781 8.6839 8.6839 9.5579 9.5579 9.5615 9.5615 10.4551 10.4551 10.4697 10.4697 11.0072 11.0072 11.0121 11.0121 11.5190 11.5190 11.5344 11.5344 12.7765 12.7765 12.7794 12.7794 k = 0.2375 0.5000-0.0000 ( 9994 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8198 -30.8198 -30.8198 -30.8198 -22.3373 -22.3373 -22.3367 -22.3367 -21.7511 -21.7511 -21.7497 -21.7497 -21.5442 -21.5442 -21.5435 -21.5435 -11.8968 -11.8968 -11.8951 -11.8951 -10.5598 -10.5598 -10.5022 -10.5022 -10.4369 -10.4369 -10.3800 -10.3800 4.0473 4.0473 4.0481 4.0481 7.8543 7.8543 7.8794 7.8794 8.6710 8.6710 8.6779 8.6779 9.5497 9.5497 9.5540 9.5540 10.4560 10.4560 10.4720 10.4720 10.9747 10.9747 10.9801 10.9801 11.5057 11.5057 11.5206 11.5206 12.7955 12.7955 12.7991 12.7991 k = 0.2500 0.5000-0.0000 ( 9990 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8196 -30.8196 -30.8196 -30.8196 -22.3393 -22.3393 -22.3386 -22.3386 -21.7542 -21.7542 -21.7528 -21.7528 -21.5394 -21.5394 -21.5387 -21.5387 -11.8976 -11.8976 -11.8960 -11.8960 -10.5606 -10.5606 -10.5021 -10.5021 -10.4394 -10.4394 -10.3816 -10.3816 4.0492 4.0492 4.0500 4.0500 7.8867 7.8867 7.9130 7.9130 8.6668 8.6668 8.6749 8.6749 9.5410 9.5410 9.5459 9.5459 10.4579 10.4579 10.4754 10.4754 10.9432 10.9432 10.9492 10.9492 11.4915 11.4915 11.5060 11.5060 12.8122 12.8122 12.8165 12.8165 k = 0.2625 0.5000-0.0000 ( 10000 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8194 -30.8194 -30.8194 -30.8194 -22.3412 -22.3412 -22.3405 -22.3405 -21.7571 -21.7571 -21.7558 -21.7558 -21.5346 -21.5346 -21.5340 -21.5340 -11.8985 -11.8985 -11.8968 -11.8968 -10.5613 -10.5613 -10.5023 -10.5023 -10.4416 -10.4416 -10.3833 -10.3833 4.0510 4.0510 4.0518 4.0518 7.9172 7.9172 7.9445 7.9445 8.6659 8.6659 8.6752 8.6752 9.5316 9.5316 9.5372 9.5372 10.4608 10.4608 10.4797 10.4797 10.9130 10.9130 10.9197 10.9197 11.4768 11.4768 11.4907 11.4907 12.8262 12.8262 12.8310 12.8310 k = 0.2750 0.5000-0.0000 ( 9998 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8192 -30.8192 -30.8192 -30.8192 -22.3431 -22.3431 -22.3424 -22.3424 -21.7599 -21.7599 -21.7586 -21.7586 -21.5301 -21.5301 -21.5294 -21.5294 -11.8993 -11.8993 -11.8977 -11.8977 -10.5618 -10.5618 -10.5030 -10.5030 -10.4434 -10.4434 -10.3851 -10.3851 4.0528 4.0528 4.0535 4.0535 7.9453 7.9453 7.9733 7.9733 8.6690 8.6690 8.6792 8.6792 9.5216 9.5216 9.5278 9.5278 10.4645 10.4645 10.4848 10.4848 10.8842 10.8842 10.8916 10.8916 11.4615 11.4615 11.4750 11.4750 12.8373 12.8373 12.8425 12.8425 k = 0.2875 0.5000-0.0000 ( 10008 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8190 -30.8190 -30.8190 -30.8190 -22.3449 -22.3449 -22.3443 -22.3443 -21.7625 -21.7625 -21.7613 -21.7613 -21.5257 -21.5257 -21.5251 -21.5251 -11.9002 -11.9002 -11.8986 -11.8986 -10.5623 -10.5623 -10.5040 -10.5040 -10.4447 -10.4447 -10.3870 -10.3870 4.0544 4.0544 4.0552 4.0552 7.9705 7.9705 7.9990 7.9990 8.6763 8.6763 8.6872 8.6872 9.5110 9.5110 9.5178 9.5178 10.4690 10.4690 10.4907 10.4907 10.8570 10.8570 10.8652 10.8652 11.4459 11.4459 11.4589 11.4589 12.8455 12.8455 12.8509 12.8509 k = 0.3000 0.5000-0.0000 ( 10012 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8188 -30.8188 -30.8188 -30.8188 -22.3467 -22.3467 -22.3461 -22.3461 -21.7650 -21.7650 -21.7638 -21.7638 -21.5215 -21.5215 -21.5209 -21.5209 -11.9010 -11.9010 -11.8994 -11.8994 -10.5626 -10.5626 -10.5054 -10.5054 -10.4455 -10.4455 -10.3889 -10.3889 4.0560 4.0560 4.0567 4.0567 7.9926 7.9926 8.0210 8.0210 8.6880 8.6880 8.6995 8.6995 9.4997 9.4997 9.5071 9.5071 10.4742 10.4742 10.4971 10.4971 10.8316 10.8316 10.8407 10.8407 11.4302 11.4302 11.4427 11.4427 12.8508 12.8508 12.8563 12.8563 k = 0.3125 0.5000-0.0000 ( 10012 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8186 -30.8186 -30.8186 -30.8186 -22.3485 -22.3485 -22.3479 -22.3479 -21.7673 -21.7673 -21.7662 -21.7662 -21.5175 -21.5175 -21.5170 -21.5170 -11.9018 -11.9018 -11.9003 -11.9003 -10.5628 -10.5628 -10.5072 -10.5072 -10.4459 -10.4459 -10.3909 -10.3909 4.0575 4.0575 4.0582 4.0582 8.0113 8.0113 8.0393 8.0393 8.7041 8.7041 8.7158 8.7158 9.4877 9.4877 9.4957 9.4957 10.4798 10.4798 10.5039 10.5039 10.8081 10.8081 10.8182 10.8182 11.4145 11.4145 11.4265 11.4265 12.8535 12.8535 12.8590 12.8590 k = 0.3250 0.5000-0.0000 ( 10000 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8184 -30.8184 -30.8184 -30.8184 -22.3502 -22.3502 -22.3497 -22.3497 -21.7694 -21.7694 -21.7684 -21.7684 -21.5137 -21.5137 -21.5133 -21.5133 -11.9026 -11.9026 -11.9011 -11.9011 -10.5629 -10.5629 -10.5094 -10.5094 -10.4459 -10.4459 -10.3929 -10.3929 4.0589 4.0589 4.0595 4.0595 8.0267 8.0267 8.0539 8.0539 8.7244 8.7244 8.7361 8.7361 9.4752 9.4752 9.4836 9.4836 10.4858 10.4858 10.5109 10.5109 10.7868 10.7868 10.7978 10.7978 11.3991 11.3991 11.4104 11.4104 12.8539 12.8539 12.8593 12.8593 k = 0.3375 0.5000-0.0000 ( 10002 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8182 -30.8182 -30.8182 -30.8182 -22.3519 -22.3519 -22.3513 -22.3513 -21.7714 -21.7714 -21.7704 -21.7704 -21.5102 -21.5102 -21.5098 -21.5098 -11.9033 -11.9033 -11.9019 -11.9019 -10.5628 -10.5628 -10.5118 -10.5118 -10.4455 -10.4455 -10.3950 -10.3950 4.0602 4.0602 4.0608 4.0608 8.0390 8.0390 8.0650 8.0650 8.7484 8.7484 8.7599 8.7599 9.4620 9.4620 9.4709 9.4709 10.4918 10.4918 10.5177 10.5177 10.7678 10.7678 10.7796 10.7796 11.3839 11.3839 11.3947 11.3947 12.8524 12.8524 12.8576 12.8576 k = 0.3500 0.5000-0.0000 ( 10002 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8180 -30.8180 -30.8180 -30.8180 -22.3534 -22.3534 -22.3529 -22.3529 -21.7732 -21.7732 -21.7723 -21.7723 -21.5069 -21.5069 -21.5065 -21.5065 -11.9040 -11.9040 -11.9027 -11.9027 -10.5626 -10.5626 -10.5144 -10.5144 -10.4448 -10.4448 -10.3972 -10.3972 4.0613 4.0613 4.0619 4.0619 8.0485 8.0485 8.0730 8.0730 8.7755 8.7755 8.7866 8.7866 9.4483 9.4483 9.4575 9.4575 10.4978 10.4978 10.5242 10.5242 10.7512 10.7512 10.7638 10.7638 11.3693 11.3693 11.3795 11.3795 12.8493 12.8493 12.8543 12.8543 k = 0.3625 0.5000-0.0000 ( 10006 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8178 -30.8178 -30.8178 -30.8178 -22.3549 -22.3549 -22.3544 -22.3544 -21.7749 -21.7749 -21.7740 -21.7740 -21.5038 -21.5038 -21.5034 -21.5034 -11.9047 -11.9047 -11.9035 -11.9035 -10.5622 -10.5622 -10.5172 -10.5172 -10.4438 -10.4438 -10.3993 -10.3993 4.0624 4.0624 4.0629 4.0629 8.0555 8.0555 8.0784 8.0784 8.8050 8.8050 8.8156 8.8156 9.4340 9.4340 9.4435 9.4435 10.5034 10.5034 10.5299 10.5299 10.7372 10.7372 10.7504 10.7504 11.3552 11.3552 11.3648 11.3648 12.8450 12.8450 12.8498 12.8498 k = 0.3750 0.5000-0.0000 ( 10010 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8177 -30.8177 -30.8177 -30.8177 -22.3563 -22.3563 -22.3558 -22.3558 -21.7764 -21.7764 -21.7756 -21.7756 -21.5009 -21.5009 -21.5006 -21.5006 -11.9053 -11.9053 -11.9042 -11.9042 -10.5617 -10.5617 -10.5201 -10.5201 -10.4426 -10.4426 -10.4015 -10.4015 4.0634 4.0634 4.0638 4.0638 8.0607 8.0607 8.0816 8.0816 8.8362 8.8362 8.8462 8.8462 9.4192 9.4192 9.4290 9.4290 10.5085 10.5085 10.5347 10.5347 10.7260 10.7260 10.7393 10.7393 11.3420 11.3420 11.3509 11.3509 12.8399 12.8399 12.8443 12.8443 k = 0.3875 0.5000-0.0000 ( 10002 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8175 -30.8175 -30.8175 -30.8175 -22.3575 -22.3575 -22.3571 -22.3571 -21.7778 -21.7778 -21.7771 -21.7771 -21.4984 -21.4984 -21.4981 -21.4981 -11.9059 -11.9059 -11.9049 -11.9049 -10.5610 -10.5610 -10.5231 -10.5231 -10.4412 -10.4412 -10.4037 -10.4037 4.0642 4.0642 4.0646 4.0646 8.0642 8.0642 8.0832 8.0832 8.8682 8.8682 8.8778 8.8778 9.4040 9.4040 9.4139 9.4139 10.5131 10.5131 10.5383 10.5383 10.7174 10.7174 10.7305 10.7305 11.3296 11.3296 11.3378 11.3378 12.8341 12.8341 12.8383 12.8383 k = 0.4000 0.5000-0.0000 ( 10026 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8174 -30.8174 -30.8174 -30.8174 -22.3587 -22.3587 -22.3583 -22.3583 -21.7790 -21.7790 -21.7784 -21.7784 -21.4960 -21.4960 -21.4958 -21.4958 -11.9064 -11.9064 -11.9055 -11.9055 -10.5601 -10.5601 -10.5261 -10.5261 -10.4397 -10.4397 -10.4060 -10.4060 4.0650 4.0650 4.0654 4.0654 8.0666 8.0666 8.0835 8.0835 8.9005 8.9005 8.9095 8.9095 9.3885 9.3885 9.3983 9.3983 10.5170 10.5170 10.5406 10.5406 10.7113 10.7113 10.7239 10.7239 11.3182 11.3182 11.3257 11.3257 12.8281 12.8281 12.8319 12.8319 k = 0.4125 0.5000-0.0000 ( 10026 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8173 -30.8173 -30.8173 -30.8173 -22.3597 -22.3597 -22.3594 -22.3594 -21.7800 -21.7800 -21.7795 -21.7795 -21.4940 -21.4940 -21.4937 -21.4937 -11.9069 -11.9069 -11.9060 -11.9060 -10.5591 -10.5591 -10.5291 -10.5291 -10.4380 -10.4380 -10.4082 -10.4082 4.0656 4.0656 4.0660 4.0660 8.0682 8.0682 8.0830 8.0830 8.9323 8.9323 8.9409 8.9409 9.3727 9.3727 9.3824 9.3824 10.5203 10.5203 10.5418 10.5418 10.7076 10.7076 10.7191 10.7191 11.3079 11.3079 11.3146 11.3146 12.8222 12.8222 12.8255 12.8255 k = 0.4250 0.5000-0.0000 ( 10022 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8172 -30.8172 -30.8172 -30.8172 -22.3606 -22.3606 -22.3603 -22.3603 -21.7810 -21.7810 -21.7805 -21.7805 -21.4921 -21.4921 -21.4920 -21.4920 -11.9073 -11.9073 -11.9066 -11.9066 -10.5580 -10.5580 -10.5320 -10.5320 -10.4362 -10.4362 -10.4105 -10.4105 4.0662 4.0662 4.0665 4.0665 8.0692 8.0692 8.0819 8.0819 8.9631 8.9631 8.9712 8.9712 9.3569 9.3569 9.3663 9.3663 10.5229 10.5229 10.5419 10.5419 10.7057 10.7057 10.7158 10.7158 11.2988 11.2988 11.3047 11.3047 12.8164 12.8164 12.8194 12.8194 k = 0.4375 0.5000-0.0000 ( 10018 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8171 -30.8171 -30.8171 -30.8171 -22.3614 -22.3614 -22.3611 -22.3611 -21.7817 -21.7817 -21.7813 -21.7813 -21.4906 -21.4906 -21.4904 -21.4904 -11.9076 -11.9076 -11.9070 -11.9070 -10.5566 -10.5566 -10.5348 -10.5348 -10.4343 -10.4343 -10.4127 -10.4127 4.0667 4.0667 4.0669 4.0669 8.0698 8.0698 8.0804 8.0804 8.9921 8.9921 8.9997 8.9997 9.3413 9.3413 9.3502 9.3502 10.5251 10.5251 10.5412 10.5412 10.7053 10.7053 10.7138 10.7138 11.2911 11.2911 11.2961 11.2961 12.8112 12.8112 12.8137 12.8137 k = 0.4500 0.5000-0.0000 ( 10022 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8170 -30.8170 -30.8170 -30.8170 -22.3620 -22.3620 -22.3618 -22.3618 -21.7823 -21.7823 -21.7820 -21.7820 -21.4893 -21.4893 -21.4892 -21.4892 -11.9079 -11.9079 -11.9074 -11.9074 -10.5551 -10.5551 -10.5376 -10.5376 -10.4323 -10.4323 -10.4150 -10.4150 4.0671 4.0671 4.0673 4.0673 8.0703 8.0703 8.0788 8.0788 9.0187 9.0187 9.0255 9.0255 9.3265 9.3265 9.3346 9.3346 10.5270 10.5270 10.5399 10.5399 10.7058 10.7058 10.7126 10.7126 11.2847 11.2847 11.2888 11.2888 12.8067 12.8067 12.8088 12.8088 k = 0.4625 0.5000-0.0000 ( 10032 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8170 -30.8170 -30.8170 -30.8170 -22.3625 -22.3625 -22.3623 -22.3623 -21.7828 -21.7828 -21.7826 -21.7826 -21.4884 -21.4884 -21.4883 -21.4883 -11.9081 -11.9081 -11.9077 -11.9077 -10.5534 -10.5534 -10.5403 -10.5403 -10.4303 -10.4303 -10.4172 -10.4172 4.0674 4.0674 4.0675 4.0675 8.0708 8.0708 8.0771 8.0771 9.0420 9.0420 9.0478 9.0478 9.3132 9.3132 9.3201 9.3201 10.5286 10.5286 10.5384 10.5384 10.7068 10.7068 10.7119 10.7119 11.2798 11.2798 11.2829 11.2829 12.8031 12.8031 12.8047 12.8047 k = 0.4750 0.5000-0.0000 ( 10040 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3628 -22.3628 -22.3627 -22.3627 -21.7831 -21.7831 -21.7830 -21.7830 -21.4876 -21.4876 -21.4876 -21.4876 -11.9082 -11.9082 -11.9080 -11.9080 -10.5516 -10.5516 -10.5428 -10.5428 -10.4282 -10.4282 -10.4195 -10.4195 4.0676 4.0676 4.0677 4.0677 8.0714 8.0714 8.0756 8.0756 9.0607 9.0607 9.0651 9.0651 9.3025 9.3025 9.3077 9.3077 10.5302 10.5302 10.5367 10.5367 10.7081 10.7081 10.7114 10.7114 11.2764 11.2764 11.2784 11.2784 12.8005 12.8005 12.8015 12.8015 k = 0.4875 0.5000-0.0000 ( 10048 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3630 -22.3630 -22.3630 -22.3630 -21.7833 -21.7833 -21.7832 -21.7832 -21.4872 -21.4872 -21.4872 -21.4872 -11.9083 -11.9083 -11.9081 -11.9081 -10.5496 -10.5496 -10.5452 -10.5452 -10.4260 -10.4260 -10.4217 -10.4217 4.0677 4.0677 4.0678 4.0678 8.0721 8.0721 8.0742 8.0742 9.0734 9.0734 9.0758 9.0758 9.2959 9.2959 9.2987 9.2987 10.5317 10.5317 10.5350 10.5350 10.7092 10.7092 10.7109 10.7109 11.2745 11.2745 11.2756 11.2756 12.7990 12.7990 12.7995 12.7995 k = 0.5000 0.5000-0.0000 ( 10040 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0678 4.0678 4.0678 4.0678 8.0731 8.0731 8.0731 8.0731 9.0788 9.0788 9.0788 9.0788 9.2945 9.2945 9.2945 9.2945 10.5333 10.5333 10.5333 10.5333 10.7101 10.7101 10.7102 10.7102 11.2742 11.2742 11.2742 11.2742 12.7987 12.7987 12.7987 12.7987 k = 0.5000 0.5000-0.0000 ( 10040 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0678 4.0678 4.0678 4.0678 8.0731 8.0731 8.0731 8.0731 9.0788 9.0788 9.0788 9.0788 9.2945 9.2945 9.2945 9.2945 10.5333 10.5333 10.5333 10.5333 10.7101 10.7101 10.7102 10.7102 11.2742 11.2742 11.2742 11.2742 12.7987 12.7987 12.7987 12.7987 k = 0.4911 0.4911-0.0000 ( 10036 PWs) bands (ev): -45.6186 -45.6186 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3629 -22.3629 -21.7833 -21.7833 -21.7832 -21.7832 -21.4873 -21.4873 -21.4871 -21.4871 -11.9083 -11.9083 -11.9081 -11.9081 -10.5497 -10.5497 -10.5452 -10.5452 -10.4261 -10.4261 -10.4217 -10.4217 4.0672 4.0672 4.0683 4.0683 8.0717 8.0717 8.0747 8.0747 9.0720 9.0720 9.0772 9.0772 9.2941 9.2941 9.3005 9.3005 10.5316 10.5316 10.5351 10.5351 10.7086 10.7086 10.7114 10.7114 11.2743 11.2743 11.2758 11.2758 12.7989 12.7989 12.7997 12.7997 k = 0.4821 0.4821-0.0000 ( 10046 PWs) bands (ev): -45.6187 -45.6187 -45.6184 -45.6184 -30.8170 -30.8170 -30.8169 -30.8169 -22.3631 -22.3631 -22.3624 -22.3624 -21.7832 -21.7832 -21.7829 -21.7829 -21.4881 -21.4881 -21.4871 -21.4871 -11.9083 -11.9083 -11.9079 -11.9079 -10.5517 -10.5517 -10.5428 -10.5428 -10.4282 -10.4282 -10.4194 -10.4194 4.0655 4.0655 4.0698 4.0698 8.0689 8.0689 8.0782 8.0782 9.0544 9.0544 9.0716 9.0716 9.2941 9.2941 9.3156 9.3156 10.5294 10.5294 10.5374 10.5374 10.7048 10.7048 10.7146 10.7146 11.2753 11.2753 11.2797 11.2797 12.7998 12.7998 12.8024 12.8024 k = 0.4732 0.4732-0.0000 ( 10038 PWs) bands (ev): -45.6189 -45.6189 -45.6182 -45.6182 -30.8171 -30.8171 -30.8169 -30.8169 -22.3632 -22.3632 -22.3616 -22.3616 -21.7831 -21.7831 -21.7823 -21.7823 -21.4895 -21.4895 -21.4872 -21.4872 -11.9083 -11.9083 -11.9075 -11.9075 -10.5535 -10.5535 -10.5402 -10.5402 -10.4303 -10.4303 -10.4171 -10.4171 4.0625 4.0625 4.0722 4.0722 8.0643 8.0643 8.0840 8.0840 9.0293 9.0293 9.0623 9.0623 9.2941 9.2941 9.3366 9.3366 10.5264 10.5264 10.5407 10.5407 10.6986 10.6986 10.7198 10.7198 11.2768 11.2768 11.2861 11.2861 12.8011 12.8011 12.8069 12.8069 k = 0.4643 0.4643-0.0000 ( 10024 PWs) bands (ev): -45.6192 -45.6192 -45.6179 -45.6179 -30.8172 -30.8172 -30.8168 -30.8168 -22.3632 -22.3632 -22.3605 -22.3605 -21.7828 -21.7828 -21.7815 -21.7815 -21.4913 -21.4913 -21.4873 -21.4873 -11.9084 -11.9084 -11.9069 -11.9069 -10.5552 -10.5552 -10.5375 -10.5375 -10.4324 -10.4324 -10.4149 -10.4149 4.0584 4.0584 4.0755 4.0755 8.0583 8.0583 8.0921 8.0921 8.9997 8.9997 9.0494 9.0494 9.2941 9.2941 9.3605 9.3605 10.5224 10.5224 10.5451 10.5451 10.6901 10.6901 10.7275 10.7275 11.2789 11.2789 11.2951 11.2951 12.8029 12.8029 12.8133 12.8133 k = 0.4554 0.4554-0.0000 ( 10028 PWs) bands (ev): -45.6196 -45.6196 -45.6176 -45.6176 -30.8174 -30.8174 -30.8168 -30.8168 -22.3633 -22.3633 -22.3591 -22.3591 -21.7825 -21.7825 -21.7804 -21.7804 -21.4937 -21.4937 -21.4875 -21.4875 -11.9084 -11.9084 -11.9062 -11.9062 -10.5567 -10.5567 -10.5347 -10.5347 -10.4345 -10.4345 -10.4126 -10.4126 4.0529 4.0529 4.0797 4.0797 8.0509 8.0509 8.1024 8.1024 8.9677 8.9677 9.0328 9.0328 9.2941 9.2941 9.3853 9.3853 10.5172 10.5172 10.5506 10.5506 10.6795 10.6795 10.7376 10.7376 11.2815 11.2815 11.3068 11.3068 12.8048 12.8048 12.8214 12.8214 k = 0.4464 0.4464-0.0000 ( 10022 PWs) bands (ev): -45.6200 -45.6200 -45.6171 -45.6171 -30.8177 -30.8177 -30.8167 -30.8167 -22.3634 -22.3634 -22.3574 -22.3574 -21.7822 -21.7822 -21.7792 -21.7792 -21.4966 -21.4966 -21.4876 -21.4876 -11.9085 -11.9085 -11.9053 -11.9053 -10.5580 -10.5580 -10.5317 -10.5317 -10.4364 -10.4364 -10.4102 -10.4102 4.0460 4.0460 4.0846 4.0846 8.0424 8.0424 8.1150 8.1150 8.9347 8.9347 9.0126 9.0126 9.2942 9.2942 9.4099 9.4099 10.5109 10.5109 10.5573 10.5573 10.6669 10.6669 10.7503 10.7503 11.2843 11.2843 11.3211 11.3211 12.8067 12.8067 12.8313 12.8313 k = 0.4375 0.4375-0.0000 ( 10024 PWs) bands (ev): -45.6205 -45.6205 -45.6166 -45.6166 -30.8180 -30.8180 -30.8167 -30.8167 -22.3636 -22.3636 -22.3555 -22.3555 -21.7818 -21.7818 -21.7777 -21.7777 -21.5000 -21.5000 -21.4878 -21.4878 -11.9086 -11.9086 -11.9042 -11.9042 -10.5591 -10.5591 -10.5287 -10.5287 -10.4384 -10.4384 -10.4079 -10.4079 4.0377 4.0377 4.0901 4.0901 8.0332 8.0332 8.1297 8.1297 8.9014 8.9014 8.9890 8.9890 9.2943 9.2943 9.4334 9.4334 10.5035 10.5035 10.5651 10.5651 10.6526 10.6526 10.7657 10.7657 11.2873 11.2873 11.3380 11.3380 12.8082 12.8082 12.8429 12.8429 k = 0.4286 0.4286-0.0000 ( 10024 PWs) bands (ev): -45.6211 -45.6211 -45.6161 -45.6161 -30.8183 -30.8183 -30.8166 -30.8166 -22.3637 -22.3637 -22.3532 -22.3532 -21.7813 -21.7813 -21.7759 -21.7759 -21.5038 -21.5038 -21.4881 -21.4881 -11.9086 -11.9086 -11.9030 -11.9030 -10.5600 -10.5600 -10.5256 -10.5256 -10.4402 -10.4402 -10.4056 -10.4056 4.0277 4.0277 4.0960 4.0960 8.0237 8.0237 8.1466 8.1466 8.8685 8.8685 8.9621 8.9621 9.2944 9.2944 9.4554 9.4554 10.4951 10.4951 10.5742 10.5742 10.6369 10.6369 10.7838 10.7838 11.2905 11.2905 11.3576 11.3576 12.8090 12.8090 12.8563 12.8563 k = 0.4196 0.4196-0.0000 ( 10024 PWs) bands (ev): -45.6218 -45.6218 -45.6154 -45.6154 -30.8186 -30.8186 -30.8165 -30.8165 -22.3639 -22.3639 -22.3507 -22.3507 -21.7808 -21.7808 -21.7739 -21.7739 -21.5081 -21.5081 -21.4883 -21.4883 -11.9087 -11.9087 -11.9017 -11.9017 -10.5608 -10.5608 -10.5224 -10.5224 -10.4420 -10.4420 -10.4033 -10.4033 4.0161 4.0161 4.1024 4.1024 8.0140 8.0140 8.1655 8.1655 8.8367 8.8367 8.9320 8.9320 9.2946 9.2946 9.4753 9.4753 10.4860 10.4860 10.5844 10.5844 10.6200 10.6200 10.8044 10.8044 11.2936 11.2936 11.3800 11.3800 12.8089 12.8089 12.8714 12.8714 k = 0.4107 0.4107-0.0000 ( 10024 PWs) bands (ev): -45.6225 -45.6225 -45.6147 -45.6147 -30.8190 -30.8190 -30.8164 -30.8164 -22.3642 -22.3642 -22.3480 -22.3480 -21.7802 -21.7802 -21.7717 -21.7717 -21.5129 -21.5129 -21.4886 -21.4886 -11.9088 -11.9088 -11.9002 -11.9002 -10.5614 -10.5614 -10.5192 -10.5192 -10.4437 -10.4437 -10.4009 -10.4009 4.0026 4.0026 4.1089 4.1089 8.0048 8.0048 8.1865 8.1865 8.8064 8.8064 8.8989 8.8989 9.2950 9.2950 9.4929 9.4929 10.4764 10.4764 10.5957 10.5957 10.6024 10.6024 10.8271 10.8271 11.2968 11.2968 11.4050 11.4050 12.8074 12.8074 12.8881 12.8881 k = 0.4018 0.4018-0.0000 ( 10026 PWs) bands (ev): -45.6234 -45.6234 -45.6140 -45.6140 -30.8195 -30.8195 -30.8163 -30.8163 -22.3644 -22.3644 -22.3451 -22.3451 -21.7796 -21.7796 -21.7692 -21.7692 -21.5180 -21.5180 -21.4889 -21.4889 -11.9089 -11.9089 -11.8985 -11.8985 -10.5617 -10.5617 -10.5160 -10.5160 -10.4453 -10.4453 -10.3986 -10.3986 3.9873 3.9873 4.1154 4.1154 7.9963 7.9963 8.2093 8.2093 8.7780 8.7780 8.8630 8.8630 9.2955 9.2955 9.5080 9.5080 10.4665 10.4665 10.5841 10.5841 10.6085 10.6085 10.8517 10.8517 11.3001 11.3001 11.4327 11.4327 12.8042 12.8042 12.9065 12.9065 k = 0.3929 0.3929-0.0000 ( 10020 PWs) bands (ev): -45.6242 -45.6242 -45.6131 -45.6131 -30.8199 -30.8199 -30.8162 -30.8162 -22.3647 -22.3647 -22.3419 -22.3419 -21.7789 -21.7789 -21.7665 -21.7665 -21.5236 -21.5236 -21.4891 -21.4891 -11.9090 -11.9090 -11.8967 -11.8967 -10.5619 -10.5619 -10.5127 -10.5127 -10.4468 -10.4468 -10.3963 -10.3963 3.9698 3.9698 4.1217 4.1217 7.9890 7.9890 8.2341 8.2341 8.7519 8.7519 8.8246 8.8246 9.2961 9.2961 9.5203 9.5203 10.4566 10.4566 10.5658 10.5658 10.6224 10.6224 10.8777 10.8777 11.3035 11.3035 11.4632 11.4632 12.7992 12.7992 12.9265 12.9265 k = 0.3839 0.3839-0.0000 ( 10012 PWs) bands (ev): -45.6252 -45.6252 -45.6122 -45.6122 -30.8204 -30.8204 -30.8161 -30.8161 -22.3651 -22.3651 -22.3386 -22.3386 -21.7782 -21.7782 -21.7636 -21.7636 -21.5295 -21.5295 -21.4894 -21.4894 -11.9091 -11.9091 -11.8948 -11.8948 -10.5619 -10.5619 -10.5094 -10.5094 -10.4482 -10.4482 -10.3940 -10.3940 3.9503 3.9503 4.1276 4.1276 7.9832 7.9832 8.2606 8.2606 8.7286 8.7286 8.7838 8.7838 9.2970 9.2970 9.5296 9.5296 10.4471 10.4471 10.5476 10.5476 10.6377 10.6377 10.9043 10.9043 11.3074 11.3074 11.4963 11.4963 12.7920 12.7920 12.9480 12.9480 k = 0.3750 0.3750-0.0000 ( 10018 PWs) bands (ev): -45.6262 -45.6262 -45.6112 -45.6112 -30.8210 -30.8210 -30.8160 -30.8160 -22.3655 -22.3655 -22.3351 -22.3351 -21.7775 -21.7775 -21.7604 -21.7604 -21.5358 -21.5358 -21.4897 -21.4897 -11.9092 -11.9092 -11.8927 -11.8927 -10.5616 -10.5616 -10.5062 -10.5062 -10.4494 -10.4494 -10.3917 -10.3917 3.9285 3.9285 4.1330 4.1330 7.9793 7.9793 8.2888 8.2888 8.7083 8.7083 8.7409 8.7409 9.2981 9.2981 9.5358 9.5358 10.4382 10.4382 10.5298 10.5298 10.6542 10.6542 10.9307 10.9307 11.3123 11.3123 11.5320 11.5320 12.7826 12.7826 12.9708 12.9708 k = 0.3661 0.3661-0.0000 ( 10022 PWs) bands (ev): -45.6272 -45.6272 -45.6102 -45.6102 -30.8215 -30.8215 -30.8159 -30.8159 -22.3659 -22.3659 -22.3316 -22.3316 -21.7767 -21.7767 -21.7570 -21.7570 -21.5424 -21.5424 -21.4900 -21.4900 -11.9093 -11.9093 -11.8905 -11.8905 -10.5612 -10.5612 -10.5031 -10.5031 -10.4504 -10.4504 -10.3895 -10.3895 3.9044 3.9044 4.1375 4.1375 7.9777 7.9777 8.3186 8.3186 8.6894 8.6894 8.6983 8.6983 9.2995 9.2995 9.5388 9.5388 10.4302 10.4302 10.5128 10.5128 10.6722 10.6722 10.9561 10.9561 11.3186 11.3186 11.5704 11.5704 12.7711 12.7711 12.9946 12.9946 k = 0.3571 0.3571-0.0000 ( 10026 PWs) bands (ev): -45.6284 -45.6284 -45.6092 -45.6092 -30.8221 -30.8221 -30.8157 -30.8157 -22.3665 -22.3665 -22.3279 -22.3279 -21.7759 -21.7759 -21.7533 -21.7533 -21.5492 -21.5492 -21.4903 -21.4903 -11.9094 -11.9094 -11.8882 -11.8882 -10.5606 -10.5606 -10.5000 -10.5000 -10.4511 -10.4511 -10.3873 -10.3873 3.8779 3.8779 4.1410 4.1410 7.9786 7.9786 8.3498 8.3498 8.6481 8.6481 8.6802 8.6802 9.3011 9.3011 9.5386 9.5386 10.4235 10.4235 10.4967 10.4967 10.6915 10.6915 10.9792 10.9792 11.3270 11.3270 11.6112 11.6112 12.7576 12.7576 13.0163 13.0163 k = 0.3482 0.3482-0.0000 ( 10030 PWs) bands (ev): -45.6295 -45.6295 -45.6080 -45.6080 -30.8228 -30.8228 -30.8156 -30.8156 -22.3670 -22.3670 -22.3241 -22.3241 -21.7752 -21.7752 -21.7494 -21.7494 -21.5563 -21.5563 -21.4905 -21.4905 -11.9095 -11.9095 -11.8858 -11.8858 -10.5598 -10.5598 -10.4972 -10.4972 -10.4516 -10.4516 -10.3851 -10.3851 3.8491 3.8491 4.1434 4.1434 7.9823 7.9823 8.3825 8.3825 8.6002 8.6002 8.6715 8.6715 9.3032 9.3032 9.5352 9.5352 10.4181 10.4181 10.4816 10.4816 10.7124 10.7124 10.9990 10.9990 11.3386 11.3386 11.6545 11.6545 12.7422 12.7422 13.0032 13.0032 k = 0.3393 0.3393-0.0000 ( 10037 PWs) bands (ev): -45.6307 -45.6307 -45.6069 -45.6069 -30.8234 -30.8234 -30.8155 -30.8155 -22.3676 -22.3676 -22.3202 -22.3202 -21.7744 -21.7744 -21.7453 -21.7453 -21.5636 -21.5636 -21.4908 -21.4908 -11.9096 -11.9096 -11.8832 -11.8832 -10.5589 -10.5589 -10.4946 -10.4946 -10.4518 -10.4518 -10.3829 -10.3829 3.8178 3.8178 4.1444 4.1444 7.9891 7.9891 8.4162 8.4162 8.5510 8.5510 8.6674 8.6674 9.3055 9.3055 9.5288 9.5288 10.4145 10.4145 10.4678 10.4678 10.7347 10.7347 11.0144 11.0144 11.3538 11.3538 11.7000 11.7000 12.7255 12.7255 12.9615 12.9615 k = 0.3304 0.3304-0.0000 ( 10023 PWs) bands (ev): -45.6320 -45.6320 -45.6057 -45.6057 -30.8241 -30.8241 -30.8153 -30.8153 -22.3683 -22.3683 -22.3164 -22.3164 -21.7736 -21.7736 -21.7409 -21.7409 -21.5711 -21.5711 -21.4909 -21.4909 -11.9097 -11.9097 -11.8806 -11.8806 -10.5577 -10.5577 -10.4924 -10.4924 -10.4515 -10.4515 -10.3808 -10.3808 3.7842 3.7842 4.1439 4.1439 7.9990 7.9990 8.4494 8.4494 8.5024 8.5024 8.6682 8.6682 9.3083 9.3083 9.5194 9.5194 10.4126 10.4126 10.4552 10.4552 10.7586 10.7586 11.0247 11.0247 11.3733 11.3733 11.7476 11.7476 12.7076 12.7076 12.9165 12.9165 k = 0.3214 0.3214-0.0000 ( 10015 PWs) bands (ev): -45.6333 -45.6333 -45.6044 -45.6044 -30.8248 -30.8248 -30.8152 -30.8152 -22.3691 -22.3691 -22.3125 -22.3125 -21.7728 -21.7728 -21.7364 -21.7364 -21.5786 -21.5786 -21.4911 -21.4911 -11.9098 -11.9098 -11.8778 -11.8778 -10.5564 -10.5564 -10.4905 -10.4905 -10.4507 -10.4507 -10.3788 -10.3788 3.7483 3.7483 4.1417 4.1417 8.0123 8.0123 8.4431 8.4431 8.4935 8.4935 8.6740 8.6740 9.3115 9.3115 9.5072 9.5072 10.4127 10.4127 10.4439 10.4439 10.7840 10.7840 11.0297 11.0297 11.3970 11.3970 11.7971 11.7971 12.6892 12.6892 12.8703 12.8703 k = 0.3125 0.3125-0.0000 ( 10015 PWs) bands (ev): -45.6346 -45.6346 -45.6032 -45.6032 -30.8255 -30.8255 -30.8150 -30.8150 -22.3699 -22.3699 -22.3086 -22.3086 -21.7721 -21.7721 -21.7316 -21.7316 -21.5863 -21.5863 -21.4912 -21.4912 -11.9099 -11.9099 -11.8750 -11.8750 -10.5549 -10.5549 -10.4890 -10.4890 -10.4495 -10.4495 -10.3768 -10.3768 3.7102 3.7102 4.1377 4.1377 8.0288 8.0288 8.3931 8.3931 8.5288 8.5288 8.6850 8.6850 9.3151 9.3151 9.4927 9.4927 10.4145 10.4145 10.4341 10.4341 10.8111 10.8111 11.0297 11.0297 11.4245 11.4245 11.8484 11.8484 12.6705 12.6705 12.8234 12.8234 k = 0.3036 0.3036-0.0000 ( 10007 PWs) bands (ev): -45.6360 -45.6360 -45.6018 -45.6018 -30.8262 -30.8262 -30.8149 -30.8149 -22.3708 -22.3708 -22.3047 -22.3047 -21.7714 -21.7714 -21.7267 -21.7267 -21.5941 -21.5941 -21.4912 -21.4912 -11.9100 -11.9100 -11.8721 -11.8721 -10.5532 -10.5532 -10.4880 -10.4880 -10.4477 -10.4477 -10.3748 -10.3748 3.6699 3.6699 4.1318 4.1318 8.0485 8.0485 8.3407 8.3407 8.5672 8.5672 8.7013 8.7013 9.3191 9.3191 9.4759 9.4759 10.4166 10.4166 10.4273 10.4273 10.8397 10.8397 11.0252 11.0252 11.4551 11.4551 11.9010 11.9010 12.6520 12.6520 12.7762 12.7762 k = 0.2946 0.2946-0.0000 ( 10009 PWs) bands (ev): -45.6374 -45.6374 -45.6005 -45.6005 -30.8270 -30.8270 -30.8147 -30.8147 -22.3718 -22.3718 -22.3009 -22.3009 -21.7708 -21.7708 -21.7216 -21.7216 -21.6018 -21.6018 -21.4911 -21.4911 -11.9101 -11.9101 -11.8691 -11.8691 -10.5514 -10.5514 -10.4874 -10.4874 -10.4455 -10.4455 -10.3729 -10.3729 3.6277 3.6277 4.1239 4.1239 8.0708 8.0708 8.2885 8.2885 8.6067 8.6067 8.7230 8.7230 9.3236 9.3236 9.4574 9.4574 10.4133 10.4133 10.4292 10.4292 10.8700 10.8700 11.0168 11.0168 11.4882 11.4882 11.9547 11.9547 12.6341 12.6341 12.7288 12.7288 k = 0.2857 0.2857-0.0000 ( 9995 PWs) bands (ev): -45.6388 -45.6388 -45.5992 -45.5992 -30.8277 -30.8277 -30.8145 -30.8145 -22.3729 -22.3729 -22.2971 -22.2971 -21.7702 -21.7702 -21.7164 -21.7164 -21.6095 -21.6095 -21.4910 -21.4910 -11.9102 -11.9102 -11.8660 -11.8660 -10.5495 -10.5495 -10.4871 -10.4871 -10.4428 -10.4428 -10.3711 -10.3711 3.5837 3.5837 4.1141 4.1141 8.0941 8.0941 8.2383 8.2383 8.6473 8.6473 8.7500 8.7500 9.3286 9.3286 9.4374 9.4374 10.4069 10.4069 10.4371 10.4371 10.9018 10.9018 11.0054 11.0054 11.5231 11.5231 12.0091 12.0091 12.6169 12.6169 12.6816 12.6816 k = 0.2768 0.2768-0.0000 ( 9981 PWs) bands (ev): -45.6402 -45.6402 -45.5978 -45.5978 -30.8285 -30.8285 -30.8144 -30.8144 -22.3740 -22.3740 -22.2935 -22.2935 -21.7698 -21.7698 -21.7111 -21.7111 -21.6172 -21.6172 -21.4907 -21.4907 -11.9102 -11.9102 -11.8629 -11.8629 -10.5474 -10.5474 -10.4871 -10.4871 -10.4398 -10.4398 -10.3694 -10.3694 3.5381 3.5381 4.1024 4.1024 8.1103 8.1103 8.1985 8.1985 8.6888 8.6888 8.7823 8.7823 9.3339 9.3339 9.4165 9.4165 10.4007 10.4007 10.4477 10.4477 10.9349 10.9349 10.9918 10.9918 11.5593 11.5593 12.0636 12.0636 12.6007 12.6007 12.6347 12.6347 k = 0.2679 0.2679-0.0000 ( 9997 PWs) bands (ev): -45.6416 -45.6416 -45.5964 -45.5964 -30.8293 -30.8293 -30.8142 -30.8142 -22.3753 -22.3753 -22.2899 -22.2899 -21.7694 -21.7694 -21.7057 -21.7057 -21.6247 -21.6247 -21.4904 -21.4904 -11.9103 -11.9103 -11.8597 -11.8597 -10.5452 -10.5452 -10.4873 -10.4873 -10.4365 -10.4365 -10.3677 -10.3677 3.4911 3.4911 4.0887 4.0887 8.0935 8.0935 8.1949 8.1949 8.7310 8.7310 8.8196 8.8196 9.3395 9.3395 9.3953 9.3953 10.3950 10.3950 10.4604 10.4604 10.9649 10.9649 10.9810 10.9810 11.5965 11.5965 12.1177 12.1177 12.5837 12.5837 12.5904 12.5904 k = 0.2589 0.2589-0.0000 ( 9999 PWs) bands (ev): -45.6431 -45.6431 -45.5950 -45.5950 -30.8300 -30.8300 -30.8140 -30.8140 -22.3766 -22.3766 -22.2864 -22.2864 -21.7692 -21.7692 -21.7002 -21.7002 -21.6320 -21.6320 -21.4899 -21.4899 -11.9103 -11.9103 -11.8565 -11.8565 -10.5429 -10.5429 -10.4877 -10.4877 -10.4330 -10.4330 -10.3661 -10.3661 3.4429 3.4429 4.0731 4.0731 8.0488 8.0488 8.2224 8.2224 8.7740 8.7740 8.8617 8.8617 9.3446 9.3446 9.3750 9.3750 10.3901 10.3901 10.4747 10.4747 10.9560 10.9560 11.0092 11.0092 11.6344 11.6344 12.1707 12.1707 12.5416 12.5416 12.5731 12.5731 k = 0.2500 0.2500-0.0000 ( 10003 PWs) bands (ev): -45.6446 -45.6446 -45.5936 -45.5936 -30.8308 -30.8308 -30.8139 -30.8139 -22.3780 -22.3780 -22.2830 -22.2830 -21.7691 -21.7691 -21.6947 -21.6947 -21.6391 -21.6391 -21.4893 -21.4893 -11.9103 -11.9103 -11.8532 -11.8532 -10.5405 -10.5405 -10.4883 -10.4883 -10.4293 -10.4293 -10.3646 -10.3646 3.3936 3.3936 4.0558 4.0558 7.9973 7.9973 8.2601 8.2601 8.8176 8.8176 8.9078 8.9078 9.3433 9.3433 9.3622 9.3622 10.3858 10.3858 10.4904 10.4904 10.9382 10.9382 11.0468 11.0468 11.6730 11.6730 12.2217 12.2217 12.4968 12.4968 12.5608 12.5608 k = 0.2411 0.2411-0.0000 ( 9995 PWs) bands (ev): -45.6460 -45.6460 -45.5922 -45.5922 -30.8316 -30.8316 -30.8137 -30.8137 -22.3795 -22.3795 -22.2798 -22.2798 -21.7692 -21.7692 -21.6892 -21.6892 -21.6459 -21.6459 -21.4886 -21.4886 -11.9104 -11.9104 -11.8500 -11.8500 -10.5380 -10.5380 -10.4889 -10.4889 -10.4254 -10.4254 -10.3631 -10.3631 3.3437 3.3437 4.0368 4.0368 7.9442 7.9442 8.3027 8.3027 8.8619 8.8619 8.9568 8.9568 9.3287 9.3287 9.3650 9.3650 10.3824 10.3824 10.5070 10.5070 10.9196 10.9196 11.0861 11.0861 11.7123 11.7123 12.2697 12.2697 12.4529 12.4529 12.5501 12.5501 k = 0.2321 0.2321-0.0000 ( 9985 PWs) bands (ev): -45.6475 -45.6475 -45.5908 -45.5908 -30.8324 -30.8324 -30.8135 -30.8135 -22.3810 -22.3810 -22.2767 -22.2767 -21.7695 -21.7695 -21.6837 -21.6837 -21.6524 -21.6524 -21.4877 -21.4877 -11.9104 -11.9104 -11.8467 -11.8467 -10.5355 -10.5355 -10.4895 -10.4895 -10.4215 -10.4215 -10.3618 -10.3618 3.2932 3.2932 4.0164 4.0164 7.8908 7.8908 8.3488 8.3488 8.9068 8.9068 9.0067 9.0067 9.3139 9.3139 9.3720 9.3720 10.3799 10.3799 10.5238 10.5238 10.9011 10.9011 11.1267 11.1267 11.7525 11.7525 12.3130 12.3130 12.4107 12.4107 12.5407 12.5407 k = 0.2232 0.2232-0.0000 ( 9981 PWs) bands (ev): -45.6489 -45.6489 -45.5894 -45.5894 -30.8332 -30.8332 -30.8134 -30.8134 -22.3826 -22.3826 -22.2737 -22.2737 -21.7701 -21.7701 -21.6783 -21.6783 -21.6585 -21.6585 -21.4866 -21.4866 -11.9104 -11.9104 -11.8434 -11.8434 -10.5329 -10.5329 -10.4901 -10.4901 -10.4176 -10.4176 -10.3605 -10.3605 3.2425 3.2425 3.9946 3.9946 7.8377 7.8377 8.3978 8.3978 8.9523 8.9523 9.0537 9.0537 9.3057 9.3057 9.3802 9.3802 10.3785 10.3785 10.5401 10.5401 10.8833 10.8833 11.1684 11.1684 11.7938 11.7938 12.3447 12.3447 12.3762 12.3762 12.5325 12.5325 k = 0.2143 0.2143-0.0000 ( 9977 PWs) bands (ev): -45.6503 -45.6503 -45.5880 -45.5880 -30.8339 -30.8339 -30.8132 -30.8132 -22.3843 -22.3843 -22.2708 -22.2708 -21.7708 -21.7708 -21.6730 -21.6730 -21.6642 -21.6642 -21.4854 -21.4854 -11.9104 -11.9104 -11.8402 -11.8402 -10.5304 -10.5304 -10.4907 -10.4907 -10.4136 -10.4136 -10.3593 -10.3593 3.1918 3.1918 3.9718 3.9718 7.7851 7.7851 8.4493 8.4493 8.9983 8.9983 9.0908 9.0908 9.3111 9.3111 9.3889 9.3889 10.3785 10.3785 10.5550 10.5550 10.8671 10.8671 11.2108 11.2108 11.8365 11.8365 12.3223 12.3223 12.3907 12.3907 12.5254 12.5254 k = 0.2054 0.2054-0.0000 ( 9973 PWs) bands (ev): -45.6517 -45.6517 -45.5867 -45.5867 -30.8347 -30.8347 -30.8131 -30.8131 -22.3861 -22.3861 -22.2682 -22.2682 -21.7719 -21.7719 -21.6695 -21.6695 -21.6678 -21.6678 -21.4839 -21.4839 -11.9103 -11.9103 -11.8369 -11.8369 -10.5278 -10.5278 -10.4913 -10.4913 -10.4096 -10.4096 -10.3583 -10.3583 3.1412 3.1412 3.9479 3.9479 7.7334 7.7334 8.5029 8.5029 9.0449 9.0449 9.1104 9.1104 9.3374 9.3374 9.3982 9.3982 10.3801 10.3801 10.5675 10.5675 10.8533 10.8533 11.2538 11.2538 11.8811 11.8811 12.2845 12.2845 12.4145 12.4145 12.5193 12.5193 k = 0.1964 0.1964-0.0000 ( 9963 PWs) bands (ev): -45.6531 -45.6531 -45.5853 -45.5853 -30.8354 -30.8354 -30.8129 -30.8129 -22.3879 -22.3879 -22.2656 -22.2656 -21.7733 -21.7733 -21.6743 -21.6743 -21.6628 -21.6628 -21.4823 -21.4823 -11.9103 -11.9103 -11.8337 -11.8337 -10.5252 -10.5252 -10.4918 -10.4918 -10.4056 -10.4056 -10.3573 -10.3573 3.0911 3.0911 3.9233 3.9233 7.6826 7.6826 8.5585 8.5585 9.0919 9.0919 9.1125 9.1125 9.3841 9.3841 9.4081 9.4081 10.3839 10.3839 10.5762 10.5762 10.8427 10.8427 11.2968 11.2968 11.9278 11.9278 12.2471 12.2471 12.4311 12.4311 12.5139 12.5139 k = 0.1875 0.1875-0.0000 ( 9975 PWs) bands (ev): -45.6545 -45.6545 -45.5840 -45.5840 -30.8362 -30.8362 -30.8127 -30.8127 -22.3897 -22.3897 -22.2632 -22.2632 -21.7749 -21.7749 -21.6786 -21.6786 -21.6580 -21.6580 -21.4805 -21.4805 -11.9103 -11.9103 -11.8306 -11.8306 -10.5228 -10.5228 -10.4922 -10.4922 -10.4016 -10.4016 -10.3564 -10.3564 3.0416 3.0416 3.8982 3.8982 7.6330 7.6330 8.6156 8.6156 9.1030 9.1030 9.1399 9.1399 9.4175 9.4175 9.4447 9.4447 10.3904 10.3904 10.5804 10.5804 10.8361 10.8361 11.3395 11.3395 11.9772 11.9772 12.2112 12.2112 12.4393 12.4393 12.5091 12.5091 k = 0.1786 0.1786-0.0000 ( 9973 PWs) bands (ev): -45.6558 -45.6558 -45.5827 -45.5827 -30.8369 -30.8369 -30.8126 -30.8126 -22.3916 -22.3916 -22.2610 -22.2610 -21.7768 -21.7768 -21.6823 -21.6823 -21.6535 -21.6535 -21.4785 -21.4785 -11.9102 -11.9102 -11.8275 -11.8275 -10.5204 -10.5204 -10.4925 -10.4925 -10.3977 -10.3977 -10.3556 -10.3556 2.9930 2.9930 3.8727 3.8727 7.5847 7.5847 8.6740 8.6740 9.0884 9.0884 9.1879 9.1879 9.4279 9.4279 9.5113 9.5113 10.4003 10.4003 10.5795 10.5795 10.8335 10.8335 11.3811 11.3811 12.0296 12.0296 12.1770 12.1770 12.4395 12.4395 12.5046 12.5046 k = 0.1696 0.1696-0.0000 ( 9977 PWs) bands (ev): -45.6571 -45.6571 -45.5815 -45.5815 -30.8376 -30.8376 -30.8125 -30.8125 -22.3935 -22.3935 -22.2589 -22.2589 -21.7789 -21.7789 -21.6856 -21.6856 -21.6491 -21.6491 -21.4764 -21.4764 -11.9102 -11.9102 -11.8245 -11.8245 -10.5182 -10.5182 -10.4926 -10.4926 -10.3939 -10.3939 -10.3549 -10.3549 2.9455 2.9455 3.8471 3.8471 7.5378 7.5378 8.7334 8.7334 9.0712 9.0712 9.2365 9.2365 9.4384 9.4384 9.5805 9.5805 10.4145 10.4145 10.5737 10.5737 10.8344 10.8344 11.4210 11.4210 12.0841 12.0841 12.1460 12.1460 12.4325 12.4325 12.5004 12.5004 k = 0.1607 0.1607-0.0000 ( 9981 PWs) bands (ev): -45.6583 -45.6583 -45.5803 -45.5803 -30.8383 -30.8383 -30.8123 -30.8123 -22.3954 -22.3954 -22.2569 -22.2569 -21.7813 -21.7813 -21.6884 -21.6884 -21.6451 -21.6451 -21.4741 -21.4741 -11.9101 -11.9101 -11.8215 -11.8215 -10.5162 -10.5162 -10.4925 -10.4925 -10.3901 -10.3901 -10.3543 -10.3543 2.8993 2.8993 3.8215 3.8215 7.4925 7.4925 8.7936 8.7936 9.0530 9.0530 9.2854 9.2854 9.4490 9.4490 9.6492 9.6492 10.4339 10.4339 10.5638 10.5638 10.8378 10.8378 11.4581 11.4581 12.1071 12.1071 12.1522 12.1522 12.4201 12.4201 12.4965 12.4965 k = 0.1518 0.1518-0.0000 ( 9981 PWs) bands (ev): -45.6595 -45.6595 -45.5791 -45.5791 -30.8389 -30.8389 -30.8122 -30.8122 -22.3974 -22.3974 -22.2551 -22.2551 -21.7839 -21.7839 -21.6908 -21.6908 -21.6413 -21.6413 -21.4716 -21.4716 -11.9100 -11.9100 -11.8186 -11.8186 -10.5144 -10.5144 -10.4922 -10.4922 -10.3865 -10.3865 -10.3537 -10.3537 2.8545 2.8545 3.7962 3.7962 7.4490 7.4490 8.8542 8.8542 9.0345 9.0345 9.3347 9.3347 9.4597 9.4597 9.7151 9.7151 10.4597 10.4597 10.5509 10.5509 10.8424 10.8424 11.4913 11.4913 12.0809 12.0809 12.2137 12.2137 12.4045 12.4045 12.4930 12.4930 k = 0.1429 0.1429-0.0000 ( 9983 PWs) bands (ev): -45.6607 -45.6607 -45.5780 -45.5780 -30.8395 -30.8395 -30.8121 -30.8121 -22.3993 -22.3993 -22.2534 -22.2534 -21.7866 -21.7866 -21.6928 -21.6928 -21.6378 -21.6378 -21.4691 -21.4691 -11.9100 -11.9100 -11.8159 -11.8159 -10.5130 -10.5130 -10.4916 -10.4916 -10.3829 -10.3829 -10.3533 -10.3533 2.8113 2.8113 3.7713 3.7713 7.4072 7.4072 8.9148 8.9148 9.0163 9.0163 9.3843 9.3843 9.4704 9.4704 9.7761 9.7761 10.4928 10.4928 10.5360 10.5360 10.8471 10.8471 11.5190 11.5190 12.0539 12.0539 12.2819 12.2819 12.3882 12.3882 12.4901 12.4901 k = 0.1339 0.1339-0.0000 ( 9979 PWs) bands (ev): -45.6618 -45.6618 -45.5769 -45.5769 -30.8401 -30.8401 -30.8119 -30.8119 -22.4012 -22.4012 -22.2519 -22.2519 -21.7893 -21.7893 -21.6944 -21.6944 -21.6345 -21.6345 -21.4664 -21.4664 -11.9099 -11.9099 -11.8132 -11.8132 -10.5118 -10.5118 -10.4906 -10.4906 -10.3795 -10.3795 -10.3529 -10.3529 2.7699 2.7699 3.7471 3.7471 7.3674 7.3674 8.9747 8.9747 8.9992 8.9992 9.4341 9.4341 9.4810 9.4810 9.8305 9.8305 10.5197 10.5197 10.5341 10.5341 10.8510 10.8510 11.5398 11.5398 12.0285 12.0285 12.3532 12.3532 12.3755 12.3755 12.4883 12.4883 k = 0.1250 0.1250-0.0000 ( 9981 PWs) bands (ev): -45.6628 -45.6628 -45.5759 -45.5759 -30.8407 -30.8407 -30.8118 -30.8118 -22.4031 -22.4031 -22.2504 -22.2504 -21.7921 -21.7921 -21.6957 -21.6957 -21.6316 -21.6316 -21.4637 -21.4637 -11.9098 -11.9098 -11.8107 -11.8107 -10.5110 -10.5110 -10.4895 -10.4895 -10.3763 -10.3763 -10.3526 -10.3526 2.7305 2.7305 3.7236 3.7236 7.3297 7.3297 8.9809 8.9809 9.0360 9.0360 9.4839 9.4839 9.4916 9.4916 9.8775 9.8775 10.5029 10.5029 10.5834 10.5834 10.8534 10.8534 11.5522 11.5522 12.0049 12.0049 12.3627 12.3627 12.4315 12.4315 12.4896 12.4896 k = 0.1161 0.1161-0.0000 ( 9989 PWs) bands (ev): -45.6638 -45.6638 -45.5749 -45.5749 -30.8413 -30.8413 -30.8117 -30.8117 -22.4049 -22.4049 -22.2491 -22.2491 -21.7949 -21.7949 -21.6967 -21.6967 -21.6290 -21.6290 -21.4610 -21.4610 -11.9097 -11.9097 -11.8083 -11.8083 -10.5104 -10.5104 -10.4881 -10.4881 -10.3731 -10.3731 -10.3524 -10.3524 2.6932 2.6932 3.7010 3.7010 7.2941 7.2941 8.9649 8.9649 9.0949 9.0949 9.5016 9.5016 9.5339 9.5339 9.9168 9.9168 10.4860 10.4860 10.6399 10.6399 10.8541 10.8541 11.5549 11.5549 11.9832 11.9832 12.3596 12.3596 12.4779 12.4779 12.5253 12.5253 k = 0.1071 0.1071-0.0000 ( 9997 PWs) bands (ev): -45.6648 -45.6648 -45.5740 -45.5740 -30.8418 -30.8418 -30.8116 -30.8116 -22.4066 -22.4066 -22.2479 -22.2479 -21.7976 -21.7976 -21.6976 -21.6976 -21.6266 -21.6266 -21.4582 -21.4582 -11.9096 -11.9096 -11.8060 -11.8060 -10.5101 -10.5101 -10.4866 -10.4866 -10.3702 -10.3702 -10.3522 -10.3522 2.6581 2.6581 3.6796 3.6796 7.2608 7.2608 8.9496 8.9496 9.1529 9.1529 9.5116 9.5116 9.5834 9.5834 9.9488 9.9488 10.4693 10.4693 10.7021 10.7021 10.8528 10.8528 11.5475 11.5475 11.9633 11.9633 12.3640 12.3640 12.4836 12.4836 12.6079 12.6079 k = 0.0982 0.0982-0.0000 ( 9993 PWs) bands (ev): -45.6656 -45.6656 -45.5731 -45.5731 -30.8422 -30.8422 -30.8115 -30.8115 -22.4083 -22.4083 -22.2469 -22.2469 -21.8002 -21.8002 -21.6982 -21.6982 -21.6244 -21.6244 -21.4556 -21.4556 -11.9096 -11.9096 -11.8039 -11.8039 -10.5099 -10.5099 -10.4850 -10.4850 -10.3675 -10.3675 -10.3521 -10.3521 2.6254 2.6254 3.6593 3.6593 7.2298 7.2298 8.9354 8.9354 9.2092 9.2092 9.5211 9.5211 9.6325 9.6325 9.9745 9.9745 10.4532 10.4532 10.7676 10.7676 10.8499 10.8499 11.5306 11.5306 11.9453 11.9453 12.3763 12.3763 12.4882 12.4882 12.6976 12.6976 k = 0.0893 0.0893-0.0000 ( 9969 PWs) bands (ev): -45.6664 -45.6664 -45.5723 -45.5723 -30.8427 -30.8427 -30.8114 -30.8114 -22.4099 -22.4099 -22.2459 -22.2459 -21.8027 -21.8027 -21.6987 -21.6987 -21.6226 -21.6226 -21.4530 -21.4530 -11.9095 -11.9095 -11.8019 -11.8019 -10.5098 -10.5098 -10.4833 -10.4833 -10.3649 -10.3649 -10.3520 -10.3520 2.5952 2.5952 3.6405 3.6405 7.2012 7.2012 8.9223 8.9223 9.2635 9.2635 9.5301 9.5301 9.6807 9.6807 9.9949 9.9949 10.4378 10.4378 10.8291 10.8291 10.8506 10.8506 11.5056 11.5056 11.9291 11.9291 12.3957 12.3957 12.4949 12.4949 12.7909 12.7909 k = 0.0804 0.0804-0.0000 ( 9977 PWs) bands (ev): -45.6672 -45.6672 -45.5716 -45.5716 -30.8431 -30.8431 -30.8113 -30.8113 -22.4114 -22.4114 -22.2451 -22.2451 -21.8050 -21.8050 -21.6990 -21.6990 -21.6209 -21.6209 -21.4505 -21.4505 -11.9094 -11.9094 -11.8001 -11.8001 -10.5098 -10.5098 -10.4817 -10.4817 -10.3625 -10.3625 -10.3520 -10.3520 2.5675 2.5675 3.6230 3.6230 7.1751 7.1751 8.9103 8.9103 9.3153 9.3153 9.5386 9.5386 9.7278 9.7278 10.0112 10.0112 10.4233 10.4233 10.8348 10.8348 10.9045 10.9045 11.4743 11.4743 11.9146 11.9146 12.4207 12.4207 12.5046 12.5046 12.8869 12.8869 k = 0.0714 0.0714-0.0000 ( 9965 PWs) bands (ev): -45.6678 -45.6678 -45.5710 -45.5710 -30.8434 -30.8434 -30.8113 -30.8113 -22.4127 -22.4127 -22.2443 -22.2443 -21.8071 -21.8071 -21.6993 -21.6993 -21.6195 -21.6195 -21.4482 -21.4482 -11.9093 -11.9093 -11.7985 -11.7985 -10.5099 -10.5099 -10.4802 -10.4802 -10.3604 -10.3604 -10.3520 -10.3520 2.5425 2.5425 3.6072 3.6072 7.1516 7.1516 8.8994 8.8994 9.3641 9.3641 9.5464 9.5464 9.7732 9.7732 10.0241 10.0241 10.4098 10.4098 10.8273 10.8273 10.9674 10.9674 11.4390 11.4390 11.9020 11.9020 12.4495 12.4495 12.5174 12.5174 12.9843 12.9843 k = 0.0625 0.0625-0.0000 ( 9965 PWs) bands (ev): -45.6684 -45.6684 -45.5704 -45.5704 -30.8438 -30.8438 -30.8112 -30.8112 -22.4139 -22.4139 -22.2437 -22.2437 -21.8090 -21.8090 -21.6995 -21.6995 -21.6182 -21.6182 -21.4460 -21.4460 -11.9093 -11.9093 -11.7970 -11.7970 -10.5100 -10.5100 -10.4788 -10.4788 -10.3585 -10.3585 -10.3520 -10.3520 2.5202 2.5202 3.5929 3.5929 7.1307 7.1307 8.8898 8.8898 9.4093 9.4093 9.5536 9.5536 9.8164 9.8164 10.0343 10.0343 10.3976 10.3976 10.8184 10.8184 11.0260 11.0260 11.4017 11.4017 11.8910 11.8910 12.4802 12.4802 12.5335 12.5335 13.0823 13.0823 k = 0.0536 0.0536-0.0000 ( 9975 PWs) bands (ev): -45.6690 -45.6690 -45.5699 -45.5699 -30.8440 -30.8440 -30.8111 -30.8111 -22.4150 -22.4150 -22.2431 -22.2431 -21.8107 -21.8107 -21.6996 -21.6996 -21.6172 -21.6172 -21.4441 -21.4441 -11.9092 -11.9092 -11.7957 -11.7957 -10.5101 -10.5101 -10.4775 -10.4775 -10.3568 -10.3568 -10.3520 -10.3520 2.5008 2.5008 3.5805 3.5805 7.1125 7.1125 8.8814 8.8814 9.4502 9.4502 9.5602 9.5602 9.8566 9.8566 10.0425 10.0425 10.3866 10.3866 10.8090 10.8090 11.0784 11.0784 11.3645 11.3645 11.8816 11.8816 12.5110 12.5110 12.5524 12.5524 13.1792 13.1792 k = 0.0446 0.0446-0.0000 ( 9981 PWs) bands (ev): -45.6694 -45.6694 -45.5695 -45.5695 -30.8443 -30.8443 -30.8111 -30.8111 -22.4160 -22.4160 -22.2426 -22.2426 -21.8122 -21.8122 -21.6997 -21.6997 -21.6164 -21.6164 -21.4425 -21.4425 -11.9092 -11.9092 -11.7946 -11.7946 -10.5102 -10.5102 -10.4764 -10.4764 -10.3554 -10.3554 -10.3521 -10.3521 2.4842 2.4842 3.5698 3.5698 7.0969 7.0969 8.8743 8.8743 9.4862 9.4862 9.5660 9.5660 9.8932 9.8932 10.0489 10.0489 10.3770 10.3770 10.7997 10.7997 11.1234 11.1234 11.3293 11.3293 11.8738 11.8738 12.5400 12.5400 12.5732 12.5732 13.2731 13.2731 k = 0.0357 0.0357-0.0000 ( 9983 PWs) bands (ev): -45.6698 -45.6698 -45.5691 -45.5691 -30.8445 -30.8445 -30.8110 -30.8110 -22.4167 -22.4167 -22.2423 -22.2423 -21.8134 -21.8134 -21.6998 -21.6998 -21.6157 -21.6157 -21.4411 -21.4411 -11.9091 -11.9091 -11.7937 -11.7937 -10.5103 -10.5103 -10.4755 -10.4755 -10.3542 -10.3542 -10.3521 -10.3521 2.4706 2.4706 3.5610 3.5610 7.0842 7.0842 8.8684 8.8684 9.5163 9.5163 9.5713 9.5713 9.9250 9.9250 10.0538 10.0538 10.3689 10.3689 10.7910 10.7910 11.1600 11.1600 11.2983 11.2983 11.8675 11.8675 12.5657 12.5657 12.5946 12.5946 13.3615 13.3615 k = 0.0268 0.0268-0.0000 ( 9983 PWs) bands (ev): -45.6700 -45.6700 -45.5688 -45.5688 -30.8446 -30.8446 -30.8110 -30.8110 -22.4173 -22.4173 -22.2420 -22.2420 -21.8143 -21.8143 -21.6998 -21.6998 -21.6151 -21.6151 -21.4400 -21.4400 -11.9091 -11.9091 -11.7930 -11.7930 -10.5104 -10.5104 -10.4747 -10.4747 -10.3533 -10.3533 -10.3522 -10.3522 2.4600 2.4600 3.5541 3.5541 7.0743 7.0743 8.8638 8.8638 9.5397 9.5397 9.5764 9.5764 9.9512 9.9512 10.0575 10.0575 10.3625 10.3625 10.7836 10.7836 11.1870 11.1870 11.2737 11.2737 11.8627 11.8627 12.5870 12.5870 12.6145 12.6145 13.4207 13.4207 k = 0.0179 0.0179-0.0000 ( 9983 PWs) bands (ev): -45.6702 -45.6702 -45.5686 -45.5686 -30.8447 -30.8447 -30.8110 -30.8110 -22.4178 -22.4178 -22.2418 -22.2418 -21.8150 -21.8150 -21.6998 -21.6998 -21.6148 -21.6148 -21.4392 -21.4392 -11.9091 -11.9091 -11.7925 -11.7925 -10.5104 -10.5104 -10.4742 -10.4742 -10.3527 -10.3527 -10.3522 -10.3522 2.4524 2.4524 3.5491 3.5491 7.0672 7.0672 8.8605 8.8605 9.5553 9.5553 9.5817 9.5817 9.9708 9.9708 10.0600 10.0600 10.3578 10.3578 10.7779 10.7779 11.2031 11.2031 11.2582 11.2582 11.8593 11.8593 12.6031 12.6031 12.6305 12.6305 13.4191 13.4191 k = 0.0089 0.0089-0.0000 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8154 -21.8154 -21.6998 -21.6998 -21.6145 -21.6145 -21.4387 -21.4387 -11.9091 -11.9091 -11.7922 -11.7922 -10.5104 -10.5104 -10.4739 -10.4739 -10.3523 -10.3523 -10.3522 -10.3522 2.4478 2.4478 3.5461 3.5461 7.0629 7.0629 8.8586 8.8586 9.5632 9.5632 9.5865 9.5865 9.9829 9.9829 10.0615 10.0615 10.3550 10.3550 10.7743 10.7743 11.2082 11.2082 11.2529 11.2529 11.8573 11.8573 12.6131 12.6131 12.6409 12.6409 13.4176 13.4176 k = 0.0000 0.0000 0.0000 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9091 -11.9091 -11.7921 -11.7921 -10.5105 -10.5105 -10.4737 -10.4737 -10.3523 -10.3523 -10.3521 -10.3521 2.4462 2.4462 3.5451 3.5451 7.0614 7.0614 8.8579 8.8579 9.5654 9.5654 9.5886 9.5886 9.9870 9.9870 10.0620 10.0620 10.3540 10.3540 10.7731 10.7731 11.2084 11.2084 11.2525 11.2525 11.8566 11.8566 12.6166 12.6166 12.6445 12.6445 13.4171 13.4171 k = 0.0000 0.0000 0.0000 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9091 -11.9091 -11.7921 -11.7921 -10.5105 -10.5105 -10.4737 -10.4737 -10.3523 -10.3523 -10.3521 -10.3521 2.4462 2.4462 3.5451 3.5451 7.0614 7.0614 8.8579 8.8579 9.5654 9.5654 9.5886 9.5886 9.9870 9.9870 10.0620 10.0620 10.3540 10.3540 10.7731 10.7731 11.2084 11.2084 11.2525 11.2525 11.8566 11.8566 12.6166 12.6166 12.6445 12.6445 13.4171 13.4171 k = 0.0000 0.0000 0.0127 ( 9997 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9090 -11.9090 -11.7921 -11.7921 -10.5104 -10.5104 -10.4738 -10.4738 -10.3523 -10.3523 -10.3521 -10.3521 2.4476 2.4476 3.5434 3.5434 7.0618 7.0618 8.8537 8.8537 9.5660 9.5660 9.5892 9.5892 9.9885 9.9885 10.0636 10.0636 10.3541 10.3541 10.7771 10.7771 11.2070 11.2070 11.2510 11.2510 11.8501 11.8501 12.6164 12.6164 12.6445 12.6445 13.4239 13.4239 k = 0.0000 0.0000 0.0254 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9090 -11.9090 -11.7922 -11.7922 -10.5104 -10.5104 -10.4738 -10.4738 -10.3524 -10.3524 -10.3521 -10.3521 2.4516 2.4516 3.5382 3.5382 7.0630 7.0630 8.8412 8.8412 9.5677 9.5677 9.5909 9.5909 9.9928 9.9928 10.0685 10.0685 10.3542 10.3542 10.7887 10.7887 11.2029 11.2029 11.2466 11.2466 11.8310 11.8310 12.6159 12.6159 12.6445 12.6445 13.4440 13.4440 k = 0.0000 0.0000 0.0381 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8448 -30.8448 -30.8110 -30.8110 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9090 -11.9090 -11.7922 -11.7922 -10.5103 -10.5103 -10.4738 -10.4738 -10.3525 -10.3525 -10.3521 -10.3521 2.4584 2.4584 3.5297 3.5297 7.0650 7.0650 8.8208 8.8208 9.5706 9.5706 9.5938 9.5938 10.0001 10.0001 10.0771 10.0771 10.3545 10.3545 10.8072 10.8072 11.1961 11.1961 11.2394 11.2394 11.8005 11.8005 12.6153 12.6153 12.6447 12.6447 13.4780 13.4780 k = 0.0000 0.0000 0.0508 ( 10001 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9089 -11.9089 -11.7923 -11.7923 -10.5101 -10.5101 -10.4738 -10.4738 -10.3527 -10.3527 -10.3520 -10.3520 2.4678 2.4678 3.5178 3.5178 7.0679 7.0679 8.7930 8.7930 9.5745 9.5745 9.5977 9.5977 10.0102 10.0102 10.0896 10.0896 10.3548 10.3548 10.8312 10.8312 11.1867 11.1867 11.2294 11.2294 11.7600 11.7600 12.6148 12.6148 12.6454 12.6454 13.5010 13.5010 k = 0.0000 0.0000 0.0635 ( 9997 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9089 -11.9089 -11.7923 -11.7923 -10.5099 -10.5099 -10.4739 -10.4739 -10.3529 -10.3529 -10.3520 -10.3520 2.4798 2.4798 3.5027 3.5027 7.0719 7.0719 8.7585 8.7585 9.5795 9.5795 9.6027 9.6027 10.0233 10.0233 10.1062 10.1062 10.3553 10.3553 10.8594 10.8594 11.1749 11.1749 11.2169 11.2169 11.7112 11.7112 12.6147 12.6147 12.6468 12.6468 13.5303 13.5303 k = 0.0000 0.0000 0.0762 ( 9997 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9088 -11.9088 -11.7924 -11.7924 -10.5097 -10.5097 -10.4739 -10.4739 -10.3532 -10.3532 -10.3519 -10.3519 2.4944 2.4944 3.4845 3.4845 7.0769 7.0769 8.7183 8.7183 9.5854 9.5854 9.6086 9.6086 10.0391 10.0391 10.1272 10.1272 10.3558 10.3558 10.8903 10.8903 11.1609 11.1609 11.2022 11.2022 11.6559 11.6559 12.6155 12.6155 12.6493 12.6493 13.5375 13.5388 k = 0.0000 0.0000 0.0889 ( 9977 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9087 -11.9087 -11.7925 -11.7925 -10.5094 -10.5094 -10.4740 -10.4740 -10.3535 -10.3535 -10.3519 -10.3519 2.5115 2.5115 3.4632 3.4632 7.0832 7.0832 8.6733 8.6733 9.5922 9.5922 9.6154 9.6154 10.0578 10.0578 10.1523 10.1523 10.3563 10.3563 10.9225 10.9225 11.1451 11.1451 11.1855 11.1855 11.5955 11.5955 12.6175 12.6175 12.6532 12.6532 13.5160 13.5160 k = 0.0000 0.0000 0.1016 ( 9981 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9086 -11.9086 -11.7926 -11.7926 -10.5091 -10.5091 -10.4740 -10.4740 -10.3539 -10.3539 -10.3518 -10.3518 2.5310 2.5310 3.4391 3.4391 7.0907 7.0907 8.6246 8.6246 9.5997 9.5997 9.6229 9.6229 10.0793 10.0793 10.1812 10.1812 10.3570 10.3570 10.9546 10.9546 11.1277 11.1277 11.1672 11.1672 11.5315 11.5315 12.6209 12.6209 12.6587 12.6587 13.4840 13.4840 k = 0.0000 0.0000 0.1142 ( 9997 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8449 -30.8449 -30.8109 -30.8109 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9085 -11.9085 -11.7927 -11.7927 -10.5088 -10.5088 -10.4741 -10.4741 -10.3542 -10.3542 -10.3518 -10.3518 2.5530 2.5530 3.4123 3.4123 7.0996 7.0996 8.5733 8.5733 9.6078 9.6078 9.6311 9.6311 10.1035 10.1035 10.2134 10.2134 10.3576 10.3576 10.9855 10.9855 11.1090 11.1090 11.1476 11.1476 11.4650 11.4650 12.6259 12.6259 12.6660 12.6660 13.4502 13.4502 k = 0.0000 0.0000 0.1269 ( 9993 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8450 -30.8450 -30.8108 -30.8108 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9084 -11.9084 -11.7929 -11.7929 -10.5085 -10.5085 -10.4741 -10.4741 -10.3546 -10.3546 -10.3517 -10.3517 2.5772 2.5772 3.3831 3.3831 7.1097 7.1097 8.5204 8.5204 9.6164 9.6164 9.6397 9.6397 10.1303 10.1303 10.2482 10.2482 10.3583 10.3583 11.0144 11.0144 11.0896 11.0896 11.1272 11.1272 11.3969 11.3969 12.6328 12.6328 12.6754 12.6754 13.4150 13.4150 k = 0.0000 0.0000 0.1396 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8450 -30.8450 -30.8108 -30.8108 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9083 -11.9083 -11.7930 -11.7930 -10.5082 -10.5082 -10.4742 -10.4742 -10.3550 -10.3550 -10.3516 -10.3516 2.6036 2.6036 3.3516 3.3516 7.1212 7.1212 8.4671 8.4671 9.6253 9.6253 9.6486 9.6486 10.1597 10.1597 10.2849 10.2849 10.3591 10.3591 11.0401 11.0401 11.0703 11.0703 11.1064 11.1064 11.3281 11.3281 12.6416 12.6416 12.6868 12.6868 13.3789 13.3789 k = 0.0000 0.0000 0.1523 ( 9989 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8450 -30.8450 -30.8108 -30.8108 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9082 -11.9082 -11.7931 -11.7931 -10.5079 -10.5079 -10.4742 -10.4742 -10.3554 -10.3554 -10.3516 -10.3516 2.6321 2.6321 3.3180 3.3180 7.1338 7.1338 8.4142 8.4142 9.6343 9.6343 9.6576 9.6576 10.1915 10.1915 10.3225 10.3225 10.3598 10.3598 11.0476 11.0476 11.0660 11.0660 11.0857 11.0857 11.2593 11.2593 12.6523 12.6523 12.7002 12.7002 13.3425 13.3425 k = 0.0000 0.0000 0.1650 ( 9993 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8450 -30.8450 -30.8108 -30.8108 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9081 -11.9081 -11.7932 -11.7932 -10.5076 -10.5076 -10.4743 -10.4743 -10.3557 -10.3557 -10.3515 -10.3515 2.6625 2.6625 3.2827 3.2827 7.1472 7.1472 8.3627 8.3627 9.6432 9.6432 9.6664 9.6664 10.2256 10.2256 10.3602 10.3602 10.3604 10.3604 11.0294 11.0294 11.0655 11.0655 11.0845 11.0845 11.1911 11.1911 12.6647 12.6647 12.7154 12.7154 13.3062 13.3062 k = 0.0000 0.0000 0.1777 ( 9996 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8450 -30.8450 -30.8108 -30.8108 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9080 -11.9080 -11.7933 -11.7933 -10.5073 -10.5073 -10.4744 -10.4744 -10.3561 -10.3561 -10.3515 -10.3515 2.6947 2.6947 3.2459 3.2459 7.1613 7.1613 8.3138 8.3138 9.6517 9.6517 9.6750 9.6750 10.2617 10.2617 10.3611 10.3611 10.3969 10.3969 11.0110 11.0110 11.0464 11.0464 11.1004 11.1004 11.1241 11.1241 12.6786 12.6786 12.7324 12.7324 13.2705 13.2705 k = 0.0000 0.0000 0.1904 ( 9988 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9079 -11.9079 -11.7934 -11.7934 -10.5070 -10.5070 -10.4744 -10.4744 -10.3564 -10.3564 -10.3514 -10.3514 2.7286 2.7286 3.2077 3.2077 7.1755 7.1755 8.2683 8.2683 9.6598 9.6598 9.6830 9.6830 10.2996 10.2996 10.3617 10.3617 10.4318 10.4318 10.9940 10.9940 11.0286 11.0286 11.0591 11.0591 11.1132 11.1132 12.6936 12.6936 12.7507 12.7507 13.2361 13.2361 k = 0.0000 0.0000 0.2031 ( 10000 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9078 -11.9078 -11.7935 -11.7935 -10.5068 -10.5068 -10.4745 -10.4745 -10.3567 -10.3567 -10.3514 -10.3514 2.7638 2.7638 3.1687 3.1687 7.1893 7.1893 8.2272 8.2272 9.6671 9.6671 9.6903 9.6903 10.3384 10.3384 10.3623 10.3623 10.4637 10.4637 10.9787 10.9787 10.9966 10.9966 11.0129 11.0129 11.1228 11.1228 12.7092 12.7092 12.7697 12.7697 13.2039 13.2039 k = 0.0000 0.0000 0.2158 ( 9984 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9077 -11.9077 -11.7936 -11.7936 -10.5066 -10.5066 -10.4745 -10.4745 -10.3569 -10.3569 -10.3513 -10.3513 2.8003 2.8003 3.1289 3.1289 7.2021 7.2021 8.1917 8.1917 9.6734 9.6734 9.6966 9.6966 10.3623 10.3623 10.3781 10.3781 10.4917 10.4917 10.9380 10.9380 10.9655 10.9655 10.9993 10.9993 11.1296 11.1296 12.7246 12.7246 12.7887 12.7887 13.1746 13.1746 k = 0.0000 0.0000 0.2285 ( 9984 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9077 -11.9077 -11.7936 -11.7936 -10.5064 -10.5064 -10.4745 -10.4745 -10.3571 -10.3571 -10.3513 -10.3513 2.8376 2.8376 3.0890 3.0890 7.2130 7.2130 8.1627 8.1627 9.6785 9.6785 9.7017 9.7017 10.3629 10.3629 10.4159 10.4159 10.5147 10.5147 10.8848 10.8848 10.9549 10.9549 10.9884 10.9884 11.1342 11.1342 12.7387 12.7387 12.8066 12.8066 13.1495 13.1496 k = 0.0000 0.0000 0.2412 ( 9984 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9076 -11.9076 -11.7937 -11.7937 -10.5063 -10.5063 -10.4745 -10.4745 -10.3573 -10.3573 -10.3513 -10.3513 2.8751 2.8751 3.0497 3.0497 7.2215 7.2215 8.1412 8.1412 9.6823 9.6823 9.7055 9.7055 10.3631 10.3631 10.4496 10.4496 10.5319 10.5319 10.8401 10.8401 10.9471 10.9471 10.9804 10.9804 11.1371 11.1371 12.7504 12.7504 12.8216 12.8216 13.1300 13.1300 k = 0.0000 0.0000 0.2539 ( 9968 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9076 -11.9076 -11.7937 -11.7937 -10.5062 -10.5062 -10.4746 -10.4746 -10.3574 -10.3574 -10.3513 -10.3513 2.9104 2.9104 3.0132 3.0132 7.2269 7.2269 8.1280 8.1280 9.6846 9.6846 9.7079 9.7079 10.3633 10.3633 10.4744 10.4744 10.5425 10.5425 10.8088 10.8088 10.9423 10.9423 10.9755 10.9755 11.1386 11.1386 12.7582 12.7582 12.8319 12.8319 13.1175 13.1175 k = 0.0000 0.0000 0.2666 ( 9968 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9076 -11.9076 -11.7937 -11.7937 -10.5062 -10.5062 -10.4746 -10.4746 -10.3574 -10.3574 -10.3513 -10.3513 2.9304 2.9304 2.9928 2.9928 7.2288 7.2288 8.1235 8.1235 9.6854 9.6854 9.7086 9.7086 10.3634 10.3634 10.4838 10.4838 10.5461 10.5461 10.7972 10.7972 10.9407 10.9407 10.9739 10.9739 11.1390 11.1390 12.7609 12.7609 12.8356 12.8356 13.1132 13.1132 k = 0.0000 0.0000 0.2666 ( 9968 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9076 -11.9076 -11.7937 -11.7937 -10.5062 -10.5062 -10.4746 -10.4746 -10.3574 -10.3574 -10.3513 -10.3513 2.9304 2.9304 2.9928 2.9928 7.2288 7.2288 8.1235 8.1235 9.6854 9.6854 9.7086 9.7086 10.3634 10.3634 10.4838 10.4838 10.5461 10.5461 10.7972 10.7972 10.9407 10.9407 10.9739 10.9739 11.1390 11.1390 12.7609 12.7609 12.8356 12.8356 13.1132 13.1132 k = 0.0000 0.0125 0.2666 ( 9986 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8154 -21.8154 -21.6998 -21.6998 -21.6145 -21.6145 -21.4387 -21.4387 -11.9076 -11.9076 -11.7938 -11.7938 -10.5062 -10.5062 -10.4747 -10.4747 -10.3574 -10.3574 -10.3514 -10.3514 2.9316 2.9316 2.9942 2.9942 7.2302 7.2302 8.1234 8.1234 9.6835 9.6835 9.7071 9.7071 10.3642 10.3642 10.4852 10.4852 10.5449 10.5449 10.7570 10.7570 10.9498 10.9498 11.0030 11.0030 11.1383 11.1383 12.7586 12.7586 12.8332 12.8332 13.1115 13.1115 k = 0.0000 0.0250 0.2666 ( 9990 PWs) bands (ev): -45.6702 -45.6702 -45.5686 -45.5686 -30.8450 -30.8450 -30.8107 -30.8107 -22.4178 -22.4178 -22.2417 -22.2417 -21.8150 -21.8150 -21.6998 -21.6998 -21.6148 -21.6148 -21.4392 -21.4392 -11.9076 -11.9076 -11.7941 -11.7941 -10.5062 -10.5062 -10.4750 -10.4750 -10.3574 -10.3574 -10.3517 -10.3517 2.9352 2.9352 2.9983 2.9983 7.2344 7.2344 8.1233 8.1233 9.6762 9.6762 9.7041 9.7041 10.3665 10.3665 10.4896 10.4896 10.5396 10.5396 10.6843 10.6843 10.9443 10.9443 11.0770 11.0770 11.1362 11.1362 12.7502 12.7502 12.8274 12.8274 13.1067 13.1067 k = 0.0000 0.0375 0.2666 ( 9994 PWs) bands (ev): -45.6700 -45.6700 -45.5688 -45.5688 -30.8449 -30.8449 -30.8107 -30.8107 -22.4174 -22.4174 -22.2419 -22.2419 -21.8143 -21.8143 -21.6998 -21.6998 -21.6151 -21.6151 -21.4400 -21.4400 -11.9076 -11.9076 -11.7946 -11.7946 -10.5061 -10.5061 -10.4756 -10.4756 -10.3575 -10.3575 -10.3521 -10.3521 2.9413 2.9413 3.0051 3.0051 7.2414 7.2414 8.1230 8.1230 9.6610 9.6610 9.7023 9.7023 10.3704 10.3704 10.4965 10.4965 10.5204 10.5204 10.6179 10.6179 10.9305 10.9305 11.1329 11.1329 11.1610 11.1610 12.7330 12.7330 12.8220 12.8220 13.0988 13.0988 k = 0.0000 0.0500 0.2666 ( 9992 PWs) bands (ev): -45.6698 -45.6698 -45.5691 -45.5691 -30.8448 -30.8448 -30.8108 -30.8108 -22.4168 -22.4168 -22.2422 -22.2422 -21.8134 -21.8134 -21.6998 -21.6998 -21.6156 -21.6156 -21.4411 -21.4411 -11.9077 -11.9077 -11.7953 -11.7953 -10.5061 -10.5061 -10.4763 -10.4763 -10.3577 -10.3577 -10.3527 -10.3527 2.9497 2.9497 3.0146 3.0146 7.2512 7.2512 8.1224 8.1224 9.6378 9.6378 9.7022 9.7022 10.3759 10.3759 10.4658 10.4658 10.5056 10.5056 10.5849 10.5849 10.9109 10.9109 11.1288 11.1288 11.2470 11.2470 12.7055 12.7055 12.8202 12.8202 13.0881 13.0881 k = 0.0000 0.0625 0.2666 ( 9984 PWs) bands (ev): -45.6694 -45.6694 -45.5695 -45.5695 -30.8446 -30.8446 -30.8108 -30.8108 -22.4160 -22.4160 -22.2426 -22.2426 -21.8122 -21.8122 -21.6998 -21.6998 -21.6162 -21.6162 -21.4425 -21.4425 -11.9078 -11.9078 -11.7961 -11.7961 -10.5061 -10.5061 -10.4772 -10.4772 -10.3582 -10.3582 -10.3532 -10.3532 2.9605 2.9605 3.0267 3.0267 7.2637 7.2637 8.1214 8.1214 9.6076 9.6076 9.7030 9.7030 10.3828 10.3828 10.3874 10.3874 10.5161 10.5161 10.5759 10.5759 10.8861 10.8861 11.1242 11.1242 11.3331 11.3331 12.6687 12.6687 12.8223 12.8223 13.0748 13.0748 k = 0.0000 0.0750 0.2666 ( 9980 PWs) bands (ev): -45.6690 -45.6690 -45.5699 -45.5699 -30.8443 -30.8443 -30.8108 -30.8108 -22.4150 -22.4150 -22.2430 -22.2430 -21.8108 -21.8108 -21.6997 -21.6997 -21.6170 -21.6170 -21.4442 -21.4442 -11.9078 -11.9078 -11.7972 -11.7972 -10.5062 -10.5062 -10.4783 -10.4783 -10.3590 -10.3590 -10.3535 -10.3535 2.9737 2.9737 3.0415 3.0415 7.2789 7.2789 8.1196 8.1196 9.5712 9.5712 9.7044 9.7044 10.3030 10.3030 10.3915 10.3915 10.5274 10.5274 10.5739 10.5739 10.8569 10.8569 11.1198 11.1198 11.4182 11.4182 12.6250 12.6250 12.8279 12.8279 13.0590 13.0590 k = 0.0000 0.0875 0.2666 ( 9980 PWs) bands (ev): -45.6685 -45.6685 -45.5704 -45.5704 -30.8441 -30.8441 -30.8109 -30.8109 -22.4139 -22.4139 -22.2436 -22.2436 -21.8090 -21.8090 -21.6997 -21.6997 -21.6179 -21.6179 -21.4463 -21.4463 -11.9079 -11.9079 -11.7984 -11.7984 -10.5063 -10.5063 -10.4794 -10.4794 -10.3603 -10.3603 -10.3536 -10.3536 2.9892 2.9892 3.0588 3.0588 7.2967 7.2967 8.1168 8.1168 9.5290 9.5290 9.7061 9.7061 10.2179 10.2179 10.4017 10.4017 10.5387 10.5387 10.5743 10.5743 10.8235 10.8235 11.1162 11.1162 11.5020 11.5020 12.5765 12.5765 12.8365 12.8365 13.0411 13.0411 k = 0.0000 0.1000 0.2666 ( 9978 PWs) bands (ev): -45.6679 -45.6679 -45.5710 -45.5710 -30.8437 -30.8437 -30.8110 -30.8110 -22.4126 -22.4126 -22.2442 -22.2442 -21.8071 -21.8071 -21.6996 -21.6996 -21.6189 -21.6189 -21.4486 -21.4486 -11.9080 -11.9080 -11.7999 -11.7999 -10.5065 -10.5065 -10.4806 -10.4806 -10.3619 -10.3619 -10.3535 -10.3535 3.0070 3.0070 3.0787 3.0787 7.3171 7.3171 8.1127 8.1127 9.4816 9.4816 9.7081 9.7081 10.1341 10.1341 10.4134 10.4134 10.5491 10.5491 10.5760 10.5760 10.7867 10.7867 11.1142 11.1142 11.5841 11.5841 12.5250 12.5250 12.8480 12.8480 13.0210 13.0210 k = 0.0000 0.1125 0.2666 ( 9990 PWs) bands (ev): -45.6672 -45.6672 -45.5716 -45.5716 -30.8434 -30.8434 -30.8111 -30.8111 -22.4112 -22.4112 -22.2449 -22.2449 -21.8048 -21.8048 -21.6995 -21.6995 -21.6201 -21.6201 -21.4512 -21.4512 -11.9081 -11.9081 -11.8014 -11.8014 -10.5069 -10.5069 -10.4819 -10.4819 -10.3638 -10.3638 -10.3534 -10.3534 3.0270 3.0270 3.1010 3.1010 7.3399 7.3399 8.1069 8.1069 9.4295 9.4295 9.7101 9.7101 10.0525 10.0525 10.4267 10.4267 10.5577 10.5577 10.5787 10.5787 10.7470 10.7470 11.1146 11.1146 11.6643 11.6643 12.4717 12.4717 12.8623 12.8623 12.9988 12.9988 k = 0.0000 0.1250 0.2666 ( 9994 PWs) bands (ev): -45.6665 -45.6665 -45.5723 -45.5723 -30.8430 -30.8430 -30.8112 -30.8112 -22.4096 -22.4096 -22.2457 -22.2457 -21.8024 -21.8024 -21.6995 -21.6995 -21.6214 -21.6214 -21.4542 -21.4542 -11.9081 -11.9081 -11.8032 -11.8032 -10.5074 -10.5074 -10.4831 -10.4831 -10.3660 -10.3660 -10.3532 -10.3532 3.0492 3.0492 3.1257 3.1257 7.3650 7.3650 8.0989 8.0989 9.3731 9.3731 9.7123 9.7123 9.9738 9.9738 10.4416 10.4416 10.5639 10.5639 10.5820 10.5820 10.7048 10.7048 11.1181 11.1181 11.7423 11.7423 12.4178 12.4178 12.8792 12.8792 12.9748 12.9748 k = 0.0000 0.1375 0.2666 ( 10002 PWs) bands (ev): -45.6657 -45.6657 -45.5731 -45.5731 -30.8426 -30.8426 -30.8113 -30.8113 -22.4078 -22.4078 -22.2466 -22.2466 -21.7996 -21.7996 -21.6994 -21.6994 -21.6228 -21.6228 -21.4574 -21.4574 -11.9082 -11.9082 -11.8051 -11.8051 -10.5081 -10.5081 -10.4842 -10.4842 -10.3683 -10.3683 -10.3529 -10.3529 3.0736 3.0736 3.1528 3.1528 7.3924 7.3924 8.0883 8.0883 9.3127 9.3127 9.7143 9.7143 9.8989 9.8989 10.4581 10.4581 10.5677 10.5677 10.5853 10.5853 10.6606 10.6606 11.1254 11.1254 11.8178 11.8178 12.3644 12.3644 12.8977 12.8977 12.9495 12.9495 k = 0.0000 0.1500 0.2666 ( 10002 PWs) bands (ev): -45.6648 -45.6648 -45.5740 -45.5740 -30.8421 -30.8421 -30.8114 -30.8114 -22.4059 -22.4059 -22.2476 -22.2476 -21.7967 -21.7967 -21.6992 -21.6992 -21.6242 -21.6242 -21.4609 -21.4609 -11.9083 -11.9083 -11.8072 -11.8072 -10.5091 -10.5091 -10.4853 -10.4853 -10.3707 -10.3707 -10.3527 -10.3527 3.1000 3.1000 3.1820 3.1820 7.4217 7.4217 8.0745 8.0745 9.2490 9.2490 9.7162 9.7162 9.8283 9.8283 10.4760 10.4760 10.5694 10.5694 10.5876 10.5876 10.6153 10.6153 11.1369 11.1369 11.8908 11.8908 12.3120 12.3120 12.9084 12.9084 12.9306 12.9306 k = 0.0000 0.1625 0.2666 ( 9996 PWs) bands (ev): -45.6638 -45.6638 -45.5749 -45.5749 -30.8416 -30.8416 -30.8115 -30.8115 -22.4038 -22.4038 -22.2486 -22.2486 -21.7934 -21.7934 -21.6991 -21.6991 -21.6258 -21.6258 -21.4646 -21.4646 -11.9083 -11.9083 -11.8094 -11.8094 -10.5103 -10.5103 -10.4862 -10.4862 -10.3732 -10.3732 -10.3525 -10.3525 3.1284 3.1284 3.2134 3.2134 7.4529 7.4529 8.0571 8.0571 9.1823 9.1823 9.7178 9.7178 9.7627 9.7627 10.4956 10.4956 10.5655 10.5655 10.5712 10.5712 10.5902 10.5902 11.1529 11.1529 11.9609 11.9609 12.2615 12.2615 12.8854 12.8854 12.9290 12.9290 k = 0.0000 0.1750 0.2666 ( 9990 PWs) bands (ev): -45.6628 -45.6628 -45.5759 -45.5759 -30.8411 -30.8411 -30.8117 -30.8117 -22.4016 -22.4016 -22.2498 -22.2498 -21.7900 -21.7900 -21.6990 -21.6990 -21.6275 -21.6275 -21.4687 -21.4687 -11.9084 -11.9084 -11.8118 -11.8118 -10.5117 -10.5117 -10.4870 -10.4870 -10.3758 -10.3758 -10.3524 -10.3524 3.1588 3.1588 3.2468 3.2468 7.4856 7.4856 8.0357 8.0357 9.1133 9.1133 9.7020 9.7020 9.7197 9.7197 10.5162 10.5162 10.5205 10.5205 10.5668 10.5668 10.5910 10.5910 11.1731 11.1731 12.0279 12.0279 12.2134 12.2134 12.8538 12.8538 12.9095 12.9095 k = 0.0000 0.1875 0.2666 ( 9994 PWs) bands (ev): -45.6617 -45.6617 -45.5770 -45.5770 -30.8405 -30.8405 -30.8118 -30.8118 -22.3992 -22.3992 -22.2510 -22.2510 -21.7863 -21.7863 -21.6988 -21.6988 -21.6293 -21.6293 -21.4729 -21.4729 -11.9084 -11.9084 -11.8142 -11.8142 -10.5133 -10.5133 -10.4878 -10.4878 -10.3783 -10.3783 -10.3523 -10.3523 3.1910 3.1910 3.2820 3.2820 7.5195 7.5195 8.0099 8.0099 9.0425 9.0425 9.6478 9.6478 9.7204 9.7204 10.4724 10.4724 10.5390 10.5390 10.5618 10.5618 10.5923 10.5923 11.1975 11.1975 12.0915 12.0915 12.1681 12.1681 12.8196 12.8196 12.8853 12.8853 k = 0.0000 0.2000 0.2666 ( 10000 PWs) bands (ev): -45.6606 -45.6606 -45.5781 -45.5781 -30.8399 -30.8399 -30.8120 -30.8120 -22.3967 -22.3967 -22.2524 -22.2524 -21.7824 -21.7824 -21.6986 -21.6986 -21.6312 -21.6312 -21.4775 -21.4775 -11.9084 -11.9084 -11.8168 -11.8168 -10.5150 -10.5150 -10.4885 -10.4885 -10.3808 -10.3808 -10.3522 -10.3522 3.2249 3.2249 3.3190 3.3190 7.5542 7.5542 7.9794 7.9794 8.9708 8.9708 9.5995 9.5995 9.7208 9.7208 10.4245 10.4245 10.5523 10.5523 10.5648 10.5648 10.5939 10.5939 11.2256 11.2256 12.1247 12.1247 12.1529 12.1529 12.7833 12.7833 12.8596 12.8596 k = 0.0000 0.2125 0.2666 ( 10008 PWs) bands (ev): -45.6593 -45.6593 -45.5793 -45.5793 -30.8393 -30.8393 -30.8122 -30.8122 -22.3941 -22.3941 -22.2538 -22.2538 -21.7782 -21.7782 -21.6983 -21.6983 -21.6331 -21.6331 -21.4823 -21.4823 -11.9084 -11.9084 -11.8196 -11.8196 -10.5169 -10.5169 -10.4891 -10.4891 -10.3832 -10.3832 -10.3523 -10.3523 3.2605 3.2605 3.3576 3.3576 7.5890 7.5890 7.9442 7.9442 8.8989 8.8989 9.5574 9.5574 9.7208 9.7208 10.3770 10.3770 10.5437 10.5437 10.5874 10.5874 10.5977 10.5977 11.2568 11.2568 12.0867 12.0867 12.2085 12.2085 12.7451 12.7451 12.8331 12.8331 k = 0.0000 0.2250 0.2666 ( 10016 PWs) bands (ev): -45.6581 -45.6581 -45.5806 -45.5806 -30.8386 -30.8386 -30.8124 -30.8124 -22.3914 -22.3914 -22.2554 -22.2554 -21.7738 -21.7738 -21.6981 -21.6981 -21.6351 -21.6351 -21.4873 -21.4873 -11.9083 -11.9083 -11.8224 -11.8224 -10.5189 -10.5189 -10.4899 -10.4899 -10.3855 -10.3855 -10.3524 -10.3524 3.2976 3.2976 3.3977 3.3977 7.6234 7.6234 7.9044 7.9044 8.8279 8.8279 9.5213 9.5213 9.7202 9.7202 10.3299 10.3299 10.5331 10.5331 10.5952 10.5952 10.6189 10.6189 11.2907 11.2907 12.0518 12.0518 12.2605 12.2605 12.7050 12.7050 12.8060 12.8060 k = 0.0000 0.2375 0.2666 ( 10004 PWs) bands (ev): -45.6567 -45.6567 -45.5819 -45.5819 -30.8380 -30.8380 -30.8127 -30.8127 -22.3885 -22.3885 -22.2570 -22.2570 -21.7693 -21.7693 -21.6978 -21.6978 -21.6371 -21.6371 -21.4925 -21.4925 -11.9082 -11.9082 -11.8253 -11.8253 -10.5209 -10.5209 -10.4907 -10.4907 -10.3876 -10.3876 -10.3526 -10.3526 3.3361 3.3361 3.4390 3.4390 7.6562 7.6562 7.8603 7.8603 8.7591 8.7591 9.4911 9.4911 9.7190 9.7190 10.2835 10.2835 10.5217 10.5217 10.5973 10.5973 10.6473 10.6473 11.3268 11.3268 12.0209 12.0209 12.3079 12.3079 12.6633 12.6633 12.7786 12.7786 k = 0.0000 0.2500 0.2666 ( 9986 PWs) bands (ev): -45.6553 -45.6553 -45.5833 -45.5833 -30.8373 -30.8373 -30.8129 -30.8129 -22.3856 -22.3856 -22.2588 -22.2588 -21.7645 -21.7645 -21.6974 -21.6974 -21.6392 -21.6392 -21.4980 -21.4980 -11.9081 -11.9081 -11.8283 -11.8283 -10.5229 -10.5229 -10.4916 -10.4916 -10.3895 -10.3895 -10.3529 -10.3529 3.3759 3.3759 3.4814 3.4814 7.6861 7.6861 7.8123 7.8123 8.6940 8.6940 9.4661 9.4661 9.7172 9.7172 10.2381 10.2381 10.5100 10.5100 10.5991 10.5991 10.6776 10.6776 11.3646 11.3646 11.9941 11.9941 12.3499 12.3499 12.6200 12.6200 12.7514 12.7514 k = 0.0000 0.2625 0.2666 ( 9990 PWs) bands (ev): -45.6539 -45.6539 -45.5847 -45.5847 -30.8366 -30.8366 -30.8132 -30.8132 -22.3825 -22.3825 -22.2606 -22.2606 -21.7595 -21.7595 -21.6971 -21.6971 -21.6414 -21.6414 -21.5036 -21.5036 -11.9079 -11.9079 -11.8313 -11.8313 -10.5249 -10.5249 -10.4927 -10.4927 -10.3911 -10.3911 -10.3533 -10.3533 3.4168 3.4168 3.5246 3.5246 7.7112 7.7112 7.7610 7.7610 8.6348 8.6348 9.4459 9.4459 9.7148 9.7148 10.1938 10.1938 10.4982 10.4982 10.6007 10.6007 10.7096 10.7096 11.4037 11.4037 11.9715 11.9715 12.3858 12.3858 12.5752 12.5752 12.7250 12.7250 k = 0.0000 0.2750 0.2666 ( 9982 PWs) bands (ev): -45.6524 -45.6524 -45.5862 -45.5862 -30.8359 -30.8359 -30.8135 -30.8135 -22.3793 -22.3793 -22.2626 -22.2626 -21.7543 -21.7543 -21.6966 -21.6966 -21.6435 -21.6435 -21.5095 -21.5095 -11.9076 -11.9076 -11.8344 -11.8344 -10.5268 -10.5268 -10.4940 -10.4940 -10.3924 -10.3924 -10.3538 -10.3538 3.4587 3.4587 3.5684 3.5684 7.7059 7.7059 7.7307 7.7307 8.5837 8.5837 9.4297 9.4297 9.7118 9.7118 10.1507 10.1507 10.4869 10.4869 10.6023 10.6023 10.7431 10.7431 11.4437 11.4437 11.9533 11.9533 12.4142 12.4142 12.5291 12.5291 12.7008 12.7008 k = 0.0000 0.2875 0.2666 ( 9986 PWs) bands (ev): -45.6508 -45.6508 -45.5877 -45.5877 -30.8351 -30.8351 -30.8138 -30.8138 -22.3761 -22.3761 -22.2646 -22.2646 -21.7489 -21.7489 -21.6962 -21.6962 -21.6457 -21.6457 -21.5155 -21.5155 -11.9073 -11.9073 -11.8376 -11.8376 -10.5286 -10.5286 -10.4955 -10.4955 -10.3935 -10.3935 -10.3544 -10.3544 3.5013 3.5013 3.6126 3.6126 7.6503 7.6503 7.7394 7.7394 8.5436 8.5436 9.4168 9.4168 9.7083 9.7083 10.1091 10.1091 10.4762 10.4762 10.6037 10.6037 10.7782 10.7782 11.4842 11.4842 11.9394 11.9394 12.4330 12.4330 12.4820 12.4820 12.6803 12.6803 k = 0.0000 0.3000 0.2666 ( 9998 PWs) bands (ev): -45.6492 -45.6492 -45.5893 -45.5893 -30.8344 -30.8344 -30.8141 -30.8141 -22.3727 -22.3727 -22.2668 -22.2668 -21.7433 -21.7433 -21.6956 -21.6956 -21.6479 -21.6479 -21.5217 -21.5217 -11.9069 -11.9069 -11.8407 -11.8407 -10.5303 -10.5303 -10.4971 -10.4971 -10.3942 -10.3942 -10.3550 -10.3550 3.5445 3.5445 3.6569 3.6569 7.5931 7.5931 7.7371 7.7371 8.5168 8.5168 9.4065 9.4065 9.7044 9.7044 10.0691 10.0691 10.4664 10.4664 10.6050 10.6050 10.8147 10.8147 11.5250 11.5250 11.9299 11.9299 12.4284 12.4284 12.4460 12.4460 12.6656 12.6656 k = 0.0000 0.3125 0.2666 ( 9994 PWs) bands (ev): -45.6476 -45.6476 -45.5909 -45.5909 -30.8336 -30.8336 -30.8145 -30.8145 -22.3693 -22.3693 -22.2691 -22.2691 -21.7376 -21.7376 -21.6951 -21.6951 -21.6501 -21.6501 -21.5281 -21.5281 -11.9065 -11.9065 -11.8439 -11.8439 -10.5319 -10.5319 -10.4990 -10.4990 -10.3947 -10.3947 -10.3558 -10.3558 3.5881 3.5881 3.7010 3.7010 7.5354 7.5354 7.7220 7.7220 8.5050 8.5050 9.3979 9.3979 9.7001 9.7001 10.0306 10.0306 10.4576 10.4576 10.6060 10.6060 10.8526 10.8526 11.5657 11.5657 11.9247 11.9247 12.3811 12.3811 12.4397 12.4397 12.6578 12.6578 k = 0.0000 0.3250 0.2666 ( 9984 PWs) bands (ev): -45.6459 -45.6459 -45.5926 -45.5926 -30.8328 -30.8328 -30.8148 -30.8148 -22.3658 -22.3658 -22.2715 -22.2715 -21.7317 -21.7317 -21.6944 -21.6944 -21.6524 -21.6524 -21.5346 -21.5346 -11.9059 -11.9059 -11.8471 -11.8471 -10.5333 -10.5333 -10.5010 -10.5010 -10.3948 -10.3948 -10.3567 -10.3567 3.6319 3.6319 3.7445 3.7445 7.4781 7.4781 7.6944 7.6944 8.5079 8.5079 9.3902 9.3902 9.6955 9.6955 9.9940 9.9940 10.4501 10.4501 10.6067 10.6067 10.8920 10.8920 11.6062 11.6062 11.9238 11.9238 12.3304 12.3304 12.4249 12.4249 12.6560 12.6560 k = 0.0000 0.3375 0.2666 ( 9974 PWs) bands (ev): -45.6441 -45.6441 -45.5943 -45.5943 -30.8321 -30.8321 -30.8152 -30.8152 -22.3623 -22.3623 -22.2739 -22.2739 -21.7256 -21.7256 -21.6937 -21.6937 -21.6546 -21.6546 -21.5413 -21.5413 -11.9053 -11.9053 -11.8503 -11.8503 -10.5346 -10.5346 -10.5032 -10.5032 -10.3947 -10.3947 -10.3577 -10.3577 3.6755 3.6755 3.7871 3.7871 7.4218 7.4218 7.6560 7.6560 8.5240 8.5240 9.3829 9.3829 9.6908 9.6908 9.9591 9.9591 10.4439 10.4439 10.6069 10.6069 10.9327 10.9327 11.6461 11.6461 11.9271 11.9271 12.2785 12.2785 12.4024 12.4024 12.6578 12.6578 k = 0.0000 0.3500 0.2666 ( 9974 PWs) bands (ev): -45.6423 -45.6423 -45.5961 -45.5961 -30.8313 -30.8313 -30.8156 -30.8156 -22.3587 -22.3587 -22.2765 -22.2765 -21.7195 -21.7195 -21.6930 -21.6930 -21.6568 -21.6568 -21.5481 -21.5481 -11.9045 -11.9045 -11.8535 -11.8535 -10.5357 -10.5357 -10.5055 -10.5055 -10.3943 -10.3943 -10.3588 -10.3588 3.7187 3.7187 3.8284 3.8284 7.3673 7.3673 7.6095 7.6095 8.5510 8.5510 9.3752 9.3752 9.6862 9.6862 9.9262 9.9262 10.4392 10.4392 10.6064 10.6064 10.9748 10.9748 11.6853 11.6853 11.9344 11.9344 12.2258 12.2258 12.3751 12.3751 12.6607 12.6607 k = 0.0000 0.3625 0.2666 ( 9982 PWs) bands (ev): -45.6405 -45.6405 -45.5979 -45.5979 -30.8305 -30.8305 -30.8161 -30.8161 -22.3550 -22.3550 -22.2792 -22.2792 -21.7132 -21.7132 -21.6921 -21.6921 -21.6589 -21.6589 -21.5550 -21.5550 -11.9037 -11.9037 -11.8567 -11.8567 -10.5366 -10.5366 -10.5079 -10.5079 -10.3937 -10.3937 -10.3599 -10.3599 3.7612 3.7612 3.8680 3.8680 7.3155 7.3155 7.5574 7.5574 8.5863 8.5863 9.3666 9.3666 9.6817 9.6817 9.8952 9.8952 10.4361 10.4361 10.6051 10.6051 11.0182 11.0182 11.7237 11.7237 11.9457 11.9457 12.1723 12.1723 12.3452 12.3452 12.6632 12.6632 k = 0.0000 0.3750 0.2666 ( 9966 PWs) bands (ev): -45.6387 -45.6387 -45.5997 -45.5997 -30.8297 -30.8297 -30.8165 -30.8165 -22.3514 -22.3514 -22.2820 -22.2820 -21.7068 -21.7068 -21.6911 -21.6911 -21.6611 -21.6611 -21.5620 -21.5620 -11.9028 -11.9028 -11.8598 -11.8598 -10.5373 -10.5373 -10.5104 -10.5104 -10.3928 -10.3928 -10.3612 -10.3612 3.8026 3.8026 3.9056 3.9056 7.2668 7.2668 7.5023 7.5023 8.6277 8.6277 9.3566 9.3566 9.6776 9.6776 9.8662 9.8662 10.4346 10.4346 10.6027 10.6027 11.0628 11.0628 11.7610 11.7610 11.9606 11.9606 12.1183 12.1183 12.3143 12.3143 12.6645 12.6645 k = 0.0000 0.3875 0.2666 ( 9978 PWs) bands (ev): -45.6368 -45.6368 -45.6015 -45.6015 -30.8289 -30.8289 -30.8170 -30.8170 -22.3477 -22.3477 -22.2848 -22.2848 -21.7006 -21.7006 -21.6898 -21.6898 -21.6632 -21.6632 -21.5691 -21.5691 -11.9017 -11.9017 -11.8629 -11.8629 -10.5378 -10.5378 -10.5129 -10.5129 -10.3918 -10.3918 -10.3625 -10.3625 3.8427 3.8427 3.9405 3.9405 7.2220 7.2220 7.4460 7.4460 8.6734 8.6734 9.3446 9.3446 9.6739 9.6739 9.8392 9.8392 10.4348 10.4348 10.5991 10.5991 11.1086 11.1086 11.7970 11.7970 11.9791 11.9791 12.0641 12.0641 12.2835 12.2835 12.6643 12.6643 k = 0.0000 0.4000 0.2666 ( 9982 PWs) bands (ev): -45.6349 -45.6349 -45.6034 -45.6034 -30.8282 -30.8282 -30.8175 -30.8175 -22.3439 -22.3439 -22.2878 -22.2878 -21.6949 -21.6949 -21.6877 -21.6877 -21.6653 -21.6653 -21.5763 -21.5763 -11.9006 -11.9006 -11.8659 -11.8659 -10.5380 -10.5380 -10.5154 -10.5154 -10.3905 -10.3905 -10.3639 -10.3639 3.8810 3.8810 3.9724 3.9724 7.1818 7.1818 7.3901 7.3901 8.7219 8.7219 9.3303 9.3303 9.6709 9.6709 9.8143 9.8143 10.4368 10.4368 10.5941 10.5941 11.1556 11.1556 11.8316 11.8316 11.9971 11.9971 12.0134 12.0134 12.2537 12.2537 12.6618 12.6618 k = 0.0000 0.4125 0.2666 ( 9972 PWs) bands (ev): -45.6330 -45.6330 -45.6053 -45.6053 -30.8274 -30.8274 -30.8180 -30.8180 -22.3402 -22.3402 -22.2908 -22.2908 -21.6910 -21.6910 -21.6837 -21.6837 -21.6673 -21.6673 -21.5835 -21.5835 -11.8993 -11.8993 -11.8689 -11.8689 -10.5381 -10.5381 -10.5179 -10.5179 -10.3892 -10.3892 -10.3654 -10.3654 3.9171 3.9171 4.0009 4.0009 7.1467 7.1467 7.3361 7.3361 8.7720 8.7720 9.3134 9.3134 9.6687 9.6687 9.7914 9.7914 10.4405 10.4405 10.5876 10.5876 11.2037 11.2037 11.8643 11.8643 11.9533 11.9533 12.0281 12.0281 12.2253 12.2253 12.6458 12.6458 k = 0.0000 0.4250 0.2666 ( 9974 PWs) bands (ev): -45.6311 -45.6311 -45.6073 -45.6073 -30.8266 -30.8266 -30.8186 -30.8186 -22.3365 -22.3365 -22.2940 -22.2940 -21.6889 -21.6889 -21.6778 -21.6778 -21.6692 -21.6692 -21.5908 -21.5908 -11.8979 -11.8979 -11.8717 -11.8717 -10.5379 -10.5379 -10.5203 -10.5203 -10.3877 -10.3877 -10.3670 -10.3670 3.9506 3.9506 4.0255 4.0255 7.1173 7.1173 7.2849 7.2849 8.8229 8.8229 9.2936 9.2936 9.6675 9.6675 9.7706 9.7706 10.4460 10.4460 10.5796 10.5796 11.2528 11.2528 11.8851 11.8851 11.9093 11.9093 12.0562 12.0562 12.1988 12.1988 12.5967 12.5967 k = 0.0000 0.4375 0.2666 ( 9970 PWs) bands (ev): -45.6291 -45.6291 -45.6092 -45.6092 -30.8259 -30.8259 -30.8191 -30.8191 -22.3327 -22.3327 -22.2972 -22.2972 -21.6874 -21.6874 -21.6719 -21.6719 -21.6703 -21.6703 -21.5981 -21.5981 -11.8964 -11.8964 -11.8745 -11.8745 -10.5376 -10.5376 -10.5227 -10.5227 -10.3861 -10.3861 -10.3686 -10.3686 3.9811 3.9811 4.0458 4.0458 7.0940 7.0940 7.2374 7.2374 8.8738 8.8738 9.2706 9.2706 9.6674 9.6674 9.7519 9.7519 10.4531 10.4531 10.5702 10.5702 11.3029 11.3029 11.8394 11.8394 11.9300 11.9300 12.0870 12.0870 12.1744 12.1744 12.5423 12.5423 k = 0.0000 0.4500 0.2666 ( 9966 PWs) bands (ev): -45.6271 -45.6271 -45.6112 -45.6112 -30.8251 -30.8251 -30.8197 -30.8197 -22.3290 -22.3290 -22.3005 -22.3005 -21.6859 -21.6859 -21.6732 -21.6732 -21.6639 -21.6639 -21.6055 -21.6055 -11.8947 -11.8947 -11.8772 -11.8772 -10.5370 -10.5370 -10.5249 -10.5249 -10.3844 -10.3844 -10.3703 -10.3703 4.0082 4.0082 4.0616 4.0616 7.0774 7.0774 7.1946 7.1946 8.9239 8.9239 9.2444 9.2444 9.6685 9.6685 9.7351 9.7351 10.4618 10.4618 10.5593 10.5593 11.3539 11.3539 11.7846 11.7846 11.9580 11.9580 12.1173 12.1173 12.1549 12.1549 12.4885 12.4885 k = 0.0000 0.4625 0.2666 ( 9972 PWs) bands (ev): -45.6251 -45.6251 -45.6132 -45.6132 -30.8244 -30.8244 -30.8203 -30.8203 -22.3253 -22.3253 -22.3039 -22.3039 -21.6845 -21.6845 -21.6749 -21.6749 -21.6569 -21.6569 -21.6129 -21.6129 -11.8929 -11.8929 -11.8798 -11.8798 -10.5361 -10.5361 -10.5270 -10.5270 -10.3827 -10.3827 -10.3720 -10.3720 4.0314 4.0314 4.0724 4.0724 7.0676 7.0676 7.1570 7.1570 8.9726 8.9726 9.2148 9.2148 9.6710 9.6710 9.7204 9.7204 10.4719 10.4719 10.5474 10.5474 11.4057 11.4057 11.7295 11.7295 11.9849 11.9849 12.1202 12.1202 12.1668 12.1668 12.4361 12.4361 k = 0.0000 0.4750 0.2666 ( 9976 PWs) bands (ev): -45.6231 -45.6231 -45.6152 -45.6152 -30.8237 -30.8237 -30.8210 -30.8210 -22.3216 -22.3216 -22.3073 -22.3073 -21.6831 -21.6831 -21.6767 -21.6767 -21.6497 -21.6497 -21.6203 -21.6203 -11.8911 -11.8911 -11.8823 -11.8823 -10.5351 -10.5351 -10.5290 -10.5290 -10.3809 -10.3809 -10.3738 -10.3738 4.0504 4.0504 4.0782 4.0782 7.0649 7.0649 7.1252 7.1252 9.0196 9.0196 9.1819 9.1819 9.6749 9.6749 9.7076 9.7076 10.4832 10.4832 10.5347 10.5347 11.4583 11.4583 11.6745 11.6745 12.0105 12.0105 12.1010 12.1010 12.2038 12.2038 12.3854 12.3854 k = 0.0000 0.4875 0.2666 ( 9986 PWs) bands (ev): -45.6211 -45.6211 -45.6171 -45.6171 -30.8230 -30.8230 -30.8216 -30.8216 -22.3180 -22.3180 -22.3108 -22.3108 -21.6815 -21.6815 -21.6784 -21.6784 -21.6424 -21.6424 -21.6277 -21.6277 -11.8890 -11.8890 -11.8846 -11.8846 -10.5339 -10.5339 -10.5308 -10.5308 -10.3791 -10.3791 -10.3755 -10.3755 4.0648 4.0648 4.0788 4.0788 7.0694 7.0694 7.0998 7.0998 9.0644 9.0644 9.1458 9.1458 9.6805 9.6805 9.6968 9.6968 10.4954 10.4954 10.5216 10.5216 11.5115 11.5115 11.6197 11.6197 12.0347 12.0347 12.0797 12.0797 12.2455 12.2455 12.3366 12.3366 k = 0.0000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3773 -10.3773 -10.3773 -10.3773 4.0743 4.0743 4.0743 4.0743 7.0811 7.0811 7.0811 7.0811 9.1065 9.1065 9.1065 9.1065 9.6877 9.6877 9.6877 9.6877 10.5083 10.5083 10.5083 10.5083 11.5654 11.5654 11.5654 11.5654 12.0577 12.0577 12.0577 12.0577 12.2899 12.2899 12.2899 12.2899 k = 0.0000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3773 -10.3773 -10.3773 -10.3773 4.0743 4.0743 4.0743 4.0743 7.0811 7.0811 7.0811 7.0811 9.1065 9.1065 9.1065 9.1065 9.6877 9.6877 9.6877 9.6877 10.5083 10.5083 10.5083 10.5083 11.5654 11.5654 11.5654 11.5654 12.0577 12.0577 12.0577 12.0577 12.2899 12.2899 12.2899 12.2899 k = 0.0125 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3145 -22.3145 -22.3144 -22.3144 -21.6809 -21.6809 -21.6805 -21.6805 -21.6344 -21.6344 -21.6341 -21.6341 -11.8870 -11.8870 -11.8869 -11.8869 -10.5342 -10.5342 -10.5306 -10.5306 -10.3792 -10.3792 -10.3757 -10.3757 4.0743 4.0743 4.0745 4.0745 7.0822 7.0822 7.0827 7.0827 9.1062 9.1062 9.1072 9.1072 9.6862 9.6862 9.6863 9.6863 10.5082 10.5082 10.5092 10.5092 11.5626 11.5626 11.5629 11.5629 12.0562 12.0562 12.0620 12.0620 12.2839 12.2839 12.2900 12.2900 k = 0.0250 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3147 -22.3147 -22.3146 -22.3146 -21.6831 -21.6831 -21.6824 -21.6824 -21.6323 -21.6323 -21.6317 -21.6317 -11.8871 -11.8871 -11.8869 -11.8869 -10.5360 -10.5360 -10.5288 -10.5288 -10.3813 -10.3813 -10.3742 -10.3742 4.0742 4.0742 4.0746 4.0746 7.0860 7.0860 7.0870 7.0870 9.1063 9.1063 9.1081 9.1081 9.6816 9.6816 9.6820 9.6820 10.5087 10.5087 10.5107 10.5107 11.5547 11.5547 11.5553 11.5553 12.0570 12.0570 12.0688 12.0688 12.2726 12.2726 12.2850 12.2850 k = 0.0375 0.5000 0.2666 ( 9980 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8222 -30.8222 -30.8222 -30.8222 -22.3151 -22.3151 -22.3150 -22.3150 -21.6863 -21.6863 -21.6853 -21.6853 -21.6290 -21.6290 -21.6282 -21.6282 -11.8873 -11.8873 -11.8870 -11.8870 -10.5377 -10.5377 -10.5270 -10.5270 -10.3836 -10.3836 -10.3730 -10.3730 4.0743 4.0743 4.0749 4.0749 7.0925 7.0925 7.0939 7.0939 9.1066 9.1066 9.1095 9.1095 9.6742 9.6742 9.6748 9.6748 10.5099 10.5099 10.5129 10.5129 11.5419 11.5419 11.5428 11.5428 12.0589 12.0589 12.0769 12.0769 12.2583 12.2583 12.2770 12.2770 k = 0.0500 0.5000 0.2666 ( 9992 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8222 -30.8222 -30.8222 -30.8222 -22.3157 -22.3157 -22.3155 -22.3155 -21.6901 -21.6901 -21.6889 -21.6889 -21.6249 -21.6249 -21.6240 -21.6240 -11.8876 -11.8876 -11.8871 -11.8871 -10.5395 -10.5395 -10.5252 -10.5252 -10.3861 -10.3861 -10.3720 -10.3720 4.0743 4.0743 4.0752 4.0752 7.1017 7.1017 7.1035 7.1035 9.1073 9.1073 9.1111 9.1111 9.6642 9.6642 9.6649 9.6649 10.5117 10.5117 10.5158 10.5158 11.5245 11.5245 11.5256 11.5256 12.0593 12.0593 12.0833 12.0833 12.2448 12.2448 12.2693 12.2693 k = 0.0625 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8221 -30.8221 -30.8221 -30.8221 -22.3164 -22.3164 -22.3161 -22.3161 -21.6942 -21.6942 -21.6929 -21.6929 -21.6203 -21.6203 -21.6192 -21.6192 -11.8879 -11.8879 -11.8873 -11.8873 -10.5412 -10.5412 -10.5233 -10.5233 -10.3888 -10.3888 -10.3712 -10.3712 4.0745 4.0745 4.0755 4.0755 7.1134 7.1134 7.1157 7.1157 9.1083 9.1083 9.1131 9.1131 9.6517 9.6517 9.6526 9.6526 10.5141 10.5141 10.5193 10.5193 11.5031 11.5031 11.5043 11.5043 12.0553 12.0553 12.0830 12.0830 12.2381 12.2381 12.2662 12.2662 k = 0.0750 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8220 -30.8220 -30.8220 -30.8220 -22.3172 -22.3172 -22.3169 -22.3169 -21.6986 -21.6986 -21.6972 -21.6972 -21.6152 -21.6152 -21.6141 -21.6141 -11.8883 -11.8883 -11.8876 -11.8876 -10.5428 -10.5428 -10.5215 -10.5215 -10.3917 -10.3917 -10.3706 -10.3706 4.0746 4.0746 4.0758 4.0758 7.1277 7.1277 7.1303 7.1303 9.1097 9.1097 9.1154 9.1154 9.6372 9.6372 9.6382 9.6382 10.5171 10.5171 10.5233 10.5233 11.4780 11.4780 11.4793 11.4793 12.0439 12.0439 12.0712 12.0712 12.2437 12.2437 12.2711 12.2711 k = 0.0875 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8219 -30.8219 -30.8219 -30.8219 -22.3182 -22.3182 -22.3178 -22.3178 -21.7031 -21.7031 -21.7016 -21.7016 -21.6099 -21.6099 -21.6088 -21.6088 -11.8887 -11.8887 -11.8879 -11.8879 -10.5445 -10.5445 -10.5197 -10.5197 -10.3948 -10.3948 -10.3703 -10.3703 4.0748 4.0748 4.0762 4.0762 7.1444 7.1444 7.1475 7.1475 9.1113 9.1113 9.1181 9.1181 9.6208 9.6208 9.6219 9.6219 10.5207 10.5207 10.5280 10.5280 11.4499 11.4499 11.4512 11.4512 12.0243 12.0243 12.0481 12.0481 12.2620 12.2620 12.2854 12.2854 k = 0.1000 0.5000 0.2666 ( 10004 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8218 -30.8218 -30.8218 -30.8218 -22.3193 -22.3193 -22.3189 -22.3189 -21.7076 -21.7076 -21.7061 -21.7061 -21.6044 -21.6044 -21.6033 -21.6033 -11.8892 -11.8892 -11.8882 -11.8882 -10.5461 -10.5461 -10.5179 -10.5179 -10.3980 -10.3980 -10.3702 -10.3702 4.0750 4.0750 4.0765 4.0765 7.1635 7.1635 7.1669 7.1669 9.1132 9.1132 9.1210 9.1210 9.6029 9.6029 9.6042 9.6042 10.5248 10.5248 10.5331 10.5331 11.4191 11.4191 11.4204 11.4204 11.9975 11.9975 12.0169 12.0169 12.2898 12.2898 12.3085 12.3085 k = 0.1125 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8217 -30.8217 -30.8217 -30.8217 -22.3205 -22.3205 -22.3201 -22.3201 -21.7121 -21.7121 -21.7105 -21.7105 -21.5988 -21.5988 -21.5977 -21.5977 -11.8897 -11.8897 -11.8886 -11.8886 -10.5476 -10.5476 -10.5162 -10.5162 -10.4013 -10.4013 -10.3702 -10.3702 4.0752 4.0752 4.0769 4.0769 7.1848 7.1848 7.1886 7.1886 9.1154 9.1154 9.1243 9.1243 9.5838 9.5838 9.5852 9.5852 10.5293 10.5293 10.5388 10.5388 11.3863 11.3863 11.3875 11.3875 11.9654 11.9654 11.9809 11.9809 12.3243 12.3243 12.3386 12.3386 k = 0.1250 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8215 -30.8215 -30.8215 -30.8215 -22.3218 -22.3218 -22.3214 -22.3214 -21.7165 -21.7165 -21.7150 -21.7150 -21.5932 -21.5932 -21.5921 -21.5921 -11.8902 -11.8902 -11.8891 -11.8891 -10.5491 -10.5491 -10.5145 -10.5145 -10.4047 -10.4047 -10.3705 -10.3705 4.0754 4.0754 4.0772 4.0772 7.2083 7.2083 7.2125 7.2125 9.1179 9.1179 9.1278 9.1278 9.5639 9.5639 9.5654 9.5654 10.5344 10.5344 10.5449 10.5449 11.3518 11.3518 11.3529 11.3529 11.9295 11.9295 11.9417 11.9417 12.3635 12.3635 12.3740 12.3740 k = 0.1375 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8214 -30.8214 -30.8214 -30.8214 -22.3233 -22.3233 -22.3228 -22.3228 -21.7209 -21.7209 -21.7193 -21.7193 -21.5875 -21.5875 -21.5865 -21.5865 -11.8908 -11.8908 -11.8896 -11.8896 -10.5506 -10.5506 -10.5128 -10.5128 -10.4083 -10.4083 -10.3709 -10.3709 4.0755 4.0755 4.0775 4.0775 7.2339 7.2339 7.2383 7.2383 9.1206 9.1206 9.1316 9.1316 9.5435 9.5435 9.5451 9.5451 10.5398 10.5398 10.5515 10.5515 11.3161 11.3161 11.3171 11.3171 11.8912 11.8912 11.9007 11.9007 12.4062 12.4062 12.4136 12.4136 k = 0.1500 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8212 -30.8212 -30.8212 -30.8212 -22.3248 -22.3248 -22.3243 -22.3243 -21.7251 -21.7251 -21.7235 -21.7235 -21.5819 -21.5819 -21.5809 -21.5809 -11.8915 -11.8915 -11.8902 -11.8902 -10.5520 -10.5520 -10.5112 -10.5112 -10.4119 -10.4119 -10.3715 -10.3715 4.0757 4.0757 4.0778 4.0778 7.2612 7.2612 7.2659 7.2659 9.1237 9.1237 9.1358 9.1358 9.5228 9.5228 9.5245 9.5245 10.5456 10.5456 10.5585 10.5585 11.2795 11.2795 11.2805 11.2805 11.8511 11.8511 11.8585 11.8585 12.4515 12.4515 12.4562 12.4562 k = 0.1625 0.5000 0.2666 ( 9976 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8210 -30.8210 -30.8210 -30.8210 -22.3264 -22.3264 -22.3259 -22.3259 -21.7292 -21.7292 -21.7277 -21.7277 -21.5762 -21.5762 -21.5753 -21.5753 -11.8921 -11.8921 -11.8908 -11.8908 -10.5533 -10.5533 -10.5096 -10.5096 -10.4155 -10.4155 -10.3723 -10.3723 4.0758 4.0758 4.0780 4.0780 7.2903 7.2903 7.2952 7.2952 9.1270 9.1270 9.1402 9.1402 9.5022 9.5022 9.5039 9.5039 10.5516 10.5516 10.5657 10.5657 11.2426 11.2426 11.2434 11.2434 11.8100 11.8100 11.8156 11.8156 12.4987 12.4987 12.5010 12.5010 k = 0.1750 0.5000 0.2666 ( 9972 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8208 -30.8208 -30.8208 -30.8208 -22.3281 -22.3281 -22.3275 -22.3275 -21.7332 -21.7332 -21.7317 -21.7317 -21.5707 -21.5707 -21.5697 -21.5697 -11.8929 -11.8929 -11.8914 -11.8914 -10.5546 -10.5546 -10.5082 -10.5082 -10.4192 -10.4192 -10.3732 -10.3732 4.0758 4.0758 4.0781 4.0781 7.3209 7.3209 7.3261 7.3261 9.1307 9.1307 9.1449 9.1449 9.4818 9.4818 9.4835 9.4835 10.5579 10.5579 10.5732 10.5732 11.2057 11.2057 11.2063 11.2063 11.7682 11.7682 11.7723 11.7723 12.5469 12.5469 12.5472 12.5472 k = 0.1875 0.5000 0.2666 ( 9984 PWs) bands (ev): -45.6190 -45.6190 -45.6190 -45.6190 -30.8206 -30.8206 -30.8206 -30.8206 -22.3299 -22.3299 -22.3293 -22.3293 -21.7371 -21.7371 -21.7356 -21.7356 -21.5652 -21.5652 -21.5643 -21.5643 -11.8936 -11.8936 -11.8921 -11.8921 -10.5558 -10.5558 -10.5068 -10.5068 -10.4228 -10.4228 -10.3743 -10.3743 4.0758 4.0758 4.0782 4.0782 7.3529 7.3529 7.3582 7.3582 9.1347 9.1347 9.1500 9.1500 9.4619 9.4619 9.4636 9.4636 10.5643 10.5643 10.5808 10.5808 11.1691 11.1691 11.1696 11.1696 11.7261 11.7261 11.7289 11.7289 12.5940 12.5940 12.5956 12.5956 k = 0.2000 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8204 -30.8204 -30.8204 -30.8204 -22.3317 -22.3317 -22.3311 -22.3311 -21.7408 -21.7408 -21.7393 -21.7393 -21.5598 -21.5598 -21.5589 -21.5589 -11.8944 -11.8944 -11.8928 -11.8928 -10.5569 -10.5569 -10.5056 -10.5056 -10.4263 -10.4263 -10.3756 -10.3756 4.0757 4.0757 4.0781 4.0781 7.3860 7.3860 7.3914 7.3914 9.1390 9.1390 9.1554 9.1554 9.4426 9.4426 9.4443 9.4443 10.5706 10.5706 10.5883 10.5883 11.1333 11.1333 11.1336 11.1336 11.6840 11.6840 11.6857 11.6857 12.6406 12.6406 12.6438 12.6438 k = 0.2125 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8202 -30.8202 -30.8202 -30.8202 -22.3336 -22.3336 -22.3329 -22.3329 -21.7444 -21.7444 -21.7429 -21.7429 -21.5545 -21.5545 -21.5537 -21.5537 -11.8951 -11.8951 -11.8936 -11.8936 -10.5579 -10.5579 -10.5046 -10.5046 -10.4297 -10.4297 -10.3769 -10.3769 4.0755 4.0755 4.0780 4.0780 7.4201 7.4201 7.4255 7.4255 9.1438 9.1438 9.1612 9.1612 9.4242 9.4242 9.4257 9.4257 10.5767 10.5767 10.5956 10.5956 11.0986 11.0986 11.0986 11.0986 11.6421 11.6421 11.6428 11.6428 12.6859 12.6859 12.6906 12.6906 k = 0.2250 0.5000 0.2666 ( 9980 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8200 -30.8200 -30.8200 -30.8200 -22.3354 -22.3354 -22.3348 -22.3348 -21.7478 -21.7478 -21.7464 -21.7464 -21.5493 -21.5493 -21.5485 -21.5485 -11.8959 -11.8959 -11.8944 -11.8944 -10.5588 -10.5588 -10.5037 -10.5037 -10.4330 -10.4330 -10.3784 -10.3784 4.0752 4.0752 4.0778 4.0778 7.4549 7.4549 7.4604 7.4604 9.1491 9.1491 9.1674 9.1674 9.4066 9.4066 9.4080 9.4080 10.5821 10.5821 10.6023 10.6023 11.0652 11.0652 11.0655 11.0655 11.6004 11.6004 11.6005 11.6005 12.7290 12.7290 12.7349 12.7349 k = 0.2375 0.5000 0.2666 ( 9976 PWs) bands (ev): -45.6189 -45.6189 -45.6189 -45.6189 -30.8198 -30.8198 -30.8198 -30.8198 -22.3373 -22.3373 -22.3367 -22.3367 -21.7511 -21.7511 -21.7497 -21.7497 -21.5442 -21.5442 -21.5435 -21.5435 -11.8968 -11.8968 -11.8952 -11.8952 -10.5597 -10.5597 -10.5032 -10.5032 -10.4360 -10.4360 -10.3800 -10.3800 4.0749 4.0749 4.0774 4.0774 7.4902 7.4902 7.4956 7.4956 9.1548 9.1548 9.1739 9.1739 9.3901 9.3901 9.3913 9.3913 10.5867 10.5867 10.6080 10.6080 11.0339 11.0339 11.0344 11.0344 11.5586 11.5586 11.5595 11.5595 12.7686 12.7686 12.7754 12.7754 k = 0.2500 0.5000 0.2666 ( 9972 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8196 -30.8196 -30.8196 -30.8196 -22.3393 -22.3393 -22.3386 -22.3386 -21.7542 -21.7542 -21.7528 -21.7528 -21.5394 -21.5394 -21.5387 -21.5387 -11.8976 -11.8976 -11.8960 -11.8960 -10.5604 -10.5604 -10.5029 -10.5029 -10.4387 -10.4387 -10.3817 -10.3817 4.0744 4.0744 4.0770 4.0770 7.5258 7.5258 7.5311 7.5311 9.1611 9.1611 9.1809 9.1809 9.3747 9.3747 9.3756 9.3756 10.5901 10.5901 10.6124 10.6124 11.0051 11.0051 11.0059 11.0059 11.5175 11.5175 11.5191 11.5191 12.8035 12.8035 12.8108 12.8108 k = 0.2625 0.5000 0.2666 ( 9968 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8194 -30.8194 -30.8194 -30.8194 -22.3412 -22.3412 -22.3405 -22.3405 -21.7571 -21.7571 -21.7558 -21.7558 -21.5346 -21.5346 -21.5340 -21.5340 -11.8984 -11.8984 -11.8968 -11.8968 -10.5610 -10.5610 -10.5029 -10.5029 -10.4410 -10.4410 -10.3835 -10.3835 4.0739 4.0739 4.0764 4.0764 7.5614 7.5614 7.5666 7.5666 9.1680 9.1680 9.1883 9.1883 9.3604 9.3604 9.3610 9.3610 10.5916 10.5916 10.6149 10.6149 10.9794 10.9794 10.9804 10.9804 11.4773 11.4773 11.4795 11.4795 12.8327 12.8327 12.8399 12.8399 k = 0.2750 0.5000 0.2666 ( 9972 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8192 -30.8192 -30.8192 -30.8192 -22.3431 -22.3431 -22.3424 -22.3424 -21.7599 -21.7599 -21.7586 -21.7586 -21.5301 -21.5301 -21.5294 -21.5294 -11.8992 -11.8992 -11.8977 -11.8977 -10.5616 -10.5616 -10.5034 -10.5034 -10.4430 -10.4430 -10.3854 -10.3854 4.0733 4.0733 4.0758 4.0758 7.5968 7.5968 7.6018 7.6018 9.1754 9.1754 9.1961 9.1961 9.3475 9.3475 9.3475 9.3475 10.5910 10.5910 10.6148 10.6148 10.9574 10.9574 10.9585 10.9585 11.4381 11.4381 11.4409 11.4409 12.8556 12.8556 12.8622 12.8622 k = 0.2875 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8190 -30.8190 -30.8190 -30.8190 -22.3449 -22.3449 -22.3443 -22.3443 -21.7625 -21.7625 -21.7613 -21.7613 -21.5257 -21.5257 -21.5251 -21.5251 -11.9001 -11.9001 -11.8985 -11.8985 -10.5619 -10.5619 -10.5042 -10.5042 -10.4445 -10.4445 -10.3873 -10.3873 4.0726 4.0726 4.0750 4.0750 7.6317 7.6317 7.6366 7.6366 9.1834 9.1834 9.2042 9.2042 9.3352 9.3352 9.3358 9.3358 10.5877 10.5877 10.6119 10.6119 10.9395 10.9395 10.9406 10.9406 11.4000 11.4000 11.4033 11.4033 12.8719 12.8719 12.8777 12.8777 k = 0.3000 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6188 -45.6188 -45.6188 -45.6188 -30.8188 -30.8188 -30.8188 -30.8188 -22.3467 -22.3467 -22.3461 -22.3461 -21.7650 -21.7650 -21.7638 -21.7638 -21.5215 -21.5215 -21.5209 -21.5209 -11.9009 -11.9009 -11.8994 -11.8994 -10.5622 -10.5622 -10.5054 -10.5054 -10.4456 -10.4456 -10.3893 -10.3893 4.0719 4.0719 4.0742 4.0742 7.6660 7.6660 7.6706 7.6706 9.1920 9.1920 9.2124 9.2124 9.3241 9.3241 9.3257 9.3257 10.5815 10.5815 10.6057 10.6057 10.9261 10.9261 10.9269 10.9269 11.3632 11.3632 11.3669 11.3669 12.8824 12.8824 12.8871 12.8871 k = 0.3125 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8186 -30.8186 -30.8186 -30.8186 -22.3485 -22.3485 -22.3479 -22.3479 -21.7673 -21.7673 -21.7662 -21.7662 -21.5175 -21.5175 -21.5170 -21.5170 -11.9017 -11.9017 -11.9002 -11.9002 -10.5624 -10.5624 -10.5070 -10.5070 -10.4462 -10.4462 -10.3914 -10.3914 4.0711 4.0711 4.0733 4.0733 7.6993 7.6993 7.7037 7.7037 9.2009 9.2009 9.2204 9.2204 9.3144 9.3144 9.3174 9.3174 10.5725 10.5725 10.5962 10.5962 10.9170 10.9170 10.9173 10.9173 11.3277 11.3277 11.3319 11.3319 12.8878 12.8878 12.8915 12.8915 k = 0.3250 0.5000 0.2666 ( 9988 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8184 -30.8184 -30.8184 -30.8184 -22.3502 -22.3502 -22.3497 -22.3497 -21.7694 -21.7694 -21.7684 -21.7684 -21.5137 -21.5137 -21.5133 -21.5133 -11.9024 -11.9024 -11.9010 -11.9010 -10.5624 -10.5624 -10.5090 -10.5090 -10.4464 -10.4464 -10.3935 -10.3935 4.0702 4.0702 4.0724 4.0724 7.7315 7.7315 7.7356 7.7356 9.2100 9.2100 9.2279 9.2279 9.3062 9.3062 9.3111 9.3111 10.5608 10.5608 10.5838 10.5838 10.9115 10.9115 10.9119 10.9119 11.2937 11.2937 11.2983 11.2983 12.8893 12.8893 12.8920 12.8920 k = 0.3375 0.5000 0.2666 ( 9980 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8182 -30.8182 -30.8182 -30.8182 -22.3519 -22.3519 -22.3513 -22.3513 -21.7714 -21.7714 -21.7704 -21.7704 -21.5102 -21.5102 -21.5098 -21.5098 -11.9032 -11.9032 -11.9018 -11.9018 -10.5622 -10.5622 -10.5112 -10.5112 -10.4462 -10.4462 -10.3957 -10.3957 4.0693 4.0693 4.0714 4.0714 7.7624 7.7624 7.7661 7.7661 9.2188 9.2188 9.2341 9.2341 9.2999 9.2999 9.3075 9.3075 10.5471 10.5471 10.5690 10.5690 10.9090 10.9090 10.9101 10.9101 11.2614 11.2614 11.2663 11.2663 12.8877 12.8877 12.8896 12.8896 k = 0.3500 0.5000 0.2666 ( 9992 PWs) bands (ev): -45.6187 -45.6187 -45.6187 -45.6187 -30.8180 -30.8180 -30.8180 -30.8180 -22.3534 -22.3534 -22.3529 -22.3529 -21.7732 -21.7732 -21.7723 -21.7723 -21.5069 -21.5069 -21.5065 -21.5065 -11.9039 -11.9039 -11.9026 -11.9026 -10.5619 -10.5619 -10.5137 -10.5137 -10.4457 -10.4457 -10.3979 -10.3979 4.0684 4.0684 4.0704 4.0704 7.7917 7.7917 7.7951 7.7951 9.2267 9.2267 9.2383 9.2383 9.2960 9.2960 9.3071 9.3071 10.5318 10.5318 10.5526 10.5526 10.9091 10.9091 10.9107 10.9107 11.2309 11.2309 11.2361 11.2361 12.8841 12.8841 12.8854 12.8854 k = 0.3625 0.5000 0.2666 ( 10004 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8178 -30.8178 -30.8178 -30.8178 -22.3549 -22.3549 -22.3544 -22.3544 -21.7749 -21.7749 -21.7740 -21.7740 -21.5038 -21.5038 -21.5034 -21.5034 -11.9045 -11.9045 -11.9033 -11.9033 -10.5615 -10.5615 -10.5164 -10.5164 -10.4448 -10.4448 -10.4001 -10.4001 4.0675 4.0675 4.0694 4.0694 7.8193 7.8193 7.8223 7.8223 9.2327 9.2327 9.2403 9.2403 9.2953 9.2953 9.3101 9.3101 10.5157 10.5157 10.5352 10.5352 10.9109 10.9109 10.9130 10.9130 11.2025 11.2025 11.2079 11.2079 12.8791 12.8791 12.8799 12.8799 k = 0.3750 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8177 -30.8177 -30.8177 -30.8177 -22.3563 -22.3563 -22.3558 -22.3558 -21.7764 -21.7764 -21.7756 -21.7756 -21.5009 -21.5009 -21.5006 -21.5006 -11.9051 -11.9051 -11.9040 -11.9040 -10.5609 -10.5609 -10.5192 -10.5192 -10.4437 -10.4437 -10.4024 -10.4024 4.0666 4.0666 4.0683 4.0683 7.8449 7.8449 7.8476 7.8476 9.2361 9.2361 9.2401 9.2401 9.2982 9.2982 9.3159 9.3159 10.4993 10.4993 10.5175 10.5175 10.9138 10.9138 10.9161 10.9161 11.1763 11.1763 11.1819 11.1819 12.8734 12.8734 12.8738 12.8738 k = 0.3875 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8175 -30.8175 -30.8175 -30.8175 -22.3575 -22.3575 -22.3571 -22.3571 -21.7778 -21.7778 -21.7771 -21.7771 -21.4984 -21.4984 -21.4981 -21.4981 -11.9057 -11.9057 -11.9047 -11.9047 -10.5602 -10.5602 -10.5221 -10.5221 -10.4424 -10.4424 -10.4047 -10.4047 4.0658 4.0658 4.0673 4.0673 7.8685 7.8685 7.8709 7.8709 9.2369 9.2369 9.2386 9.2386 9.3045 9.3045 9.3237 9.3237 10.4832 10.4832 10.5000 10.5000 10.9172 10.9172 10.9195 10.9195 11.1526 11.1526 11.1583 11.1583 12.8675 12.8675 12.8676 12.8676 k = 0.4000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8174 -30.8174 -30.8174 -30.8174 -22.3587 -22.3587 -22.3583 -22.3583 -21.7790 -21.7790 -21.7784 -21.7784 -21.4960 -21.4960 -21.4958 -21.4958 -11.9062 -11.9062 -11.9053 -11.9053 -10.5593 -10.5593 -10.5250 -10.5250 -10.4409 -10.4409 -10.4070 -10.4070 4.0650 4.0650 4.0664 4.0664 7.8900 7.8900 7.8920 7.8920 9.2361 9.2361 9.2364 9.2364 9.3132 9.3132 9.3325 9.3325 10.4677 10.4677 10.4831 10.4831 10.9205 10.9205 10.9227 10.9227 11.1317 11.1317 11.1373 11.1373 12.8615 12.8615 12.8616 12.8616 k = 0.4125 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8173 -30.8173 -30.8173 -30.8173 -22.3597 -22.3597 -22.3594 -22.3594 -21.7801 -21.7801 -21.7795 -21.7795 -21.4940 -21.4940 -21.4937 -21.4937 -11.9067 -11.9067 -11.9059 -11.9059 -10.5582 -10.5582 -10.5279 -10.5279 -10.4393 -10.4393 -10.4093 -10.4093 4.0642 4.0642 4.0655 4.0655 7.9091 7.9091 7.9108 7.9108 9.2341 9.2341 9.2343 9.2343 9.3231 9.3231 9.3415 9.3415 10.4534 10.4534 10.4673 10.4673 10.9232 10.9232 10.9252 10.9252 11.1136 11.1136 11.1192 11.1192 12.8559 12.8559 12.8561 12.8561 k = 0.4250 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8172 -30.8172 -30.8172 -30.8172 -22.3606 -22.3606 -22.3603 -22.3603 -21.7810 -21.7810 -21.7805 -21.7805 -21.4921 -21.4921 -21.4920 -21.4920 -11.9071 -11.9071 -11.9064 -11.9064 -10.5570 -10.5570 -10.5308 -10.5308 -10.4375 -10.4375 -10.4116 -10.4116 4.0636 4.0636 4.0647 4.0647 7.9259 7.9259 7.9273 7.9273 9.2317 9.2317 9.2323 9.2323 9.3333 9.3333 9.3501 9.3501 10.4405 10.4405 10.4527 10.4527 10.9252 10.9252 10.9268 10.9268 11.0987 11.0987 11.1040 11.1040 12.8509 12.8509 12.8511 12.8511 k = 0.4375 0.5000 0.2666 ( 10012 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8171 -30.8171 -30.8171 -30.8171 -22.3614 -22.3614 -22.3611 -22.3611 -21.7817 -21.7817 -21.7813 -21.7813 -21.4906 -21.4906 -21.4904 -21.4904 -11.9074 -11.9074 -11.9068 -11.9068 -10.5556 -10.5556 -10.5337 -10.5337 -10.4356 -10.4356 -10.4139 -10.4139 4.0630 4.0630 4.0639 4.0639 7.9402 7.9402 7.9413 7.9413 9.2296 9.2296 9.2302 9.2302 9.3432 9.3432 9.3579 9.3579 10.4293 10.4293 10.4397 10.4397 10.9262 10.9262 10.9274 10.9274 11.0868 11.0868 11.0917 11.0917 12.8465 12.8465 12.8468 12.8468 k = 0.4500 0.5000 0.2666 ( 10008 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8170 -30.8170 -30.8170 -30.8170 -22.3620 -22.3620 -22.3618 -22.3618 -21.7823 -21.7823 -21.7820 -21.7820 -21.4893 -21.4893 -21.4892 -21.4892 -11.9077 -11.9077 -11.9072 -11.9072 -10.5541 -10.5541 -10.5364 -10.5364 -10.4337 -10.4337 -10.4162 -10.4162 4.0625 4.0625 4.0633 4.0633 7.9520 7.9520 7.9529 7.9529 9.2279 9.2279 9.2284 9.2284 9.3523 9.3523 9.3645 9.3645 10.4200 10.4200 10.4286 10.4286 10.9263 10.9263 10.9273 10.9273 11.0780 11.0780 11.0821 11.0821 12.8429 12.8429 12.8432 12.8432 k = 0.4625 0.5000 0.2666 ( 9992 PWs) bands (ev): -45.6186 -45.6186 -45.6186 -45.6186 -30.8170 -30.8170 -30.8170 -30.8170 -22.3625 -22.3625 -22.3623 -22.3623 -21.7828 -21.7828 -21.7826 -21.7826 -21.4884 -21.4884 -21.4883 -21.4883 -11.9079 -11.9079 -11.9075 -11.9075 -10.5524 -10.5524 -10.5391 -10.5391 -10.4316 -10.4316 -10.4185 -10.4185 4.0622 4.0622 4.0627 4.0627 7.9612 7.9612 7.9619 7.9619 9.2265 9.2265 9.2269 9.2269 9.3601 9.3601 9.3696 9.3696 10.4129 10.4129 10.4194 10.4194 10.9259 10.9259 10.9266 10.9266 11.0718 11.0718 11.0751 11.0751 12.8402 12.8402 12.8404 12.8404 k = 0.4750 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3628 -22.3628 -22.3627 -22.3627 -21.7831 -21.7831 -21.7830 -21.7830 -21.4876 -21.4876 -21.4876 -21.4876 -11.9080 -11.9080 -11.9077 -11.9077 -10.5505 -10.5505 -10.5416 -10.5416 -10.4295 -10.4295 -10.4207 -10.4207 4.0619 4.0619 4.0623 4.0623 7.9679 7.9679 7.9683 7.9683 9.2255 9.2255 9.2258 9.2258 9.3665 9.3665 9.3729 9.3729 10.4080 10.4080 10.4124 10.4124 10.9253 10.9253 10.9256 10.9256 11.0679 11.0679 11.0702 11.0702 12.8382 12.8382 12.8384 12.8384 k = 0.4875 0.5000 0.2666 ( 9996 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3630 -22.3630 -22.3630 -22.3630 -21.7833 -21.7833 -21.7832 -21.7832 -21.4872 -21.4872 -21.4872 -21.4872 -11.9080 -11.9080 -11.9079 -11.9079 -10.5485 -10.5485 -10.5441 -10.5441 -10.4274 -10.4274 -10.4230 -10.4230 4.0618 4.0618 4.0620 4.0620 7.9719 7.9719 7.9721 7.9721 9.2249 9.2249 9.2251 9.2251 9.3710 9.3710 9.3743 9.3743 10.4055 10.4055 10.4077 10.4077 10.9247 10.9247 10.9249 10.9249 11.0660 11.0660 11.0672 11.0672 12.8371 12.8371 12.8371 12.8371 k = 0.5000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4252 -10.4252 -10.4252 -10.4252 4.0619 4.0619 4.0619 4.0619 7.9733 7.9733 7.9733 7.9733 9.2248 9.2248 9.2248 9.2248 9.3737 9.3737 9.3737 9.3737 10.4054 10.4054 10.4054 10.4054 10.9246 10.9246 10.9246 10.9246 11.0658 11.0658 11.0658 11.0658 12.8367 12.8367 12.8367 12.8367 k = 0.5000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4252 -10.4252 -10.4252 -10.4252 4.0619 4.0619 4.0619 4.0619 7.9733 7.9733 7.9733 7.9733 9.2248 9.2248 9.2248 9.2248 9.3737 9.3737 9.3737 9.3737 10.4054 10.4054 10.4054 10.4054 10.9246 10.9246 10.9246 10.9246 11.0658 11.0658 11.0658 11.0658 12.8367 12.8367 12.8367 12.8367 k = 0.4911 0.4911 0.2666 ( 9996 PWs) bands (ev): -45.6186 -45.6186 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3629 -22.3629 -21.7833 -21.7833 -21.7832 -21.7832 -21.4873 -21.4873 -21.4871 -21.4871 -11.9080 -11.9080 -11.9079 -11.9079 -10.5485 -10.5485 -10.5441 -10.5441 -10.4274 -10.4274 -10.4230 -10.4230 4.0618 4.0618 4.0620 4.0620 7.9695 7.9695 7.9745 7.9745 9.2228 9.2228 9.2272 9.2272 9.3708 9.3708 9.3745 9.3745 10.4055 10.4055 10.4078 10.4078 10.9235 10.9235 10.9261 10.9261 11.0657 11.0657 11.0675 11.0675 12.8367 12.8367 12.8375 12.8375 k = 0.4821 0.4821 0.2666 ( 9992 PWs) bands (ev): -45.6187 -45.6187 -45.6184 -45.6184 -30.8170 -30.8170 -30.8169 -30.8169 -22.3631 -22.3631 -22.3624 -22.3624 -21.7832 -21.7832 -21.7829 -21.7829 -21.4881 -21.4881 -21.4871 -21.4871 -11.9081 -11.9081 -11.9076 -11.9076 -10.5506 -10.5506 -10.5416 -10.5416 -10.4296 -10.4296 -10.4207 -10.4207 4.0619 4.0619 4.0623 4.0623 7.9582 7.9582 7.9780 7.9780 9.2165 9.2165 9.2343 9.2343 9.3650 9.3650 9.3744 9.3744 10.4081 10.4081 10.4126 10.4126 10.9204 10.9204 10.9308 10.9308 11.0662 11.0662 11.0718 11.0718 12.8366 12.8366 12.8401 12.8401 k = 0.4732 0.4732 0.2666 ( 9992 PWs) bands (ev): -45.6189 -45.6189 -45.6182 -45.6182 -30.8171 -30.8171 -30.8169 -30.8169 -22.3632 -22.3632 -22.3616 -22.3616 -21.7831 -21.7831 -21.7823 -21.7823 -21.4895 -21.4895 -21.4872 -21.4872 -11.9081 -11.9081 -11.9072 -11.9072 -10.5524 -10.5524 -10.5390 -10.5390 -10.4317 -10.4317 -10.4184 -10.4184 4.0620 4.0620 4.0628 4.0628 7.9400 7.9400 7.9839 7.9839 9.2056 9.2056 9.2452 9.2452 9.3568 9.3568 9.3739 9.3739 10.4131 10.4131 10.4198 10.4198 10.9153 10.9153 10.9386 10.9386 11.0669 11.0669 11.0788 11.0788 12.8367 12.8367 12.8443 12.8443 k = 0.4643 0.4643 0.2666 ( 9992 PWs) bands (ev): -45.6192 -45.6192 -45.6179 -45.6179 -30.8172 -30.8172 -30.8168 -30.8168 -22.3632 -22.3632 -22.3605 -22.3605 -21.7828 -21.7828 -21.7815 -21.7815 -21.4913 -21.4913 -21.4873 -21.4873 -11.9081 -11.9081 -11.9067 -11.9067 -10.5541 -10.5541 -10.5363 -10.5363 -10.4338 -10.4338 -10.4161 -10.4161 4.0622 4.0622 4.0632 4.0632 7.9160 7.9160 7.9921 7.9921 9.1894 9.1894 9.2588 9.2588 9.3470 9.3470 9.3731 9.3731 10.4204 10.4204 10.4294 10.4294 10.9084 10.9084 10.9496 10.9496 11.0679 11.0679 11.0884 11.0884 12.8371 12.8371 12.8502 12.8502 k = 0.4554 0.4554 0.2666 ( 10004 PWs) bands (ev): -45.6196 -45.6196 -45.6176 -45.6176 -30.8174 -30.8174 -30.8168 -30.8168 -22.3633 -22.3633 -22.3591 -22.3591 -21.7825 -21.7825 -21.7804 -21.7804 -21.4937 -21.4937 -21.4875 -21.4875 -11.9082 -11.9082 -11.9060 -11.9060 -10.5557 -10.5557 -10.5335 -10.5335 -10.4358 -10.4358 -10.4137 -10.4137 4.0622 4.0622 4.0636 4.0636 7.8872 7.8872 8.0027 8.0027 9.1673 9.1673 9.2735 9.2735 9.3375 9.3375 9.3721 9.3721 10.4299 10.4299 10.4411 10.4411 10.9000 10.9000 10.9636 10.9636 11.0692 11.0692 11.1002 11.1002 12.8380 12.8380 12.8577 12.8577 k = 0.4464 0.4464 0.2666 ( 10006 PWs) bands (ev): -45.6200 -45.6200 -45.6171 -45.6171 -30.8177 -30.8177 -30.8167 -30.8167 -22.3634 -22.3634 -22.3574 -22.3574 -21.7822 -21.7822 -21.7792 -21.7792 -21.4966 -21.4966 -21.4876 -21.4876 -11.9082 -11.9082 -11.9051 -11.9051 -10.5570 -10.5570 -10.5306 -10.5306 -10.4378 -10.4378 -10.4114 -10.4114 4.0621 4.0621 4.0639 4.0639 7.8547 7.8547 8.0155 8.0155 9.1389 9.1389 9.2867 9.2867 9.3305 9.3305 9.3710 9.3710 10.4413 10.4413 10.4548 10.4548 10.8903 10.8903 10.9808 10.9808 11.0706 11.0706 11.1141 11.1141 12.8399 12.8399 12.8669 12.8669 k = 0.4375 0.4375 0.2666 ( 10000 PWs) bands (ev): -45.6205 -45.6205 -45.6166 -45.6166 -30.8180 -30.8180 -30.8167 -30.8167 -22.3636 -22.3636 -22.3555 -22.3555 -21.7818 -21.7818 -21.7777 -21.7777 -21.5000 -21.5000 -21.4878 -21.4878 -11.9083 -11.9083 -11.9041 -11.9041 -10.5582 -10.5582 -10.5276 -10.5276 -10.4396 -10.4396 -10.4090 -10.4090 4.0618 4.0618 4.0638 4.0638 7.8199 7.8199 8.0306 8.0306 9.1044 9.1044 9.2940 9.2940 9.3297 9.3297 9.3701 9.3701 10.4543 10.4543 10.4703 10.4703 10.8799 10.8799 11.0010 11.0010 11.0723 11.0723 11.1298 11.1298 12.8430 12.8430 12.8777 12.8777 k = 0.4286 0.4286 0.2666 ( 9988 PWs) bands (ev): -45.6211 -45.6211 -45.6161 -45.6161 -30.8183 -30.8183 -30.8166 -30.8166 -22.3637 -22.3637 -22.3532 -22.3532 -21.7813 -21.7813 -21.7759 -21.7759 -21.5038 -21.5038 -21.4881 -21.4881 -11.9084 -11.9084 -11.9029 -11.9029 -10.5592 -10.5592 -10.5245 -10.5245 -10.4414 -10.4414 -10.4066 -10.4066 4.0611 4.0611 4.0632 4.0632 7.7838 7.7838 8.0479 8.0479 9.0644 9.0644 9.2936 9.2936 9.3358 9.3358 9.3696 9.3696 10.4684 10.4684 10.4872 10.4872 10.8691 10.8691 11.0243 11.0243 11.0740 11.0740 11.1472 11.1472 12.8478 12.8478 12.8900 12.8900 k = 0.4196 0.4196 0.2666 ( 9992 PWs) bands (ev): -45.6218 -45.6218 -45.6154 -45.6154 -30.8187 -30.8187 -30.8165 -30.8165 -22.3639 -22.3639 -22.3507 -22.3507 -21.7808 -21.7808 -21.7739 -21.7739 -21.5081 -21.5081 -21.4883 -21.4883 -11.9085 -11.9085 -11.9015 -11.9015 -10.5600 -10.5600 -10.5214 -10.5214 -10.4432 -10.4432 -10.4043 -10.4043 4.0600 4.0600 4.0619 4.0619 7.7475 7.7475 8.0674 8.0674 9.0196 9.0196 9.2901 9.2901 9.3430 9.3430 9.3701 9.3701 10.4831 10.4831 10.5051 10.5051 10.8587 10.8587 11.0506 11.0506 11.0758 11.0758 11.1660 11.1660 12.8546 12.8546 12.9039 12.9039 k = 0.4107 0.4107 0.2666 ( 9996 PWs) bands (ev): -45.6225 -45.6225 -45.6147 -45.6147 -30.8191 -30.8191 -30.8164 -30.8164 -22.3642 -22.3642 -22.3480 -22.3480 -21.7802 -21.7802 -21.7717 -21.7717 -21.5129 -21.5129 -21.4886 -21.4886 -11.9086 -11.9086 -11.9001 -11.9001 -10.5606 -10.5606 -10.5182 -10.5182 -10.4448 -10.4448 -10.4019 -10.4019 4.0582 4.0582 4.0596 4.0596 7.7120 7.7120 8.0891 8.0891 8.9710 8.9710 9.2863 9.2863 9.3473 9.3473 9.3717 9.3717 10.4977 10.4977 10.5237 10.5237 10.8491 10.8491 11.0774 11.0774 11.0801 11.0801 11.1863 11.1863 12.8638 12.8638 12.9194 12.9194 k = 0.4018 0.4018 0.2666 ( 9996 PWs) bands (ev): -45.6234 -45.6234 -45.6140 -45.6140 -30.8195 -30.8195 -30.8163 -30.8163 -22.3644 -22.3644 -22.3451 -22.3451 -21.7796 -21.7796 -21.7692 -21.7692 -21.5180 -21.5180 -21.4889 -21.4889 -11.9086 -11.9086 -11.8984 -11.8984 -10.5610 -10.5610 -10.5151 -10.5151 -10.4463 -10.4463 -10.3995 -10.3995 4.0556 4.0556 4.0563 4.0563 7.6780 7.6780 8.1129 8.1129 8.9197 8.9197 9.2835 9.2835 9.3485 9.3485 9.3731 9.3731 10.5115 10.5115 10.5424 10.5424 10.8411 10.8411 11.0791 11.0791 11.1123 11.1123 11.2079 11.2079 12.8758 12.8758 12.9362 12.9362 k = 0.3929 0.3929 0.2666 ( 9990 PWs) bands (ev): -45.6242 -45.6242 -45.6131 -45.6131 -30.8200 -30.8200 -30.8162 -30.8162 -22.3648 -22.3648 -22.3419 -22.3419 -21.7789 -21.7789 -21.7665 -21.7665 -21.5236 -21.5236 -21.4891 -21.4891 -11.9087 -11.9087 -11.8967 -11.8967 -10.5612 -10.5612 -10.5119 -10.5119 -10.4476 -10.4476 -10.3972 -10.3972 4.0515 4.0515 4.0522 4.0522 7.6464 7.6464 8.1387 8.1387 8.8664 8.8664 9.2819 9.2819 9.3474 9.3474 9.3726 9.3726 10.5238 10.5238 10.5609 10.5609 10.8352 10.8352 11.0805 11.0805 11.1476 11.1476 11.2310 11.2310 12.8909 12.8909 12.9545 12.9545 k = 0.3839 0.3839 0.2666 ( 9990 PWs) bands (ev): -45.6252 -45.6252 -45.6122 -45.6122 -30.8205 -30.8205 -30.8161 -30.8161 -22.3651 -22.3651 -22.3386 -22.3386 -21.7782 -21.7782 -21.7636 -21.7636 -21.5295 -21.5295 -21.4894 -21.4894 -11.9088 -11.9088 -11.8948 -11.8948 -10.5613 -10.5613 -10.5087 -10.5087 -10.4488 -10.4488 -10.3949 -10.3949 4.0452 4.0452 4.0476 4.0476 7.6177 7.6177 8.1666 8.1666 8.8119 8.8119 9.2816 9.2816 9.3446 9.3446 9.3694 9.3694 10.5341 10.5341 10.5786 10.5786 10.8318 10.8318 11.0816 11.0816 11.1858 11.1858 11.2557 11.2557 12.9094 12.9094 12.9740 12.9740 k = 0.3750 0.3750 0.2666 ( 9986 PWs) bands (ev): -45.6262 -45.6262 -45.6112 -45.6112 -30.8210 -30.8210 -30.8160 -30.8160 -22.3655 -22.3655 -22.3352 -22.3352 -21.7775 -21.7775 -21.7604 -21.7604 -21.5358 -21.5358 -21.4897 -21.4897 -11.9089 -11.9089 -11.8927 -11.8927 -10.5611 -10.5611 -10.5057 -10.5057 -10.4498 -10.4498 -10.3926 -10.3926 4.0371 4.0371 4.0418 4.0418 7.5926 7.5926 8.1965 8.1965 8.7572 8.7572 9.2825 9.2825 9.3396 9.3396 9.3640 9.3640 10.5422 10.5422 10.5953 10.5953 10.8309 10.8309 11.0823 11.0823 11.2267 11.2267 11.2820 11.2820 12.9315 12.9315 12.9946 12.9946 k = 0.3661 0.3661 0.2666 ( 9988 PWs) bands (ev): -45.6272 -45.6272 -45.6102 -45.6102 -30.8216 -30.8216 -30.8158 -30.8158 -22.3660 -22.3660 -22.3316 -22.3316 -21.7767 -21.7767 -21.7570 -21.7570 -21.5424 -21.5424 -21.4900 -21.4900 -11.9091 -11.9091 -11.8906 -11.8906 -10.5608 -10.5608 -10.5027 -10.5027 -10.4506 -10.4506 -10.3903 -10.3903 4.0270 4.0270 4.0345 4.0345 7.5715 7.5715 8.2282 8.2282 8.7027 8.7027 9.2840 9.2840 9.3312 9.3312 9.3586 9.3586 10.5482 10.5482 10.6105 10.6105 10.8323 10.8323 11.0825 11.0825 11.2704 11.2704 11.3100 11.3100 12.9574 12.9574 13.0164 13.0164 k = 0.3571 0.3571 0.2666 ( 9988 PWs) bands (ev): -45.6284 -45.6284 -45.6092 -45.6092 -30.8222 -30.8222 -30.8157 -30.8157 -22.3665 -22.3665 -22.3279 -22.3279 -21.7760 -21.7760 -21.7533 -21.7533 -21.5492 -21.5492 -21.4903 -21.4903 -11.9092 -11.9092 -11.8883 -11.8883 -10.5602 -10.5602 -10.4999 -10.4999 -10.4511 -10.4511 -10.3881 -10.3881 4.0148 4.0148 4.0257 4.0257 7.5547 7.5547 8.2618 8.2618 8.6492 8.6492 9.2833 9.2833 9.3204 9.3204 9.3548 9.3548 10.5524 10.5524 10.6238 10.6238 10.8355 10.8355 11.0821 11.0821 11.3167 11.3167 11.3400 11.3400 12.9873 12.9873 13.0389 13.0389 k = 0.3482 0.3482 0.2666 ( 9984 PWs) bands (ev): -45.6295 -45.6295 -45.6080 -45.6080 -30.8228 -30.8228 -30.8155 -30.8155 -22.3670 -22.3670 -22.3241 -22.3241 -21.7752 -21.7752 -21.7494 -21.7494 -21.5563 -21.5563 -21.4905 -21.4905 -11.9092 -11.9092 -11.8859 -11.8859 -10.5595 -10.5595 -10.4973 -10.4973 -10.4512 -10.4512 -10.3859 -10.3859 4.0003 4.0003 4.0152 4.0152 7.5425 7.5425 8.2972 8.2972 8.5972 8.5972 9.2729 9.2729 9.3152 9.3152 9.3530 9.3530 10.5556 10.5556 10.6351 10.6351 10.8396 10.8396 11.0809 11.0809 11.3654 11.3654 11.3722 11.3722 13.0210 13.0210 13.0618 13.0618 k = 0.3393 0.3393 0.2666 ( 9982 PWs) bands (ev): -45.6307 -45.6307 -45.6069 -45.6069 -30.8235 -30.8235 -30.8154 -30.8154 -22.3676 -22.3676 -22.3202 -22.3202 -21.7744 -21.7744 -21.7453 -21.7453 -21.5636 -21.5636 -21.4908 -21.4908 -11.9093 -11.9093 -11.8834 -11.8834 -10.5586 -10.5586 -10.4950 -10.4950 -10.4510 -10.4510 -10.3837 -10.3837 3.9833 3.9833 4.0029 4.0029 7.5350 7.5350 8.3342 8.3342 8.5473 8.5473 9.2501 9.2501 9.3187 9.3187 9.3531 9.3531 10.5583 10.5583 10.6441 10.6441 10.8439 10.8439 11.0790 11.0790 11.4060 11.4060 11.4169 11.4169 13.0585 13.0585 13.0780 13.0780 k = 0.3304 0.3304 0.2666 ( 9982 PWs) bands (ev): -45.6320 -45.6320 -45.6057 -45.6057 -30.8242 -30.8242 -30.8152 -30.8152 -22.3683 -22.3683 -22.3164 -22.3164 -21.7736 -21.7736 -21.7409 -21.7409 -21.5711 -21.5711 -21.4909 -21.4909 -11.9094 -11.9094 -11.8808 -11.8808 -10.5575 -10.5575 -10.4930 -10.4930 -10.4504 -10.4504 -10.3816 -10.3816 3.9639 3.9639 3.9885 3.9885 7.5323 7.5323 8.3725 8.3725 8.5001 8.5001 9.2201 9.2201 9.3259 9.3259 9.3557 9.3557 10.5610 10.5610 10.6508 10.6508 10.8478 10.8478 11.0760 11.0760 11.4423 11.4423 11.4703 11.4703 13.0185 13.0185 13.1001 13.1004 k = 0.3214 0.3214 0.2666 ( 9982 PWs) bands (ev): -45.6333 -45.6333 -45.6044 -45.6044 -30.8249 -30.8249 -30.8151 -30.8151 -22.3691 -22.3691 -22.3125 -22.3125 -21.7728 -21.7728 -21.7364 -21.7364 -21.5787 -21.5787 -21.4911 -21.4911 -11.9095 -11.9095 -11.8781 -11.8781 -10.5562 -10.5562 -10.4914 -10.4914 -10.4493 -10.4493 -10.3796 -10.3796 3.9421 3.9421 3.9721 3.9721 7.5343 7.5343 8.4093 8.4093 8.4587 8.4587 9.1856 9.1856 9.3326 9.3326 9.3629 9.3629 10.5642 10.5642 10.6553 10.6553 10.8506 10.8506 11.0721 11.0721 11.4808 11.4808 11.5256 11.5256 12.9571 12.9571 13.1320 13.1320 k = 0.3125 0.3125 0.2666 ( 9988 PWs) bands (ev): -45.6346 -45.6346 -45.6032 -45.6032 -30.8256 -30.8256 -30.8149 -30.8149 -22.3699 -22.3699 -22.3086 -22.3086 -21.7721 -21.7721 -21.7316 -21.7316 -21.5863 -21.5863 -21.4912 -21.4912 -11.9096 -11.9096 -11.8753 -11.8753 -10.5547 -10.5547 -10.4901 -10.4901 -10.4478 -10.4478 -10.3776 -10.3776 3.9178 3.9178 3.9536 3.9536 7.5408 7.5408 8.4052 8.4052 8.4629 8.4629 9.1481 9.1481 9.3371 9.3371 9.3759 9.3759 10.5682 10.5682 10.6577 10.6577 10.8520 10.8520 11.0671 11.0671 11.5212 11.5212 11.5828 11.5828 12.8980 12.8980 13.1531 13.1531 k = 0.3036 0.3036 0.2666 ( 9992 PWs) bands (ev): -45.6360 -45.6360 -45.6018 -45.6018 -30.8263 -30.8263 -30.8148 -30.8148 -22.3708 -22.3708 -22.3047 -22.3047 -21.7714 -21.7714 -21.7267 -21.7267 -21.5941 -21.5941 -21.4912 -21.4912 -11.9097 -11.9097 -11.8724 -11.8724 -10.5531 -10.5531 -10.4892 -10.4892 -10.4458 -10.4458 -10.3756 -10.3756 3.8911 3.8911 3.9329 3.9329 7.5514 7.5514 8.3688 8.3688 8.5040 8.5040 9.1087 9.1087 9.3402 9.3402 9.3938 9.3938 10.5732 10.5732 10.6581 10.6581 10.8516 10.8516 11.0608 11.0608 11.5637 11.5637 11.6414 11.6414 12.8411 12.8411 13.1721 13.1721 k = 0.2946 0.2946 0.2666 ( 9992 PWs) bands (ev): -45.6374 -45.6374 -45.6005 -45.6005 -30.8271 -30.8271 -30.8146 -30.8146 -22.3718 -22.3718 -22.3009 -22.3009 -21.7708 -21.7708 -21.7216 -21.7216 -21.6018 -21.6018 -21.4911 -21.4911 -11.9097 -11.9097 -11.8694 -11.8694 -10.5514 -10.5514 -10.4887 -10.4887 -10.4434 -10.4434 -10.3738 -10.3738 3.8622 3.8622 3.9101 3.9101 7.5657 7.5657 8.3334 8.3334 8.5490 8.5490 9.0685 9.0685 9.3428 9.3428 9.4155 9.4155 10.5791 10.5791 10.6568 10.6568 10.8495 10.8495 11.0534 11.0534 11.6080 11.6080 11.7012 11.7012 12.7866 12.7866 13.1884 13.1884 k = 0.2857 0.2857 0.2666 ( 10004 PWs) bands (ev): -45.6388 -45.6388 -45.5992 -45.5992 -30.8278 -30.8278 -30.8144 -30.8144 -22.3729 -22.3729 -22.2971 -22.2971 -21.7702 -21.7702 -21.7164 -21.7164 -21.6095 -21.6095 -21.4910 -21.4910 -11.9098 -11.9098 -11.8664 -11.8664 -10.5495 -10.5495 -10.4885 -10.4885 -10.4406 -10.4406 -10.3720 -10.3720 3.8312 3.8312 3.8851 3.8851 7.5830 7.5830 8.3008 8.3008 8.5960 8.5960 9.0284 9.0284 9.3456 9.3456 9.4405 9.4405 10.5860 10.5860 10.6541 10.6541 10.8456 10.8456 11.0446 11.0446 11.6540 11.6540 11.7617 11.7617 12.7344 12.7344 13.2017 13.2017 k = 0.2768 0.2768 0.2666 ( 10004 PWs) bands (ev): -45.6402 -45.6402 -45.5978 -45.5978 -30.8286 -30.8286 -30.8143 -30.8143 -22.3741 -22.3741 -22.2935 -22.2935 -21.7698 -21.7698 -21.7111 -21.7111 -21.6172 -21.6172 -21.4907 -21.4907 -11.9098 -11.9098 -11.8633 -11.8633 -10.5474 -10.5474 -10.4884 -10.4884 -10.4375 -10.4375 -10.3703 -10.3703 3.7982 3.7982 3.8580 3.8580 7.6026 7.6026 8.2714 8.2714 8.6447 8.6447 8.9896 8.9896 9.3489 9.3489 9.4686 9.4686 10.5938 10.5938 10.6503 10.6503 10.8399 10.8399 11.0345 11.0345 11.7017 11.7017 11.8224 11.8224 12.6845 12.6845 13.2123 13.2123 k = 0.2679 0.2679 0.2666 ( 10002 PWs) bands (ev): -45.6416 -45.6416 -45.5964 -45.5964 -30.8294 -30.8294 -30.8141 -30.8141 -22.3753 -22.3753 -22.2899 -22.2899 -21.7694 -21.7694 -21.7057 -21.7057 -21.6247 -21.6247 -21.4904 -21.4904 -11.9098 -11.9098 -11.8602 -11.8602 -10.5453 -10.5453 -10.4886 -10.4886 -10.4342 -10.4342 -10.3687 -10.3687 3.7635 3.7635 3.8289 3.8289 7.6234 7.6234 8.2451 8.2451 8.6949 8.6949 8.9533 8.9533 9.3528 9.3528 9.4995 9.4995 10.6023 10.6023 10.6457 10.6457 10.8328 10.8328 11.0231 11.0231 11.7508 11.7508 11.8829 11.8829 12.6371 12.6371 13.2196 13.2196 k = 0.2589 0.2589 0.2666 ( 9990 PWs) bands (ev): -45.6431 -45.6431 -45.5950 -45.5950 -30.8302 -30.8302 -30.8139 -30.8139 -22.3766 -22.3766 -22.2864 -22.2864 -21.7692 -21.7692 -21.7002 -21.7002 -21.6320 -21.6320 -21.4899 -21.4899 -11.9098 -11.9098 -11.8571 -11.8571 -10.5430 -10.5430 -10.4889 -10.4889 -10.4307 -10.4307 -10.3671 -10.3671 3.7272 3.7272 3.7979 3.7979 7.6444 7.6444 8.2220 8.2220 8.7466 8.7466 8.9208 8.9208 9.3574 9.3574 9.5333 9.5333 10.6112 10.6112 10.6408 10.6408 10.8245 10.8245 11.0103 11.0103 11.8012 11.8012 11.9424 11.9424 12.5921 12.5921 13.2186 13.2187 k = 0.2500 0.2500 0.2666 ( 9992 PWs) bands (ev): -45.6446 -45.6446 -45.5936 -45.5936 -30.8310 -30.8310 -30.8137 -30.8137 -22.3780 -22.3780 -22.2830 -22.2830 -21.7691 -21.7691 -21.6947 -21.6947 -21.6391 -21.6391 -21.4893 -21.4893 -11.9098 -11.9098 -11.8539 -11.8539 -10.5406 -10.5406 -10.4893 -10.4893 -10.4270 -10.4270 -10.3657 -10.3657 3.6897 3.6897 3.7652 3.7652 7.6642 7.6642 8.2018 8.2018 8.7997 8.7997 8.8935 8.8935 9.3628 9.3628 9.5698 9.5698 10.6196 10.6196 10.6361 10.6361 10.8156 10.8156 10.9963 10.9963 11.8528 11.8528 12.0002 12.0002 12.5497 12.5497 13.2101 13.2101 k = 0.2411 0.2411 0.2666 ( 10000 PWs) bands (ev): -45.6460 -45.6460 -45.5922 -45.5922 -30.8318 -30.8318 -30.8136 -30.8136 -22.3795 -22.3795 -22.2798 -22.2798 -21.7692 -21.7692 -21.6892 -21.6892 -21.6459 -21.6459 -21.4886 -21.4886 -11.9098 -11.9098 -11.8507 -11.8507 -10.5381 -10.5381 -10.4898 -10.4898 -10.4233 -10.4233 -10.3643 -10.3643 3.6512 3.6512 3.7310 3.7310 7.6815 7.6815 8.1844 8.1844 8.8523 8.8523 8.8747 8.8747 9.3690 9.3690 9.6089 9.6089 10.6247 10.6247 10.6345 10.6345 10.8067 10.8067 10.9809 10.9809 11.9054 11.9054 12.0554 12.0554 12.5099 12.5099 13.2006 13.2006 k = 0.2321 0.2321 0.2666 ( 10004 PWs) bands (ev): -45.6475 -45.6475 -45.5908 -45.5908 -30.8326 -30.8326 -30.8134 -30.8134 -22.3810 -22.3810 -22.2766 -22.2766 -21.7695 -21.7695 -21.6837 -21.6837 -21.6524 -21.6524 -21.4877 -21.4877 -11.9098 -11.9098 -11.8474 -11.8474 -10.5356 -10.5356 -10.4903 -10.4903 -10.4194 -10.4194 -10.3631 -10.3631 3.6119 3.6119 3.6953 3.6953 7.6950 7.6950 8.1697 8.1697 8.8576 8.8576 8.9124 8.9124 9.3761 9.3761 9.6507 9.6507 10.6225 10.6225 10.6391 10.6391 10.7989 10.7989 10.9644 10.9644 11.9589 11.9589 12.1069 12.1069 12.4730 12.4730 13.1913 13.1913 k = 0.2232 0.2232 0.2666 ( 9994 PWs) bands (ev): -45.6489 -45.6489 -45.5894 -45.5894 -30.8333 -30.8333 -30.8132 -30.8132 -22.3826 -22.3826 -22.2737 -22.2737 -21.7701 -21.7701 -21.6783 -21.6783 -21.6585 -21.6585 -21.4866 -21.4866 -11.9098 -11.9098 -11.8442 -11.8442 -10.5329 -10.5329 -10.4908 -10.4908 -10.4156 -10.4156 -10.3619 -10.3619 3.5720 3.5720 3.6586 3.6586 7.7034 7.7034 8.1574 8.1574 8.8535 8.8535 8.9696 8.9696 9.3840 9.3840 9.6948 9.6948 10.6186 10.6186 10.6437 10.6437 10.7935 10.7935 10.9467 10.9467 12.0132 12.0132 12.1536 12.1536 12.4389 12.4389 13.1827 13.1827 k = 0.2143 0.2143 0.2666 ( 9998 PWs) bands (ev): -45.6503 -45.6503 -45.5880 -45.5880 -30.8341 -30.8341 -30.8130 -30.8130 -22.3843 -22.3843 -22.2708 -22.2708 -21.7709 -21.7709 -21.6730 -21.6730 -21.6642 -21.6642 -21.4854 -21.4854 -11.9097 -11.9097 -11.8410 -11.8410 -10.5303 -10.5303 -10.4913 -10.4913 -10.4117 -10.4117 -10.3608 -10.3608 3.5319 3.5319 3.6209 3.6209 7.7061 7.7061 8.1473 8.1473 8.8585 8.8585 9.0287 9.0287 9.3928 9.3928 9.7412 9.7412 10.6150 10.6150 10.6449 10.6449 10.7918 10.7918 10.9279 10.9279 12.0681 12.0681 12.1942 12.1942 12.4079 12.4079 13.1749 13.1749 k = 0.2054 0.2054 0.2666 ( 9990 PWs) bands (ev): -45.6517 -45.6517 -45.5867 -45.5867 -30.8349 -30.8349 -30.8129 -30.8129 -22.3861 -22.3861 -22.2681 -22.2681 -21.7719 -21.7719 -21.6695 -21.6695 -21.6678 -21.6678 -21.4839 -21.4839 -11.9096 -11.9096 -11.8378 -11.8378 -10.5276 -10.5276 -10.4918 -10.4918 -10.4078 -10.4078 -10.3599 -10.3599 3.4917 3.4917 3.5825 3.5825 7.7024 7.7024 8.1392 8.1392 8.8730 8.8730 9.0893 9.0893 9.4025 9.4025 9.7897 9.7897 10.6122 10.6122 10.6418 10.6418 10.7950 10.7950 10.9082 10.9082 12.1234 12.1234 12.2274 12.2274 12.3802 12.3802 13.1682 13.1682 k = 0.1964 0.1964 0.2666 ( 9994 PWs) bands (ev): -45.6531 -45.6531 -45.5853 -45.5853 -30.8356 -30.8356 -30.8127 -30.8127 -22.3879 -22.3879 -22.2656 -22.2656 -21.7733 -21.7733 -21.6743 -21.6743 -21.6628 -21.6628 -21.4823 -21.4823 -11.9096 -11.9096 -11.8347 -11.8347 -10.5250 -10.5250 -10.4922 -10.4922 -10.4039 -10.4039 -10.3590 -10.3590 3.4516 3.4516 3.5436 3.5436 7.6925 7.6925 8.1327 8.1327 8.8967 8.8967 9.1514 9.1514 9.4131 9.4131 9.8399 9.8399 10.6104 10.6104 10.6343 10.6343 10.8033 10.8033 10.8875 10.8875 12.1788 12.1788 12.2518 12.2518 12.3563 12.3563 13.1628 13.1628 k = 0.1875 0.1875 0.2666 ( 10002 PWs) bands (ev): -45.6545 -45.6545 -45.5840 -45.5840 -30.8364 -30.8364 -30.8125 -30.8125 -22.3897 -22.3897 -22.2632 -22.2632 -21.7749 -21.7749 -21.6786 -21.6786 -21.6580 -21.6580 -21.4805 -21.4805 -11.9095 -11.9095 -11.8316 -11.8316 -10.5223 -10.5223 -10.4926 -10.4926 -10.4000 -10.4000 -10.3582 -10.3582 3.4119 3.4119 3.5046 3.5046 7.6769 7.6769 8.1277 8.1277 8.9288 8.9288 9.2149 9.2149 9.4246 9.4246 9.8917 9.8917 10.6092 10.6092 10.6238 10.6238 10.8160 10.8160 10.8660 10.8660 12.2331 12.2331 12.2665 12.2665 12.3371 12.3371 13.1587 13.1587 k = 0.1786 0.1786 0.2666 ( 10002 PWs) bands (ev): -45.6558 -45.6558 -45.5827 -45.5827 -30.8371 -30.8371 -30.8124 -30.8124 -22.3916 -22.3916 -22.2610 -22.2610 -21.7768 -21.7768 -21.6823 -21.6823 -21.6534 -21.6534 -21.4785 -21.4785 -11.9094 -11.9094 -11.8285 -11.8285 -10.5198 -10.5198 -10.4928 -10.4928 -10.3962 -10.3962 -10.3575 -10.3575 3.3728 3.3728 3.4656 3.4656 7.6564 7.6564 8.1240 8.1240 8.9680 8.9680 9.2800 9.2800 9.4370 9.4370 9.9446 9.9446 10.6039 10.6039 10.6162 10.6162 10.8322 10.8322 10.8439 10.8439 12.2691 12.2691 12.2816 12.2816 12.3291 12.3291 13.1559 13.1559 k = 0.1696 0.1696 0.2666 ( 9998 PWs) bands (ev): -45.6571 -45.6571 -45.5815 -45.5815 -30.8378 -30.8378 -30.8122 -30.8122 -22.3935 -22.3935 -22.2589 -22.2589 -21.7789 -21.7789 -21.6856 -21.6856 -21.6491 -21.6491 -21.4764 -21.4764 -11.9093 -11.9093 -11.8255 -11.8255 -10.5173 -10.5173 -10.4930 -10.4930 -10.3925 -10.3925 -10.3570 -10.3570 3.3345 3.3345 3.4269 3.4269 7.6319 7.6319 8.1214 8.1214 9.0131 9.0131 9.3464 9.3464 9.4502 9.4502 9.9982 9.9982 10.5899 10.5899 10.6173 10.6173 10.8212 10.8212 10.8510 10.8510 12.2621 12.2621 12.2933 12.2933 12.3604 12.3604 13.1541 13.1541 k = 0.1607 0.1607 0.2666 ( 9988 PWs) bands (ev): -45.6583 -45.6583 -45.5803 -45.5803 -30.8385 -30.8385 -30.8121 -30.8121 -22.3954 -22.3954 -22.2569 -22.2569 -21.7813 -21.7813 -21.6884 -21.6884 -21.6451 -21.6451 -21.4741 -21.4741 -11.9092 -11.9092 -11.8226 -11.8226 -10.5150 -10.5150 -10.4930 -10.4930 -10.3889 -10.3889 -10.3565 -10.3565 3.2972 3.2972 3.3887 3.3887 7.6044 7.6044 8.1196 8.1196 9.0627 9.0627 9.4143 9.4143 9.4642 9.4642 10.0521 10.0521 10.5732 10.5732 10.6219 10.6219 10.7981 10.7981 10.8718 10.8718 12.2432 12.2432 12.2885 12.2885 12.4131 12.4131 13.1531 13.1531 k = 0.1518 0.1518 0.2666 ( 9980 PWs) bands (ev): -45.6595 -45.6595 -45.5791 -45.5791 -30.8392 -30.8392 -30.8119 -30.8119 -22.3974 -22.3974 -22.2551 -22.2551 -21.7839 -21.7839 -21.6908 -21.6908 -21.6413 -21.6413 -21.4716 -21.4716 -11.9091 -11.9091 -11.8198 -11.8198 -10.5129 -10.5129 -10.4927 -10.4927 -10.3854 -10.3854 -10.3561 -10.3561 3.2609 3.2609 3.3512 3.3512 7.5747 7.5747 8.1185 8.1185 9.1152 9.1152 9.4782 9.4782 9.4844 9.4844 10.1057 10.1057 10.5555 10.5555 10.6288 10.6288 10.7747 10.7747 10.8941 10.8941 12.2135 12.2135 12.2855 12.2855 12.4684 12.4684 13.1524 13.1524 k = 0.1429 0.1429 0.2666 ( 9974 PWs) bands (ev): -45.6607 -45.6607 -45.5780 -45.5780 -30.8398 -30.8398 -30.8118 -30.8118 -22.3993 -22.3993 -22.2534 -22.2534 -21.7866 -21.7866 -21.6928 -21.6928 -21.6378 -21.6378 -21.4691 -21.4691 -11.9089 -11.9089 -11.8171 -11.8171 -10.5111 -10.5111 -10.4923 -10.4923 -10.3820 -10.3820 -10.3557 -10.3557 3.2260 3.2260 3.3147 3.3147 7.5439 7.5439 8.1180 8.1180 9.1695 9.1695 9.4942 9.4942 9.5547 9.5547 10.1584 10.1584 10.5376 10.5376 10.6381 10.6381 10.7511 10.7511 10.9173 10.9173 12.1735 12.1735 12.2870 12.2870 12.5241 12.5241 13.1397 13.1398 k = 0.1339 0.1339 0.2666 ( 9974 PWs) bands (ev): -45.6618 -45.6618 -45.5769 -45.5769 -30.8404 -30.8404 -30.8117 -30.8117 -22.4012 -22.4012 -22.2518 -22.2518 -21.7893 -21.7893 -21.6944 -21.6944 -21.6345 -21.6345 -21.4664 -21.4664 -11.9088 -11.9088 -11.8145 -11.8145 -10.5096 -10.5096 -10.4915 -10.4915 -10.3787 -10.3787 -10.3555 -10.3555 3.1925 3.1925 3.2794 3.2794 7.5124 7.5124 8.1179 8.1179 9.2244 9.2244 9.5101 9.5101 9.6269 9.6269 10.2094 10.2094 10.5197 10.5197 10.6499 10.6499 10.7276 10.7276 10.9410 10.9410 12.1242 12.1242 12.2937 12.2937 12.5795 12.5795 13.1134 13.1134 k = 0.1250 0.1250 0.2666 ( 9974 PWs) bands (ev): -45.6628 -45.6628 -45.5759 -45.5759 -30.8410 -30.8410 -30.8116 -30.8116 -22.4031 -22.4031 -22.2504 -22.2504 -21.7921 -21.7921 -21.6957 -21.6957 -21.6316 -21.6316 -21.4637 -21.4637 -11.9087 -11.9087 -11.8120 -11.8120 -10.5084 -10.5084 -10.4905 -10.4905 -10.3756 -10.3756 -10.3553 -10.3553 3.1606 3.1606 3.2455 3.2455 7.4811 7.4811 8.1181 8.1181 9.2788 9.2788 9.5266 9.5266 9.7007 9.7007 10.2581 10.2581 10.5021 10.5021 10.6637 10.6637 10.7048 10.7048 10.9648 10.9648 12.0669 12.0669 12.3060 12.3060 12.6342 12.6342 13.0852 13.0852 k = 0.1161 0.1161 0.2666 ( 9976 PWs) bands (ev): -45.6638 -45.6638 -45.5749 -45.5749 -30.8415 -30.8415 -30.8114 -30.8114 -22.4049 -22.4049 -22.2491 -22.2491 -21.7949 -21.7949 -21.6967 -21.6967 -21.6290 -21.6290 -21.4610 -21.4610 -11.9086 -11.9086 -11.8096 -11.8096 -10.5075 -10.5075 -10.4892 -10.4892 -10.3726 -10.3726 -10.3552 -10.3552 3.1304 3.1304 3.2130 3.2130 7.4503 7.4503 8.1185 8.1185 9.3318 9.3318 9.5434 9.5434 9.7758 9.7758 10.3036 10.3036 10.4850 10.4850 10.6721 10.6721 10.6908 10.6908 10.9882 10.9882 12.0024 12.0024 12.3243 12.3243 12.6879 12.6879 13.0558 13.0558 k = 0.1071 0.1071 0.2666 ( 9958 PWs) bands (ev): -45.6648 -45.6648 -45.5740 -45.5740 -30.8420 -30.8420 -30.8113 -30.8113 -22.4066 -22.4066 -22.2479 -22.2479 -21.7976 -21.7976 -21.6976 -21.6976 -21.6266 -21.6266 -21.4582 -21.4582 -11.9084 -11.9084 -11.8074 -11.8074 -10.5069 -10.5069 -10.4877 -10.4877 -10.3698 -10.3698 -10.3551 -10.3551 3.1019 3.1019 3.1824 3.1824 7.4205 7.4205 8.1190 8.1190 9.3826 9.3826 9.5604 9.5604 9.8524 9.8524 10.3453 10.3453 10.4686 10.4686 10.6543 10.6543 10.7064 10.7064 11.0108 11.0108 11.9319 11.9319 12.3488 12.3488 12.7404 12.7404 13.0258 13.0258 k = 0.0982 0.0982 0.2666 ( 9966 PWs) bands (ev): -45.6656 -45.6656 -45.5731 -45.5731 -30.8425 -30.8425 -30.8112 -30.8112 -22.4083 -22.4083 -22.2469 -22.2469 -21.8002 -21.8002 -21.6982 -21.6982 -21.6244 -21.6244 -21.4556 -21.4556 -11.9083 -11.9083 -11.8053 -11.8053 -10.5065 -10.5065 -10.4862 -10.4862 -10.3672 -10.3672 -10.3551 -10.3551 3.0754 3.0754 3.1535 3.1535 7.3921 7.3921 8.1196 8.1196 9.4306 9.4306 9.5775 9.5775 9.9303 9.9303 10.3826 10.3826 10.4530 10.4530 10.6325 10.6325 10.7296 10.7296 11.0321 11.0321 11.8565 11.8565 12.3793 12.3793 12.7913 12.7913 12.9959 12.9959 k = 0.0893 0.0893 0.2666 ( 9974 PWs) bands (ev): -45.6664 -45.6664 -45.5723 -45.5723 -30.8429 -30.8429 -30.8111 -30.8111 -22.4099 -22.4099 -22.2459 -22.2459 -21.8027 -21.8027 -21.6987 -21.6987 -21.6226 -21.6226 -21.4530 -21.4530 -11.9082 -11.9082 -11.8033 -11.8033 -10.5062 -10.5062 -10.4845 -10.4845 -10.3648 -10.3648 -10.3551 -10.3551 3.0509 3.0509 3.1267 3.1267 7.3654 7.3654 8.1202 8.1202 9.4753 9.4753 9.5945 9.5945 10.0096 10.0096 10.4153 10.4153 10.4384 10.4384 10.6108 10.6108 10.7558 10.7558 11.0518 11.0518 11.7769 11.7769 12.4157 12.4157 12.8401 12.8401 12.9667 12.9667 k = 0.0804 0.0804 0.2666 ( 9982 PWs) bands (ev): -45.6672 -45.6672 -45.5716 -45.5716 -30.8434 -30.8434 -30.8111 -30.8111 -22.4114 -22.4114 -22.2451 -22.2451 -21.8050 -21.8050 -21.6990 -21.6990 -21.6209 -21.6209 -21.4505 -21.4505 -11.9081 -11.9081 -11.8016 -11.8016 -10.5061 -10.5061 -10.4829 -10.4829 -10.3627 -10.3627 -10.3550 -10.3550 3.0285 3.0285 3.1021 3.1021 7.3406 7.3406 8.1208 8.1208 9.5162 9.5162 9.6112 9.6112 10.0902 10.0902 10.4248 10.4248 10.4434 10.4434 10.5900 10.5900 10.7840 10.7840 11.0695 11.0695 11.6940 11.6940 12.4573 12.4573 12.8865 12.8865 12.9389 12.9389 k = 0.0714 0.0714 0.2666 ( 9978 PWs) bands (ev): -45.6678 -45.6678 -45.5710 -45.5710 -30.8437 -30.8437 -30.8110 -30.8110 -22.4127 -22.4127 -22.2443 -22.2443 -21.8071 -21.8071 -21.6993 -21.6993 -21.6195 -21.6195 -21.4482 -21.4482 -11.9080 -11.9080 -11.8000 -11.8000 -10.5060 -10.5060 -10.4813 -10.4813 -10.3609 -10.3609 -10.3549 -10.3549 3.0082 3.0082 3.0797 3.0797 7.3179 7.3179 8.1213 8.1213 9.5531 9.5531 9.6274 9.6274 10.1721 10.1721 10.4124 10.4124 10.4672 10.4672 10.5702 10.5702 10.8130 10.8130 11.0852 11.0852 11.6085 11.6085 12.5031 12.5031 12.9109 12.9109 12.9322 12.9322 k = 0.0625 0.0625 0.2666 ( 9982 PWs) bands (ev): -45.6684 -45.6684 -45.5704 -45.5704 -30.8440 -30.8440 -30.8109 -30.8109 -22.4139 -22.4139 -22.2437 -22.2437 -21.8090 -21.8090 -21.6995 -21.6995 -21.6182 -21.6182 -21.4460 -21.4460 -11.9079 -11.9079 -11.7985 -11.7985 -10.5060 -10.5060 -10.4798 -10.4798 -10.3594 -10.3594 -10.3547 -10.3547 2.9902 2.9902 3.0597 3.0597 7.2975 7.2975 8.1218 8.1218 9.5856 9.5856 9.6429 9.6429 10.2551 10.2551 10.4013 10.4013 10.4870 10.4870 10.5519 10.5519 10.8418 10.8418 11.0987 11.0987 11.5211 11.5211 12.5516 12.5516 12.8880 12.8880 12.9718 12.9718 k = 0.0536 0.0536 0.2666 ( 9982 PWs) bands (ev): -45.6690 -45.6690 -45.5699 -45.5699 -30.8443 -30.8443 -30.8108 -30.8108 -22.4150 -22.4150 -22.2431 -22.2431 -21.8107 -21.8107 -21.6996 -21.6996 -21.6172 -21.6172 -21.4441 -21.4441 -11.9078 -11.9078 -11.7973 -11.7973 -10.5060 -10.5060 -10.4785 -10.4785 -10.3584 -10.3584 -10.3542 -10.3542 2.9745 2.9745 3.0422 3.0422 7.2796 7.2796 8.1223 8.1223 9.6135 9.6135 9.6576 9.6576 10.3392 10.3392 10.3915 10.3915 10.5033 10.5033 10.5353 10.5353 10.8692 10.8692 11.1101 11.1101 11.4324 11.4324 12.6010 12.6010 12.8672 12.8672 13.0086 13.0086 k = 0.0446 0.0446 0.2666 ( 9980 PWs) bands (ev): -45.6694 -45.6694 -45.5695 -45.5695 -30.8446 -30.8446 -30.8108 -30.8108 -22.4160 -22.4160 -22.2426 -22.2426 -21.8122 -21.8122 -21.6997 -21.6997 -21.6163 -21.6163 -21.4425 -21.4425 -11.9078 -11.9078 -11.7962 -11.7962 -10.5061 -10.5061 -10.4773 -10.4773 -10.3578 -10.3578 -10.3536 -10.3536 2.9611 2.9611 3.0273 3.0273 7.2643 7.2643 8.1226 8.1226 9.6367 9.6367 9.6711 9.6711 10.3830 10.3830 10.4242 10.4242 10.5151 10.5151 10.5222 10.5222 10.8942 10.8942 11.1193 11.1193 11.3429 11.3429 12.6487 12.6487 12.8498 12.8498 13.0411 13.0411 k = 0.0357 0.0357 0.2666 ( 9988 PWs) bands (ev): -45.6698 -45.6698 -45.5691 -45.5691 -30.8448 -30.8448 -30.8108 -30.8108 -22.4167 -22.4167 -22.2422 -22.2422 -21.8134 -21.8134 -21.6998 -21.6998 -21.6157 -21.6157 -21.4411 -21.4411 -11.9077 -11.9077 -11.7953 -11.7953 -10.5061 -10.5061 -10.4764 -10.4764 -10.3576 -10.3576 -10.3529 -10.3529 2.9501 2.9501 3.0150 3.0150 7.2516 7.2516 8.1229 8.1229 9.6551 9.6551 9.6833 9.6833 10.3760 10.3760 10.5067 10.5067 10.5099 10.5099 10.5283 10.5283 10.9157 10.9157 11.1267 11.1267 11.2533 11.2533 12.6917 12.6917 12.8368 12.8368 13.0686 13.0687 k = 0.0268 0.0268 0.2666 ( 9988 PWs) bands (ev): -45.6700 -45.6700 -45.5688 -45.5688 -30.8449 -30.8449 -30.8107 -30.8107 -22.4173 -22.4173 -22.2420 -22.2420 -21.8143 -21.8143 -21.6998 -21.6998 -21.6151 -21.6151 -21.4400 -21.4400 -11.9077 -11.9077 -11.7946 -11.7946 -10.5061 -10.5061 -10.4756 -10.4756 -10.3574 -10.3574 -10.3522 -10.3522 2.9415 2.9415 3.0053 3.0053 7.2417 7.2417 8.1232 8.1232 9.6688 9.6688 9.6937 9.6937 10.3705 10.3705 10.4972 10.4972 10.5360 10.5360 10.5953 10.5953 10.9331 10.9331 11.1321 11.1321 11.1646 11.1646 12.7261 12.7261 12.8296 12.8296 13.0901 13.0901 k = 0.0179 0.0179 0.2666 ( 9988 PWs) bands (ev): -45.6702 -45.6702 -45.5686 -45.5686 -30.8450 -30.8450 -30.8107 -30.8107 -22.4178 -22.4178 -22.2417 -22.2417 -21.8150 -21.8150 -21.6998 -21.6998 -21.6148 -21.6148 -21.4392 -21.4392 -11.9076 -11.9076 -11.7941 -11.7941 -10.5062 -10.5062 -10.4750 -10.4750 -10.3574 -10.3574 -10.3517 -10.3517 2.9353 2.9353 2.9984 2.9984 7.2345 7.2345 8.1233 8.1233 9.6782 9.6782 9.7018 9.7018 10.3666 10.3666 10.4898 10.4898 10.5416 10.5416 10.6792 10.6792 10.9455 10.9455 11.0786 11.0786 11.1360 11.1360 12.7483 12.7483 12.8292 12.8292 13.1044 13.1044 k = 0.0089 0.0089 0.2666 ( 9980 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8154 -21.8154 -21.6998 -21.6998 -21.6145 -21.6145 -21.4387 -21.4387 -11.9076 -11.9076 -11.7938 -11.7938 -10.5062 -10.5062 -10.4747 -10.4747 -10.3574 -10.3574 -10.3514 -10.3514 2.9316 2.9316 2.9942 2.9942 7.2302 7.2302 8.1234 8.1234 9.6836 9.6836 9.7069 9.7069 10.3642 10.3642 10.4853 10.4853 10.5450 10.5450 10.7560 10.7560 10.9501 10.9501 11.0035 11.0035 11.1383 11.1383 12.7584 12.7584 12.8333 12.8333 13.1114 13.1114 k = 0.0000 0.0000 0.2666 ( 9968 PWs) bands (ev): -45.6704 -45.6704 -45.5685 -45.5685 -30.8451 -30.8451 -30.8107 -30.8107 -22.4181 -22.4181 -22.2416 -22.2416 -21.8155 -21.8155 -21.6998 -21.6998 -21.6145 -21.6145 -21.4385 -21.4385 -11.9076 -11.9076 -11.7937 -11.7937 -10.5062 -10.5062 -10.4746 -10.4746 -10.3574 -10.3574 -10.3513 -10.3513 2.9304 2.9304 2.9928 2.9928 7.2288 7.2288 8.1235 8.1235 9.6854 9.6854 9.7086 9.7086 10.3634 10.3634 10.4838 10.4838 10.5461 10.5461 10.7972 10.7972 10.9407 10.9407 10.9739 10.9739 11.1390 11.1390 12.7609 12.7609 12.8356 12.8356 13.1132 13.1132 k = 0.0000 0.5000-0.0000 ( 10006 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5313 -10.5313 -10.5313 -10.5313 -10.3787 -10.3787 -10.3787 -10.3787 4.0208 4.0208 4.0208 4.0208 7.4185 7.4185 7.4185 7.4185 8.8584 8.8584 8.8584 8.8584 9.6387 9.6387 9.6387 9.6387 10.5110 10.5110 10.5110 10.5110 11.4813 11.4813 11.4813 11.4813 11.5593 11.5593 11.5593 11.5593 12.6200 12.6200 12.6200 12.6200 k = 0.0000 0.5000 0.0127 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5313 -10.5313 -10.5313 -10.5313 -10.3787 -10.3787 -10.3787 -10.3787 4.0211 4.0211 4.0211 4.0211 7.4162 7.4162 7.4162 7.4162 8.8603 8.8603 8.8603 8.8603 9.6389 9.6389 9.6389 9.6389 10.5106 10.5106 10.5106 10.5106 11.4839 11.4839 11.4839 11.4839 11.5593 11.5593 11.5593 11.5593 12.6178 12.6178 12.6178 12.6178 k = 0.0000 0.5000 0.0254 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5314 -10.5314 -10.5314 -10.5314 -10.3787 -10.3787 -10.3787 -10.3787 4.0220 4.0220 4.0220 4.0220 7.4095 7.4095 7.4095 7.4095 8.8659 8.8659 8.8659 8.8659 9.6397 9.6397 9.6397 9.6397 10.5097 10.5097 10.5097 10.5097 11.4916 11.4916 11.4916 11.4916 11.5595 11.5595 11.5595 11.5595 12.6113 12.6113 12.6113 12.6113 k = 0.0000 0.5000 0.0381 ( 9992 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5314 -10.5314 -10.5314 -10.5314 -10.3786 -10.3786 -10.3786 -10.3786 4.0234 4.0234 4.0234 4.0234 7.3986 7.3986 7.3986 7.3986 8.8750 8.8750 8.8750 8.8750 9.6410 9.6410 9.6410 9.6410 10.5083 10.5083 10.5083 10.5083 11.5043 11.5043 11.5043 11.5043 11.5598 11.5598 11.5598 11.5598 12.6008 12.6008 12.6008 12.6008 k = 0.0000 0.5000 0.0508 ( 9996 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5314 -10.5314 -10.5314 -10.5314 -10.3786 -10.3786 -10.3786 -10.3786 4.0253 4.0253 4.0253 4.0253 7.3839 7.3839 7.3839 7.3839 8.8872 8.8872 8.8872 8.8872 9.6428 9.6428 9.6428 9.6428 10.5066 10.5066 10.5066 10.5066 11.5214 11.5214 11.5214 11.5214 11.5605 11.5605 11.5605 11.5605 12.5865 12.5865 12.5865 12.5865 k = 0.0000 0.5000 0.0635 ( 9992 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5315 -10.5315 -10.5315 -10.5315 -10.3785 -10.3785 -10.3785 -10.3785 4.0277 4.0277 4.0277 4.0277 7.3659 7.3659 7.3659 7.3659 8.9019 8.9019 8.9019 8.9019 9.6450 9.6450 9.6450 9.6450 10.5046 10.5046 10.5046 10.5046 11.5420 11.5420 11.5420 11.5420 11.5624 11.5624 11.5624 11.5624 12.5691 12.5691 12.5691 12.5691 k = 0.0000 0.5000 0.0762 ( 9998 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5315 -10.5315 -10.5315 -10.5315 -10.3784 -10.3784 -10.3784 -10.3784 4.0306 4.0306 4.0306 4.0306 7.3452 7.3452 7.3452 7.3452 8.9186 8.9186 8.9186 8.9186 9.6476 9.6476 9.6476 9.6476 10.5027 10.5027 10.5027 10.5027 11.5561 11.5561 11.5561 11.5561 11.5750 11.5750 11.5750 11.5750 12.5490 12.5490 12.5490 12.5490 k = 0.0000 0.5000 0.0889 ( 9994 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8867 -11.8867 -11.8867 -11.8867 -10.5316 -10.5316 -10.5316 -10.5316 -10.3783 -10.3783 -10.3783 -10.3783 4.0338 4.0338 4.0338 4.0338 7.3225 7.3225 7.3225 7.3225 8.9367 8.9367 8.9367 8.9367 9.6505 9.6505 9.6505 9.6505 10.5009 10.5009 10.5009 10.5009 11.5587 11.5587 11.5587 11.5587 11.6029 11.6029 11.6029 11.6029 12.5269 12.5269 12.5269 12.5269 k = 0.0000 0.5000 0.1016 ( 9998 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5317 -10.5317 -10.5317 -10.5317 -10.3783 -10.3783 -10.3783 -10.3783 4.0374 4.0374 4.0374 4.0374 7.2984 7.2984 7.2984 7.2984 8.9555 8.9555 8.9555 8.9555 9.6538 9.6538 9.6538 9.6538 10.4994 10.4994 10.4994 10.4994 11.5597 11.5597 11.5597 11.5597 11.6360 11.6360 11.6360 11.6360 12.5033 12.5033 12.5033 12.5033 k = 0.0000 0.5000 0.1142 ( 10002 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5318 -10.5318 -10.5318 -10.5318 -10.3782 -10.3782 -10.3782 -10.3782 4.0411 4.0411 4.0411 4.0411 7.2734 7.2734 7.2734 7.2734 8.9746 8.9746 8.9746 8.9746 9.6572 9.6572 9.6572 9.6572 10.4984 10.4984 10.4984 10.4984 11.5604 11.5604 11.5604 11.5604 11.6724 11.6724 11.6724 11.6724 12.4789 12.4789 12.4789 12.4789 k = 0.0000 0.5000 0.1269 ( 10012 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5318 -10.5318 -10.5318 -10.5318 -10.3781 -10.3781 -10.3781 -10.3781 4.0451 4.0451 4.0451 4.0451 7.2483 7.2483 7.2483 7.2483 8.9935 8.9935 8.9935 8.9935 9.6608 9.6608 9.6608 9.6608 10.4978 10.4978 10.4978 10.4978 11.5610 11.5610 11.5610 11.5610 11.7112 11.7112 11.7112 11.7112 12.4543 12.4543 12.4543 12.4543 k = 0.0000 0.5000 0.1396 ( 9990 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5319 -10.5319 -10.5319 -10.5319 -10.3780 -10.3780 -10.3780 -10.3780 4.0490 4.0490 4.0490 4.0490 7.2234 7.2234 7.2235 7.2235 9.0116 9.0116 9.0116 9.0116 9.6645 9.6645 9.6645 9.6645 10.4978 10.4978 10.4978 10.4978 11.5615 11.5615 11.5616 11.5616 11.7520 11.7520 11.7520 11.7520 12.4299 12.4299 12.4299 12.4299 k = 0.0000 0.5000 0.1523 ( 9982 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5320 -10.5320 -10.5320 -10.5320 -10.3779 -10.3779 -10.3779 -10.3779 4.0530 4.0530 4.0530 4.0530 7.1995 7.1995 7.1995 7.1995 9.0287 9.0287 9.0287 9.0287 9.6682 9.6682 9.6682 9.6682 10.4983 10.4983 10.4983 10.4983 11.5621 11.5621 11.5621 11.5621 11.7940 11.7940 11.7940 11.7940 12.4064 12.4064 12.4064 12.4064 k = 0.0000 0.5000 0.1650 ( 9968 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5321 -10.5321 -10.5321 -10.5321 -10.3778 -10.3778 -10.3778 -10.3778 4.0569 4.0569 4.0569 4.0569 7.1768 7.1768 7.1768 7.1768 9.0445 9.0445 9.0445 9.0445 9.6717 9.6717 9.6717 9.6717 10.4992 10.4992 10.4992 10.4992 11.5627 11.5627 11.5627 11.5627 11.8364 11.8364 11.8364 11.8364 12.3841 12.3841 12.3841 12.3841 k = 0.0000 0.5000 0.1777 ( 9980 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8868 -11.8868 -11.8868 -11.8868 -10.5322 -10.5322 -10.5322 -10.5322 -10.3777 -10.3777 -10.3777 -10.3777 4.0605 4.0605 4.0605 4.0605 7.1558 7.1558 7.1558 7.1558 9.0588 9.0588 9.0588 9.0588 9.6751 9.6751 9.6751 9.6751 10.5005 10.5005 10.5005 10.5005 11.5632 11.5632 11.5632 11.5632 11.8783 11.8783 11.8783 11.8783 12.3635 12.3635 12.3635 12.3635 k = 0.0000 0.5000 0.1904 ( 9990 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5322 -10.5322 -10.5322 -10.5322 -10.3776 -10.3776 -10.3776 -10.3776 4.0639 4.0639 4.0639 4.0639 7.1369 7.1369 7.1369 7.1369 9.0713 9.0713 9.0713 9.0713 9.6782 9.6782 9.6782 9.6782 10.5020 10.5020 10.5020 10.5020 11.5637 11.5637 11.5637 11.5637 11.9187 11.9187 11.9187 11.9187 12.3449 12.3449 12.3449 12.3449 k = 0.0000 0.5000 0.2031 ( 9998 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5323 -10.5323 -10.5323 -10.5323 -10.3775 -10.3775 -10.3775 -10.3775 4.0669 4.0669 4.0669 4.0669 7.1204 7.1204 7.1204 7.1204 9.0820 9.0820 9.0820 9.0820 9.6809 9.6809 9.6809 9.6809 10.5036 10.5036 10.5036 10.5036 11.5642 11.5642 11.5642 11.5642 11.9564 11.9564 11.9564 11.9564 12.3286 12.3286 12.3286 12.3286 k = 0.0000 0.5000 0.2158 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5323 -10.5323 -10.5323 -10.5323 -10.3775 -10.3775 -10.3775 -10.3775 4.0695 4.0695 4.0695 4.0695 7.1066 7.1066 7.1066 7.1066 9.0908 9.0908 9.0908 9.0908 9.6833 9.6833 9.6833 9.6833 10.5051 10.5051 10.5051 10.5051 11.5646 11.5646 11.5646 11.5646 11.9901 11.9901 11.9901 11.9901 12.3149 12.3149 12.3149 12.3149 k = 0.0000 0.5000 0.2285 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3774 -10.3774 -10.3774 -10.3774 4.0716 4.0716 4.0716 4.0716 7.0955 7.0955 7.0956 7.0956 9.0977 9.0977 9.0977 9.0977 9.6852 9.6852 9.6852 9.6852 10.5064 10.5064 10.5064 10.5064 11.5649 11.5649 11.5649 11.5649 12.0183 12.0183 12.0183 12.0183 12.3041 12.3041 12.3041 12.3041 k = 0.0000 0.5000 0.2412 ( 9988 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3774 -10.3774 -10.3774 -10.3774 4.0731 4.0731 4.0731 4.0731 7.0876 7.0876 7.0876 7.0876 9.1026 9.1026 9.1026 9.1026 9.6866 9.6866 9.6866 9.6866 10.5075 10.5075 10.5075 10.5075 11.5652 11.5652 11.5652 11.5652 12.0397 12.0397 12.0397 12.0397 12.2963 12.2963 12.2963 12.2963 k = 0.0000 0.5000 0.2539 ( 10000 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3773 -10.3773 -10.3773 -10.3773 4.0740 4.0740 4.0740 4.0740 7.0827 7.0827 7.0827 7.0827 9.1055 9.1055 9.1055 9.1055 9.6875 9.6875 9.6875 9.6875 10.5081 10.5081 10.5081 10.5081 11.5653 11.5653 11.5653 11.5653 12.0531 12.0531 12.0531 12.0531 12.2915 12.2915 12.2915 12.2915 k = 0.0000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6191 -45.6191 -45.6191 -45.6191 -30.8223 -30.8223 -30.8223 -30.8223 -22.3144 -22.3144 -22.3144 -22.3144 -21.6800 -21.6800 -21.6800 -21.6800 -21.6350 -21.6350 -21.6350 -21.6350 -11.8869 -11.8869 -11.8869 -11.8869 -10.5324 -10.5324 -10.5324 -10.5324 -10.3773 -10.3773 -10.3773 -10.3773 4.0743 4.0743 4.0743 4.0743 7.0811 7.0811 7.0811 7.0811 9.1065 9.1065 9.1065 9.1065 9.6877 9.6877 9.6877 9.6877 10.5083 10.5083 10.5083 10.5083 11.5654 11.5654 11.5654 11.5654 12.0577 12.0577 12.0577 12.0577 12.2899 12.2899 12.2899 12.2899 k = 0.5000 0.5000-0.0000 ( 10040 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0678 4.0678 4.0678 4.0678 8.0731 8.0731 8.0731 8.0731 9.0788 9.0788 9.0788 9.0788 9.2945 9.2945 9.2945 9.2945 10.5333 10.5333 10.5333 10.5333 10.7101 10.7101 10.7102 10.7102 11.2742 11.2742 11.2742 11.2742 12.7987 12.7987 12.7987 12.7987 k = 0.5000 0.5000 0.0127 ( 10032 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0678 4.0678 4.0678 4.0678 8.0724 8.0724 8.0724 8.0724 9.0795 9.0795 9.0795 9.0795 9.2950 9.2950 9.2950 9.2950 10.5347 10.5347 10.5347 10.5347 10.7085 10.7085 10.7085 10.7085 11.2737 11.2737 11.2737 11.2737 12.7989 12.7989 12.7989 12.7989 k = 0.5000 0.5000 0.0254 ( 10032 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0677 4.0677 4.0677 4.0677 8.0706 8.0706 8.0706 8.0706 9.0815 9.0815 9.0815 9.0815 9.2966 9.2966 9.2966 9.2966 10.5388 10.5388 10.5388 10.5388 10.7037 10.7037 10.7037 10.7037 11.2722 11.2722 11.2722 11.2722 12.7995 12.7995 12.7995 12.7995 k = 0.5000 0.5000 0.0381 ( 10032 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5475 -10.5475 -10.5475 -10.5475 -10.4239 -10.4239 -10.4239 -10.4239 4.0675 4.0675 4.0675 4.0675 8.0676 8.0676 8.0676 8.0676 9.0850 9.0850 9.0850 9.0850 9.2992 9.2992 9.2992 9.2992 10.5456 10.5456 10.5456 10.5456 10.6959 10.6959 10.6959 10.6959 11.2696 11.2696 11.2696 11.2696 12.8005 12.8005 12.8005 12.8005 k = 0.5000 0.5000 0.0508 ( 10048 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5474 -10.5474 -10.5474 -10.5474 -10.4240 -10.4240 -10.4240 -10.4240 4.0673 4.0673 4.0673 4.0673 8.0635 8.0635 8.0635 8.0635 9.0898 9.0898 9.0898 9.0898 9.3026 9.3026 9.3026 9.3026 10.5550 10.5550 10.5550 10.5550 10.6853 10.6853 10.6853 10.6853 11.2659 11.2659 11.2659 11.2659 12.8019 12.8019 12.8019 12.8019 k = 0.5000 0.5000 0.0635 ( 10048 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5474 -10.5474 -10.5474 -10.5474 -10.4241 -10.4241 -10.4241 -10.4241 4.0670 4.0670 4.0670 4.0670 8.0585 8.0585 8.0585 8.0585 9.0958 9.0958 9.0958 9.0958 9.3069 9.3069 9.3069 9.3069 10.5667 10.5667 10.5667 10.5667 10.6722 10.6722 10.6722 10.6722 11.2612 11.2612 11.2612 11.2612 12.8036 12.8036 12.8036 12.8036 k = 0.5000 0.5000 0.0762 ( 10056 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5473 -10.5473 -10.5473 -10.5473 -10.4241 -10.4241 -10.4241 -10.4241 4.0667 4.0667 4.0667 4.0667 8.0526 8.0526 8.0526 8.0526 9.1029 9.1029 9.1029 9.1029 9.3118 9.3118 9.3118 9.3118 10.5803 10.5803 10.5803 10.5803 10.6574 10.6574 10.6574 10.6574 11.2554 11.2554 11.2554 11.2554 12.8057 12.8057 12.8057 12.8057 k = 0.5000 0.5000 0.0889 ( 10048 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5472 -10.5472 -10.5472 -10.5472 -10.4242 -10.4242 -10.4242 -10.4242 4.0663 4.0663 4.0663 4.0663 8.0461 8.0461 8.0461 8.0461 9.1111 9.1111 9.1111 9.1111 9.3172 9.3172 9.3172 9.3172 10.5938 10.5938 10.5938 10.5938 10.6431 10.6431 10.6431 10.6431 11.2485 11.2485 11.2485 11.2485 12.8080 12.8080 12.8080 12.8080 k = 0.5000 0.5000 0.1016 ( 10040 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5472 -10.5472 -10.5472 -10.5472 -10.4243 -10.4243 -10.4243 -10.4243 4.0659 4.0659 4.0659 4.0659 8.0391 8.0391 8.0391 8.0391 9.1202 9.1202 9.1202 9.1202 9.3230 9.3230 9.3230 9.3230 10.5989 10.5989 10.5989 10.5989 10.6376 10.6376 10.6376 10.6376 11.2404 11.2404 11.2404 11.2404 12.8105 12.8105 12.8105 12.8105 k = 0.5000 0.5000 0.1142 ( 10028 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9082 -11.9082 -11.9082 -11.9082 -10.5471 -10.5471 -10.5471 -10.5471 -10.4244 -10.4244 -10.4244 -10.4244 4.0655 4.0655 4.0655 4.0655 8.0318 8.0318 8.0318 8.0318 9.1301 9.1301 9.1301 9.1301 9.3289 9.3289 9.3289 9.3289 10.5868 10.5868 10.5868 10.5868 10.6503 10.6503 10.6503 10.6503 11.2311 11.2311 11.2312 11.2312 12.8132 12.8132 12.8132 12.8132 k = 0.5000 0.5000 0.1269 ( 9996 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9081 -11.9081 -11.9081 -11.9081 -10.5470 -10.5470 -10.5470 -10.5470 -10.4245 -10.4245 -10.4245 -10.4245 4.0650 4.0650 4.0650 4.0650 8.0244 8.0244 8.0244 8.0244 9.1405 9.1405 9.1405 9.1405 9.3349 9.3349 9.3349 9.3349 10.5674 10.5674 10.5674 10.5674 10.6711 10.6711 10.6711 10.6711 11.2207 11.2207 11.2207 11.2207 12.8160 12.8160 12.8160 12.8160 k = 0.5000 0.5000 0.1396 ( 10016 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9081 -11.9081 -11.9081 -11.9081 -10.5469 -10.5469 -10.5469 -10.5469 -10.4246 -10.4246 -10.4246 -10.4246 4.0646 4.0646 4.0646 4.0646 8.0170 8.0170 8.0170 8.0170 9.1513 9.1513 9.1513 9.1513 9.3407 9.3407 9.3407 9.3407 10.5461 10.5461 10.5461 10.5461 10.6951 10.6951 10.6951 10.6951 11.2090 11.2090 11.2090 11.2090 12.8188 12.8188 12.8188 12.8188 k = 0.5000 0.5000 0.1523 ( 9996 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9081 -11.9081 -11.9081 -11.9081 -10.5468 -10.5468 -10.5468 -10.5468 -10.4247 -10.4247 -10.4247 -10.4247 4.0642 4.0642 4.0642 4.0642 8.0097 8.0097 8.0097 8.0097 9.1622 9.1622 9.1622 9.1622 9.3464 9.3464 9.3464 9.3464 10.5245 10.5245 10.5245 10.5245 10.7209 10.7209 10.7209 10.7209 11.1961 11.1961 11.1961 11.1961 12.8217 12.8217 12.8217 12.8217 k = 0.5000 0.5000 0.1650 ( 10004 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9081 -11.9081 -11.9081 -11.9081 -10.5467 -10.5467 -10.5467 -10.5467 -10.4248 -10.4248 -10.4248 -10.4248 4.0637 4.0637 4.0637 4.0637 8.0028 8.0028 8.0028 8.0028 9.1731 9.1731 9.1731 9.1731 9.3517 9.3517 9.3517 9.3517 10.5032 10.5032 10.5032 10.5032 10.7479 10.7479 10.7479 10.7479 11.1820 11.1820 11.1820 11.1820 12.8244 12.8244 12.8244 12.8244 k = 0.5000 0.5000 0.1777 ( 10004 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9081 -11.9081 -11.9081 -11.9081 -10.5467 -10.5467 -10.5467 -10.5467 -10.4249 -10.4249 -10.4249 -10.4249 4.0633 4.0633 4.0633 4.0633 7.9964 7.9964 7.9964 7.9964 9.1835 9.1835 9.1835 9.1835 9.3565 9.3565 9.3565 9.3565 10.4828 10.4828 10.4828 10.4828 10.7756 10.7756 10.7756 10.7756 11.1667 11.1667 11.1667 11.1667 12.8270 12.8270 12.8270 12.8270 k = 0.5000 0.5000 0.1904 ( 9988 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5466 -10.5466 -10.5466 -10.5466 -10.4250 -10.4250 -10.4250 -10.4250 4.0630 4.0630 4.0630 4.0630 7.9906 7.9906 7.9906 7.9906 9.1933 9.1933 9.1933 9.1933 9.3609 9.3609 9.3609 9.3609 10.4640 10.4640 10.4640 10.4640 10.8036 10.8036 10.8036 10.8036 11.1504 11.1504 11.1504 11.1504 12.8294 12.8294 12.8294 12.8294 k = 0.5000 0.5000 0.2031 ( 9996 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5465 -10.5465 -10.5465 -10.5465 -10.4250 -10.4250 -10.4250 -10.4250 4.0627 4.0627 4.0627 4.0627 7.9855 7.9855 7.9855 7.9855 9.2023 9.2023 9.2023 9.2023 9.3647 9.3647 9.3647 9.3647 10.4471 10.4471 10.4472 10.4472 10.8312 10.8312 10.8312 10.8312 11.1332 11.1332 11.1332 11.1332 12.8315 12.8315 12.8315 12.8315 k = 0.5000 0.5000 0.2158 ( 9988 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5465 -10.5465 -10.5465 -10.5465 -10.4251 -10.4251 -10.4251 -10.4251 4.0624 4.0624 4.0624 4.0624 7.9812 7.9812 7.9812 7.9812 9.2100 9.2100 9.2100 9.2100 9.3679 9.3679 9.3679 9.3679 10.4327 10.4327 10.4327 10.4327 10.8579 10.8579 10.8579 10.8579 11.1155 11.1155 11.1155 11.1155 12.8333 12.8333 12.8333 12.8333 k = 0.5000 0.5000 0.2285 ( 9980 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4251 -10.4251 -10.4251 -10.4251 4.0622 4.0622 4.0622 4.0622 7.9778 7.9778 7.9778 7.9778 9.2163 9.2163 9.2163 9.2163 9.3704 9.3704 9.3704 9.3704 10.4210 10.4210 10.4210 10.4210 10.8826 10.8826 10.8826 10.8826 11.0980 11.0980 11.0980 11.0980 12.8348 12.8348 12.8348 12.8348 k = 0.5000 0.5000 0.2412 ( 10016 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4252 -10.4252 -10.4252 -10.4252 4.0620 4.0620 4.0620 4.0620 7.9753 7.9753 7.9753 7.9753 9.2210 9.2210 9.2210 9.2210 9.3722 9.3722 9.3722 9.3722 10.4124 10.4124 10.4124 10.4124 10.9038 10.9038 10.9038 10.9038 11.0822 11.0822 11.0822 11.0822 12.8358 12.8358 12.8358 12.8358 k = 0.5000 0.5000 0.2539 ( 10008 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4252 -10.4252 -10.4252 -10.4252 4.0619 4.0619 4.0619 4.0619 7.9738 7.9738 7.9738 7.9738 9.2238 9.2238 9.2238 9.2238 9.3733 9.3733 9.3733 9.3733 10.4072 10.4072 10.4072 10.4072 10.9189 10.9189 10.9189 10.9189 11.0704 11.0704 11.0704 11.0704 12.8365 12.8365 12.8365 12.8365 k = 0.5000 0.5000 0.2666 ( 10000 PWs) bands (ev): -45.6185 -45.6185 -45.6185 -45.6185 -30.8169 -30.8169 -30.8169 -30.8169 -22.3631 -22.3631 -22.3631 -22.3631 -21.7833 -21.7833 -21.7833 -21.7833 -21.4870 -21.4870 -21.4870 -21.4870 -11.9080 -11.9080 -11.9080 -11.9080 -10.5464 -10.5464 -10.5464 -10.5464 -10.4252 -10.4252 -10.4252 -10.4252 4.0619 4.0619 4.0619 4.0619 7.9733 7.9733 7.9733 7.9733 9.2248 9.2248 9.2248 9.2248 9.3737 9.3737 9.3737 9.3737 10.4054 10.4054 10.4054 10.4054 10.9246 10.9246 10.9246 10.9246 11.0658 11.0658 11.0658 11.0658 12.8367 12.8367 12.8367 12.8367 Writing output data file YTiSi.save init_run : 0.28s CPU 4.79s WALL ( 1 calls) electrons : 549.90s CPU 556.55s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 549.89s CPU 556.53s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.15s CPU 0.21s WALL ( 344 calls) cegterg : 521.63s CPU 526.19s WALL ( 838 calls) Called by sum_band: Called by *egterg: h_psi : 309.51s CPU 312.53s WALL ( 14585 calls) s_psi : 19.45s CPU 19.52s WALL ( 14585 calls) g_psi : 1.18s CPU 1.15s WALL ( 13403 calls) cdiaghg : 128.52s CPU 130.10s WALL ( 13747 calls) cegterg:over : 29.11s CPU 29.12s WALL ( 13403 calls) cegterg:upda : 29.56s CPU 29.47s WALL ( 13403 calls) cegterg:last : 14.78s CPU 14.79s WALL ( 2175 calls) cdiaghg:chol : 7.30s CPU 7.56s WALL ( 13747 calls) cdiaghg:inve : 5.27s CPU 5.14s WALL ( 13747 calls) cdiaghg:para : 8.70s CPU 8.57s WALL ( 27494 calls) Called by h_psi: h_psi:vloc : 259.71s CPU 262.81s WALL ( 14585 calls) h_psi:vnl : 48.57s CPU 48.45s WALL ( 14585 calls) add_vuspsi : 25.53s CPU 25.48s WALL ( 14585 calls) General routines calbec : 23.01s CPU 22.93s WALL ( 14585 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 247.05s CPU 249.84s WALL ( 1575532 calls) davcio : 0.36s CPU 0.57s WALL ( 688 calls) Parallel routines fft_scatter : 81.52s CPU 82.27s WALL ( 1575547 calls) PWSCF : 9m44.77s CPU 10m20.86s WALL This run was terminated on: 21:27:21 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=