Program PWSCF v.5.1.1 starts on 16Jul2015 at 16:19: 9 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 32 processors R & G space division: proc/nbgrp/npool/nimage = 32 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: ./CrCl2.save/ file Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3P 3P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 85 36 10 4846 1348 214 Max 87 37 11 4849 1371 221 Sum 2725 1163 337 155109 43555 6939 bravais-lattice index = 14 lattice parameter (alat) = 6.6027 a.u. unit-cell volume = 939.9586 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 49.0000 Ry charge density cutoff = 457.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.602703 celldm(2)= 1.714940 celldm(3)= 1.904121 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 1.714940 0.000000 ) a(3) = ( 0.000000 0.000000 1.904121 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.583111 -0.000000 ) b(3) = ( 0.000000 0.000000 0.525177 ) PseudoPot. # 1 for Cr read from file: /home/autes/Pseudo/Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 5eb7f017135fb502322d448d1515490d Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1183 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cl read from file: /home/autes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 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 Cr 14.00 51.99610 Cr( 1.00) Cl 7.00 35.45300 Cl( 1.00) 4 Sym. Ops., with inversion, found (note: 4 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 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 [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 396 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 2) = ( 0.0111111 -0.0000000 -0.0000000), wk = 0.0025253 k( 3) = ( 0.0222222 -0.0000000 -0.0000000), wk = 0.0025253 k( 4) = ( 0.0333333 -0.0000000 -0.0000000), wk = 0.0025253 k( 5) = ( 0.0444444 -0.0000000 -0.0000000), wk = 0.0025253 k( 6) = ( 0.0555556 -0.0000000 -0.0000000), wk = 0.0025253 k( 7) = ( 0.0666667 -0.0000000 -0.0000000), wk = 0.0025253 k( 8) = ( 0.0777778 -0.0000000 -0.0000000), wk = 0.0025253 k( 9) = ( 0.0888889 -0.0000000 -0.0000000), wk = 0.0025253 k( 10) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 11) = ( 0.1111111 -0.0000000 -0.0000000), wk = 0.0025253 k( 12) = ( 0.1222222 -0.0000000 -0.0000000), wk = 0.0025253 k( 13) = ( 0.1333333 -0.0000000 -0.0000000), wk = 0.0025253 k( 14) = ( 0.1444444 -0.0000000 -0.0000000), wk = 0.0025253 k( 15) = ( 0.1555556 -0.0000000 -0.0000000), wk = 0.0025253 k( 16) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0025253 k( 17) = ( 0.1777778 -0.0000000 -0.0000000), wk = 0.0025253 k( 18) = ( 0.1888889 -0.0000000 -0.0000000), wk = 0.0025253 k( 19) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 20) = ( 0.2111111 -0.0000000 -0.0000000), wk = 0.0025253 k( 21) = ( 0.2222222 -0.0000000 -0.0000000), wk = 0.0025253 k( 22) = ( 0.2333333 -0.0000000 -0.0000000), wk = 0.0025253 k( 23) = ( 0.2444444 -0.0000000 -0.0000000), wk = 0.0025253 k( 24) = ( 0.2555556 -0.0000000 -0.0000000), wk = 0.0025253 k( 25) = ( 0.2666667 -0.0000000 -0.0000000), wk = 0.0025253 k( 26) = ( 0.2777778 -0.0000000 -0.0000000), wk = 0.0025253 k( 27) = ( 0.2888889 -0.0000000 -0.0000000), wk = 0.0025253 k( 28) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 29) = ( 0.3111111 -0.0000000 -0.0000000), wk = 0.0025253 k( 30) = ( 0.3222222 -0.0000000 -0.0000000), wk = 0.0025253 k( 31) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0025253 k( 32) = ( 0.3444444 -0.0000000 -0.0000000), wk = 0.0025253 k( 33) = ( 0.3555556 -0.0000000 -0.0000000), wk = 0.0025253 k( 34) = ( 0.3666667 -0.0000000 -0.0000000), wk = 0.0025253 k( 35) = ( 0.3777778 -0.0000000 -0.0000000), wk = 0.0025253 k( 36) = ( 0.3888889 -0.0000000 -0.0000000), wk = 0.0025253 k( 37) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 38) = ( 0.4111111 -0.0000000 -0.0000000), wk = 0.0025253 k( 39) = ( 0.4222222 -0.0000000 -0.0000000), wk = 0.0025253 k( 40) = ( 0.4333333 -0.0000000 -0.0000000), wk = 0.0025253 k( 41) = ( 0.4444444 -0.0000000 -0.0000000), wk = 0.0025253 k( 42) = ( 0.4555556 -0.0000000 -0.0000000), wk = 0.0025253 k( 43) = ( 0.4666667 -0.0000000 -0.0000000), wk = 0.0025253 k( 44) = ( 0.4777778 -0.0000000 -0.0000000), wk = 0.0025253 k( 45) = ( 0.4888889 -0.0000000 -0.0000000), wk = 0.0025253 k( 46) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 47) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 48) = ( 0.5000000 0.0107983 -0.0000000), wk = 0.0025253 k( 49) = ( 0.5000000 0.0215967 -0.0000000), wk = 0.0025253 k( 50) = ( 0.5000000 0.0323950 -0.0000000), wk = 0.0025253 k( 51) = ( 0.5000000 0.0431934 -0.0000000), wk = 0.0025253 k( 52) = ( 0.5000000 0.0539917 -0.0000000), wk = 0.0025253 k( 53) = ( 0.5000000 0.0647901 -0.0000000), wk = 0.0025253 k( 54) = ( 0.5000000 0.0755884 -0.0000000), wk = 0.0025253 k( 55) = ( 0.5000000 0.0863868 -0.0000000), wk = 0.0025253 k( 56) = ( 0.5000000 0.0971851 -0.0000000), wk = 0.0025253 k( 57) = ( 0.5000000 0.1079835 -0.0000000), wk = 0.0025253 k( 58) = ( 0.5000000 0.1187818 -0.0000000), wk = 0.0025253 k( 59) = ( 0.5000000 0.1295802 -0.0000000), wk = 0.0025253 k( 60) = ( 0.5000000 0.1403785 -0.0000000), wk = 0.0025253 k( 61) = ( 0.5000000 0.1511769 -0.0000000), wk = 0.0025253 k( 62) = ( 0.5000000 0.1619752 -0.0000000), wk = 0.0025253 k( 63) = ( 0.5000000 0.1727736 -0.0000000), wk = 0.0025253 k( 64) = ( 0.5000000 0.1835719 -0.0000000), wk = 0.0025253 k( 65) = ( 0.5000000 0.1943703 -0.0000000), wk = 0.0025253 k( 66) = ( 0.5000000 0.2051686 -0.0000000), wk = 0.0025253 k( 67) = ( 0.5000000 0.2159670 -0.0000000), wk = 0.0025253 k( 68) = ( 0.5000000 0.2267653 -0.0000000), wk = 0.0025253 k( 69) = ( 0.5000000 0.2375637 -0.0000000), wk = 0.0025253 k( 70) = ( 0.5000000 0.2483620 -0.0000000), wk = 0.0025253 k( 71) = ( 0.5000000 0.2591604 -0.0000000), wk = 0.0025253 k( 72) = ( 0.5000000 0.2699587 -0.0000000), wk = 0.0025253 k( 73) = ( 0.5000000 0.2807571 -0.0000000), wk = 0.0025253 k( 74) = ( 0.5000000 0.2915554 -0.0000000), wk = 0.0025253 k( 75) = ( 0.5000000 0.2915554 -0.0000000), wk = 0.0025253 k( 76) = ( 0.4888889 0.2915554 -0.0000000), wk = 0.0025253 k( 77) = ( 0.4777778 0.2915554 -0.0000000), wk = 0.0025253 k( 78) = ( 0.4666667 0.2915554 -0.0000000), wk = 0.0025253 k( 79) = ( 0.4555556 0.2915554 -0.0000000), wk = 0.0025253 k( 80) = ( 0.4444444 0.2915554 -0.0000000), wk = 0.0025253 k( 81) = ( 0.4333333 0.2915554 -0.0000000), wk = 0.0025253 k( 82) = ( 0.4222222 0.2915554 -0.0000000), wk = 0.0025253 k( 83) = ( 0.4111111 0.2915554 -0.0000000), wk = 0.0025253 k( 84) = ( 0.4000000 0.2915554 -0.0000000), wk = 0.0025253 k( 85) = ( 0.3888889 0.2915554 -0.0000000), wk = 0.0025253 k( 86) = ( 0.3777778 0.2915554 -0.0000000), wk = 0.0025253 k( 87) = ( 0.3666667 0.2915554 -0.0000000), wk = 0.0025253 k( 88) = ( 0.3555556 0.2915554 -0.0000000), wk = 0.0025253 k( 89) = ( 0.3444444 0.2915554 -0.0000000), wk = 0.0025253 k( 90) = ( 0.3333333 0.2915554 -0.0000000), wk = 0.0025253 k( 91) = ( 0.3222222 0.2915554 -0.0000000), wk = 0.0025253 k( 92) = ( 0.3111111 0.2915554 -0.0000000), wk = 0.0025253 k( 93) = ( 0.3000000 0.2915554 -0.0000000), wk = 0.0025253 k( 94) = ( 0.2888889 0.2915554 -0.0000000), wk = 0.0025253 k( 95) = ( 0.2777778 0.2915554 -0.0000000), wk = 0.0025253 k( 96) = ( 0.2666667 0.2915554 -0.0000000), wk = 0.0025253 k( 97) = ( 0.2555556 0.2915554 -0.0000000), wk = 0.0025253 k( 98) = ( 0.2444444 0.2915554 -0.0000000), wk = 0.0025253 k( 99) = ( 0.2333333 0.2915554 -0.0000000), wk = 0.0025253 k( 100) = ( 0.2222222 0.2915554 -0.0000000), wk = 0.0025253 k( 101) = ( 0.2111111 0.2915554 -0.0000000), wk = 0.0025253 k( 102) = ( 0.2000000 0.2915554 -0.0000000), wk = 0.0025253 k( 103) = ( 0.1888889 0.2915554 -0.0000000), wk = 0.0025253 k( 104) = ( 0.1777778 0.2915554 -0.0000000), wk = 0.0025253 k( 105) = ( 0.1666667 0.2915554 -0.0000000), wk = 0.0025253 k( 106) = ( 0.1555556 0.2915554 -0.0000000), wk = 0.0025253 k( 107) = ( 0.1444444 0.2915554 -0.0000000), wk = 0.0025253 k( 108) = ( 0.1333333 0.2915554 -0.0000000), wk = 0.0025253 k( 109) = ( 0.1222222 0.2915554 -0.0000000), wk = 0.0025253 k( 110) = ( 0.1111111 0.2915554 -0.0000000), wk = 0.0025253 k( 111) = ( 0.1000000 0.2915554 -0.0000000), wk = 0.0025253 k( 112) = ( 0.0888889 0.2915554 -0.0000000), wk = 0.0025253 k( 113) = ( 0.0777778 0.2915554 -0.0000000), wk = 0.0025253 k( 114) = ( 0.0666667 0.2915554 -0.0000000), wk = 0.0025253 k( 115) = ( 0.0555556 0.2915554 -0.0000000), wk = 0.0025253 k( 116) = ( 0.0444444 0.2915554 -0.0000000), wk = 0.0025253 k( 117) = ( 0.0333333 0.2915554 -0.0000000), wk = 0.0025253 k( 118) = ( 0.0222222 0.2915554 -0.0000000), wk = 0.0025253 k( 119) = ( 0.0111111 0.2915554 -0.0000000), wk = 0.0025253 k( 120) = ( 0.0000000 0.2915554 -0.0000000), wk = 0.0025253 k( 121) = ( 0.0000000 0.2915554 -0.0000000), wk = 0.0025253 k( 122) = ( 0.0000000 0.2807571 -0.0000000), wk = 0.0025253 k( 123) = ( 0.0000000 0.2699587 -0.0000000), wk = 0.0025253 k( 124) = ( 0.0000000 0.2591604 -0.0000000), wk = 0.0025253 k( 125) = ( 0.0000000 0.2483620 -0.0000000), wk = 0.0025253 k( 126) = ( 0.0000000 0.2375637 -0.0000000), wk = 0.0025253 k( 127) = ( 0.0000000 0.2267653 -0.0000000), wk = 0.0025253 k( 128) = ( 0.0000000 0.2159670 -0.0000000), wk = 0.0025253 k( 129) = ( 0.0000000 0.2051686 -0.0000000), wk = 0.0025253 k( 130) = ( 0.0000000 0.1943703 -0.0000000), wk = 0.0025253 k( 131) = ( 0.0000000 0.1835719 -0.0000000), wk = 0.0025253 k( 132) = ( 0.0000000 0.1727736 -0.0000000), wk = 0.0025253 k( 133) = ( 0.0000000 0.1619752 -0.0000000), wk = 0.0025253 k( 134) = ( 0.0000000 0.1511769 -0.0000000), wk = 0.0025253 k( 135) = ( 0.0000000 0.1403785 -0.0000000), wk = 0.0025253 k( 136) = ( 0.0000000 0.1295802 -0.0000000), wk = 0.0025253 k( 137) = ( 0.0000000 0.1187818 -0.0000000), wk = 0.0025253 k( 138) = ( 0.0000000 0.1079835 -0.0000000), wk = 0.0025253 k( 139) = ( 0.0000000 0.0971851 -0.0000000), wk = 0.0025253 k( 140) = ( 0.0000000 0.0863868 -0.0000000), wk = 0.0025253 k( 141) = ( 0.0000000 0.0755884 -0.0000000), wk = 0.0025253 k( 142) = ( 0.0000000 0.0647901 -0.0000000), wk = 0.0025253 k( 143) = ( 0.0000000 0.0539917 -0.0000000), wk = 0.0025253 k( 144) = ( 0.0000000 0.0431934 -0.0000000), wk = 0.0025253 k( 145) = ( 0.0000000 0.0323950 -0.0000000), wk = 0.0025253 k( 146) = ( 0.0000000 0.0215967 -0.0000000), wk = 0.0025253 k( 147) = ( 0.0000000 0.0107983 -0.0000000), wk = 0.0025253 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 149) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 150) = ( 0.0000000 0.0000000 0.0109412), wk = 0.0025253 k( 151) = ( 0.0000000 0.0000000 0.0218824), wk = 0.0025253 k( 152) = ( 0.0000000 0.0000000 0.0328235), wk = 0.0025253 k( 153) = ( 0.0000000 0.0000000 0.0437647), wk = 0.0025253 k( 154) = ( 0.0000000 0.0000000 0.0547059), wk = 0.0025253 k( 155) = ( 0.0000000 0.0000000 0.0656471), wk = 0.0025253 k( 156) = ( 0.0000000 0.0000000 0.0765883), wk = 0.0025253 k( 157) = ( 0.0000000 0.0000000 0.0875294), wk = 0.0025253 k( 158) = ( 0.0000000 0.0000000 0.0984706), wk = 0.0025253 k( 159) = ( 0.0000000 0.0000000 0.1094118), wk = 0.0025253 k( 160) = ( 0.0000000 0.0000000 0.1203530), wk = 0.0025253 k( 161) = ( 0.0000000 0.0000000 0.1312942), wk = 0.0025253 k( 162) = ( 0.0000000 0.0000000 0.1422353), wk = 0.0025253 k( 163) = ( 0.0000000 0.0000000 0.1531765), wk = 0.0025253 k( 164) = ( 0.0000000 0.0000000 0.1641177), wk = 0.0025253 k( 165) = ( 0.0000000 0.0000000 0.1750589), wk = 0.0025253 k( 166) = ( 0.0000000 0.0000000 0.1860001), wk = 0.0025253 k( 167) = ( 0.0000000 0.0000000 0.1969412), wk = 0.0025253 k( 168) = ( 0.0000000 0.0000000 0.2078824), wk = 0.0025253 k( 169) = ( 0.0000000 0.0000000 0.2188236), wk = 0.0025253 k( 170) = ( 0.0000000 0.0000000 0.2297648), wk = 0.0025253 k( 171) = ( 0.0000000 0.0000000 0.2407059), wk = 0.0025253 k( 172) = ( 0.0000000 0.0000000 0.2516471), wk = 0.0025253 k( 173) = ( 0.0000000 0.0000000 0.2625883), wk = 0.0025253 k( 174) = ( 0.0000000 0.0000000 0.2625883), wk = 0.0025253 k( 175) = ( 0.0111111 -0.0000000 0.2625883), wk = 0.0025253 k( 176) = ( 0.0222222 -0.0000000 0.2625883), wk = 0.0025253 k( 177) = ( 0.0333333 -0.0000000 0.2625883), wk = 0.0025253 k( 178) = ( 0.0444444 -0.0000000 0.2625883), wk = 0.0025253 k( 179) = ( 0.0555556 -0.0000000 0.2625883), wk = 0.0025253 k( 180) = ( 0.0666667 -0.0000000 0.2625883), wk = 0.0025253 k( 181) = ( 0.0777778 -0.0000000 0.2625883), wk = 0.0025253 k( 182) = ( 0.0888889 -0.0000000 0.2625883), wk = 0.0025253 k( 183) = ( 0.1000000 -0.0000000 0.2625883), wk = 0.0025253 k( 184) = ( 0.1111111 -0.0000000 0.2625883), wk = 0.0025253 k( 185) = ( 0.1222222 -0.0000000 0.2625883), wk = 0.0025253 k( 186) = ( 0.1333333 -0.0000000 0.2625883), wk = 0.0025253 k( 187) = ( 0.1444444 -0.0000000 0.2625883), wk = 0.0025253 k( 188) = ( 0.1555556 -0.0000000 0.2625883), wk = 0.0025253 k( 189) = ( 0.1666667 -0.0000000 0.2625883), wk = 0.0025253 k( 190) = ( 0.1777778 -0.0000000 0.2625883), wk = 0.0025253 k( 191) = ( 0.1888889 -0.0000000 0.2625883), wk = 0.0025253 k( 192) = ( 0.2000000 -0.0000000 0.2625883), wk = 0.0025253 k( 193) = ( 0.2111111 -0.0000000 0.2625883), wk = 0.0025253 k( 194) = ( 0.2222222 -0.0000000 0.2625883), wk = 0.0025253 k( 195) = ( 0.2333333 -0.0000000 0.2625883), wk = 0.0025253 k( 196) = ( 0.2444444 -0.0000000 0.2625883), wk = 0.0025253 k( 197) = ( 0.2555556 -0.0000000 0.2625883), wk = 0.0025253 k( 198) = ( 0.2666667 -0.0000000 0.2625883), wk = 0.0025253 k( 199) = ( 0.2777778 -0.0000000 0.2625883), wk = 0.0025253 k( 200) = ( 0.2888889 -0.0000000 0.2625883), wk = 0.0025253 k( 201) = ( 0.3000000 -0.0000000 0.2625883), wk = 0.0025253 k( 202) = ( 0.3111111 -0.0000000 0.2625883), wk = 0.0025253 k( 203) = ( 0.3222222 -0.0000000 0.2625883), wk = 0.0025253 k( 204) = ( 0.3333333 -0.0000000 0.2625883), wk = 0.0025253 k( 205) = ( 0.3444444 -0.0000000 0.2625883), wk = 0.0025253 k( 206) = ( 0.3555556 -0.0000000 0.2625883), wk = 0.0025253 k( 207) = ( 0.3666667 -0.0000000 0.2625883), wk = 0.0025253 k( 208) = ( 0.3777778 -0.0000000 0.2625883), wk = 0.0025253 k( 209) = ( 0.3888889 -0.0000000 0.2625883), wk = 0.0025253 k( 210) = ( 0.4000000 -0.0000000 0.2625883), wk = 0.0025253 k( 211) = ( 0.4111111 -0.0000000 0.2625883), wk = 0.0025253 k( 212) = ( 0.4222222 -0.0000000 0.2625883), wk = 0.0025253 k( 213) = ( 0.4333333 -0.0000000 0.2625883), wk = 0.0025253 k( 214) = ( 0.4444444 -0.0000000 0.2625883), wk = 0.0025253 k( 215) = ( 0.4555556 -0.0000000 0.2625883), wk = 0.0025253 k( 216) = ( 0.4666667 -0.0000000 0.2625883), wk = 0.0025253 k( 217) = ( 0.4777778 -0.0000000 0.2625883), wk = 0.0025253 k( 218) = ( 0.4888889 -0.0000000 0.2625883), wk = 0.0025253 k( 219) = ( 0.5000000 -0.0000000 0.2625883), wk = 0.0025253 k( 220) = ( 0.5000000 -0.0000000 0.2625883), wk = 0.0025253 k( 221) = ( 0.5000000 0.0107983 0.2625883), wk = 0.0025253 k( 222) = ( 0.5000000 0.0215967 0.2625883), wk = 0.0025253 k( 223) = ( 0.5000000 0.0323950 0.2625883), wk = 0.0025253 k( 224) = ( 0.5000000 0.0431934 0.2625883), wk = 0.0025253 k( 225) = ( 0.5000000 0.0539917 0.2625883), wk = 0.0025253 k( 226) = ( 0.5000000 0.0647901 0.2625883), wk = 0.0025253 k( 227) = ( 0.5000000 0.0755884 0.2625883), wk = 0.0025253 k( 228) = ( 0.5000000 0.0863868 0.2625883), wk = 0.0025253 k( 229) = ( 0.5000000 0.0971851 0.2625883), wk = 0.0025253 k( 230) = ( 0.5000000 0.1079835 0.2625883), wk = 0.0025253 k( 231) = ( 0.5000000 0.1187818 0.2625883), wk = 0.0025253 k( 232) = ( 0.5000000 0.1295802 0.2625883), wk = 0.0025253 k( 233) = ( 0.5000000 0.1403785 0.2625883), wk = 0.0025253 k( 234) = ( 0.5000000 0.1511769 0.2625883), wk = 0.0025253 k( 235) = ( 0.5000000 0.1619752 0.2625883), wk = 0.0025253 k( 236) = ( 0.5000000 0.1727736 0.2625883), wk = 0.0025253 k( 237) = ( 0.5000000 0.1835719 0.2625883), wk = 0.0025253 k( 238) = ( 0.5000000 0.1943703 0.2625883), wk = 0.0025253 k( 239) = ( 0.5000000 0.2051686 0.2625883), wk = 0.0025253 k( 240) = ( 0.5000000 0.2159670 0.2625883), wk = 0.0025253 k( 241) = ( 0.5000000 0.2267653 0.2625883), wk = 0.0025253 k( 242) = ( 0.5000000 0.2375637 0.2625883), wk = 0.0025253 k( 243) = ( 0.5000000 0.2483620 0.2625883), wk = 0.0025253 k( 244) = ( 0.5000000 0.2591604 0.2625883), wk = 0.0025253 k( 245) = ( 0.5000000 0.2699587 0.2625883), wk = 0.0025253 k( 246) = ( 0.5000000 0.2807571 0.2625883), wk = 0.0025253 k( 247) = ( 0.5000000 0.2915554 0.2625883), wk = 0.0025253 k( 248) = ( 0.5000000 0.2915554 0.2625883), wk = 0.0025253 k( 249) = ( 0.4888889 0.2915554 0.2625883), wk = 0.0025253 k( 250) = ( 0.4777778 0.2915554 0.2625883), wk = 0.0025253 k( 251) = ( 0.4666667 0.2915554 0.2625883), wk = 0.0025253 k( 252) = ( 0.4555556 0.2915554 0.2625883), wk = 0.0025253 k( 253) = ( 0.4444444 0.2915554 0.2625883), wk = 0.0025253 k( 254) = ( 0.4333333 0.2915554 0.2625883), wk = 0.0025253 k( 255) = ( 0.4222222 0.2915554 0.2625883), wk = 0.0025253 k( 256) = ( 0.4111111 0.2915554 0.2625883), wk = 0.0025253 k( 257) = ( 0.4000000 0.2915554 0.2625883), wk = 0.0025253 k( 258) = ( 0.3888889 0.2915554 0.2625883), wk = 0.0025253 k( 259) = ( 0.3777778 0.2915554 0.2625883), wk = 0.0025253 k( 260) = ( 0.3666667 0.2915554 0.2625883), wk = 0.0025253 k( 261) = ( 0.3555556 0.2915554 0.2625883), wk = 0.0025253 k( 262) = ( 0.3444444 0.2915554 0.2625883), wk = 0.0025253 k( 263) = ( 0.3333333 0.2915554 0.2625883), wk = 0.0025253 k( 264) = ( 0.3222222 0.2915554 0.2625883), wk = 0.0025253 k( 265) = ( 0.3111111 0.2915554 0.2625883), wk = 0.0025253 k( 266) = ( 0.3000000 0.2915554 0.2625883), wk = 0.0025253 k( 267) = ( 0.2888889 0.2915554 0.2625883), wk = 0.0025253 k( 268) = ( 0.2777778 0.2915554 0.2625883), wk = 0.0025253 k( 269) = ( 0.2666667 0.2915554 0.2625883), wk = 0.0025253 k( 270) = ( 0.2555556 0.2915554 0.2625883), wk = 0.0025253 k( 271) = ( 0.2444444 0.2915554 0.2625883), wk = 0.0025253 k( 272) = ( 0.2333333 0.2915554 0.2625883), wk = 0.0025253 k( 273) = ( 0.2222222 0.2915554 0.2625883), wk = 0.0025253 k( 274) = ( 0.2111111 0.2915554 0.2625883), wk = 0.0025253 k( 275) = ( 0.2000000 0.2915554 0.2625883), wk = 0.0025253 k( 276) = ( 0.1888889 0.2915554 0.2625883), wk = 0.0025253 k( 277) = ( 0.1777778 0.2915554 0.2625883), wk = 0.0025253 k( 278) = ( 0.1666667 0.2915554 0.2625883), wk = 0.0025253 k( 279) = ( 0.1555556 0.2915554 0.2625883), wk = 0.0025253 k( 280) = ( 0.1444444 0.2915554 0.2625883), wk = 0.0025253 k( 281) = ( 0.1333333 0.2915554 0.2625883), wk = 0.0025253 k( 282) = ( 0.1222222 0.2915554 0.2625883), wk = 0.0025253 k( 283) = ( 0.1111111 0.2915554 0.2625883), wk = 0.0025253 k( 284) = ( 0.1000000 0.2915554 0.2625883), wk = 0.0025253 k( 285) = ( 0.0888889 0.2915554 0.2625883), wk = 0.0025253 k( 286) = ( 0.0777778 0.2915554 0.2625883), wk = 0.0025253 k( 287) = ( 0.0666667 0.2915554 0.2625883), wk = 0.0025253 k( 288) = ( 0.0555556 0.2915554 0.2625883), wk = 0.0025253 k( 289) = ( 0.0444444 0.2915554 0.2625883), wk = 0.0025253 k( 290) = ( 0.0333333 0.2915554 0.2625883), wk = 0.0025253 k( 291) = ( 0.0222222 0.2915554 0.2625883), wk = 0.0025253 k( 292) = ( 0.0111111 0.2915554 0.2625883), wk = 0.0025253 k( 293) = ( 0.0000000 0.2915554 0.2625883), wk = 0.0025253 k( 294) = ( 0.0000000 0.2915554 0.2625883), wk = 0.0025253 k( 295) = ( 0.0000000 0.2807571 0.2625883), wk = 0.0025253 k( 296) = ( 0.0000000 0.2699587 0.2625883), wk = 0.0025253 k( 297) = ( 0.0000000 0.2591604 0.2625883), wk = 0.0025253 k( 298) = ( 0.0000000 0.2483620 0.2625883), wk = 0.0025253 k( 299) = ( 0.0000000 0.2375637 0.2625883), wk = 0.0025253 k( 300) = ( 0.0000000 0.2267653 0.2625883), wk = 0.0025253 k( 301) = ( 0.0000000 0.2159670 0.2625883), wk = 0.0025253 k( 302) = ( 0.0000000 0.2051686 0.2625883), wk = 0.0025253 k( 303) = ( 0.0000000 0.1943703 0.2625883), wk = 0.0025253 k( 304) = ( 0.0000000 0.1835719 0.2625883), wk = 0.0025253 k( 305) = ( 0.0000000 0.1727736 0.2625883), wk = 0.0025253 k( 306) = ( 0.0000000 0.1619752 0.2625883), wk = 0.0025253 k( 307) = ( 0.0000000 0.1511769 0.2625883), wk = 0.0025253 k( 308) = ( 0.0000000 0.1403785 0.2625883), wk = 0.0025253 k( 309) = ( 0.0000000 0.1295802 0.2625883), wk = 0.0025253 k( 310) = ( 0.0000000 0.1187818 0.2625883), wk = 0.0025253 k( 311) = ( 0.0000000 0.1079835 0.2625883), wk = 0.0025253 k( 312) = ( 0.0000000 0.0971851 0.2625883), wk = 0.0025253 k( 313) = ( 0.0000000 0.0863868 0.2625883), wk = 0.0025253 k( 314) = ( 0.0000000 0.0755884 0.2625883), wk = 0.0025253 k( 315) = ( 0.0000000 0.0647901 0.2625883), wk = 0.0025253 k( 316) = ( 0.0000000 0.0539917 0.2625883), wk = 0.0025253 k( 317) = ( 0.0000000 0.0431934 0.2625883), wk = 0.0025253 k( 318) = ( 0.0000000 0.0323950 0.2625883), wk = 0.0025253 k( 319) = ( 0.0000000 0.0215967 0.2625883), wk = 0.0025253 k( 320) = ( 0.0000000 0.0107983 0.2625883), wk = 0.0025253 k( 321) = ( 0.0000000 0.0000000 0.2625883), wk = 0.0025253 k( 322) = ( 0.0000000 0.2915554 -0.0000000), wk = 0.0025253 k( 323) = ( 0.0000000 0.2915554 0.0109412), wk = 0.0025253 k( 324) = ( 0.0000000 0.2915554 0.0218824), wk = 0.0025253 k( 325) = ( 0.0000000 0.2915554 0.0328235), wk = 0.0025253 k( 326) = ( 0.0000000 0.2915554 0.0437647), wk = 0.0025253 k( 327) = ( 0.0000000 0.2915554 0.0547059), wk = 0.0025253 k( 328) = ( 0.0000000 0.2915554 0.0656471), wk = 0.0025253 k( 329) = ( 0.0000000 0.2915554 0.0765883), wk = 0.0025253 k( 330) = ( 0.0000000 0.2915554 0.0875294), wk = 0.0025253 k( 331) = ( 0.0000000 0.2915554 0.0984706), wk = 0.0025253 k( 332) = ( 0.0000000 0.2915554 0.1094118), wk = 0.0025253 k( 333) = ( 0.0000000 0.2915554 0.1203530), wk = 0.0025253 k( 334) = ( 0.0000000 0.2915554 0.1312942), wk = 0.0025253 k( 335) = ( 0.0000000 0.2915554 0.1422353), wk = 0.0025253 k( 336) = ( 0.0000000 0.2915554 0.1531765), wk = 0.0025253 k( 337) = ( 0.0000000 0.2915554 0.1641177), wk = 0.0025253 k( 338) = ( 0.0000000 0.2915554 0.1750589), wk = 0.0025253 k( 339) = ( 0.0000000 0.2915554 0.1860001), wk = 0.0025253 k( 340) = ( 0.0000000 0.2915554 0.1969412), wk = 0.0025253 k( 341) = ( 0.0000000 0.2915554 0.2078824), wk = 0.0025253 k( 342) = ( 0.0000000 0.2915554 0.2188236), wk = 0.0025253 k( 343) = ( 0.0000000 0.2915554 0.2297648), wk = 0.0025253 k( 344) = ( 0.0000000 0.2915554 0.2407059), wk = 0.0025253 k( 345) = ( 0.0000000 0.2915554 0.2516471), wk = 0.0025253 k( 346) = ( 0.0000000 0.2915554 0.2625883), wk = 0.0025253 k( 347) = ( 0.5000000 -0.0000000 0.2625883), wk = 0.0025253 k( 348) = ( 0.5000000 -0.0000000 0.2516471), wk = 0.0025253 k( 349) = ( 0.5000000 -0.0000000 0.2407059), wk = 0.0025253 k( 350) = ( 0.5000000 -0.0000000 0.2297648), wk = 0.0025253 k( 351) = ( 0.5000000 -0.0000000 0.2188236), wk = 0.0025253 k( 352) = ( 0.5000000 -0.0000000 0.2078824), wk = 0.0025253 k( 353) = ( 0.5000000 -0.0000000 0.1969412), wk = 0.0025253 k( 354) = ( 0.5000000 -0.0000000 0.1860001), wk = 0.0025253 k( 355) = ( 0.5000000 -0.0000000 0.1750589), wk = 0.0025253 k( 356) = ( 0.5000000 -0.0000000 0.1641177), wk = 0.0025253 k( 357) = ( 0.5000000 -0.0000000 0.1531765), wk = 0.0025253 k( 358) = ( 0.5000000 -0.0000000 0.1422353), wk = 0.0025253 k( 359) = ( 0.5000000 -0.0000000 0.1312942), wk = 0.0025253 k( 360) = ( 0.5000000 -0.0000000 0.1203530), wk = 0.0025253 k( 361) = ( 0.5000000 -0.0000000 0.1094118), wk = 0.0025253 k( 362) = ( 0.5000000 -0.0000000 0.0984706), wk = 0.0025253 k( 363) = ( 0.5000000 -0.0000000 0.0875294), wk = 0.0025253 k( 364) = ( 0.5000000 -0.0000000 0.0765883), wk = 0.0025253 k( 365) = ( 0.5000000 -0.0000000 0.0656471), wk = 0.0025253 k( 366) = ( 0.5000000 -0.0000000 0.0547059), wk = 0.0025253 k( 367) = ( 0.5000000 -0.0000000 0.0437647), wk = 0.0025253 k( 368) = ( 0.5000000 -0.0000000 0.0328235), wk = 0.0025253 k( 369) = ( 0.5000000 -0.0000000 0.0218824), wk = 0.0025253 k( 370) = ( 0.5000000 -0.0000000 0.0109412), wk = 0.0025253 k( 371) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025253 k( 372) = ( 0.5000000 0.2915554 -0.0000000), wk = 0.0025253 k( 373) = ( 0.5000000 0.2915554 0.0109412), wk = 0.0025253 k( 374) = ( 0.5000000 0.2915554 0.0218824), wk = 0.0025253 k( 375) = ( 0.5000000 0.2915554 0.0328235), wk = 0.0025253 k( 376) = ( 0.5000000 0.2915554 0.0437647), wk = 0.0025253 k( 377) = ( 0.5000000 0.2915554 0.0547059), wk = 0.0025253 k( 378) = ( 0.5000000 0.2915554 0.0656471), wk = 0.0025253 k( 379) = ( 0.5000000 0.2915554 0.0765883), wk = 0.0025253 k( 380) = ( 0.5000000 0.2915554 0.0875294), wk = 0.0025253 k( 381) = ( 0.5000000 0.2915554 0.0984706), wk = 0.0025253 k( 382) = ( 0.5000000 0.2915554 0.1094118), wk = 0.0025253 k( 383) = ( 0.5000000 0.2915554 0.1203530), wk = 0.0025253 k( 384) = ( 0.5000000 0.2915554 0.1312942), wk = 0.0025253 k( 385) = ( 0.5000000 0.2915554 0.1422353), wk = 0.0025253 k( 386) = ( 0.5000000 0.2915554 0.1531765), wk = 0.0025253 k( 387) = ( 0.5000000 0.2915554 0.1641177), wk = 0.0025253 k( 388) = ( 0.5000000 0.2915554 0.1750589), wk = 0.0025253 k( 389) = ( 0.5000000 0.2915554 0.1860001), wk = 0.0025253 k( 390) = ( 0.5000000 0.2915554 0.1969412), wk = 0.0025253 k( 391) = ( 0.5000000 0.2915554 0.2078824), wk = 0.0025253 k( 392) = ( 0.5000000 0.2915554 0.2188236), wk = 0.0025253 k( 393) = ( 0.5000000 0.2915554 0.2297648), wk = 0.0025253 k( 394) = ( 0.5000000 0.2915554 0.2407059), wk = 0.0025253 k( 395) = ( 0.5000000 0.2915554 0.2516471), wk = 0.0025253 k( 396) = ( 0.5000000 0.2915554 0.2625883), wk = 0.0025253 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 2) = ( 0.0111111 0.0000000 0.0000000), wk = 0.0025253 k( 3) = ( 0.0222222 0.0000000 0.0000000), wk = 0.0025253 k( 4) = ( 0.0333333 0.0000000 0.0000000), wk = 0.0025253 k( 5) = ( 0.0444444 0.0000000 0.0000000), wk = 0.0025253 k( 6) = ( 0.0555556 0.0000000 -0.0000000), wk = 0.0025253 k( 7) = ( 0.0666667 0.0000000 0.0000000), wk = 0.0025253 k( 8) = ( 0.0777778 0.0000000 0.0000000), wk = 0.0025253 k( 9) = ( 0.0888889 0.0000000 0.0000000), wk = 0.0025253 k( 10) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0025253 k( 11) = ( 0.1111111 0.0000000 0.0000000), wk = 0.0025253 k( 12) = ( 0.1222222 0.0000000 -0.0000000), wk = 0.0025253 k( 13) = ( 0.1333333 0.0000000 0.0000000), wk = 0.0025253 k( 14) = ( 0.1444444 0.0000000 -0.0000000), wk = 0.0025253 k( 15) = ( 0.1555556 0.0000000 0.0000000), wk = 0.0025253 k( 16) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0025253 k( 17) = ( 0.1777778 0.0000000 0.0000000), wk = 0.0025253 k( 18) = ( 0.1888889 0.0000000 -0.0000000), wk = 0.0025253 k( 19) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0025253 k( 20) = ( 0.2111111 0.0000000 0.0000000), wk = 0.0025253 k( 21) = ( 0.2222222 0.0000000 0.0000000), wk = 0.0025253 k( 22) = ( 0.2333333 0.0000000 0.0000000), wk = 0.0025253 k( 23) = ( 0.2444444 0.0000000 -0.0000000), wk = 0.0025253 k( 24) = ( 0.2555556 0.0000000 0.0000000), wk = 0.0025253 k( 25) = ( 0.2666667 0.0000000 0.0000000), wk = 0.0025253 k( 26) = ( 0.2777778 0.0000000 -0.0000000), wk = 0.0025253 k( 27) = ( 0.2888889 0.0000000 0.0000000), wk = 0.0025253 k( 28) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0025253 k( 29) = ( 0.3111111 0.0000000 0.0000000), wk = 0.0025253 k( 30) = ( 0.3222222 0.0000000 0.0000000), wk = 0.0025253 k( 31) = ( 0.3333333 0.0000000 -0.0000000), wk = 0.0025253 k( 32) = ( 0.3444444 0.0000000 -0.0000000), wk = 0.0025253 k( 33) = ( 0.3555556 0.0000000 0.0000000), wk = 0.0025253 k( 34) = ( 0.3666667 0.0000000 -0.0000000), wk = 0.0025253 k( 35) = ( 0.3777778 0.0000000 -0.0000000), wk = 0.0025253 k( 36) = ( 0.3888889 0.0000000 0.0000000), wk = 0.0025253 k( 37) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0025253 k( 38) = ( 0.4111111 0.0000000 0.0000000), wk = 0.0025253 k( 39) = ( 0.4222222 0.0000000 0.0000000), wk = 0.0025253 k( 40) = ( 0.4333333 0.0000000 0.0000000), wk = 0.0025253 k( 41) = ( 0.4444444 0.0000000 0.0000000), wk = 0.0025253 k( 42) = ( 0.4555556 0.0000000 -0.0000000), wk = 0.0025253 k( 43) = ( 0.4666667 0.0000000 0.0000000), wk = 0.0025253 k( 44) = ( 0.4777778 0.0000000 0.0000000), wk = 0.0025253 k( 45) = ( 0.4888889 0.0000000 0.0000000), wk = 0.0025253 k( 46) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 47) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 48) = ( 0.5000000 0.0185185 0.0000000), wk = 0.0025253 k( 49) = ( 0.5000000 0.0370370 0.0000000), wk = 0.0025253 k( 50) = ( 0.5000000 0.0555556 0.0000000), wk = 0.0025253 k( 51) = ( 0.5000000 0.0740741 0.0000000), wk = 0.0025253 k( 52) = ( 0.5000000 0.0925926 0.0000000), wk = 0.0025253 k( 53) = ( 0.5000000 0.1111111 -0.0000000), wk = 0.0025253 k( 54) = ( 0.5000000 0.1296296 0.0000000), wk = 0.0025253 k( 55) = ( 0.5000000 0.1481481 0.0000000), wk = 0.0025253 k( 56) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0025253 k( 57) = ( 0.5000000 0.1851852 0.0000000), wk = 0.0025253 k( 58) = ( 0.5000000 0.2037037 0.0000000), wk = 0.0025253 k( 59) = ( 0.5000000 0.2222222 0.0000000), wk = 0.0025253 k( 60) = ( 0.5000000 0.2407407 0.0000000), wk = 0.0025253 k( 61) = ( 0.5000000 0.2592593 0.0000000), wk = 0.0025253 k( 62) = ( 0.5000000 0.2777778 0.0000000), wk = 0.0025253 k( 63) = ( 0.5000000 0.2962963 0.0000000), wk = 0.0025253 k( 64) = ( 0.5000000 0.3148148 0.0000000), wk = 0.0025253 k( 65) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0025253 k( 66) = ( 0.5000000 0.3518519 0.0000000), wk = 0.0025253 k( 67) = ( 0.5000000 0.3703704 -0.0000000), wk = 0.0025253 k( 68) = ( 0.5000000 0.3888889 0.0000000), wk = 0.0025253 k( 69) = ( 0.5000000 0.4074074 0.0000000), wk = 0.0025253 k( 70) = ( 0.5000000 0.4259259 0.0000000), wk = 0.0025253 k( 71) = ( 0.5000000 0.4444444 -0.0000000), wk = 0.0025253 k( 72) = ( 0.5000000 0.4629630 0.0000000), wk = 0.0025253 k( 73) = ( 0.5000000 0.4814815 -0.0000000), wk = 0.0025253 k( 74) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025253 k( 75) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025253 k( 76) = ( 0.4888889 0.5000000 -0.0000000), wk = 0.0025253 k( 77) = ( 0.4777778 0.5000000 -0.0000000), wk = 0.0025253 k( 78) = ( 0.4666667 0.5000000 -0.0000000), wk = 0.0025253 k( 79) = ( 0.4555556 0.5000000 -0.0000000), wk = 0.0025253 k( 80) = ( 0.4444444 0.5000000 -0.0000000), wk = 0.0025253 k( 81) = ( 0.4333333 0.5000000 -0.0000000), wk = 0.0025253 k( 82) = ( 0.4222222 0.5000000 0.0000000), wk = 0.0025253 k( 83) = ( 0.4111111 0.5000000 -0.0000000), wk = 0.0025253 k( 84) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0025253 k( 85) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0025253 k( 86) = ( 0.3777778 0.5000000 -0.0000000), wk = 0.0025253 k( 87) = ( 0.3666667 0.5000000 0.0000000), wk = 0.0025253 k( 88) = ( 0.3555556 0.5000000 0.0000000), wk = 0.0025253 k( 89) = ( 0.3444444 0.5000000 0.0000000), wk = 0.0025253 k( 90) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0025253 k( 91) = ( 0.3222222 0.5000000 -0.0000000), wk = 0.0025253 k( 92) = ( 0.3111111 0.5000000 0.0000000), wk = 0.0025253 k( 93) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0025253 k( 94) = ( 0.2888889 0.5000000 -0.0000000), wk = 0.0025253 k( 95) = ( 0.2777778 0.5000000 -0.0000000), wk = 0.0025253 k( 96) = ( 0.2666667 0.5000000 -0.0000000), wk = 0.0025253 k( 97) = ( 0.2555556 0.5000000 0.0000000), wk = 0.0025253 k( 98) = ( 0.2444444 0.5000000 -0.0000000), wk = 0.0025253 k( 99) = ( 0.2333333 0.5000000 0.0000000), wk = 0.0025253 k( 100) = ( 0.2222222 0.5000000 -0.0000000), wk = 0.0025253 k( 101) = ( 0.2111111 0.5000000 0.0000000), wk = 0.0025253 k( 102) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0025253 k( 103) = ( 0.1888889 0.5000000 0.0000000), wk = 0.0025253 k( 104) = ( 0.1777778 0.5000000 0.0000000), wk = 0.0025253 k( 105) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0025253 k( 106) = ( 0.1555556 0.5000000 0.0000000), wk = 0.0025253 k( 107) = ( 0.1444444 0.5000000 -0.0000000), wk = 0.0025253 k( 108) = ( 0.1333333 0.5000000 -0.0000000), wk = 0.0025253 k( 109) = ( 0.1222222 0.5000000 -0.0000000), wk = 0.0025253 k( 110) = ( 0.1111111 0.5000000 -0.0000000), wk = 0.0025253 k( 111) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0025253 k( 112) = ( 0.0888889 0.5000000 0.0000000), wk = 0.0025253 k( 113) = ( 0.0777778 0.5000000 -0.0000000), wk = 0.0025253 k( 114) = ( 0.0666667 0.5000000 -0.0000000), wk = 0.0025253 k( 115) = ( 0.0555556 0.5000000 -0.0000000), wk = 0.0025253 k( 116) = ( 0.0444444 0.5000000 -0.0000000), wk = 0.0025253 k( 117) = ( 0.0333333 0.5000000 -0.0000000), wk = 0.0025253 k( 118) = ( 0.0222222 0.5000000 -0.0000000), wk = 0.0025253 k( 119) = ( 0.0111111 0.5000000 -0.0000000), wk = 0.0025253 k( 120) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025253 k( 121) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025253 k( 122) = ( 0.0000000 0.4814815 -0.0000000), wk = 0.0025253 k( 123) = ( 0.0000000 0.4629630 -0.0000000), wk = 0.0025253 k( 124) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0025253 k( 125) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0025253 k( 126) = ( 0.0000000 0.4074074 -0.0000000), wk = 0.0025253 k( 127) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0025253 k( 128) = ( 0.0000000 0.3703704 0.0000000), wk = 0.0025253 k( 129) = ( 0.0000000 0.3518519 -0.0000000), wk = 0.0025253 k( 130) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0025253 k( 131) = ( 0.0000000 0.3148148 -0.0000000), wk = 0.0025253 k( 132) = ( 0.0000000 0.2962963 -0.0000000), wk = 0.0025253 k( 133) = ( 0.0000000 0.2777778 -0.0000000), wk = 0.0025253 k( 134) = ( 0.0000000 0.2592593 0.0000000), wk = 0.0025253 k( 135) = ( 0.0000000 0.2407407 -0.0000000), wk = 0.0025253 k( 136) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0025253 k( 137) = ( 0.0000000 0.2037037 0.0000000), wk = 0.0025253 k( 138) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0025253 k( 139) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0025253 k( 140) = ( 0.0000000 0.1481482 -0.0000000), wk = 0.0025253 k( 141) = ( 0.0000000 0.1296296 0.0000000), wk = 0.0025253 k( 142) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0025253 k( 143) = ( 0.0000000 0.0925926 -0.0000000), wk = 0.0025253 k( 144) = ( 0.0000000 0.0740741 0.0000000), wk = 0.0025253 k( 145) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0025253 k( 146) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0025253 k( 147) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0025253 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 149) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025253 k( 150) = ( 0.0000000 0.0000000 0.0208333), wk = 0.0025253 k( 151) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0025253 k( 152) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0025253 k( 153) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0025253 k( 154) = ( 0.0000000 0.0000000 0.1041667), wk = 0.0025253 k( 155) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0025253 k( 156) = ( 0.0000000 0.0000000 0.1458333), wk = 0.0025253 k( 157) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0025253 k( 158) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0025253 k( 159) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0025253 k( 160) = ( 0.0000000 0.0000000 0.2291667), wk = 0.0025253 k( 161) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0025253 k( 162) = ( 0.0000000 0.0000000 0.2708333), wk = 0.0025253 k( 163) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0025253 k( 164) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0025253 k( 165) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0025253 k( 166) = ( 0.0000000 0.0000000 0.3541667), wk = 0.0025253 k( 167) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0025253 k( 168) = ( 0.0000000 0.0000000 0.3958333), wk = 0.0025253 k( 169) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0025253 k( 170) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0025253 k( 171) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0025253 k( 172) = ( 0.0000000 0.0000000 0.4791667), wk = 0.0025253 k( 173) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 174) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 175) = ( 0.0111111 0.0000000 0.5000000), wk = 0.0025253 k( 176) = ( 0.0222222 0.0000000 0.5000000), wk = 0.0025253 k( 177) = ( 0.0333333 0.0000000 0.5000000), wk = 0.0025253 k( 178) = ( 0.0444444 0.0000000 0.5000000), wk = 0.0025253 k( 179) = ( 0.0555556 0.0000000 0.5000000), wk = 0.0025253 k( 180) = ( 0.0666667 0.0000000 0.5000000), wk = 0.0025253 k( 181) = ( 0.0777778 0.0000000 0.5000000), wk = 0.0025253 k( 182) = ( 0.0888889 0.0000000 0.5000000), wk = 0.0025253 k( 183) = ( 0.1000000 0.0000000 0.5000000), wk = 0.0025253 k( 184) = ( 0.1111111 0.0000000 0.5000000), wk = 0.0025253 k( 185) = ( 0.1222222 0.0000000 0.5000000), wk = 0.0025253 k( 186) = ( 0.1333333 0.0000000 0.5000000), wk = 0.0025253 k( 187) = ( 0.1444444 0.0000000 0.5000000), wk = 0.0025253 k( 188) = ( 0.1555556 0.0000000 0.5000000), wk = 0.0025253 k( 189) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0025253 k( 190) = ( 0.1777778 0.0000000 0.5000000), wk = 0.0025253 k( 191) = ( 0.1888889 0.0000000 0.5000000), wk = 0.0025253 k( 192) = ( 0.2000000 0.0000000 0.5000000), wk = 0.0025253 k( 193) = ( 0.2111111 0.0000000 0.5000000), wk = 0.0025253 k( 194) = ( 0.2222222 0.0000000 0.5000000), wk = 0.0025253 k( 195) = ( 0.2333333 0.0000000 0.5000000), wk = 0.0025253 k( 196) = ( 0.2444444 0.0000000 0.5000000), wk = 0.0025253 k( 197) = ( 0.2555556 0.0000000 0.5000000), wk = 0.0025253 k( 198) = ( 0.2666667 0.0000000 0.5000000), wk = 0.0025253 k( 199) = ( 0.2777778 0.0000000 0.5000000), wk = 0.0025253 k( 200) = ( 0.2888889 0.0000000 0.5000000), wk = 0.0025253 k( 201) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0025253 k( 202) = ( 0.3111111 0.0000000 0.5000000), wk = 0.0025253 k( 203) = ( 0.3222222 0.0000000 0.5000000), wk = 0.0025253 k( 204) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0025253 k( 205) = ( 0.3444444 0.0000000 0.5000000), wk = 0.0025253 k( 206) = ( 0.3555556 0.0000000 0.5000000), wk = 0.0025253 k( 207) = ( 0.3666667 0.0000000 0.5000000), wk = 0.0025253 k( 208) = ( 0.3777778 0.0000000 0.5000000), wk = 0.0025253 k( 209) = ( 0.3888889 0.0000000 0.5000000), wk = 0.0025253 k( 210) = ( 0.4000000 0.0000000 0.5000000), wk = 0.0025253 k( 211) = ( 0.4111111 0.0000000 0.5000000), wk = 0.0025253 k( 212) = ( 0.4222222 0.0000000 0.5000000), wk = 0.0025253 k( 213) = ( 0.4333333 0.0000000 0.5000000), wk = 0.0025253 k( 214) = ( 0.4444444 0.0000000 0.5000000), wk = 0.0025253 k( 215) = ( 0.4555556 0.0000000 0.5000000), wk = 0.0025253 k( 216) = ( 0.4666667 0.0000000 0.5000000), wk = 0.0025253 k( 217) = ( 0.4777778 0.0000000 0.5000000), wk = 0.0025253 k( 218) = ( 0.4888889 0.0000000 0.5000000), wk = 0.0025253 k( 219) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 220) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 221) = ( 0.5000000 0.0185185 0.5000000), wk = 0.0025253 k( 222) = ( 0.5000000 0.0370370 0.5000000), wk = 0.0025253 k( 223) = ( 0.5000000 0.0555556 0.5000000), wk = 0.0025253 k( 224) = ( 0.5000000 0.0740741 0.5000000), wk = 0.0025253 k( 225) = ( 0.5000000 0.0925926 0.5000000), wk = 0.0025253 k( 226) = ( 0.5000000 0.1111111 0.5000000), wk = 0.0025253 k( 227) = ( 0.5000000 0.1296296 0.5000000), wk = 0.0025253 k( 228) = ( 0.5000000 0.1481481 0.5000000), wk = 0.0025253 k( 229) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0025253 k( 230) = ( 0.5000000 0.1851852 0.5000000), wk = 0.0025253 k( 231) = ( 0.5000000 0.2037037 0.5000000), wk = 0.0025253 k( 232) = ( 0.5000000 0.2222222 0.5000000), wk = 0.0025253 k( 233) = ( 0.5000000 0.2407407 0.5000000), wk = 0.0025253 k( 234) = ( 0.5000000 0.2592593 0.5000000), wk = 0.0025253 k( 235) = ( 0.5000000 0.2777778 0.5000000), wk = 0.0025253 k( 236) = ( 0.5000000 0.2962963 0.5000000), wk = 0.0025253 k( 237) = ( 0.5000000 0.3148148 0.5000000), wk = 0.0025253 k( 238) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0025253 k( 239) = ( 0.5000000 0.3518519 0.5000000), wk = 0.0025253 k( 240) = ( 0.5000000 0.3703704 0.5000000), wk = 0.0025253 k( 241) = ( 0.5000000 0.3888889 0.5000000), wk = 0.0025253 k( 242) = ( 0.5000000 0.4074074 0.5000000), wk = 0.0025253 k( 243) = ( 0.5000000 0.4259259 0.5000000), wk = 0.0025253 k( 244) = ( 0.5000000 0.4444444 0.5000000), wk = 0.0025253 k( 245) = ( 0.5000000 0.4629630 0.5000000), wk = 0.0025253 k( 246) = ( 0.5000000 0.4814815 0.5000000), wk = 0.0025253 k( 247) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 k( 248) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 k( 249) = ( 0.4888889 0.5000000 0.5000000), wk = 0.0025253 k( 250) = ( 0.4777778 0.5000000 0.5000000), wk = 0.0025253 k( 251) = ( 0.4666667 0.5000000 0.5000000), wk = 0.0025253 k( 252) = ( 0.4555556 0.5000000 0.5000000), wk = 0.0025253 k( 253) = ( 0.4444444 0.5000000 0.5000000), wk = 0.0025253 k( 254) = ( 0.4333333 0.5000000 0.5000000), wk = 0.0025253 k( 255) = ( 0.4222222 0.5000000 0.5000000), wk = 0.0025253 k( 256) = ( 0.4111111 0.5000000 0.5000000), wk = 0.0025253 k( 257) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0025253 k( 258) = ( 0.3888889 0.5000000 0.5000000), wk = 0.0025253 k( 259) = ( 0.3777778 0.5000000 0.5000000), wk = 0.0025253 k( 260) = ( 0.3666667 0.5000000 0.5000000), wk = 0.0025253 k( 261) = ( 0.3555556 0.5000000 0.5000000), wk = 0.0025253 k( 262) = ( 0.3444444 0.5000000 0.5000000), wk = 0.0025253 k( 263) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0025253 k( 264) = ( 0.3222222 0.5000000 0.5000000), wk = 0.0025253 k( 265) = ( 0.3111111 0.5000000 0.5000000), wk = 0.0025253 k( 266) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0025253 k( 267) = ( 0.2888889 0.5000000 0.5000000), wk = 0.0025253 k( 268) = ( 0.2777778 0.5000000 0.5000000), wk = 0.0025253 k( 269) = ( 0.2666667 0.5000000 0.5000000), wk = 0.0025253 k( 270) = ( 0.2555556 0.5000000 0.5000000), wk = 0.0025253 k( 271) = ( 0.2444444 0.5000000 0.5000000), wk = 0.0025253 k( 272) = ( 0.2333333 0.5000000 0.5000000), wk = 0.0025253 k( 273) = ( 0.2222222 0.5000000 0.5000000), wk = 0.0025253 k( 274) = ( 0.2111111 0.5000000 0.5000000), wk = 0.0025253 k( 275) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0025253 k( 276) = ( 0.1888889 0.5000000 0.5000000), wk = 0.0025253 k( 277) = ( 0.1777778 0.5000000 0.5000000), wk = 0.0025253 k( 278) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0025253 k( 279) = ( 0.1555556 0.5000000 0.5000000), wk = 0.0025253 k( 280) = ( 0.1444444 0.5000000 0.5000000), wk = 0.0025253 k( 281) = ( 0.1333333 0.5000000 0.5000000), wk = 0.0025253 k( 282) = ( 0.1222222 0.5000000 0.5000000), wk = 0.0025253 k( 283) = ( 0.1111111 0.5000000 0.5000000), wk = 0.0025253 k( 284) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0025253 k( 285) = ( 0.0888889 0.5000000 0.5000000), wk = 0.0025253 k( 286) = ( 0.0777778 0.5000000 0.5000000), wk = 0.0025253 k( 287) = ( 0.0666667 0.5000000 0.5000000), wk = 0.0025253 k( 288) = ( 0.0555556 0.5000000 0.5000000), wk = 0.0025253 k( 289) = ( 0.0444444 0.5000000 0.5000000), wk = 0.0025253 k( 290) = ( 0.0333333 0.5000000 0.5000000), wk = 0.0025253 k( 291) = ( 0.0222222 0.5000000 0.5000000), wk = 0.0025253 k( 292) = ( 0.0111111 0.5000000 0.5000000), wk = 0.0025253 k( 293) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 294) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 295) = ( 0.0000000 0.4814815 0.5000000), wk = 0.0025253 k( 296) = ( 0.0000000 0.4629630 0.5000000), wk = 0.0025253 k( 297) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0025253 k( 298) = ( 0.0000000 0.4259259 0.5000000), wk = 0.0025253 k( 299) = ( 0.0000000 0.4074074 0.5000000), wk = 0.0025253 k( 300) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0025253 k( 301) = ( 0.0000000 0.3703704 0.5000000), wk = 0.0025253 k( 302) = ( 0.0000000 0.3518519 0.5000000), wk = 0.0025253 k( 303) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0025253 k( 304) = ( 0.0000000 0.3148148 0.5000000), wk = 0.0025253 k( 305) = ( 0.0000000 0.2962963 0.5000000), wk = 0.0025253 k( 306) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0025253 k( 307) = ( 0.0000000 0.2592593 0.5000000), wk = 0.0025253 k( 308) = ( 0.0000000 0.2407407 0.5000000), wk = 0.0025253 k( 309) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0025253 k( 310) = ( 0.0000000 0.2037037 0.5000000), wk = 0.0025253 k( 311) = ( 0.0000000 0.1851852 0.5000000), wk = 0.0025253 k( 312) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0025253 k( 313) = ( 0.0000000 0.1481482 0.5000000), wk = 0.0025253 k( 314) = ( 0.0000000 0.1296296 0.5000000), wk = 0.0025253 k( 315) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0025253 k( 316) = ( 0.0000000 0.0925926 0.5000000), wk = 0.0025253 k( 317) = ( 0.0000000 0.0740741 0.5000000), wk = 0.0025253 k( 318) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0025253 k( 319) = ( 0.0000000 0.0370370 0.5000000), wk = 0.0025253 k( 320) = ( 0.0000000 0.0185185 0.5000000), wk = 0.0025253 k( 321) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025253 k( 322) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025253 k( 323) = ( 0.0000000 0.5000000 0.0208333), wk = 0.0025253 k( 324) = ( 0.0000000 0.5000000 0.0416667), wk = 0.0025253 k( 325) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0025253 k( 326) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0025253 k( 327) = ( 0.0000000 0.5000000 0.1041667), wk = 0.0025253 k( 328) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0025253 k( 329) = ( 0.0000000 0.5000000 0.1458333), wk = 0.0025253 k( 330) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0025253 k( 331) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0025253 k( 332) = ( 0.0000000 0.5000000 0.2083333), wk = 0.0025253 k( 333) = ( 0.0000000 0.5000000 0.2291667), wk = 0.0025253 k( 334) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0025253 k( 335) = ( 0.0000000 0.5000000 0.2708333), wk = 0.0025253 k( 336) = ( 0.0000000 0.5000000 0.2916667), wk = 0.0025253 k( 337) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0025253 k( 338) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0025253 k( 339) = ( 0.0000000 0.5000000 0.3541667), wk = 0.0025253 k( 340) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0025253 k( 341) = ( 0.0000000 0.5000000 0.3958333), wk = 0.0025253 k( 342) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0025253 k( 343) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0025253 k( 344) = ( 0.0000000 0.5000000 0.4583333), wk = 0.0025253 k( 345) = ( 0.0000000 0.5000000 0.4791667), wk = 0.0025253 k( 346) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025253 k( 347) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025253 k( 348) = ( 0.5000000 0.0000000 0.4791667), wk = 0.0025253 k( 349) = ( 0.5000000 0.0000000 0.4583333), wk = 0.0025253 k( 350) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0025253 k( 351) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0025253 k( 352) = ( 0.5000000 0.0000000 0.3958333), wk = 0.0025253 k( 353) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0025253 k( 354) = ( 0.5000000 0.0000000 0.3541667), wk = 0.0025253 k( 355) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0025253 k( 356) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0025253 k( 357) = ( 0.5000000 0.0000000 0.2916667), wk = 0.0025253 k( 358) = ( 0.5000000 0.0000000 0.2708333), wk = 0.0025253 k( 359) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0025253 k( 360) = ( 0.5000000 0.0000000 0.2291667), wk = 0.0025253 k( 361) = ( 0.5000000 0.0000000 0.2083333), wk = 0.0025253 k( 362) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0025253 k( 363) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0025253 k( 364) = ( 0.5000000 0.0000000 0.1458333), wk = 0.0025253 k( 365) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0025253 k( 366) = ( 0.5000000 0.0000000 0.1041667), wk = 0.0025253 k( 367) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0025253 k( 368) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0025253 k( 369) = ( 0.5000000 0.0000000 0.0416667), wk = 0.0025253 k( 370) = ( 0.5000000 0.0000000 0.0208333), wk = 0.0025253 k( 371) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025253 k( 372) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025253 k( 373) = ( 0.5000000 0.5000000 0.0208333), wk = 0.0025253 k( 374) = ( 0.5000000 0.5000000 0.0416667), wk = 0.0025253 k( 375) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0025253 k( 376) = ( 0.5000000 0.5000000 0.0833333), wk = 0.0025253 k( 377) = ( 0.5000000 0.5000000 0.1041667), wk = 0.0025253 k( 378) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0025253 k( 379) = ( 0.5000000 0.5000000 0.1458333), wk = 0.0025253 k( 380) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0025253 k( 381) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0025253 k( 382) = ( 0.5000000 0.5000000 0.2083333), wk = 0.0025253 k( 383) = ( 0.5000000 0.5000000 0.2291667), wk = 0.0025253 k( 384) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0025253 k( 385) = ( 0.5000000 0.5000000 0.2708333), wk = 0.0025253 k( 386) = ( 0.5000000 0.5000000 0.2916667), wk = 0.0025253 k( 387) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0025253 k( 388) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0025253 k( 389) = ( 0.5000000 0.5000000 0.3541667), wk = 0.0025253 k( 390) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0025253 k( 391) = ( 0.5000000 0.5000000 0.3958333), wk = 0.0025253 k( 392) = ( 0.5000000 0.5000000 0.4166667), wk = 0.0025253 k( 393) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0025253 k( 394) = ( 0.5000000 0.5000000 0.4583333), wk = 0.0025253 k( 395) = ( 0.5000000 0.5000000 0.4791667), wk = 0.0025253 k( 396) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025253 Dense grid: 155109 G-vectors FFT dimensions: ( 45, 80, 90) Smooth grid: 43555 G-vectors FFT dimensions: ( 30, 54, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.37 Mb ( 356, 68) NL pseudopotentials 0.55 Mb ( 178, 204) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.04 Mb ( 4847) G-vector shells 0.02 Mb ( 2342) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.48 Mb ( 356, 272) Each subspace H/S matrix 1.13 Mb ( 272, 272) Each matrix 0.42 Mb ( 204, 2, 68) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CrCl2.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.8 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 7.8 secs Computing kpt #: 4 total cpu time spent up to now is 9.3 secs Computing kpt #: 5 total cpu time spent up to now is 10.8 secs Computing kpt #: 6 total cpu time spent up to now is 12.4 secs Computing kpt #: 7 total cpu time spent up to now is 13.9 secs Computing kpt #: 8 total cpu time spent up to now is 15.5 secs Computing kpt #: 9 total cpu time spent up to now is 17.0 secs Computing kpt #: 10 total cpu time spent up to now is 18.5 secs Computing kpt #: 11 total cpu time spent up to now is 20.0 secs Computing kpt #: 12 total cpu time spent up to now is 21.6 secs Computing kpt #: 13 total cpu time spent up to now is 23.1 secs Computing kpt #: 14 total cpu time spent up to now is 26.6 secs Computing kpt #: 15 total cpu time spent up to now is 29.2 secs Computing kpt #: 16 total cpu time spent up to now is 30.7 secs Computing kpt #: 17 total cpu time spent up to now is 32.2 secs Computing kpt #: 18 total cpu time spent up to now is 33.7 secs Computing kpt #: 19 total cpu time spent up to now is 35.1 secs Computing kpt #: 20 total cpu time spent up to now is 36.6 secs Computing kpt #: 21 total cpu time spent up to now is 38.1 secs Computing kpt #: 22 total cpu time spent up to now is 39.5 secs Computing kpt #: 23 total cpu time spent up to now is 41.0 secs Computing kpt #: 24 total cpu time spent up to now is 42.4 secs Computing kpt #: 25 total cpu time spent up to now is 43.8 secs Computing kpt #: 26 total cpu time spent up to now is 45.2 secs Computing kpt #: 27 total cpu time spent up to now is 46.7 secs Computing kpt #: 28 total cpu time spent up to now is 48.1 secs Computing kpt #: 29 total cpu time spent up to now is 49.6 secs Computing kpt #: 30 total cpu time spent up to now is 51.0 secs Computing kpt #: 31 total cpu time spent up to now is 52.5 secs Computing kpt #: 32 total cpu time spent up to now is 54.0 secs Computing kpt #: 33 total cpu time spent up to now is 55.4 secs Computing kpt #: 34 total cpu time spent up to now is 56.9 secs Computing kpt #: 35 total cpu time spent up to now is 58.3 secs Computing kpt #: 36 total cpu time spent up to now is 59.8 secs Computing kpt #: 37 total cpu time spent up to now is 61.2 secs Computing kpt #: 38 total cpu time spent up to now is 62.7 secs Computing kpt #: 39 total cpu time spent up to now is 64.2 secs Computing kpt #: 40 total cpu time spent up to now is 65.6 secs Computing kpt #: 41 total cpu time spent up to now is 67.0 secs Computing kpt #: 42 total cpu time spent up to now is 68.5 secs Computing kpt #: 43 total cpu time spent up to now is 69.9 secs Computing kpt #: 44 total cpu time spent up to now is 71.4 secs Computing kpt #: 45 total cpu time spent up to now is 72.8 secs Computing kpt #: 46 total cpu time spent up to now is 74.2 secs Computing kpt #: 47 total cpu time spent up to now is 75.6 secs Computing kpt #: 48 total cpu time spent up to now is 77.1 secs Computing kpt #: 49 total cpu time spent up to now is 78.5 secs Computing kpt #: 50 total cpu time spent up to now is 80.0 secs Computing kpt #: 51 total cpu time spent up to now is 81.4 secs Computing kpt #: 52 total cpu time spent up to now is 82.9 secs Computing kpt #: 53 total cpu time spent up to now is 84.3 secs Computing kpt #: 54 total cpu time spent up to now is 85.8 secs Computing kpt #: 55 total cpu time spent up to now is 87.3 secs Computing kpt #: 56 total cpu time spent up to now is 88.7 secs Computing kpt #: 57 total cpu time spent up to now is 90.2 secs Computing kpt #: 58 total cpu time spent up to now is 91.7 secs Computing kpt #: 59 total cpu time spent up to now is 93.2 secs Computing kpt #: 60 total cpu time spent up to now is 94.7 secs Computing kpt #: 61 total cpu time spent up to now is 96.2 secs Computing kpt #: 62 total cpu time spent up to now is 97.6 secs Computing kpt #: 63 total cpu time spent up to now is 99.1 secs Computing kpt #: 64 total cpu time spent up to now is 100.6 secs Computing kpt #: 65 total cpu time spent up to now is 102.1 secs Computing kpt #: 66 total cpu time spent up to now is 103.6 secs Computing kpt #: 67 total cpu time spent up to now is 105.1 secs Computing kpt #: 68 total cpu time spent up to now is 106.6 secs Computing kpt #: 69 total cpu time spent up to now is 108.1 secs Computing kpt #: 70 total cpu time spent up to now is 109.5 secs Computing kpt #: 71 total cpu time spent up to now is 111.0 secs Computing kpt #: 72 total cpu time spent up to now is 112.5 secs Computing kpt #: 73 total cpu time spent up to now is 114.0 secs Computing kpt #: 74 total cpu time spent up to now is 115.5 secs Computing kpt #: 75 total cpu time spent up to now is 116.9 secs Computing kpt #: 76 total cpu time spent up to now is 118.4 secs Computing kpt #: 77 total cpu time spent up to now is 119.9 secs Computing kpt #: 78 total cpu time spent up to now is 121.4 secs Computing kpt #: 79 total cpu time spent up to now is 122.9 secs Computing kpt #: 80 total cpu time spent up to now is 124.4 secs Computing kpt #: 81 total cpu time spent up to now is 125.9 secs Computing kpt #: 82 total cpu time spent up to now is 127.4 secs Computing kpt #: 83 total cpu time spent up to now is 128.9 secs Computing kpt #: 84 total cpu time spent up to now is 130.4 secs Computing kpt #: 85 total cpu time spent up to now is 131.9 secs Computing kpt #: 86 total cpu time spent up to now is 133.4 secs Computing kpt #: 87 total cpu time spent up to now is 134.9 secs Computing kpt #: 88 total cpu time spent up to now is 136.4 secs Computing kpt #: 89 total cpu time spent up to now is 137.9 secs Computing kpt #: 90 total cpu time spent up to now is 139.4 secs Computing kpt #: 91 total cpu time spent up to now is 140.9 secs Computing kpt #: 92 total cpu time spent up to now is 142.5 secs Computing kpt #: 93 total cpu time spent up to now is 144.0 secs Computing kpt #: 94 total cpu time spent up to now is 145.5 secs Computing kpt #: 95 total cpu time spent up to now is 147.0 secs Computing kpt #: 96 total cpu time spent up to now is 148.5 secs Computing kpt #: 97 total cpu time spent up to now is 150.0 secs Computing kpt #: 98 total cpu time spent up to now is 151.5 secs Computing kpt #: 99 total cpu time spent up to now is 153.0 secs Computing kpt #: 100 total cpu time spent up to now is 154.5 secs Computing kpt #: 101 total cpu time spent up to now is 156.0 secs Computing kpt #: 102 total cpu time spent up to now is 157.4 secs Computing kpt #: 103 total cpu time spent up to now is 158.9 secs Computing kpt #: 104 total cpu time spent up to now is 160.4 secs Computing kpt #: 105 total cpu time spent up to now is 161.9 secs Computing kpt #: 106 total cpu time spent up to now is 163.4 secs Computing kpt #: 107 total cpu time spent up to now is 164.9 secs Computing kpt #: 108 total cpu time spent up to now is 166.3 secs Computing kpt #: 109 total cpu time spent up to now is 167.8 secs Computing kpt #: 110 total cpu time spent up to now is 169.3 secs Computing kpt #: 111 total cpu time spent up to now is 170.8 secs Computing kpt #: 112 total cpu time spent up to now is 172.3 secs Computing kpt #: 113 total cpu time spent up to now is 173.8 secs Computing kpt #: 114 total cpu time spent up to now is 175.2 secs Computing kpt #: 115 total cpu time spent up to now is 176.7 secs Computing kpt #: 116 total cpu time spent up to now is 178.2 secs Computing kpt #: 117 total cpu 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up to now is 201.8 secs Computing kpt #: 133 total cpu time spent up to now is 203.4 secs Computing kpt #: 134 total cpu time spent up to now is 204.9 secs Computing kpt #: 135 total cpu time spent up to now is 206.4 secs Computing kpt #: 136 total cpu time spent up to now is 207.9 secs Computing kpt #: 137 total cpu time spent up to now is 209.4 secs Computing kpt #: 138 total cpu time spent up to now is 211.0 secs Computing kpt #: 139 total cpu time spent up to now is 212.5 secs Computing kpt #: 140 total cpu time spent up to now is 214.1 secs Computing kpt #: 141 total cpu time spent up to now is 215.6 secs Computing kpt #: 142 total cpu time spent up to now is 217.1 secs Computing kpt #: 143 total cpu time spent up to now is 218.6 secs Computing kpt #: 144 total cpu time spent up to now is 220.2 secs Computing kpt #: 145 total cpu time spent up to now is 221.7 secs Computing kpt #: 146 total cpu time spent up to now is 223.3 secs Computing kpt #: 147 total cpu time spent up to now is 224.8 secs Computing kpt #: 148 total cpu time spent up to now is 226.3 secs Computing kpt #: 149 total cpu time spent up to now is 227.8 secs Computing kpt #: 150 total cpu time spent up to now is 229.3 secs Computing kpt #: 151 total cpu time spent up to now is 230.8 secs Computing kpt #: 152 total cpu time spent up to now is 232.4 secs Computing kpt #: 153 total cpu time spent up to now is 233.9 secs Computing kpt #: 154 total cpu time spent up to now is 235.4 secs Computing kpt #: 155 total cpu time spent up to now is 237.0 secs Computing kpt #: 156 total cpu time spent up to now is 238.5 secs Computing kpt #: 157 total cpu time spent up to now is 240.0 secs Computing kpt #: 158 total cpu time spent up to now is 241.5 secs Computing kpt #: 159 total cpu time spent up to now is 243.1 secs Computing kpt #: 160 total cpu time spent up to now is 244.6 secs Computing kpt #: 161 total cpu time spent up to now is 246.0 secs Computing kpt #: 162 total cpu time spent up to now is 247.6 secs Computing kpt #: 163 total cpu time spent up to now is 249.0 secs Computing kpt #: 164 total cpu time spent up to now is 250.5 secs Computing kpt #: 165 total cpu time spent up to now is 252.0 secs Computing kpt #: 166 total cpu time spent up to now is 253.4 secs Computing kpt #: 167 total cpu time spent up to now is 254.9 secs Computing kpt #: 168 total cpu time spent up to now is 256.3 secs Computing kpt #: 169 total cpu time spent up to now is 257.8 secs Computing kpt #: 170 total cpu time spent up to now is 259.3 secs Computing kpt #: 171 total cpu time spent up to now is 260.7 secs Computing kpt #: 172 total cpu time spent up to now is 262.2 secs Computing kpt #: 173 total cpu time spent up to now is 263.6 secs Computing kpt #: 174 total cpu time spent up to now is 265.1 secs Computing kpt #: 175 total cpu time spent up to now is 266.5 secs Computing kpt #: 176 total cpu time spent up to now is 268.0 secs Computing kpt #: 177 total cpu time spent up to now is 269.5 secs Computing kpt #: 178 total cpu time spent up to now is 271.0 secs Computing kpt #: 179 total cpu time spent up to now is 272.5 secs Computing kpt #: 180 total cpu time spent up to now is 273.9 secs Computing kpt #: 181 total cpu time spent up to now is 275.4 secs Computing kpt #: 182 total cpu time spent up to now is 276.9 secs Computing kpt #: 183 total cpu time spent up to now is 278.5 secs Computing kpt #: 184 total cpu time spent up to now is 279.9 secs Computing kpt #: 185 total cpu time spent up to now is 281.5 secs Computing kpt #: 186 total cpu time spent up to now is 283.0 secs Computing kpt #: 187 total cpu time spent up to now is 284.5 secs Computing kpt #: 188 total cpu time spent up to now is 285.9 secs Computing kpt #: 189 total cpu time spent up to now is 287.4 secs Computing kpt #: 190 total cpu time spent up to now is 288.9 secs Computing kpt #: 191 total cpu time spent up to now is 290.4 secs Computing kpt #: 192 total cpu time spent up to now is 291.9 secs Computing kpt #: 193 total cpu time spent up to now is 293.4 secs Computing kpt #: 194 total cpu time spent up to now is 295.0 secs Computing kpt #: 195 total cpu time spent up to now is 296.5 secs Computing kpt #: 196 total cpu time spent up to now is 298.0 secs Computing kpt #: 197 total cpu time spent up to now is 299.6 secs Computing kpt #: 198 total cpu time spent up to now is 301.1 secs Computing kpt #: 199 total cpu time spent up to now is 302.6 secs Computing kpt #: 200 total cpu time spent up to now is 304.2 secs Computing kpt #: 201 total cpu time spent up to now is 305.7 secs Computing kpt #: 202 total cpu time spent up to now is 307.2 secs Computing kpt #: 203 total cpu time spent up to now is 308.8 secs Computing kpt #: 204 total cpu time spent up to now is 310.3 secs Computing kpt #: 205 total cpu time spent up to now is 311.9 secs Computing kpt #: 206 total cpu time spent up to now is 313.4 secs Computing kpt #: 207 total cpu time spent up to now is 315.0 secs Computing kpt #: 208 total cpu time spent up to now is 316.5 secs Computing kpt #: 209 total cpu time spent up to now is 318.1 secs Computing kpt #: 210 total cpu time spent up to now is 319.6 secs Computing kpt #: 211 total cpu time spent up to now is 321.2 secs Computing kpt #: 212 total cpu time spent up to now is 322.7 secs Computing kpt #: 213 total cpu time spent up to now is 324.6 secs Computing kpt #: 214 total cpu time spent up to now is 329.0 secs Computing kpt #: 215 total cpu time spent up to now is 330.6 secs Computing kpt #: 216 total cpu time spent up to now is 332.1 secs Computing kpt #: 217 total cpu time spent up to now is 333.7 secs Computing kpt #: 218 total cpu time spent up to now is 335.2 secs Computing kpt #: 219 total cpu time spent up to now is 336.8 secs Computing kpt #: 220 total cpu time spent up to now is 338.3 secs Computing kpt #: 221 total cpu time spent up to now is 339.8 secs Computing kpt #: 222 total cpu time spent up to now is 341.4 secs Computing kpt #: 223 total cpu time spent up to now is 342.9 secs Computing kpt #: 224 total cpu time spent up to now is 344.5 secs Computing kpt #: 225 total cpu time spent up to now is 346.1 secs Computing kpt #: 226 total cpu time spent up to now is 347.6 secs Computing kpt #: 227 total cpu time spent up to now is 349.2 secs Computing kpt #: 228 total cpu time spent up to now is 350.7 secs Computing kpt #: 229 total cpu time spent up to now is 352.2 secs Computing kpt #: 230 total cpu time spent up to now is 353.7 secs Computing kpt #: 231 total cpu time spent up to now is 355.2 secs Computing kpt #: 232 total cpu time spent up to now is 356.7 secs Computing kpt #: 233 total cpu time spent up to now is 358.3 secs Computing kpt #: 234 total cpu time spent up to now is 359.8 secs Computing kpt #: 235 total cpu time spent up to now is 361.3 secs Computing kpt #: 236 total cpu time spent up to now is 362.8 secs Computing kpt #: 237 total cpu time spent up to now is 364.3 secs Computing kpt #: 238 total cpu time spent up to now is 365.8 secs Computing kpt #: 239 total cpu time spent up to now is 367.3 secs Computing kpt #: 240 total cpu time spent up to now is 368.8 secs Computing kpt #: 241 total cpu time spent up to now is 370.3 secs Computing kpt #: 242 total cpu time spent up to now is 371.8 secs Computing kpt #: 243 total cpu time spent up to now is 373.2 secs Computing kpt #: 244 total cpu time spent up to now is 374.7 secs Computing kpt #: 245 total cpu time spent up to now is 376.2 secs Computing kpt #: 246 total cpu time spent up to now is 377.7 secs Computing kpt #: 247 total cpu time spent up to now is 379.1 secs Computing kpt #: 248 total cpu time spent up to now is 380.6 secs Computing kpt #: 249 total cpu time spent up to now is 382.1 secs Computing kpt #: 250 total cpu time spent up to now is 383.6 secs Computing kpt #: 251 total cpu time spent up to now is 385.0 secs Computing kpt #: 252 total cpu time spent up to now is 386.4 secs Computing kpt #: 253 total cpu time spent up to now is 387.9 secs Computing kpt #: 254 total cpu time spent up to now is 389.4 secs Computing kpt #: 255 total cpu time spent up to now is 390.8 secs Computing kpt #: 256 total cpu time spent up to now is 392.2 secs Computing kpt #: 257 total cpu time spent up to now is 393.7 secs Computing kpt #: 258 total cpu time spent up to now is 395.1 secs Computing kpt #: 259 total cpu time spent up to now is 396.5 secs Computing kpt #: 260 total cpu time spent up to now is 398.0 secs Computing kpt #: 261 total cpu time spent up to now is 399.4 secs Computing kpt #: 262 total cpu time spent up to now is 400.9 secs Computing kpt #: 263 total cpu time spent up to now is 402.3 secs Computing kpt #: 264 total cpu time spent up to now is 403.7 secs Computing kpt #: 265 total cpu time spent up to now is 405.2 secs Computing kpt #: 266 total cpu time spent up to now is 406.7 secs Computing kpt #: 267 total cpu time spent up to now is 408.1 secs Computing kpt #: 268 total cpu time spent up to now is 409.6 secs Computing kpt #: 269 total cpu time spent up to now is 411.1 secs Computing kpt #: 270 total cpu time spent up to now is 412.5 secs Computing kpt #: 271 total cpu time spent up to now is 414.0 secs Computing kpt #: 272 total cpu time spent up to now is 415.5 secs Computing kpt #: 273 total cpu time spent up to now is 417.0 secs Computing kpt #: 274 total cpu time spent up to now is 418.5 secs Computing kpt #: 275 total cpu time spent up to now is 420.0 secs Computing kpt #: 276 total cpu time spent up to now is 421.5 secs Computing kpt #: 277 total cpu time spent up to now is 423.1 secs Computing kpt #: 278 total cpu time spent up to now is 424.6 secs Computing kpt #: 279 total cpu time spent up to now is 426.1 secs Computing kpt #: 280 total cpu time spent up to now is 427.6 secs Computing kpt #: 281 total cpu time spent up to now is 429.1 secs Computing kpt #: 282 total cpu time spent up to now is 430.6 secs Computing kpt #: 283 total cpu time spent up to now is 432.2 secs Computing kpt #: 284 total cpu time spent up to now is 433.7 secs Computing kpt #: 285 total cpu time spent up to now is 435.2 secs Computing kpt #: 286 total cpu time spent up to now is 436.7 secs Computing kpt #: 287 total cpu time spent up to now is 438.3 secs Computing kpt #: 288 total cpu time spent up to now is 439.7 secs Computing kpt #: 289 total cpu time spent up to now is 441.2 secs Computing kpt #: 290 total cpu time spent up to now is 442.7 secs Computing kpt #: 291 total cpu time spent up to now is 444.3 secs Computing kpt #: 292 total cpu time spent up to now is 445.8 secs Computing kpt #: 293 total cpu time spent up to now is 447.3 secs Computing kpt #: 294 total cpu time spent up to now is 448.8 secs Computing kpt #: 295 total cpu time spent up to now is 450.3 secs Computing kpt #: 296 total cpu time spent up to now is 451.8 secs Computing kpt #: 297 total cpu time spent up to now is 453.3 secs Computing kpt #: 298 total cpu time spent up to now is 454.8 secs Computing kpt #: 299 total cpu time spent up to now is 456.3 secs Computing kpt #: 300 total cpu time spent up to now is 457.8 secs Computing kpt #: 301 total cpu time spent up to now is 459.3 secs Computing kpt #: 302 total cpu time spent up to now is 460.9 secs Computing kpt #: 303 total cpu time spent up to now is 462.4 secs Computing kpt #: 304 total cpu time spent up to now is 463.9 secs Computing kpt #: 305 total cpu time spent up to now is 465.4 secs Computing kpt #: 306 total cpu time spent up to now is 466.9 secs Computing kpt #: 307 total cpu time spent up to now is 468.4 secs Computing kpt #: 308 total cpu time spent up to now is 469.9 secs Computing kpt #: 309 total cpu time spent up to now is 471.4 secs Computing kpt #: 310 total cpu time spent up to now is 472.9 secs Computing kpt #: 311 total cpu time spent up to now is 474.4 secs Computing kpt #: 312 total cpu time spent up to now is 475.9 secs Computing kpt #: 313 total cpu time spent up to now is 477.4 secs Computing kpt #: 314 total cpu time spent up to now is 478.9 secs Computing kpt #: 315 total cpu time spent up to now is 480.3 secs Computing kpt #: 316 total cpu time spent up to now is 481.8 secs Computing kpt #: 317 total cpu time spent up to now is 483.2 secs Computing kpt #: 318 total cpu time spent up to now is 484.7 secs Computing kpt #: 319 total cpu time spent up to now is 486.1 secs Computing kpt #: 320 total cpu time spent up to now is 487.6 secs Computing kpt #: 321 total cpu time spent up to now is 489.0 secs Computing kpt #: 322 total cpu time spent up to now is 490.5 secs Computing kpt #: 323 total cpu time spent up to now is 491.9 secs Computing kpt #: 324 total cpu time spent up to now is 493.4 secs Computing kpt #: 325 total cpu time spent up to now is 494.9 secs Computing kpt #: 326 total cpu time spent up to now is 496.3 secs Computing kpt #: 327 total cpu time spent up to now is 497.8 secs Computing kpt #: 328 total cpu time spent up to now is 499.3 secs Computing kpt #: 329 total cpu 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up to now is 523.5 secs Computing kpt #: 345 total cpu time spent up to now is 524.9 secs Computing kpt #: 346 total cpu time spent up to now is 526.4 secs Computing kpt #: 347 total cpu time spent up to now is 528.0 secs Computing kpt #: 348 total cpu time spent up to now is 529.5 secs Computing kpt #: 349 total cpu time spent up to now is 531.1 secs Computing kpt #: 350 total cpu time spent up to now is 532.6 secs Computing kpt #: 351 total cpu time spent up to now is 534.1 secs Computing kpt #: 352 total cpu time spent up to now is 535.7 secs Computing kpt #: 353 total cpu time spent up to now is 537.2 secs Computing kpt #: 354 total cpu time spent up to now is 538.7 secs Computing kpt #: 355 total cpu time spent up to now is 540.2 secs Computing kpt #: 356 total cpu time spent up to now is 541.7 secs Computing kpt #: 357 total cpu time spent up to now is 543.2 secs Computing kpt #: 358 total cpu time spent up to now is 544.7 secs Computing kpt #: 359 total cpu time spent up to now is 546.3 secs Computing kpt #: 360 total cpu time spent up to now is 547.8 secs Computing kpt #: 361 total cpu time spent up to now is 549.3 secs Computing kpt #: 362 total cpu time spent up to now is 550.8 secs Computing kpt #: 363 total cpu time spent up to now is 552.3 secs Computing kpt #: 364 total cpu time spent up to now is 553.8 secs Computing kpt #: 365 total cpu time spent up to now is 555.3 secs Computing kpt #: 366 total cpu time spent up to now is 556.7 secs Computing kpt #: 367 total cpu time spent up to now is 558.2 secs Computing kpt #: 368 total cpu time spent up to now is 559.7 secs Computing kpt #: 369 total cpu time spent up to now is 561.1 secs Computing kpt #: 370 total cpu time spent up to now is 562.5 secs Computing kpt #: 371 total cpu time spent up to now is 564.0 secs Computing kpt #: 372 total cpu time spent up to now is 565.5 secs Computing kpt #: 373 total cpu time spent up to now is 567.0 secs Computing kpt #: 374 total cpu time spent up to now is 568.4 secs Computing kpt #: 375 total cpu time spent up to now is 570.0 secs Computing kpt #: 376 total cpu time spent up to now is 571.5 secs Computing kpt #: 377 total cpu time spent up to now is 573.0 secs Computing kpt #: 378 total cpu time spent up to now is 574.5 secs Computing kpt #: 379 total cpu time spent up to now is 576.0 secs Computing kpt #: 380 total cpu time spent up to now is 577.5 secs Computing kpt #: 381 total cpu time spent up to now is 579.0 secs Computing kpt #: 382 total cpu time spent up to now is 580.5 secs Computing kpt #: 383 total cpu time spent up to now is 582.0 secs Computing kpt #: 384 total cpu time spent up to now is 583.5 secs Computing kpt #: 385 total cpu time spent up to now is 585.0 secs Computing kpt #: 386 total cpu time spent up to now is 586.4 secs Computing kpt #: 387 total cpu time spent up to now is 587.9 secs Computing kpt #: 388 total cpu time spent up to now is 589.4 secs Computing kpt #: 389 total cpu time spent up to now is 590.9 secs Computing kpt #: 390 total cpu time spent up to now is 592.4 secs Computing kpt #: 391 total cpu time spent up to now is 593.9 secs Computing kpt #: 392 total cpu time spent up to now is 595.3 secs Computing kpt #: 393 total cpu time spent up to now is 596.8 secs Computing kpt #: 394 total cpu time spent up to now is 598.3 secs Computing kpt #: 395 total cpu time spent up to now is 599.7 secs Computing kpt #: 396 total cpu time spent up to now is 601.2 secs ethr = 1.79E-11, avg # of iterations = 18.2 total cpu time spent up to now is 601.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9578 -10.9578 -10.4509 -10.4509 -10.2387 -10.2387 -10.2337 -10.2337 -0.8470 -0.8470 0.2406 0.2406 0.6125 0.6125 0.6609 0.6609 1.2250 1.2250 1.2381 1.2381 1.3873 1.3873 1.8822 1.8822 2.2989 2.2989 2.3933 2.3933 2.6218 2.6218 2.6911 2.6911 5.1894 5.1894 5.1939 5.1939 5.8311 5.8311 5.8689 5.8689 5.9211 5.9211 5.9533 5.9533 6.4164 6.4164 6.8397 6.8397 7.3527 7.3527 7.3654 7.3654 k = 0.0111-0.0000-0.0000 ( 5451 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9572 -10.9572 -10.4506 -10.4506 -10.2385 -10.2385 -10.2336 -10.2336 -0.8460 -0.8460 0.2412 0.2412 0.6120 0.6120 0.6617 0.6617 1.2250 1.2250 1.2336 1.2336 1.3911 1.3911 1.8782 1.8782 2.2990 2.2990 2.3892 2.3892 2.6207 2.6207 2.6904 2.6904 5.1913 5.1913 5.1957 5.1957 5.8313 5.8313 5.8691 5.8691 5.9212 5.9212 5.9534 5.9534 6.4160 6.4160 6.8396 6.8396 7.3510 7.3510 7.3637 7.3637 k = 0.0222-0.0000-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9170 -36.9170 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9555 -10.9555 -10.4496 -10.4496 -10.2381 -10.2381 -10.2331 -10.2331 -0.8431 -0.8431 0.2432 0.2432 0.6106 0.6106 0.6642 0.6642 1.2212 1.2212 1.2250 1.2250 1.4015 1.4015 1.8663 1.8663 2.2990 2.2990 2.3772 2.3772 2.6173 2.6173 2.6882 2.6882 5.1968 5.1968 5.2008 5.2008 5.8321 5.8321 5.8697 5.8697 5.9212 5.9212 5.9540 5.9540 6.4149 6.4149 6.8394 6.8394 7.3459 7.3459 7.3586 7.3586 k = 0.0333-0.0000-0.0000 ( 5449 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9170 -36.9170 -36.9166 -36.9166 -36.7973 -36.7973 -36.7971 -36.7971 -10.9526 -10.9526 -10.4479 -10.4479 -10.2374 -10.2374 -10.2324 -10.2324 -0.8384 -0.8384 0.2464 0.2464 0.6083 0.6083 0.6682 0.6682 1.2034 1.2034 1.2250 1.2250 1.4159 1.4159 1.8466 1.8466 2.2982 2.2982 2.3577 2.3577 2.6118 2.6118 2.6845 2.6845 5.2055 5.2055 5.2096 5.2096 5.8334 5.8334 5.8705 5.8705 5.9211 5.9211 5.9551 5.9551 6.4131 6.4131 6.8390 6.8390 7.3376 7.3376 7.3504 7.3504 k = 0.0444-0.0000-0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8944 -37.8944 -37.8940 -37.8940 -36.9170 -36.9170 -36.9167 -36.9167 -36.7974 -36.7974 -36.7972 -36.7972 -10.9486 -10.9486 -10.4456 -10.4456 -10.2365 -10.2365 -10.2315 -10.2315 -0.8317 -0.8317 0.2509 0.2509 0.6051 0.6051 0.6740 0.6740 1.1822 1.1822 1.2250 1.2250 1.4324 1.4324 1.8195 1.8195 2.2938 2.2938 2.3341 2.3341 2.6044 2.6044 2.6793 2.6793 5.2168 5.2168 5.2223 5.2223 5.8352 5.8352 5.8713 5.8713 5.9207 5.9207 5.9573 5.9573 6.4105 6.4105 6.8383 6.8383 7.3263 7.3263 7.3393 7.3393 k = 0.0556-0.0000-0.0000 ( 5449 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8944 -37.8944 -37.8940 -37.8940 -36.9171 -36.9171 -36.9167 -36.9167 -36.7975 -36.7975 -36.7972 -36.7972 -10.9435 -10.9435 -10.4426 -10.4426 -10.2352 -10.2352 -10.2303 -10.2303 -0.8232 -0.8232 0.2567 0.2567 0.6010 0.6010 0.6813 0.6813 1.1590 1.1590 1.2251 1.2251 1.4495 1.4495 1.7856 1.7856 2.2737 2.2737 2.3183 2.3183 2.5953 2.5953 2.6726 2.6726 5.2303 5.2303 5.2384 5.2384 5.8375 5.8375 5.8721 5.8721 5.9199 5.9199 5.9608 5.9608 6.4072 6.4072 6.8372 6.8372 7.3125 7.3125 7.3258 7.3258 k = 0.0667-0.0000-0.0000 ( 5445 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8945 -37.8945 -37.8941 -37.8941 -36.9171 -36.9171 -36.9168 -36.9168 -36.7976 -36.7976 -36.7973 -36.7973 -10.9372 -10.9372 -10.4390 -10.4390 -10.2337 -10.2337 -10.2288 -10.2288 -0.8128 -0.8128 0.2636 0.2636 0.5960 0.5960 0.6901 0.6901 1.1344 1.1344 1.2252 1.2252 1.4664 1.4664 1.7454 1.7454 2.2338 2.2338 2.3151 2.3151 2.5845 2.5845 2.6644 2.6644 5.2461 5.2461 5.2575 5.2575 5.8403 5.8403 5.8723 5.8723 5.9187 5.9187 5.9658 5.9658 6.4033 6.4033 6.8356 6.8356 7.2964 7.2964 7.3103 7.3103 k = 0.0778-0.0000-0.0000 ( 5453 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8946 -37.8946 -37.8941 -37.8941 -36.9172 -36.9172 -36.9169 -36.9169 -36.7977 -36.7977 -36.7975 -36.7975 -10.9299 -10.9299 -10.4348 -10.4348 -10.2320 -10.2320 -10.2271 -10.2271 -0.8006 -0.8006 0.2718 0.2718 0.5903 0.5903 0.7005 0.7005 1.1090 1.1090 1.2256 1.2256 1.4824 1.4824 1.6998 1.6998 2.1831 2.1831 2.3159 2.3159 2.5721 2.5721 2.6547 2.6547 5.2638 5.2638 5.2788 5.2788 5.8436 5.8436 5.8715 5.8715 5.9177 5.9177 5.9723 5.9723 6.3987 6.3987 6.8334 6.8334 7.2786 7.2786 7.2931 7.2931 k = 0.0889-0.0000-0.0000 ( 5469 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8947 -37.8947 -37.8942 -37.8942 -36.9173 -36.9173 -36.9170 -36.9170 -36.7979 -36.7979 -36.7976 -36.7976 -10.9215 -10.9215 -10.4300 -10.4300 -10.2299 -10.2299 -10.2251 -10.2251 -0.7866 -0.7866 0.2810 0.2810 0.5838 0.5838 0.7124 0.7124 1.0832 1.0832 1.2261 1.2261 1.4963 1.4963 1.6502 1.6502 2.1248 2.1248 2.3180 2.3180 2.5581 2.5581 2.6434 2.6434 5.2833 5.2833 5.3019 5.3019 5.8473 5.8473 5.8692 5.8692 5.9172 5.9172 5.9804 5.9804 6.3935 6.3935 6.8303 6.8303 7.2596 7.2596 7.2749 7.2749 k = 0.1000-0.0000-0.0000 ( 5465 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8948 -37.8948 -37.8943 -37.8943 -36.9174 -36.9174 -36.9171 -36.9171 -36.7980 -36.7980 -36.7978 -36.7978 -10.9121 -10.9121 -10.4246 -10.4246 -10.2277 -10.2277 -10.2229 -10.2229 -0.7708 -0.7708 0.2913 0.2913 0.5767 0.5767 0.7258 0.7258 1.0572 1.0572 1.2269 1.2269 1.5052 1.5052 1.6001 1.6001 2.0603 2.0603 2.3208 2.3208 2.5424 2.5424 2.6306 2.6306 5.3044 5.3044 5.3264 5.3264 5.8514 5.8514 5.8653 5.8653 5.9178 5.9178 5.9899 5.9899 6.3877 6.3877 6.8264 6.8264 7.2399 7.2399 7.2561 7.2561 k = 0.1111-0.0000-0.0000 ( 5469 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8949 -37.8949 -37.8944 -37.8944 -36.9176 -36.9176 -36.9172 -36.9172 -36.7982 -36.7982 -36.7979 -36.7979 -10.9016 -10.9016 -10.4187 -10.4187 -10.2252 -10.2252 -10.2204 -10.2204 -0.7534 -0.7534 0.3027 0.3027 0.5689 0.5689 0.7405 0.7405 1.0312 1.0312 1.2279 1.2279 1.4948 1.4948 1.5642 1.5642 1.9905 1.9905 2.3240 2.3240 2.5250 2.5250 2.6161 2.6161 5.3267 5.3267 5.3517 5.3517 5.8539 5.8539 5.8615 5.8615 5.9196 5.9196 6.0006 6.0006 6.3815 6.3815 6.8215 6.8215 7.2200 7.2200 7.2373 7.2373 k = 0.1222-0.0000-0.0000 ( 5463 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8950 -37.8950 -37.8945 -37.8945 -36.9177 -36.9177 -36.9173 -36.9173 -36.7983 -36.7983 -36.7981 -36.7981 -10.8901 -10.8901 -10.4123 -10.4123 -10.2225 -10.2225 -10.2178 -10.2178 -0.7344 -0.7344 0.3150 0.3150 0.5605 0.5605 0.7565 0.7565 1.0054 1.0054 1.2291 1.2291 1.4488 1.4488 1.5595 1.5595 1.9162 1.9162 2.3274 2.3274 2.5059 2.5059 2.5999 2.5999 5.3501 5.3501 5.3776 5.3776 5.8487 5.8487 5.8642 5.8642 5.9226 5.9226 6.0123 6.0123 6.3749 6.3749 6.8154 6.8154 7.2004 7.2004 7.2189 7.2189 k = 0.1333-0.0000-0.0000 ( 5449 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8951 -37.8951 -37.8946 -37.8946 -36.9178 -36.9178 -36.9175 -36.9175 -36.7985 -36.7985 -36.7982 -36.7982 -10.8777 -10.8777 -10.4055 -10.4055 -10.2196 -10.2196 -10.2149 -10.2149 -0.7138 -0.7138 0.3282 0.3282 0.5517 0.5517 0.7735 0.7735 0.9800 0.9800 1.2306 1.2306 1.3878 1.3878 1.5661 1.5661 1.8381 1.8381 2.3310 2.3310 2.4851 2.4851 2.5820 2.5820 5.3744 5.3744 5.4037 5.4037 5.8395 5.8395 5.8700 5.8700 5.9264 5.9264 6.0247 6.0247 6.3680 6.3680 6.8081 6.8081 7.1816 7.1816 7.2012 7.2012 k = 0.1444-0.0000-0.0000 ( 5449 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8952 -37.8952 -37.8947 -37.8947 -36.9179 -36.9179 -36.9176 -36.9176 -36.7987 -36.7987 -36.7984 -36.7984 -10.8643 -10.8643 -10.3983 -10.3983 -10.2165 -10.2165 -10.2119 -10.2119 -0.6917 -0.6917 0.3421 0.3421 0.5426 0.5426 0.7913 0.7913 0.9551 0.9551 1.2317 1.2317 1.3228 1.3228 1.5741 1.5741 1.7567 1.7567 2.3347 2.3347 2.4628 2.4628 2.5624 2.5624 5.3994 5.3994 5.4295 5.4295 5.8285 5.8285 5.8766 5.8766 5.9311 5.9311 6.0375 6.0375 6.3610 6.3610 6.7994 6.7994 7.1640 7.1640 7.1846 7.1846 k = 0.1556-0.0000-0.0000 ( 5451 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8953 -37.8953 -37.8949 -37.8949 -36.9181 -36.9181 -36.9178 -36.9178 -36.7989 -36.7989 -36.7986 -36.7986 -10.8501 -10.8501 -10.3907 -10.3907 -10.2132 -10.2132 -10.2086 -10.2086 -0.6682 -0.6682 0.3568 0.3568 0.5332 0.5332 0.8094 0.8094 0.9310 0.9310 1.2277 1.2277 1.2615 1.2615 1.5814 1.5814 1.6729 1.6729 2.3383 2.3383 2.4389 2.4389 2.5410 2.5410 5.4250 5.4250 5.4549 5.4549 5.8164 5.8164 5.8839 5.8839 5.9365 5.9365 6.0502 6.0502 6.3542 6.3542 6.7895 6.7895 7.1479 7.1479 7.1694 7.1694 k = 0.1667-0.0000-0.0000 ( 5447 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8955 -37.8955 -37.8950 -37.8950 -36.9182 -36.9182 -36.9179 -36.9179 -36.7991 -36.7991 -36.7989 -36.7989 -10.8351 -10.8351 -10.3829 -10.3829 -10.2098 -10.2098 -10.2053 -10.2053 -0.6434 -0.6434 0.3720 0.3720 0.5236 0.5236 0.8262 0.8262 0.9085 0.9085 1.1808 1.1808 1.2436 1.2436 1.5811 1.5811 1.5935 1.5935 2.3418 2.3418 2.4137 2.4137 2.5179 2.5179 5.4511 5.4511 5.4799 5.4799 5.8032 5.8032 5.8918 5.8918 5.9424 5.9424 6.0624 6.0624 6.3477 6.3477 6.7781 6.7781 7.1337 7.1337 7.1559 7.1559 k = 0.1778-0.0000-0.0000 ( 5455 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8956 -37.8956 -37.8952 -37.8952 -36.9184 -36.9184 -36.9181 -36.9181 -36.7994 -36.7994 -36.7991 -36.7991 -10.8192 -10.8192 -10.3747 -10.3747 -10.2062 -10.2062 -10.2017 -10.2017 -0.6174 -0.6174 0.3877 0.3877 0.5140 0.5140 0.8383 0.8383 0.8895 0.8895 1.1176 1.1176 1.2449 1.2449 1.4985 1.4985 1.5932 1.5932 2.3451 2.3451 2.3874 2.3874 2.4931 2.4931 5.4776 5.4776 5.5042 5.5042 5.7892 5.7892 5.9001 5.9001 5.9487 5.9487 6.0736 6.0736 6.3420 6.3420 6.7653 6.7653 7.1215 7.1215 7.1443 7.1443 k = 0.1889-0.0000-0.0000 ( 5445 PWs) bands (ev): -65.8241 -65.8241 -65.8238 -65.8238 -37.8958 -37.8958 -37.8953 -37.8953 -36.9186 -36.9186 -36.9183 -36.9183 -36.7996 -36.7996 -36.7993 -36.7993 -10.8026 -10.8026 -10.3664 -10.3664 -10.2025 -10.2025 -10.1981 -10.1981 -0.5903 -0.5903 0.4037 0.4037 0.5046 0.5046 0.8370 0.8370 0.8782 0.8782 1.0605 1.0605 1.2479 1.2479 1.4101 1.4101 1.5960 1.5960 2.3475 2.3475 2.3606 2.3606 2.4666 2.4666 5.5043 5.5043 5.5279 5.5279 5.7746 5.7746 5.9090 5.9090 5.9555 5.9555 6.0833 6.0833 6.3375 6.3375 6.7511 6.7511 7.1116 7.1116 7.1348 7.1348 k = 0.2000-0.0000-0.0000 ( 5437 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8959 -37.8959 -37.8955 -37.8955 -36.9187 -36.9187 -36.9185 -36.9185 -36.7998 -36.7998 -36.7995 -36.7995 -10.7854 -10.7854 -10.3579 -10.3579 -10.1986 -10.1986 -10.1943 -10.1943 -0.5623 -0.5623 0.4197 0.4197 0.4956 0.4956 0.8207 0.8207 0.8662 0.8662 1.0213 1.0213 1.2516 1.2516 1.3210 1.3210 1.5970 1.5970 2.3308 2.3308 2.3517 2.3517 2.4387 2.4387 5.5310 5.5310 5.5509 5.5509 5.7596 5.7596 5.9183 5.9183 5.9627 5.9627 6.0907 6.0907 6.3344 6.3344 6.7355 6.7355 7.1042 7.1042 7.1274 7.1274 k = 0.2111-0.0000-0.0000 ( 5435 PWs) bands (ev): -65.8240 -65.8240 -65.8237 -65.8237 -37.8960 -37.8960 -37.8956 -37.8956 -36.9189 -36.9189 -36.9186 -36.9186 -36.8000 -36.8000 -36.7998 -36.7998 -10.7674 -10.7674 -10.3493 -10.3493 -10.1947 -10.1947 -10.1905 -10.1905 -0.5336 -0.5336 0.4352 0.4352 0.4875 0.4875 0.7952 0.7952 0.8377 0.8377 1.0109 1.0109 1.2315 1.2315 1.2557 1.2557 1.5962 1.5962 2.3023 2.3023 2.3536 2.3536 2.4094 2.4094 5.5573 5.5573 5.5735 5.5735 5.7445 5.7445 5.9279 5.9279 5.9701 5.9701 6.0954 6.0954 6.3333 6.3333 6.7185 6.7185 7.0992 7.0992 7.1223 7.1223 k = 0.2222-0.0000-0.0000 ( 5439 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8962 -37.8962 -37.8958 -37.8958 -36.9191 -36.9191 -36.9188 -36.9188 -36.8003 -36.8003 -36.8000 -36.8000 -10.7490 -10.7490 -10.3407 -10.3407 -10.1907 -10.1907 -10.1866 -10.1866 -0.5043 -0.5043 0.4487 0.4487 0.4817 0.4817 0.7553 0.7553 0.8051 0.8051 1.0223 1.0223 1.1423 1.1423 1.2600 1.2600 1.5932 1.5932 2.2732 2.2732 2.3548 2.3548 2.3792 2.3792 5.5823 5.5823 5.5963 5.5963 5.7294 5.7294 5.9377 5.9377 5.9777 5.9777 6.0969 6.0969 6.3343 6.3343 6.7002 6.7002 7.0968 7.0968 7.1194 7.1194 k = 0.2333-0.0000-0.0000 ( 5437 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8964 -37.8964 -37.8960 -37.8960 -36.9193 -36.9193 -36.9190 -36.9190 -36.8005 -36.8005 -36.8003 -36.8003 -10.7300 -10.7300 -10.3322 -10.3322 -10.1866 -10.1866 -10.1826 -10.1826 -0.4748 -0.4748 0.4551 0.4551 0.4833 0.4833 0.7009 0.7009 0.7806 0.7806 1.0442 1.0442 1.0537 1.0537 1.2645 1.2645 1.5881 1.5881 2.2441 2.2441 2.3455 2.3455 2.3578 2.3578 5.6049 5.6049 5.6199 5.6199 5.7153 5.7153 5.9478 5.9478 5.9856 5.9856 6.0953 6.0953 6.3374 6.3374 6.6807 6.6807 7.0969 7.0969 7.1188 7.1188 k = 0.2444-0.0000-0.0000 ( 5429 PWs) bands (ev): -65.8239 -65.8239 -65.8236 -65.8236 -37.8965 -37.8965 -37.8961 -37.8961 -36.9195 -36.9195 -36.9192 -36.9192 -36.8008 -36.8008 -36.8005 -36.8005 -10.7105 -10.7105 -10.3237 -10.3237 -10.1825 -10.1825 -10.1786 -10.1786 -0.4452 -0.4452 0.4523 0.4523 0.4942 0.4942 0.6418 0.6418 0.7605 0.7605 0.9657 0.9657 1.0714 1.0714 1.2691 1.2691 1.5808 1.5808 2.2151 2.2151 2.3141 2.3141 2.3570 2.3570 5.6248 5.6248 5.6428 5.6428 5.7040 5.7040 5.9579 5.9579 5.9936 5.9936 6.0905 6.0905 6.3424 6.3424 6.6600 6.6600 7.0995 7.0995 7.1205 7.1205 k = 0.2556-0.0000-0.0000 ( 5431 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8967 -37.8967 -37.8963 -37.8963 -36.9197 -36.9197 -36.9194 -36.9194 -36.8010 -36.8010 -36.8007 -36.8007 -10.6907 -10.6907 -10.3155 -10.3155 -10.1784 -10.1784 -10.1746 -10.1746 -0.4160 -0.4160 0.4462 0.4462 0.5080 0.5080 0.5833 0.5833 0.7425 0.7425 0.8790 0.8790 1.1016 1.1016 1.2736 1.2736 1.5713 1.5713 2.1866 2.1866 2.2813 2.2813 2.3562 2.3562 5.6409 5.6409 5.6590 5.6590 5.7027 5.7027 5.9679 5.9679 6.0016 6.0016 6.0830 6.0830 6.3489 6.3489 6.6381 6.6381 7.1044 7.1044 7.1243 7.1243 k = 0.2667-0.0000-0.0000 ( 5431 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8968 -37.8968 -37.8965 -37.8965 -36.9199 -36.9199 -36.9196 -36.9196 -36.8012 -36.8012 -36.8010 -36.8010 -10.6705 -10.6705 -10.3074 -10.3074 -10.1743 -10.1743 -10.1706 -10.1706 -0.3877 -0.3877 0.4390 0.4390 0.5151 0.5151 0.5348 0.5348 0.7260 0.7260 0.7939 0.7939 1.1337 1.1337 1.2782 1.2782 1.5594 1.5594 2.1587 2.1587 2.2481 2.2481 2.3544 2.3544 5.6454 5.6454 5.6690 5.6690 5.7187 5.7187 5.9777 5.9777 6.0097 6.0097 6.0734 6.0734 6.3563 6.3563 6.6152 6.6152 7.1115 7.1115 7.1301 7.1301 k = 0.2778-0.0000-0.0000 ( 5429 PWs) bands (ev): -65.8238 -65.8238 -65.8235 -65.8235 -37.8970 -37.8970 -37.8966 -37.8966 -36.9201 -36.9201 -36.9198 -36.9198 -36.8015 -36.8015 -36.8012 -36.8012 -10.6501 -10.6501 -10.2997 -10.2997 -10.1702 -10.1702 -10.1666 -10.1666 -0.3606 -0.3606 0.4289 0.4289 0.4747 0.4747 0.5403 0.5403 0.7069 0.7069 0.7143 0.7143 1.1674 1.1674 1.2826 1.2826 1.5454 1.5454 2.1316 2.1316 2.2150 2.2150 2.3516 2.3516 5.6368 5.6368 5.6832 5.6832 5.7433 5.7433 5.9868 5.9868 6.0177 6.0177 6.0625 6.0625 6.3643 6.3643 6.5914 6.5914 7.1206 7.1206 7.1379 7.1379 k = 0.2889-0.0000-0.0000 ( 5419 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8971 -37.8971 -37.8968 -37.8968 -36.9203 -36.9203 -36.9200 -36.9200 -36.8017 -36.8017 -36.8014 -36.8014 -10.6295 -10.6295 -10.2924 -10.2924 -10.1661 -10.1661 -10.1627 -10.1627 -0.3356 -0.3356 0.4049 0.4049 0.4450 0.4450 0.5533 0.5533 0.6287 0.6287 0.6974 0.6974 1.2021 1.2021 1.2869 1.2869 1.5293 1.5293 2.1054 2.1054 2.1823 2.1823 2.3475 2.3475 5.6248 5.6248 5.6982 5.6982 5.7704 5.7704 5.9945 5.9945 6.0257 6.0257 6.0513 6.0513 6.3723 6.3723 6.5668 6.5668 7.1316 7.1316 7.1475 7.1475 k = 0.3000-0.0000-0.0000 ( 5423 PWs) bands (ev): -65.8237 -65.8237 -65.8234 -65.8234 -37.8973 -37.8973 -37.8970 -37.8970 -36.9205 -36.9205 -36.9202 -36.9202 -36.8019 -36.8019 -36.8017 -36.8017 -10.6088 -10.6088 -10.2855 -10.2855 -10.1621 -10.1621 -10.1588 -10.1588 -0.3135 -0.3135 0.3672 0.3672 0.4349 0.4349 0.5459 0.5459 0.5696 0.5696 0.6846 0.6846 1.2370 1.2370 1.2915 1.2915 1.5113 1.5113 2.0802 2.0802 2.1504 2.1504 2.3421 2.3421 5.6123 5.6123 5.7127 5.7127 5.7981 5.7981 5.9989 5.9989 6.0336 6.0336 6.0424 6.0424 6.3799 6.3799 6.5415 6.5415 7.1440 7.1440 7.1587 7.1587 k = 0.3111-0.0000-0.0000 ( 5423 PWs) bands (ev): -65.8237 -65.8237 -65.8234 -65.8234 -37.8974 -37.8974 -37.8971 -37.8971 -36.9207 -36.9207 -36.9204 -36.9204 -36.8021 -36.8021 -36.8019 -36.8019 -10.5881 -10.5881 -10.2791 -10.2791 -10.1582 -10.1582 -10.1550 -10.1550 -0.2950 -0.2950 0.3316 0.3316 0.4299 0.4299 0.4714 0.4714 0.5795 0.5795 0.6731 0.6731 1.2691 1.2691 1.2994 1.2994 1.4916 1.4916 2.0558 2.0558 2.1198 2.1198 2.3352 2.3352 5.6002 5.6002 5.7262 5.7262 5.8261 5.8261 5.9966 5.9966 6.0392 6.0392 6.0415 6.0415 6.3869 6.3869 6.5157 6.5157 7.1578 7.1578 7.1713 7.1713 k = 0.3222-0.0000-0.0000 ( 5421 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8976 -37.8976 -37.8973 -37.8973 -36.9208 -36.9208 -36.9206 -36.9206 -36.8023 -36.8023 -36.8021 -36.8021 -10.5674 -10.5674 -10.2733 -10.2733 -10.1544 -10.1544 -10.1514 -10.1514 -0.2813 -0.2813 0.3027 0.3027 0.3950 0.3950 0.4294 0.4294 0.5899 0.5899 0.6628 0.6628 1.2857 1.2857 1.3227 1.3227 1.4706 1.4706 2.0322 2.0322 2.0910 2.0910 2.3269 2.3269 5.5889 5.5889 5.7386 5.7386 5.8537 5.8537 5.9878 5.9878 6.0425 6.0425 6.0491 6.0491 6.3929 6.3929 6.4895 6.4895 7.1726 7.1726 7.1850 7.1850 k = 0.3333-0.0000-0.0000 ( 5423 PWs) bands (ev): -65.8236 -65.8236 -65.8233 -65.8233 -37.8977 -37.8977 -37.8974 -37.8974 -36.9210 -36.9210 -36.9208 -36.9208 -36.8026 -36.8026 -36.8023 -36.8023 -10.5468 -10.5468 -10.2682 -10.2682 -10.1507 -10.1507 -10.1478 -10.1478 -0.2729 -0.2729 0.2820 0.2820 0.3240 0.3240 0.4277 0.4277 0.5987 0.5987 0.6538 0.6538 1.2899 1.2899 1.3579 1.3579 1.4487 1.4487 2.0093 2.0093 2.0642 2.0642 2.3169 2.3169 5.5787 5.5787 5.7494 5.7494 5.8807 5.8807 5.9765 5.9765 6.0488 6.0488 6.0566 6.0566 6.3979 6.3979 6.4632 6.4632 7.1882 7.1882 7.1998 7.1998 k = 0.3444-0.0000-0.0000 ( 5425 PWs) bands (ev): -65.8236 -65.8236 -65.8233 -65.8233 -37.8979 -37.8979 -37.8976 -37.8976 -36.9212 -36.9212 -36.9210 -36.9210 -36.8027 -36.8027 -36.8025 -36.8025 -10.5264 -10.5264 -10.2637 -10.2637 -10.1471 -10.1471 -10.1444 -10.1444 -0.2704 -0.2704 0.2551 0.2551 0.2702 0.2702 0.4278 0.4278 0.6055 0.6055 0.6465 0.6465 1.2908 1.2908 1.3936 1.3936 1.4284 1.4284 1.9870 1.9870 2.0399 2.0399 2.3052 2.3052 5.5697 5.5697 5.7583 5.7583 5.9057 5.9057 5.9666 5.9666 6.0560 6.0560 6.0640 6.0640 6.4014 6.4014 6.4370 6.4370 7.2042 7.2042 7.2152 7.2152 k = 0.3556-0.0000-0.0000 ( 5435 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8980 -37.8980 -37.8977 -37.8977 -36.9214 -36.9214 -36.9212 -36.9212 -36.8029 -36.8029 -36.8027 -36.8027 -10.5063 -10.5063 -10.2600 -10.2600 -10.1437 -10.1437 -10.1411 -10.1411 -0.2733 -0.2733 0.1893 0.1893 0.2668 0.2668 0.4292 0.4292 0.6093 0.6093 0.6412 0.6412 1.2900 1.2900 1.3973 1.3973 1.4410 1.4410 1.9656 1.9656 2.0180 2.0180 2.2918 2.2918 5.5622 5.5622 5.7644 5.7644 5.9241 5.9241 5.9641 5.9641 6.0633 6.0633 6.0712 6.0712 6.4020 6.4020 6.4125 6.4125 7.2205 7.2205 7.2310 7.2310 k = 0.3667-0.0000-0.0000 ( 5428 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8982 -37.8982 -37.8978 -37.8978 -36.9215 -36.9215 -36.9213 -36.9213 -36.8031 -36.8031 -36.8029 -36.8029 -10.4865 -10.4865 -10.2572 -10.2572 -10.1404 -10.1404 -10.1381 -10.1381 -0.2807 -0.2807 0.1268 0.1268 0.2714 0.2714 0.4318 0.4318 0.6095 0.6095 0.6385 0.6385 1.2877 1.2877 1.3758 1.3758 1.4794 1.4794 1.9453 1.9453 1.9984 1.9984 2.2766 2.2766 5.5561 5.5561 5.7673 5.7673 5.9290 5.9290 5.9772 5.9772 6.0704 6.0704 6.0782 6.0782 6.3834 6.3834 6.4062 6.4062 7.2368 7.2368 7.2471 7.2471 k = 0.3778-0.0000-0.0000 ( 5430 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8983 -37.8983 -37.8980 -37.8980 -36.9217 -36.9217 -36.9215 -36.9215 -36.8033 -36.8033 -36.8030 -36.8030 -10.4672 -10.4672 -10.2552 -10.2552 -10.1374 -10.1374 -10.1352 -10.1352 -0.2914 -0.2914 0.0676 0.0676 0.2823 0.2823 0.4356 0.4356 0.6066 0.6066 0.6377 0.6377 1.2840 1.2840 1.3534 1.3534 1.5197 1.5197 1.9265 1.9265 1.9807 1.9807 2.2596 2.2596 5.5517 5.5517 5.7661 5.7661 5.9279 5.9279 5.9990 5.9990 6.0772 6.0772 6.0850 6.0850 6.3586 6.3586 6.4052 6.4052 7.2529 7.2529 7.2629 7.2629 k = 0.3889-0.0000-0.0000 ( 5434 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8984 -37.8984 -37.8981 -37.8981 -36.9219 -36.9219 -36.9216 -36.9216 -36.8034 -36.8034 -36.8032 -36.8032 -10.4483 -10.4483 -10.2541 -10.2541 -10.1345 -10.1345 -10.1325 -10.1325 -0.3039 -0.3039 0.0119 0.0119 0.2983 0.2983 0.4404 0.4404 0.6020 0.6020 0.6370 0.6370 1.2790 1.2790 1.3317 1.3317 1.5604 1.5604 1.9097 1.9097 1.9647 1.9647 2.2406 2.2406 5.5489 5.5489 5.7606 5.7606 5.9283 5.9283 6.0219 6.0219 6.0837 6.0837 6.0914 6.0914 6.3345 6.3345 6.4029 6.4029 7.2686 7.2686 7.2783 7.2783 k = 0.4000-0.0000-0.0000 ( 5444 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8985 -37.8985 -37.8982 -37.8982 -36.9220 -36.9220 -36.9218 -36.9218 -36.8036 -36.8036 -36.8034 -36.8034 -10.4300 -10.4300 -10.2540 -10.2540 -10.1319 -10.1319 -10.1300 -10.1300 -0.3168 -0.3168 -0.0402 -0.0402 0.3180 0.3180 0.4463 0.4463 0.5964 0.5964 0.6355 0.6355 1.2727 1.2727 1.3112 1.3112 1.6015 1.6015 1.8952 1.8952 1.9501 1.9501 2.2199 2.2199 5.5477 5.5477 5.7512 5.7512 5.9318 5.9318 6.0436 6.0436 6.0903 6.0903 6.0974 6.0974 6.3118 6.3118 6.3992 6.3992 7.2836 7.2836 7.2930 7.2930 k = 0.4111-0.0000-0.0000 ( 5448 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8986 -37.8986 -37.8983 -37.8983 -36.9221 -36.9221 -36.9219 -36.9219 -36.8037 -36.8037 -36.8035 -36.8035 -10.4124 -10.4124 -10.2549 -10.2549 -10.1295 -10.1295 -10.1278 -10.1278 -0.3292 -0.3292 -0.0885 -0.0885 0.3401 0.3401 0.4532 0.4532 0.5904 0.5904 0.6326 0.6326 1.2652 1.2652 1.2925 1.2925 1.6425 1.6425 1.8830 1.8830 1.9368 1.9368 2.1973 2.1973 5.5484 5.5484 5.7388 5.7388 5.9383 5.9383 6.0621 6.0621 6.0976 6.0976 6.1031 6.1031 6.2911 6.2911 6.3939 6.3939 7.2978 7.2978 7.3068 7.3068 k = 0.4222-0.0000-0.0000 ( 5436 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8986 -37.8986 -37.8984 -37.8984 -36.9222 -36.9222 -36.9220 -36.9220 -36.8038 -36.8038 -36.8036 -36.8036 -10.3954 -10.3954 -10.2569 -10.2569 -10.1273 -10.1273 -10.1258 -10.1258 -0.3400 -0.3400 -0.1329 -0.1329 0.3636 0.3636 0.4609 0.4609 0.5840 0.5840 0.6280 0.6280 1.2568 1.2568 1.2761 1.2761 1.6834 1.6834 1.8733 1.8733 1.9245 1.9245 2.1728 2.1728 5.5508 5.5508 5.7243 5.7243 5.9472 5.9472 6.0751 6.0751 6.1064 6.1064 6.1090 6.1090 6.2736 6.2736 6.3870 6.3870 7.3110 7.3110 7.3193 7.3193 k = 0.4333-0.0000-0.0000 ( 5448 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8987 -37.8987 -37.8985 -37.8985 -36.9223 -36.9223 -36.9221 -36.9221 -36.8039 -36.8039 -36.8037 -36.8037 -10.3792 -10.3792 -10.2598 -10.2598 -10.1254 -10.1254 -10.1241 -10.1241 -0.3486 -0.3486 -0.1735 -0.1735 0.3878 0.3878 0.4695 0.4695 0.5771 0.5771 0.6215 0.6215 1.2476 1.2476 1.2622 1.2622 1.7240 1.7240 1.8661 1.8661 1.9131 1.9131 2.1466 2.1466 5.5549 5.5549 5.7084 5.7084 5.9579 5.9579 6.0818 6.0818 6.1122 6.1122 6.1185 6.1185 6.2605 6.2605 6.3786 6.3786 7.3229 7.3229 7.3305 7.3305 k = 0.4444-0.0000-0.0000 ( 5444 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9224 -36.9224 -36.9222 -36.9222 -36.8040 -36.8040 -36.8038 -36.8038 -10.3638 -10.3638 -10.2639 -10.2639 -10.1237 -10.1237 -10.1227 -10.1227 -0.3545 -0.3545 -0.2101 -0.2101 0.4120 0.4120 0.4788 0.4788 0.5698 0.5698 0.6131 0.6131 1.2384 1.2384 1.2506 1.2506 1.7641 1.7641 1.8612 1.8612 1.9028 1.9028 2.1187 2.1187 5.5607 5.5607 5.6919 5.6919 5.9699 5.9699 6.0835 6.0835 6.1164 6.1164 6.1273 6.1273 6.2537 6.2537 6.3688 6.3688 7.3334 7.3334 7.3401 7.3401 k = 0.4556-0.0000-0.0000 ( 5430 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9224 -36.9224 -36.9223 -36.9223 -36.8040 -36.8040 -36.8038 -36.8038 -10.3492 -10.3492 -10.2691 -10.2691 -10.1223 -10.1223 -10.1215 -10.1215 -0.3572 -0.3572 -0.2426 -0.2426 0.4355 0.4355 0.4886 0.4886 0.5622 0.5622 0.6030 0.6030 1.2302 1.2302 1.2410 1.2410 1.8036 1.8036 1.8586 1.8586 1.8933 1.8933 2.0891 2.0891 5.5682 5.5682 5.6752 5.6752 5.9831 5.9831 6.0812 6.0812 6.1200 6.1200 6.1321 6.1321 6.2543 6.2543 6.3576 6.3576 7.3425 7.3425 7.3480 7.3480 k = 0.4667-0.0000-0.0000 ( 5422 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9225 -36.9225 -36.9223 -36.9223 -36.8040 -36.8040 -36.8039 -36.8039 -10.3356 -10.3356 -10.2753 -10.2753 -10.1212 -10.1212 -10.1206 -10.1206 -0.3565 -0.3565 -0.2710 -0.2710 0.4576 0.4576 0.4987 0.4987 0.5544 0.5544 0.5913 0.5913 1.2239 1.2239 1.2330 1.2330 1.8414 1.8414 1.8588 1.8588 1.8851 1.8851 2.0580 2.0580 5.5773 5.5773 5.6587 5.6587 5.9969 5.9969 6.0751 6.0751 6.1231 6.1231 6.1334 6.1334 6.2616 6.2616 6.3452 6.3452 7.3498 7.3498 7.3541 7.3541 k = 0.4778-0.0000-0.0000 ( 5416 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9223 -36.9223 -36.8041 -36.8041 -36.8039 -36.8039 -10.3230 -10.3230 -10.2827 -10.2827 -10.1204 -10.1204 -10.1200 -10.1200 -0.3521 -0.3521 -0.2954 -0.2954 0.4776 0.4776 0.5079 0.5079 0.5475 0.5475 0.5782 0.5782 1.2199 1.2199 1.2265 1.2265 1.8572 1.8572 1.8741 1.8741 1.8857 1.8857 2.0254 2.0254 5.5879 5.5879 5.6428 5.6428 6.0113 6.0113 6.0657 6.0657 6.1257 6.1257 6.1327 6.1327 6.2733 6.2733 6.3316 6.3316 7.3554 7.3554 7.3583 7.3583 k = 0.4889-0.0000-0.0000 ( 5422 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.3113 -10.3113 -10.2912 -10.2912 -10.1199 -10.1199 -10.1196 -10.1196 -0.3439 -0.3439 -0.3156 -0.3156 0.4945 0.4945 0.5123 0.5123 0.5453 0.5453 0.5647 0.5647 1.2182 1.2182 1.2217 1.2217 1.8604 1.8604 1.8698 1.8698 1.9203 1.9203 1.9915 1.9915 5.5999 5.5999 5.6274 5.6274 6.0258 6.0258 6.0537 6.0537 6.1279 6.1279 6.1314 6.1314 6.2873 6.2873 6.3172 6.3172 7.3590 7.3590 7.3605 7.3605 k = 0.5000-0.0000-0.0000 ( 5418 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.3008 -10.3008 -10.3007 -10.3007 -10.1196 -10.1196 -10.1196 -10.1196 -0.3318 -0.3318 -0.3318 -0.3318 0.5070 0.5070 0.5070 0.5070 0.5523 0.5523 0.5524 0.5524 1.2189 1.2189 1.2189 1.2189 1.8645 1.8645 1.8646 1.8646 1.9563 1.9563 1.9563 1.9563 5.6130 5.6130 5.6132 5.6132 6.0401 6.0401 6.0402 6.0402 6.1296 6.1296 6.1298 6.1298 6.3022 6.3022 6.3024 6.3024 7.3607 7.3607 7.3609 7.3609 k = 0.5000-0.0000-0.0000 ( 5418 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.3008 -10.3008 -10.3007 -10.3007 -10.1196 -10.1196 -10.1196 -10.1196 -0.3318 -0.3318 -0.3318 -0.3318 0.5070 0.5070 0.5070 0.5070 0.5523 0.5523 0.5524 0.5524 1.2189 1.2189 1.2189 1.2189 1.8645 1.8645 1.8646 1.8646 1.9563 1.9563 1.9563 1.9563 5.6130 5.6130 5.6132 5.6132 6.0401 6.0401 6.0402 6.0402 6.1296 6.1296 6.1298 6.1298 6.3022 6.3022 6.3024 6.3024 7.3607 7.3607 7.3609 7.3609 k = 0.5000 0.0108-0.0000 ( 5422 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.3006 -10.3006 -10.3005 -10.3005 -10.1198 -10.1198 -10.1197 -10.1197 -0.3320 -0.3320 -0.3316 -0.3316 0.4948 0.4948 0.5111 0.5111 0.5476 0.5476 0.5655 0.5655 1.2179 1.2179 1.2193 1.2193 1.8558 1.8558 1.8607 1.8607 1.9618 1.9618 1.9644 1.9644 5.6126 5.6126 5.6134 5.6134 6.0359 6.0359 6.0431 6.0431 6.1264 6.1264 6.1315 6.1315 6.3028 6.3028 6.3038 6.3038 7.3615 7.3615 7.3617 7.3617 k = 0.5000 0.0216-0.0000 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.3003 -10.3003 -10.3001 -10.3001 -10.1202 -10.1202 -10.1201 -10.1201 -0.3321 -0.3321 -0.3315 -0.3315 0.4805 0.4805 0.5027 0.5027 0.5557 0.5557 0.5811 0.5811 1.2164 1.2164 1.2190 1.2190 1.8389 1.8389 1.8469 1.8469 1.9781 1.9781 1.9814 1.9814 5.6118 5.6118 5.6134 5.6134 6.0305 6.0305 6.0449 6.0449 6.1217 6.1217 6.1318 6.1318 6.3054 6.3054 6.3074 6.3074 7.3639 7.3639 7.3641 7.3641 k = 0.5000 0.0324-0.0000 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.2996 -10.2996 -10.2995 -10.2995 -10.1209 -10.1209 -10.1208 -10.1208 -0.3323 -0.3323 -0.3314 -0.3314 0.4656 0.4656 0.4891 0.4891 0.5692 0.5692 0.5975 0.5975 1.2144 1.2144 1.2183 1.2183 1.8186 1.8186 1.8285 1.8285 1.9998 1.9998 2.0026 2.0026 5.6108 5.6108 5.6133 5.6133 6.0239 6.0239 6.0452 6.0452 6.1160 6.1160 6.1310 6.1310 6.3098 6.3098 6.3127 6.3127 7.3679 7.3679 7.3682 7.3682 k = 0.5000 0.0432-0.0000 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.2987 -10.2987 -10.2985 -10.2985 -10.1218 -10.1218 -10.1217 -10.1217 -0.3325 -0.3325 -0.3313 -0.3313 0.4508 0.4508 0.4744 0.4744 0.5841 0.5841 0.6140 0.6140 1.2118 1.2118 1.2169 1.2169 1.7970 1.7970 1.8082 1.8082 2.0240 2.0240 2.0260 2.0260 5.6095 5.6095 5.6128 5.6128 6.0162 6.0162 6.0438 6.0438 6.1098 6.1098 6.1294 6.1294 6.3156 6.3156 6.3192 6.3192 7.3735 7.3735 7.3738 7.3738 k = 0.5000 0.0540-0.0000 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.2976 -10.2976 -10.2973 -10.2973 -10.1230 -10.1230 -10.1229 -10.1229 -0.3327 -0.3327 -0.3312 -0.3312 0.4363 0.4363 0.4596 0.4596 0.5994 0.5994 0.6306 0.6306 1.2088 1.2088 1.2151 1.2151 1.7751 1.7751 1.7874 1.7874 2.0497 2.0497 2.0504 2.0504 5.6080 5.6080 5.6120 5.6120 6.0074 6.0074 6.0406 6.0406 6.1040 6.1040 6.1274 6.1274 6.3225 6.3225 6.3266 6.3266 7.3807 7.3807 7.3810 7.3810 k = 0.5000 0.0648-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2962 -10.2962 -10.2959 -10.2959 -10.1245 -10.1245 -10.1243 -10.1243 -0.3329 -0.3329 -0.3311 -0.3311 0.4222 0.4222 0.4452 0.4452 0.6146 0.6146 0.6469 0.6469 1.2054 1.2054 1.2129 1.2129 1.7533 1.7533 1.7664 1.7664 2.0755 2.0755 2.0761 2.0761 5.6062 5.6062 5.6110 5.6110 5.9977 5.9977 6.0352 6.0352 6.0990 6.0990 6.1252 6.1252 6.3300 6.3300 6.3346 6.3346 7.3892 7.3892 7.3896 7.3896 k = 0.5000 0.0756-0.0000 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2945 -10.2945 -10.2942 -10.2942 -10.1262 -10.1262 -10.1260 -10.1260 -0.3332 -0.3332 -0.3311 -0.3311 0.4087 0.4087 0.4313 0.4313 0.6295 0.6295 0.6629 0.6629 1.2017 1.2017 1.2103 1.2103 1.7318 1.7318 1.7456 1.7456 2.1010 2.1010 2.1029 2.1029 5.6041 5.6041 5.6096 5.6096 5.9872 5.9872 6.0277 6.0277 6.0952 6.0952 6.1231 6.1231 6.3379 6.3379 6.3428 6.3428 7.3992 7.3992 7.3996 7.3996 k = 0.5000 0.0864-0.0000 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2926 -10.2926 -10.2923 -10.2923 -10.1282 -10.1282 -10.1280 -10.1280 -0.3335 -0.3335 -0.3312 -0.3312 0.3958 0.3958 0.4180 0.4180 0.6441 0.6441 0.6784 0.6784 1.1978 1.1978 1.2074 1.2074 1.7107 1.7107 1.7252 1.7252 2.1267 2.1267 2.1300 2.1300 5.6018 5.6018 5.6080 5.6080 5.9762 5.9762 6.0186 6.0186 6.0925 6.0925 6.1212 6.1212 6.3459 6.3459 6.3511 6.3511 7.4105 7.4105 7.4109 7.4109 k = 0.5000 0.0972-0.0000 ( 5434 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2905 -10.2905 -10.2901 -10.2901 -10.1303 -10.1303 -10.1301 -10.1301 -0.3338 -0.3338 -0.3313 -0.3313 0.3835 0.3835 0.4054 0.4054 0.6582 0.6582 0.6935 0.6935 1.1936 1.1936 1.2043 1.2043 1.6902 1.6902 1.7052 1.7052 2.1524 2.1524 2.1570 2.1570 5.5992 5.5992 5.6059 5.6059 5.9649 5.9649 6.0082 6.0082 6.0908 6.0908 6.1194 6.1194 6.3539 6.3539 6.3591 6.3591 7.4230 7.4230 7.4234 7.4234 k = 0.5000 0.1080-0.0000 ( 5446 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2882 -10.2882 -10.2877 -10.2877 -10.1327 -10.1327 -10.1325 -10.1325 -0.3342 -0.3342 -0.3315 -0.3315 0.3719 0.3719 0.3935 0.3935 0.6717 0.6717 0.7079 0.7079 1.1894 1.1894 1.2009 1.2009 1.6702 1.6702 1.6856 1.6856 2.1779 2.1779 2.1839 2.1839 5.5963 5.5963 5.6035 5.6035 5.9533 5.9533 5.9971 5.9971 6.0896 6.0896 6.1178 6.1178 6.3616 6.3616 6.3668 6.3668 7.4364 7.4364 7.4369 7.4369 k = 0.5000 0.1188-0.0000 ( 5446 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2857 -10.2857 -10.2852 -10.2852 -10.1353 -10.1353 -10.1351 -10.1351 -0.3346 -0.3346 -0.3317 -0.3317 0.3611 0.3611 0.3824 0.3824 0.6847 0.6847 0.7218 0.7218 1.1851 1.1851 1.1975 1.1975 1.6510 1.6510 1.6667 1.6667 2.2031 2.2031 2.2105 2.2105 5.5931 5.5931 5.6007 5.6007 5.9419 5.9419 5.9856 5.9856 6.0890 6.0890 6.1164 6.1164 6.3690 6.3690 6.3741 6.3741 7.4509 7.4509 7.4514 7.4514 k = 0.5000 0.1296-0.0000 ( 5446 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2830 -10.2830 -10.2824 -10.2824 -10.1381 -10.1381 -10.1379 -10.1379 -0.3351 -0.3351 -0.3320 -0.3320 0.3510 0.3510 0.3721 0.3721 0.6970 0.6970 0.7349 0.7349 1.1808 1.1808 1.1940 1.1940 1.6325 1.6325 1.6484 1.6484 2.2279 2.2279 2.2366 2.2366 5.5896 5.5896 5.5976 5.5976 5.9307 5.9307 5.9742 5.9742 6.0886 6.0886 6.1153 6.1153 6.3760 6.3760 6.3809 6.3809 7.4660 7.4660 7.4665 7.4665 k = 0.5000 0.1404-0.0000 ( 5454 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2801 -10.2801 -10.2795 -10.2795 -10.1411 -10.1411 -10.1408 -10.1408 -0.3357 -0.3357 -0.3324 -0.3324 0.3417 0.3417 0.3627 0.3627 0.7086 0.7086 0.7473 0.7473 1.1765 1.1765 1.1905 1.1905 1.6147 1.6147 1.6309 1.6309 2.2521 2.2521 2.2621 2.2621 5.5858 5.5858 5.5941 5.5941 5.9198 5.9198 5.9629 5.9629 6.0884 6.0884 6.1143 6.1143 6.3825 6.3825 6.3872 6.3872 7.4817 7.4817 7.4822 7.4822 k = 0.5000 0.1512-0.0000 ( 5454 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2771 -10.2771 -10.2764 -10.2764 -10.1442 -10.1442 -10.1439 -10.1439 -0.3363 -0.3363 -0.3329 -0.3329 0.3332 0.3332 0.3540 0.3540 0.7195 0.7195 0.7589 0.7589 1.1724 1.1724 1.1870 1.1870 1.5979 1.5979 1.6141 1.6141 2.2755 2.2755 2.2868 2.2868 5.5818 5.5818 5.5903 5.5903 5.9095 5.9095 5.9521 5.9521 6.0883 6.0883 6.1134 6.1134 6.3885 6.3885 6.3929 6.3929 7.4977 7.4977 7.4983 7.4983 k = 0.5000 0.1620-0.0000 ( 5462 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8990 -37.8990 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2739 -10.2739 -10.2732 -10.2732 -10.1474 -10.1474 -10.1472 -10.1472 -0.3369 -0.3369 -0.3334 -0.3334 0.3254 0.3254 0.3462 0.3462 0.7296 0.7296 0.7698 0.7698 1.1684 1.1684 1.1836 1.1836 1.5819 1.5819 1.5982 1.5982 2.2981 2.2981 2.3105 2.3105 5.5776 5.5776 5.5861 5.5861 5.8998 5.8998 5.9418 5.9418 6.0883 6.0883 6.1127 6.1127 6.3940 6.3940 6.3981 6.3981 7.5139 7.5139 7.5144 7.5144 k = 0.5000 0.1728-0.0000 ( 5458 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2707 -10.2707 -10.2699 -10.2699 -10.1507 -10.1507 -10.1505 -10.1505 -0.3376 -0.3376 -0.3339 -0.3339 0.3185 0.3185 0.3391 0.3391 0.7390 0.7390 0.7798 0.7798 1.1645 1.1645 1.1803 1.1803 1.5670 1.5670 1.5833 1.5833 2.3196 2.3196 2.3332 2.3332 5.5733 5.5733 5.5818 5.5818 5.8909 5.8909 5.9322 5.9322 6.0884 6.0884 6.1121 6.1121 6.3989 6.3989 6.4027 6.4027 7.5300 7.5300 7.5305 7.5305 k = 0.5000 0.1836-0.0000 ( 5450 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2673 -10.2673 -10.2665 -10.2665 -10.1541 -10.1541 -10.1539 -10.1539 -0.3382 -0.3382 -0.3345 -0.3345 0.3122 0.3122 0.3328 0.3328 0.7477 0.7477 0.7891 0.7891 1.1609 1.1609 1.1772 1.1772 1.5531 1.5531 1.5694 1.5694 2.3399 2.3399 2.3546 2.3546 5.5690 5.5690 5.5773 5.5773 5.8827 5.8827 5.9234 5.9234 6.0885 6.0885 6.1116 6.1116 6.4034 6.4034 6.4068 6.4068 7.5458 7.5458 7.5463 7.5463 k = 0.5000 0.1944-0.0000 ( 5438 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2640 -10.2640 -10.2631 -10.2631 -10.1575 -10.1575 -10.1573 -10.1573 -0.3389 -0.3389 -0.3351 -0.3351 0.3067 0.3067 0.3272 0.3272 0.7556 0.7556 0.7976 0.7976 1.1574 1.1574 1.1741 1.1741 1.5404 1.5404 1.5565 1.5565 2.3588 2.3588 2.3745 2.3745 5.5646 5.5646 5.5728 5.5728 5.8753 5.8753 5.9153 5.9153 6.0887 6.0887 6.1113 6.1113 6.4073 6.4073 6.4105 6.4105 7.5610 7.5610 7.5614 7.5614 k = 0.5000 0.2052-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2606 -10.2606 -10.2597 -10.2597 -10.1610 -10.1610 -10.1607 -10.1607 -0.3396 -0.3396 -0.3357 -0.3357 0.3018 0.3018 0.3224 0.3224 0.7628 0.7628 0.8052 0.8052 1.1542 1.1542 1.1712 1.1712 1.5288 1.5288 1.5449 1.5449 2.3763 2.3763 2.3928 2.3928 5.5603 5.5603 5.5683 5.5683 5.8687 5.8687 5.9081 5.9081 6.0888 6.0888 6.1109 6.1109 6.4107 6.4107 6.4136 6.4136 7.5754 7.5754 7.5758 7.5758 k = 0.5000 0.2160-0.0000 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2573 -10.2573 -10.2564 -10.2564 -10.1643 -10.1643 -10.1641 -10.1641 -0.3402 -0.3402 -0.3363 -0.3363 0.2976 0.2976 0.3182 0.3182 0.7692 0.7692 0.8120 0.8120 1.1512 1.1512 1.1685 1.1685 1.5185 1.5185 1.5344 1.5344 2.3921 2.3921 2.4094 2.4094 5.5562 5.5562 5.5640 5.5640 5.8630 5.8630 5.9017 5.9017 6.0890 6.0890 6.1106 6.1106 6.4137 6.4137 6.4162 6.4162 7.5888 7.5888 7.5891 7.5891 k = 0.5000 0.2268-0.0000 ( 5442 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2542 -10.2542 -10.2532 -10.2532 -10.1675 -10.1675 -10.1673 -10.1673 -0.3409 -0.3409 -0.3369 -0.3369 0.2941 0.2941 0.3146 0.3146 0.7748 0.7748 0.8180 0.8180 1.1485 1.1485 1.1660 1.1660 1.5095 1.5095 1.5253 1.5253 2.4060 2.4060 2.4241 2.4241 5.5524 5.5524 5.5599 5.5599 5.8581 5.8581 5.8962 5.8962 6.0891 6.0891 6.1104 6.1104 6.4161 6.4161 6.4185 6.4185 7.6009 7.6009 7.6012 7.6012 k = 0.5000 0.2376-0.0000 ( 5438 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2512 -10.2512 -10.2502 -10.2502 -10.1705 -10.1705 -10.1704 -10.1704 -0.3414 -0.3414 -0.3374 -0.3374 0.2911 0.2911 0.3117 0.3117 0.7795 0.7795 0.8231 0.8231 1.1461 1.1461 1.1637 1.1637 1.5018 1.5018 1.5175 1.5175 2.4181 2.4181 2.4368 2.4368 5.5490 5.5490 5.5562 5.5562 5.8540 5.8540 5.8916 5.8916 6.0892 6.0892 6.1102 6.1102 6.4182 6.4182 6.4203 6.4203 7.6115 7.6115 7.6118 7.6118 k = 0.5000 0.2484-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2486 -10.2486 -10.2475 -10.2475 -10.1732 -10.1732 -10.1731 -10.1731 -0.3419 -0.3419 -0.3379 -0.3379 0.2887 0.2887 0.3093 0.3093 0.7835 0.7835 0.8274 0.8274 1.1441 1.1441 1.1618 1.1618 1.4955 1.4955 1.5110 1.5110 2.4281 2.4281 2.4473 2.4473 5.5460 5.5460 5.5530 5.5530 5.8508 5.8508 5.8878 5.8878 6.0892 6.0892 6.1101 6.1101 6.4198 6.4198 6.4218 6.4218 7.6205 7.6205 7.6207 7.6207 k = 0.5000 0.2592-0.0000 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2463 -10.2463 -10.2452 -10.2452 -10.1755 -10.1755 -10.1754 -10.1754 -0.3422 -0.3422 -0.3382 -0.3382 0.2869 0.2869 0.3075 0.3075 0.7866 0.7866 0.8307 0.8307 1.1424 1.1424 1.1602 1.1602 1.4905 1.4905 1.5059 1.5059 2.4360 2.4360 2.4556 2.4556 5.5436 5.5436 5.5504 5.5504 5.8482 5.8482 5.8849 5.8849 6.0893 6.0893 6.1099 6.1099 6.4211 6.4211 6.4229 6.4229 7.6277 7.6277 7.6279 7.6279 k = 0.5000 0.2700-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2446 -10.2446 -10.2434 -10.2434 -10.1772 -10.1772 -10.1772 -10.1772 -0.3425 -0.3425 -0.3385 -0.3385 0.2856 0.2856 0.3062 0.3062 0.7889 0.7889 0.8331 0.8331 1.1412 1.1412 1.1591 1.1591 1.4870 1.4870 1.5023 1.5023 2.4418 2.4418 2.4616 2.4616 5.5418 5.5418 5.5485 5.5485 5.8464 5.8464 5.8828 5.8828 6.0894 6.0894 6.1099 6.1099 6.4220 6.4220 6.4237 6.4237 7.6329 7.6329 7.6331 7.6331 k = 0.5000 0.2808-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2435 -10.2435 -10.2423 -10.2423 -10.1783 -10.1783 -10.1783 -10.1783 -0.3427 -0.3427 -0.3386 -0.3386 0.2849 0.2849 0.3054 0.3054 0.7902 0.7902 0.8345 0.8345 1.1405 1.1405 1.1584 1.1584 1.4849 1.4849 1.5001 1.5001 2.4452 2.4452 2.4652 2.4652 5.5408 5.5408 5.5473 5.5473 5.8453 5.8453 5.8816 5.8816 6.0894 6.0894 6.1098 6.1098 6.4226 6.4226 6.4242 6.4242 7.6361 7.6361 7.6362 7.6362 k = 0.5000 0.2916-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2431 -10.2431 -10.2419 -10.2419 -10.1787 -10.1787 -10.1786 -10.1786 -0.3427 -0.3427 -0.3387 -0.3387 0.2846 0.2846 0.3052 0.3052 0.7907 0.7907 0.8350 0.8350 1.1402 1.1402 1.1581 1.1581 1.4842 1.4842 1.4994 1.4994 2.4464 2.4464 2.4664 2.4664 5.5404 5.5404 5.5469 5.5469 5.8450 5.8450 5.8811 5.8811 6.0894 6.0894 6.1098 6.1098 6.4227 6.4227 6.4243 6.4243 7.6371 7.6371 7.6373 7.6373 k = 0.5000 0.2916-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2431 -10.2431 -10.2419 -10.2419 -10.1787 -10.1787 -10.1786 -10.1786 -0.3427 -0.3427 -0.3387 -0.3387 0.2846 0.2846 0.3052 0.3052 0.7907 0.7907 0.8350 0.8350 1.1402 1.1402 1.1581 1.1581 1.4842 1.4842 1.4994 1.4994 2.4464 2.4464 2.4664 2.4664 5.5404 5.5404 5.5469 5.5469 5.8450 5.8450 5.8811 5.8811 6.0894 6.0894 6.1098 6.1098 6.4227 6.4227 6.4243 6.4243 7.6371 7.6371 7.6373 7.6373 k = 0.4889 0.2916-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2441 -10.2441 -10.2429 -10.2429 -10.1784 -10.1784 -10.1784 -10.1784 -0.3406 -0.3406 -0.3366 -0.3366 0.2840 0.2840 0.3047 0.3047 0.7889 0.7889 0.8333 0.8333 1.1417 1.1417 1.1596 1.1596 1.4853 1.4853 1.5006 1.5006 2.4459 2.4459 2.4660 2.4660 5.5413 5.5413 5.5478 5.5478 5.8450 5.8450 5.8812 5.8812 6.0892 6.0892 6.1096 6.1096 6.4222 6.4222 6.4238 6.4238 7.6358 7.6358 7.6359 7.6359 k = 0.4778 0.2916-0.0000 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2469 -10.2469 -10.2458 -10.2458 -10.1777 -10.1777 -10.1776 -10.1776 -0.3344 -0.3344 -0.3302 -0.3302 0.2823 0.2823 0.3033 0.3033 0.7839 0.7839 0.8283 0.8283 1.1460 1.1460 1.1639 1.1639 1.4887 1.4887 1.5041 1.5041 2.4447 2.4447 2.4647 2.4647 5.5439 5.5439 5.5503 5.5503 5.8451 5.8451 5.8812 5.8812 6.0886 6.0886 6.1088 6.1088 6.4204 6.4204 6.4222 6.4222 7.6318 7.6318 7.6319 7.6319 k = 0.4667 0.2916-0.0000 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9222 -36.9222 -36.8042 -36.8042 -36.8038 -36.8038 -10.2513 -10.2513 -10.2503 -10.2503 -10.1767 -10.1767 -10.1765 -10.1765 -0.3239 -0.3239 -0.3197 -0.3197 0.2795 0.2795 0.3009 0.3009 0.7757 0.7757 0.8201 0.8201 1.1531 1.1531 1.1709 1.1709 1.4941 1.4941 1.5096 1.5096 2.4426 2.4426 2.4625 2.4625 5.5482 5.5482 5.5545 5.5545 5.8452 5.8452 5.8812 5.8812 6.0877 6.0877 6.1075 6.1075 6.4175 6.4175 6.4197 6.4197 7.6252 7.6252 7.6254 7.6254 k = 0.4556 0.2916-0.0000 ( 5440 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9225 -36.9225 -36.9222 -36.9222 -36.8041 -36.8041 -36.8037 -36.8037 -10.2573 -10.2573 -10.2564 -10.2564 -10.1755 -10.1755 -10.1752 -10.1752 -0.3094 -0.3094 -0.3050 -0.3050 0.2755 0.2755 0.2975 0.2975 0.7649 0.7649 0.8093 0.8093 1.1628 1.1628 1.1806 1.1806 1.5013 1.5013 1.5169 1.5169 2.4398 2.4398 2.4595 2.4595 5.5543 5.5543 5.5604 5.5604 5.8455 5.8455 5.8813 5.8813 6.0864 6.0864 6.1057 6.1057 6.4135 6.4135 6.4162 6.4162 7.6161 7.6161 7.6163 7.6163 k = 0.4444 0.2916-0.0000 ( 5444 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9224 -36.9224 -36.9221 -36.9221 -36.8041 -36.8041 -36.8037 -36.8037 -10.2645 -10.2645 -10.2638 -10.2638 -10.1744 -10.1744 -10.1739 -10.1739 -0.2908 -0.2908 -0.2862 -0.2862 0.2705 0.2705 0.2931 0.2931 0.7519 0.7519 0.7964 0.7964 1.1750 1.1750 1.1927 1.1927 1.5099 1.5099 1.5257 1.5257 2.4364 2.4364 2.4557 2.4557 5.5619 5.5619 5.5678 5.5678 5.8458 5.8458 5.8814 5.8814 6.0845 6.0845 6.1033 6.1033 6.4085 6.4085 6.4118 6.4118 7.6046 7.6046 7.6048 7.6048 k = 0.4333 0.2916-0.0000 ( 5442 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8987 -37.8987 -37.8985 -37.8985 -36.9223 -36.9223 -36.9220 -36.9220 -36.8040 -36.8040 -36.8036 -36.8036 -10.2729 -10.2729 -10.2723 -10.2723 -10.1734 -10.1734 -10.1729 -10.1729 -0.2683 -0.2683 -0.2635 -0.2635 0.2643 0.2643 0.2877 0.2877 0.7373 0.7373 0.7818 0.7818 1.1895 1.1895 1.2071 1.2071 1.5196 1.5196 1.5356 1.5356 2.4324 2.4324 2.4514 2.4514 5.5710 5.5710 5.5767 5.5767 5.8463 5.8463 5.8817 5.8817 6.0822 6.0822 6.1002 6.1002 6.4025 6.4025 6.4066 6.4066 7.5909 7.5909 7.5911 7.5911 k = 0.4222 0.2916-0.0000 ( 5446 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8986 -37.8986 -37.8984 -37.8984 -36.9223 -36.9223 -36.9220 -36.9220 -36.8039 -36.8039 -36.8035 -36.8035 -10.2823 -10.2823 -10.2817 -10.2817 -10.1727 -10.1727 -10.1720 -10.1720 -0.2421 -0.2421 -0.2369 -0.2369 0.2569 0.2569 0.2813 0.2813 0.7217 0.7217 0.7662 0.7662 1.2060 1.2060 1.2234 1.2234 1.5302 1.5302 1.5461 1.5461 2.4280 2.4280 2.4465 2.4465 5.5815 5.5815 5.5868 5.5868 5.8470 5.8470 5.8820 5.8820 6.0793 6.0793 6.0964 6.0964 6.3957 6.3957 6.4008 6.4008 7.5751 7.5751 7.5754 7.5754 k = 0.4111 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8985 -37.8985 -37.8983 -37.8983 -36.9221 -36.9221 -36.9218 -36.9218 -36.8038 -36.8038 -36.8034 -36.8034 -10.2925 -10.2925 -10.2921 -10.2921 -10.1723 -10.1723 -10.1715 -10.1715 -0.2123 -0.2123 -0.2067 -0.2067 0.2485 0.2485 0.2738 0.2738 0.7059 0.7059 0.7503 0.7503 1.2243 1.2243 1.2414 1.2414 1.5411 1.5411 1.5569 1.5569 2.4232 2.4232 2.4413 2.4413 5.5934 5.5934 5.5983 5.5983 5.8479 5.8479 5.8826 5.8826 6.0759 6.0759 6.0918 6.0918 6.3882 6.3882 6.3943 6.3943 7.5576 7.5576 7.5579 7.5579 k = 0.4000 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8984 -37.8984 -37.8982 -37.8982 -36.9220 -36.9220 -36.9217 -36.9217 -36.8036 -36.8036 -36.8032 -36.8032 -10.3035 -10.3035 -10.3032 -10.3032 -10.1722 -10.1722 -10.1714 -10.1714 -0.1794 -0.1794 -0.1731 -0.1731 0.2391 0.2391 0.2654 0.2654 0.6903 0.6903 0.7345 0.7345 1.2441 1.2441 1.2607 1.2607 1.5523 1.5523 1.5678 1.5678 2.4183 2.4183 2.4357 2.4357 5.6064 5.6064 5.6107 5.6107 5.8492 5.8492 5.8833 5.8833 6.0717 6.0717 6.0864 6.0864 6.3800 6.3800 6.3874 6.3874 7.5384 7.5384 7.5387 7.5387 k = 0.3889 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8983 -37.8983 -37.8981 -37.8981 -36.9219 -36.9219 -36.9216 -36.9216 -36.8035 -36.8035 -36.8031 -36.8031 -10.3153 -10.3153 -10.3151 -10.3151 -10.1725 -10.1725 -10.1716 -10.1716 -0.1436 -0.1436 -0.1366 -0.1366 0.2289 0.2289 0.2562 0.2562 0.6757 0.6757 0.7196 0.7196 1.2650 1.2650 1.2812 1.2812 1.5634 1.5634 1.5784 1.5784 2.4133 2.4133 2.4301 2.4301 5.6203 5.6203 5.6241 5.6241 5.8509 5.8509 5.8843 5.8843 6.0667 6.0667 6.0801 6.0801 6.3715 6.3715 6.3802 6.3802 7.5179 7.5179 7.5183 7.5183 k = 0.3778 0.2916-0.0000 ( 5436 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8982 -37.8982 -37.8980 -37.8980 -36.9217 -36.9217 -36.9214 -36.9214 -36.8034 -36.8034 -36.8030 -36.8030 -10.3277 -10.3277 -10.3276 -10.3276 -10.1732 -10.1732 -10.1721 -10.1721 -0.1057 -0.1057 -0.0978 -0.0978 0.2183 0.2183 0.2466 0.2466 0.6627 0.6627 0.7060 0.7060 1.2868 1.2868 1.3023 1.3023 1.5744 1.5744 1.5887 1.5887 2.4084 2.4084 2.4244 2.4244 5.6351 5.6351 5.6381 5.6381 5.8531 5.8531 5.8857 5.8857 6.0609 6.0609 6.0727 6.0727 6.3626 6.3626 6.3728 6.3728 7.4963 7.4963 7.4967 7.4967 k = 0.3667 0.2916-0.0000 ( 5432 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8981 -37.8981 -37.8979 -37.8979 -36.9216 -36.9216 -36.9213 -36.9213 -36.8032 -36.8032 -36.8028 -36.8028 -10.3407 -10.3407 -10.3406 -10.3406 -10.1741 -10.1741 -10.1731 -10.1731 -0.0669 -0.0669 -0.0578 -0.0578 0.2082 0.2082 0.2376 0.2376 0.6516 0.6516 0.6941 0.6941 1.3091 1.3091 1.3237 1.3237 1.5853 1.5853 1.5984 1.5984 2.4037 2.4037 2.4188 2.4188 5.6504 5.6504 5.6527 5.6527 5.8560 5.8560 5.8875 5.8875 6.0542 6.0542 6.0643 6.0643 6.3537 6.3537 6.3654 6.3654 7.4738 7.4738 7.4743 7.4743 k = 0.3556 0.2916-0.0000 ( 5428 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8980 -37.8980 -37.8978 -37.8978 -36.9214 -36.9214 -36.9211 -36.9211 -36.8030 -36.8030 -36.8026 -36.8026 -10.3542 -10.3542 -10.3542 -10.3542 -10.1755 -10.1755 -10.1743 -10.1743 -0.0293 -0.0293 -0.0190 -0.0190 0.2008 0.2008 0.2310 0.2310 0.6428 0.6428 0.6843 0.6843 1.3315 1.3315 1.3449 1.3449 1.5959 1.5959 1.6076 1.6076 2.3993 2.3993 2.4135 2.4135 5.6661 5.6661 5.6674 5.6674 5.8596 5.8596 5.8899 5.8899 6.0465 6.0465 6.0548 6.0548 6.3448 6.3448 6.3582 6.3582 7.4507 7.4507 7.4513 7.4513 k = 0.3444 0.2916-0.0000 ( 5434 PWs) bands (ev): -65.8236 -65.8236 -65.8233 -65.8233 -37.8978 -37.8978 -37.8976 -37.8976 -36.9212 -36.9212 -36.9210 -36.9210 -36.8028 -36.8028 -36.8024 -36.8024 -10.3682 -10.3682 -10.3681 -10.3681 -10.1771 -10.1771 -10.1759 -10.1759 0.0035 0.0035 0.0141 0.0141 0.2004 0.2004 0.2303 0.2303 0.6368 0.6368 0.6770 0.6770 1.3535 1.3535 1.3654 1.3654 1.6066 1.6066 1.6164 1.6164 2.3954 2.3954 2.4085 2.4085 5.6820 5.6820 5.6821 5.6821 5.8641 5.8641 5.8929 5.8929 6.0378 6.0378 6.0441 6.0441 6.3361 6.3361 6.3512 6.3512 7.4273 7.4273 7.4279 7.4279 k = 0.3333 0.2916-0.0000 ( 5434 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8977 -37.8977 -37.8975 -37.8975 -36.9211 -36.9211 -36.9208 -36.9208 -36.8026 -36.8026 -36.8023 -36.8023 -10.3826 -10.3826 -10.3825 -10.3825 -10.1790 -10.1790 -10.1778 -10.1778 0.0260 0.0260 0.0347 0.0347 0.2138 0.2138 0.2409 0.2409 0.6336 0.6336 0.6724 0.6724 1.3747 1.3747 1.3848 1.3848 1.6174 1.6174 1.6248 1.6248 2.3919 2.3919 2.4040 2.4040 5.6965 5.6965 5.6977 5.6977 5.8697 5.8697 5.8966 5.8966 6.0281 6.0281 6.0322 6.0322 6.3280 6.3280 6.3448 6.3448 7.4038 7.4038 7.4045 7.4045 k = 0.3222 0.2916-0.0000 ( 5442 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8976 -37.8976 -37.8974 -37.8974 -36.9209 -36.9209 -36.9206 -36.9206 -36.8024 -36.8024 -36.8021 -36.8021 -10.3973 -10.3973 -10.3972 -10.3972 -10.1812 -10.1812 -10.1800 -10.1800 0.0341 0.0341 0.0385 0.0385 0.2450 0.2450 0.2669 0.2669 0.6334 0.6334 0.6706 0.6706 1.3946 1.3946 1.4024 1.4024 1.6286 1.6286 1.6332 1.6332 2.3891 2.3891 2.3999 2.3999 5.7102 5.7102 5.7129 5.7129 5.8764 5.8764 5.9012 5.9012 6.0173 6.0173 6.0192 6.0192 6.3204 6.3204 6.3389 6.3389 7.3805 7.3805 7.3811 7.3811 k = 0.3111 0.2916-0.0000 ( 5446 PWs) bands (ev): -65.8237 -65.8237 -65.8234 -65.8234 -37.8974 -37.8974 -37.8972 -37.8972 -36.9207 -36.9207 -36.9204 -36.9204 -36.8022 -36.8022 -36.8019 -36.8019 -10.4123 -10.4123 -10.4121 -10.4121 -10.1837 -10.1837 -10.1824 -10.1824 0.0288 0.0288 0.0292 0.0292 0.2903 0.2903 0.3070 0.3070 0.6363 0.6363 0.6717 0.6717 1.4128 1.4128 1.4178 1.4178 1.6406 1.6406 1.6418 1.6418 2.3868 2.3868 2.3963 2.3963 5.7231 5.7231 5.7273 5.7273 5.8842 5.8842 5.9065 5.9065 6.0052 6.0052 6.0057 6.0057 6.3136 6.3136 6.3337 6.3337 7.3575 7.3575 7.3582 7.3582 k = 0.3000 0.2916-0.0000 ( 5442 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8972 -37.8972 -37.8970 -37.8970 -36.9205 -36.9205 -36.9202 -36.9202 -36.8020 -36.8020 -36.8016 -36.8016 -10.4275 -10.4275 -10.4272 -10.4272 -10.1863 -10.1863 -10.1851 -10.1851 0.0121 0.0121 0.0143 0.0143 0.3442 0.3442 0.3569 0.3569 0.6425 0.6425 0.6759 0.6759 1.4287 1.4287 1.4306 1.4306 1.6510 1.6510 1.6536 1.6536 2.3851 2.3851 2.3932 2.3932 5.7349 5.7349 5.7404 5.7404 5.8931 5.8931 5.9126 5.9126 5.9904 5.9904 5.9937 5.9937 6.3079 6.3079 6.3294 6.3294 7.3351 7.3351 7.3358 7.3358 k = 0.2889 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8971 -37.8971 -37.8969 -37.8969 -36.9203 -36.9203 -36.9200 -36.9200 -36.8017 -36.8017 -36.8014 -36.8014 -10.4428 -10.4428 -10.4425 -10.4425 -10.1892 -10.1892 -10.1879 -10.1879 -0.0095 -0.0095 -0.0057 -0.0057 0.4030 0.4030 0.4127 0.4127 0.6522 0.6522 0.6834 0.6834 1.4405 1.4405 1.4419 1.4419 1.6609 1.6609 1.6676 1.6676 2.3840 2.3840 2.3907 2.3907 5.7453 5.7453 5.7520 5.7520 5.9025 5.9025 5.9189 5.9189 5.9754 5.9754 5.9819 5.9819 6.3032 6.3032 6.3262 6.3262 7.3136 7.3136 7.3143 7.3143 k = 0.2778 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8238 -65.8238 -65.8235 -65.8235 -37.8969 -37.8969 -37.8967 -37.8967 -36.9201 -36.9201 -36.9198 -36.9198 -36.8015 -36.8015 -36.8012 -36.8012 -10.4581 -10.4581 -10.4578 -10.4578 -10.1922 -10.1922 -10.1909 -10.1909 -0.0337 -0.0337 -0.0292 -0.0292 0.4643 0.4643 0.4712 0.4712 0.6660 0.6660 0.6944 0.6944 1.4475 1.4475 1.4524 1.4524 1.6718 1.6718 1.6826 1.6826 2.3834 2.3834 2.3888 2.3888 5.7543 5.7543 5.7616 5.7616 5.9109 5.9109 5.9238 5.9238 5.9619 5.9619 5.9723 5.9723 6.2999 6.2999 6.3240 6.3240 7.2930 7.2930 7.2938 7.2938 k = 0.2667 0.2916-0.0000 ( 5430 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8967 -37.8967 -37.8965 -37.8965 -36.9199 -36.9199 -36.9196 -36.9196 -36.8012 -36.8012 -36.8009 -36.8009 -10.4735 -10.4735 -10.4732 -10.4732 -10.1954 -10.1954 -10.1941 -10.1941 -0.0594 -0.0594 -0.0547 -0.0547 0.5260 0.5260 0.5296 0.5296 0.6855 0.6855 0.7100 0.7100 1.4519 1.4519 1.4602 1.4602 1.6836 1.6836 1.6985 1.6985 2.3834 2.3834 2.3873 2.3873 5.7615 5.7615 5.7686 5.7686 5.9133 5.9133 5.9237 5.9237 5.9549 5.9549 5.9688 5.9688 6.2979 6.2979 6.3231 6.3231 7.2737 7.2737 7.2744 7.2744 k = 0.2556 0.2916-0.0000 ( 5426 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8966 -37.8966 -37.8964 -37.8964 -36.9197 -36.9197 -36.9194 -36.9194 -36.8010 -36.8010 -36.8007 -36.8007 -10.4888 -10.4888 -10.4884 -10.4884 -10.1986 -10.1986 -10.1974 -10.1974 -0.0861 -0.0861 -0.0814 -0.0814 0.5835 0.5835 0.5851 0.5851 0.7137 0.7137 0.7321 0.7321 1.4539 1.4539 1.4654 1.4654 1.6961 1.6961 1.7148 1.7148 2.3838 2.3838 2.3862 2.3862 5.7667 5.7667 5.7725 5.7725 5.9049 5.9049 5.9172 5.9172 5.9594 5.9594 5.9734 5.9734 6.2975 6.2975 6.3235 6.3235 7.2557 7.2557 7.2564 7.2564 k = 0.2444 0.2916-0.0000 ( 5426 PWs) bands (ev): -65.8239 -65.8239 -65.8236 -65.8236 -37.8964 -37.8964 -37.8962 -37.8962 -36.9195 -36.9195 -36.9192 -36.9192 -36.8008 -36.8008 -36.8005 -36.8005 -10.5039 -10.5039 -10.5036 -10.5036 -10.2020 -10.2020 -10.2007 -10.2007 -0.1133 -0.1133 -0.1088 -0.1088 0.6282 0.6282 0.6372 0.6372 0.7544 0.7544 0.7642 0.7642 1.4541 1.4541 1.4687 1.4687 1.7090 1.7090 1.7313 1.7313 2.3845 2.3845 2.3856 2.3856 5.7691 5.7691 5.7724 5.7724 5.8910 5.8910 5.9077 5.9077 5.9707 5.9707 5.9832 5.9832 6.2986 6.2986 6.3253 6.3253 7.2392 7.2392 7.2399 7.2399 k = 0.2333 0.2916-0.0000 ( 5414 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8962 -37.8962 -37.8960 -37.8960 -36.9192 -36.9192 -36.9190 -36.9190 -36.8005 -36.8005 -36.8002 -36.8002 -10.5189 -10.5189 -10.5185 -10.5185 -10.2054 -10.2054 -10.2042 -10.2042 -0.1406 -0.1406 -0.1363 -0.1363 0.6629 0.6629 0.6788 0.6788 0.8077 0.8077 0.8090 0.8090 1.4528 1.4528 1.4707 1.4707 1.7221 1.7221 1.7477 1.7477 2.3853 2.3853 2.3856 2.3856 5.7676 5.7676 5.7678 5.7678 5.8769 5.8769 5.8988 5.8988 5.9846 5.9846 5.9956 5.9956 6.3014 6.3014 6.3286 6.3286 7.2244 7.2244 7.2251 7.2251 k = 0.2222 0.2916-0.0000 ( 5422 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8961 -37.8961 -37.8959 -37.8959 -36.9190 -36.9190 -36.9188 -36.9188 -36.8003 -36.8003 -36.8000 -36.8000 -10.5336 -10.5336 -10.5333 -10.5333 -10.2088 -10.2088 -10.2076 -10.2076 -0.1678 -0.1678 -0.1638 -0.1638 0.6911 0.6911 0.7110 0.7110 0.8644 0.8644 0.8691 0.8691 1.4508 1.4508 1.4719 1.4719 1.7349 1.7349 1.7636 1.7636 2.3853 2.3853 2.3870 2.3870 5.7575 5.7575 5.7611 5.7611 5.8657 5.8657 5.8922 5.8922 5.9993 5.9993 6.0091 6.0091 6.3059 6.3059 6.3332 6.3332 7.2114 7.2114 7.2121 7.2121 k = 0.2111 0.2916-0.0000 ( 5418 PWs) bands (ev): -65.8240 -65.8240 -65.8237 -65.8237 -37.8959 -37.8959 -37.8957 -37.8957 -36.9188 -36.9188 -36.9186 -36.9186 -36.8000 -36.8000 -36.7997 -36.7997 -10.5480 -10.5480 -10.5477 -10.5477 -10.2123 -10.2123 -10.2111 -10.2111 -0.1946 -0.1946 -0.1909 -0.1909 0.7166 0.7166 0.7381 0.7381 0.9249 0.9249 0.9338 0.9338 1.4486 1.4486 1.4735 1.4735 1.7473 1.7473 1.7791 1.7791 2.3855 2.3855 2.3885 2.3885 5.7423 5.7423 5.7483 5.7483 5.8588 5.8588 5.8883 5.8883 6.0143 6.0143 6.0231 6.0231 6.3119 6.3119 6.3393 6.3393 7.2003 7.2003 7.2010 7.2010 k = 0.2000 0.2916-0.0000 ( 5424 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8957 -37.8957 -37.8955 -37.8955 -36.9187 -36.9187 -36.9184 -36.9184 -36.7998 -36.7998 -36.7995 -36.7995 -10.5621 -10.5621 -10.5617 -10.5617 -10.2157 -10.2157 -10.2146 -10.2146 -0.2209 -0.2209 -0.2175 -0.2175 0.7411 0.7411 0.7632 0.7632 0.9862 0.9862 0.9987 0.9987 1.4469 1.4469 1.4763 1.4763 1.7591 1.7591 1.7940 1.7940 2.3859 2.3859 2.3901 2.3901 5.7228 5.7228 5.7298 5.7298 5.8560 5.8560 5.8868 5.8868 6.0293 6.0293 6.0373 6.0373 6.3195 6.3195 6.3467 6.3467 7.1913 7.1913 7.1919 7.1919 k = 0.1889 0.2916-0.0000 ( 5428 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8956 -37.8956 -37.8954 -37.8954 -36.9185 -36.9185 -36.9183 -36.9183 -36.7995 -36.7995 -36.7993 -36.7993 -10.5757 -10.5757 -10.5753 -10.5753 -10.2191 -10.2191 -10.2180 -10.2180 -0.2464 -0.2464 -0.2434 -0.2434 0.7656 0.7656 0.7878 0.7878 1.0449 1.0449 1.0614 1.0614 1.4470 1.4470 1.4817 1.4817 1.7705 1.7705 1.8085 1.8085 2.3863 2.3863 2.3918 2.3918 5.6999 5.6999 5.7070 5.7070 5.8561 5.8561 5.8869 5.8869 6.0440 6.0440 6.0514 6.0514 6.3285 6.3285 6.3553 6.3553 7.1844 7.1844 7.1850 7.1850 k = 0.1778 0.2916-0.0000 ( 5416 PWs) bands (ev): -65.8241 -65.8241 -65.8238 -65.8238 -37.8954 -37.8954 -37.8952 -37.8952 -36.9183 -36.9183 -36.9181 -36.9181 -36.7993 -36.7993 -36.7991 -36.7991 -10.5888 -10.5888 -10.5885 -10.5885 -10.2224 -10.2224 -10.2214 -10.2214 -0.2711 -0.2711 -0.2683 -0.2683 0.7904 0.7904 0.8124 0.8124 1.0983 1.0983 1.1194 1.1194 1.4501 1.4501 1.4911 1.4911 1.7815 1.7815 1.8227 1.8227 2.3869 2.3869 2.3935 2.3935 5.6745 5.6745 5.6813 5.6813 5.8582 5.8582 5.8882 5.8882 6.0583 6.0583 6.0652 6.0652 6.3387 6.3387 6.3648 6.3648 7.1798 7.1798 7.1803 7.1803 k = 0.1667 0.2916-0.0000 ( 5424 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8953 -37.8953 -37.8951 -37.8951 -36.9181 -36.9181 -36.9179 -36.9179 -36.7991 -36.7991 -36.7989 -36.7989 -10.6014 -10.6014 -10.6011 -10.6011 -10.2256 -10.2256 -10.2246 -10.2246 -0.2949 -0.2949 -0.2923 -0.2923 0.8156 0.8156 0.8374 0.8374 1.1440 1.1440 1.1699 1.1699 1.4579 1.4579 1.5057 1.5057 1.7927 1.7927 1.8372 1.8372 2.3874 2.3874 2.3950 2.3950 5.6473 5.6473 5.6535 5.6535 5.8612 5.8612 5.8901 5.8901 6.0722 6.0722 6.0785 6.0785 6.3499 6.3499 6.3751 6.3751 7.1774 7.1774 7.1779 7.1779 k = 0.1556 0.2916-0.0000 ( 5418 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8951 -37.8951 -37.8949 -37.8949 -36.9180 -36.9180 -36.9178 -36.9178 -36.7988 -36.7988 -36.7986 -36.7986 -10.6134 -10.6134 -10.6131 -10.6131 -10.2288 -10.2288 -10.2278 -10.2278 -0.3175 -0.3175 -0.3152 -0.3152 0.8412 0.8412 0.8628 0.8628 1.1801 1.1801 1.2102 1.2102 1.4722 1.4722 1.5261 1.5261 1.8050 1.8050 1.8526 1.8526 2.3878 2.3878 2.3965 2.3965 5.6188 5.6188 5.6246 5.6246 5.8649 5.8649 5.8923 5.8923 6.0856 6.0856 6.0914 6.0914 6.3617 6.3617 6.3859 6.3859 7.1774 7.1774 7.1778 7.1778 k = 0.1444 0.2916-0.0000 ( 5418 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8950 -37.8950 -37.8948 -37.8948 -36.9178 -36.9178 -36.9176 -36.9176 -36.7986 -36.7986 -36.7984 -36.7984 -10.6249 -10.6249 -10.6245 -10.6245 -10.2318 -10.2318 -10.2309 -10.2309 -0.3389 -0.3389 -0.3369 -0.3369 0.8671 0.8671 0.8886 0.8886 1.2060 1.2060 1.2386 1.2386 1.4934 1.4934 1.5511 1.5511 1.8195 1.8195 1.8698 1.8698 2.3882 2.3882 2.3978 2.3978 5.5896 5.5896 5.5948 5.5948 5.8688 5.8688 5.8946 5.8946 6.0983 6.0983 6.1036 6.1036 6.3739 6.3739 6.3969 6.3969 7.1796 7.1796 7.1800 7.1800 k = 0.1333 0.2916-0.0000 ( 5414 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8949 -37.8949 -37.8947 -37.8947 -36.9176 -36.9176 -36.9175 -36.9175 -36.7984 -36.7984 -36.7982 -36.7982 -10.6356 -10.6356 -10.6353 -10.6353 -10.2346 -10.2346 -10.2338 -10.2338 -0.3590 -0.3590 -0.3572 -0.3572 0.8933 0.8933 0.9146 0.9146 1.2228 1.2228 1.2558 1.2558 1.5192 1.5192 1.5778 1.5778 1.8378 1.8378 1.8897 1.8897 2.3885 2.3885 2.3988 2.3988 5.5600 5.5600 5.5647 5.5647 5.8728 5.8728 5.8969 5.8969 6.1103 6.1103 6.1152 6.1152 6.3862 6.3862 6.4079 6.4079 7.1839 7.1839 7.1843 7.1843 k = 0.1222 0.2916-0.0000 ( 5420 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8948 -37.8948 -37.8946 -37.8946 -36.9175 -36.9175 -36.9173 -36.9173 -36.7982 -36.7982 -36.7981 -36.7981 -10.6456 -10.6456 -10.6453 -10.6453 -10.2373 -10.2373 -10.2365 -10.2365 -0.3778 -0.3778 -0.3762 -0.3762 0.9196 0.9196 0.9408 0.9408 1.2323 1.2323 1.2645 1.2645 1.5459 1.5459 1.6023 1.6023 1.8615 1.8615 1.9131 1.9131 2.3885 2.3885 2.3997 2.3997 5.5304 5.5304 5.5346 5.5346 5.8768 5.8768 5.8992 5.8992 6.1216 6.1216 6.1261 6.1261 6.3983 6.3983 6.4185 6.4185 7.1903 7.1903 7.1906 7.1906 k = 0.1111 0.2916-0.0000 ( 5432 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8947 -37.8947 -37.8945 -37.8945 -36.9174 -36.9174 -36.9172 -36.9172 -36.7981 -36.7981 -36.7979 -36.7979 -10.6549 -10.6549 -10.6546 -10.6546 -10.2398 -10.2398 -10.2391 -10.2391 -0.3952 -0.3952 -0.3938 -0.3938 0.9457 0.9457 0.9669 0.9669 1.2366 1.2366 1.2675 1.2675 1.5700 1.5700 1.6216 1.6216 1.8914 1.8914 1.9406 1.9406 2.3884 2.3884 2.4002 2.4002 5.5013 5.5013 5.5051 5.5051 5.8807 5.8807 5.9012 5.9012 6.1322 6.1322 6.1362 6.1362 6.4099 6.4099 6.4286 6.4286 7.1984 7.1984 7.1987 7.1987 k = 0.1000 0.2916-0.0000 ( 5428 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8946 -37.8946 -37.8944 -37.8944 -36.9173 -36.9173 -36.9171 -36.9171 -36.7979 -36.7979 -36.7977 -36.7977 -10.6634 -10.6634 -10.6632 -10.6632 -10.2421 -10.2421 -10.2414 -10.2414 -0.4111 -0.4111 -0.4098 -0.4098 0.9716 0.9716 0.9928 0.9928 1.2372 1.2372 1.2667 1.2667 1.5893 1.5893 1.6345 1.6345 1.9266 1.9266 1.9719 1.9719 2.3880 2.3880 2.4004 2.4004 5.4731 5.4731 5.4764 5.4764 5.8845 5.8845 5.9031 5.9031 6.1419 6.1419 6.1455 6.1455 6.4209 6.4209 6.4379 6.4379 7.2080 7.2080 7.2083 7.2083 k = 0.0889 0.2916-0.0000 ( 5428 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8945 -37.8945 -37.8943 -37.8943 -36.9172 -36.9172 -36.9170 -36.9170 -36.7978 -36.7978 -36.7976 -36.7976 -10.6711 -10.6711 -10.6709 -10.6709 -10.2442 -10.2442 -10.2436 -10.2436 -0.4254 -0.4254 -0.4243 -0.4243 0.9970 0.9970 1.0183 1.0183 1.2352 1.2352 1.2635 1.2635 1.6033 1.6033 1.6416 1.6416 1.9652 1.9652 2.0057 2.0057 2.3875 2.3875 2.4002 2.4002 5.4461 5.4461 5.4490 5.4490 5.8881 5.8881 5.9048 5.9048 6.1508 6.1508 6.1539 6.1539 6.4310 6.4310 6.4462 6.4462 7.2186 7.2186 7.2189 7.2189 k = 0.0778 0.2916-0.0000 ( 5426 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8944 -37.8944 -37.8942 -37.8942 -36.9171 -36.9171 -36.9169 -36.9169 -36.7976 -36.7976 -36.7975 -36.7975 -10.6779 -10.6779 -10.6778 -10.6778 -10.2461 -10.2461 -10.2455 -10.2455 -0.4381 -0.4381 -0.4372 -0.4372 1.0216 1.0216 1.0431 1.0431 1.2314 1.2314 1.2587 1.2587 1.6125 1.6125 1.6441 1.6441 2.0050 2.0050 2.0406 2.0406 2.3867 2.3867 2.3996 2.3996 5.4209 5.4209 5.4234 5.4234 5.8915 5.8915 5.9062 5.9062 6.1587 6.1587 6.1614 6.1614 6.4402 6.4402 6.4536 6.4536 7.2298 7.2298 7.2301 7.2301 k = 0.0667 0.2916-0.0000 ( 5442 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8943 -37.8943 -37.8942 -37.8942 -36.9170 -36.9170 -36.9169 -36.9169 -36.7975 -36.7975 -36.7974 -36.7974 -10.6839 -10.6839 -10.6838 -10.6838 -10.2477 -10.2477 -10.2473 -10.2473 -0.4493 -0.4493 -0.4485 -0.4485 1.0453 1.0453 1.0668 1.0668 1.2263 1.2263 1.2528 1.2528 1.6178 1.6178 1.6434 1.6434 2.0438 2.0438 2.0747 2.0747 2.3857 2.3857 2.3985 2.3985 5.3978 5.3978 5.4000 5.4000 5.8946 5.8946 5.9073 5.9073 6.1657 6.1657 6.1680 6.1680 6.4483 6.4483 6.4598 6.4598 7.2410 7.2410 7.2413 7.2413 k = 0.0556 0.2916-0.0000 ( 5434 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8943 -37.8943 -37.8941 -37.8941 -36.9170 -36.9170 -36.9168 -36.9168 -36.7974 -36.7974 -36.7973 -36.7973 -10.6890 -10.6890 -10.6889 -10.6889 -10.2491 -10.2491 -10.2487 -10.2487 -0.4587 -0.4587 -0.4581 -0.4581 1.0677 1.0677 1.0893 1.0893 1.2203 1.2203 1.2459 1.2459 1.6203 1.6203 1.6406 1.6406 2.0800 2.0800 2.1064 2.1064 2.3846 2.3846 2.3970 2.3970 5.3774 5.3774 5.3792 5.3792 5.8975 5.8975 5.9081 5.9081 6.1717 6.1717 6.1736 6.1736 6.4553 6.4553 6.4649 6.4649 7.2518 7.2518 7.2521 7.2521 k = 0.0444 0.2916-0.0000 ( 5438 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7974 -36.7974 -36.7972 -36.7972 -10.6932 -10.6932 -10.6931 -10.6931 -10.2502 -10.2502 -10.2499 -10.2499 -0.4665 -0.4665 -0.4660 -0.4660 1.0886 1.0886 1.1101 1.1101 1.2135 1.2135 1.2381 1.2381 1.6211 1.6211 1.6366 1.6366 2.1121 2.1121 2.1341 2.1341 2.3836 2.3836 2.3949 2.3949 5.3600 5.3600 5.3615 5.3615 5.9001 5.9001 5.9086 5.9086 6.1767 6.1767 6.1782 6.1782 6.4611 6.4611 6.4689 6.4689 7.2615 7.2615 7.2618 7.2618 k = 0.0333 0.2916-0.0000 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.6965 -10.6965 -10.6964 -10.6964 -10.2511 -10.2511 -10.2509 -10.2509 -0.4725 -0.4725 -0.4722 -0.4722 1.1077 1.1077 1.1284 1.1284 1.2066 1.2066 1.2296 1.2296 1.6210 1.6210 1.6324 1.6324 2.1392 2.1392 2.1564 2.1564 2.3829 2.3829 2.3925 2.3925 5.3461 5.3461 5.3472 5.3472 5.9023 5.9023 5.9087 5.9087 6.1807 6.1807 6.1818 6.1818 6.4658 6.4658 6.4717 6.4717 7.2696 7.2696 7.2699 7.2699 k = 0.0222 0.2916-0.0000 ( 5464 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.6989 -10.6989 -10.6988 -10.6988 -10.2518 -10.2518 -10.2516 -10.2516 -0.4769 -0.4769 -0.4766 -0.4766 1.1247 1.1247 1.1429 1.1429 1.2005 1.2005 1.2203 1.2203 1.6210 1.6210 1.6284 1.6284 2.1603 2.1603 2.1723 2.1723 2.3828 2.3828 2.3898 2.3898 5.3359 5.3359 5.3367 5.3367 5.9042 5.9042 5.9085 5.9085 6.1835 6.1835 6.1843 6.1843 6.4695 6.4695 6.4734 6.4734 7.2758 7.2758 7.2761 7.2761 k = 0.0111 0.2916-0.0000 ( 5460 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7003 -10.7003 -10.7002 -10.7002 -10.2521 -10.2521 -10.2520 -10.2520 -0.4794 -0.4794 -0.4793 -0.4793 1.1388 1.1388 1.1505 1.1505 1.1982 1.1982 1.2108 1.2108 1.6214 1.6214 1.6251 1.6251 2.1747 2.1747 2.1809 2.1809 2.3834 2.3834 2.3872 2.3872 5.3298 5.3298 5.3302 5.3302 5.9058 5.9058 5.9080 5.9080 6.1853 6.1853 6.1857 6.1857 6.4721 6.4721 6.4740 6.4740 7.2797 7.2797 7.2799 7.2799 k = 0.0000 0.2916-0.0000 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7007 -10.7007 -10.7007 -10.7007 -10.2522 -10.2522 -10.2522 -10.2522 -0.4803 -0.4803 -0.4802 -0.4802 1.1485 1.1485 1.1485 1.1485 1.2023 1.2023 1.2024 1.2024 1.6227 1.6227 1.6227 1.6227 2.1816 2.1816 2.1817 2.1817 2.3849 2.3849 2.3849 2.3849 5.3278 5.3278 5.3280 5.3280 5.9070 5.9070 5.9072 5.9072 6.1860 6.1860 6.1862 6.1862 6.4736 6.4736 6.4737 6.4737 7.2810 7.2810 7.2812 7.2812 k = 0.0000 0.2916-0.0000 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7007 -10.7007 -10.7007 -10.7007 -10.2522 -10.2522 -10.2522 -10.2522 -0.4803 -0.4803 -0.4802 -0.4802 1.1485 1.1485 1.1485 1.1485 1.2023 1.2023 1.2024 1.2024 1.6227 1.6227 1.6227 1.6227 2.1816 2.1816 2.1817 2.1817 2.3849 2.3849 2.3849 2.3849 5.3278 5.3278 5.3280 5.3280 5.9070 5.9070 5.9072 5.9072 6.1860 6.1860 6.1862 6.1862 6.4736 6.4736 6.4737 6.4737 7.2810 7.2810 7.2812 7.2812 k = 0.0000 0.2808-0.0000 ( 5454 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.7160 -10.7160 -10.6854 -10.6854 -10.2530 -10.2530 -10.2514 -10.2514 -0.4988 -0.4988 -0.4611 -0.4611 1.0994 1.0994 1.1825 1.1825 1.1987 1.1987 1.2211 1.2211 1.6025 1.6025 1.6428 1.6428 2.1669 2.1669 2.1961 2.1961 2.3827 2.3827 2.3877 2.3877 5.3267 5.3267 5.3285 5.3285 5.9050 5.9050 5.9088 5.9088 6.1735 6.1735 6.1980 6.1980 6.4451 6.4451 6.5021 6.5021 7.2807 7.2807 7.2820 7.2820 k = 0.0000 0.2700-0.0000 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.7313 -10.7313 -10.6701 -10.6701 -10.2537 -10.2537 -10.2505 -10.2505 -0.5169 -0.5169 -0.4412 -0.4412 1.0489 1.0489 1.1908 1.1908 1.1978 1.1978 1.2632 1.2632 1.5845 1.5845 1.6613 1.6613 2.1519 2.1519 2.2101 2.2101 2.3813 2.3813 2.3907 2.3907 5.3248 5.3248 5.3283 5.3283 5.9027 5.9027 5.9102 5.9102 6.1605 6.1605 6.2089 6.2089 6.4171 6.4171 6.5303 6.5303 7.2810 7.2810 7.2834 7.2834 k = 0.0000 0.2592-0.0000 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.7464 -10.7464 -10.6549 -10.6549 -10.2543 -10.2543 -10.2496 -10.2496 -0.5346 -0.5346 -0.4206 -0.4206 0.9996 0.9996 1.1933 1.1933 1.1977 1.1977 1.3049 1.3049 1.5727 1.5727 1.6775 1.6775 2.1368 2.1368 2.2237 2.2237 2.3812 2.3812 2.3936 2.3936 5.3222 5.3222 5.3273 5.3273 5.8999 5.8999 5.9113 5.9113 6.1471 6.1471 6.2183 6.2183 6.3901 6.3901 6.5580 6.5580 7.2817 7.2817 7.2853 7.2853 k = 0.0000 0.2484-0.0000 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.7613 -10.7613 -10.6398 -10.6398 -10.2548 -10.2548 -10.2486 -10.2486 -0.5520 -0.5520 -0.3991 -0.3991 0.9525 0.9525 1.1948 1.1948 1.1981 1.1981 1.3342 1.3342 1.5740 1.5740 1.6907 1.6907 2.1216 2.1216 2.2368 2.2368 2.3828 2.3828 2.3964 2.3964 5.3190 5.3190 5.3256 5.3256 5.8970 5.8970 5.9120 5.9120 6.1335 6.1335 6.2254 6.2254 6.3653 6.3653 6.5847 6.5847 7.2830 7.2830 7.2877 7.2877 k = 0.0000 0.2376-0.0000 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.7760 -10.7760 -10.6250 -10.6250 -10.2552 -10.2552 -10.2476 -10.2476 -0.5691 -0.5691 -0.3767 -0.3767 0.9081 0.9081 1.1961 1.1961 1.1988 1.1988 1.3440 1.3440 1.5947 1.5947 1.7005 1.7005 2.1063 2.1063 2.2493 2.2493 2.3863 2.3863 2.3988 2.3988 5.3152 5.3152 5.3231 5.3231 5.8938 5.8938 5.9123 5.9123 6.1197 6.1197 6.2284 6.2284 6.3444 6.3444 6.6106 6.6106 7.2847 7.2847 7.2905 7.2905 k = 0.0000 0.2268-0.0000 ( 5446 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.7903 -10.7903 -10.6105 -10.6105 -10.2555 -10.2555 -10.2466 -10.2466 -0.5861 -0.5861 -0.3533 -0.3533 0.8668 0.8668 1.1973 1.1973 1.1998 1.1998 1.3348 1.3348 1.6332 1.6332 1.7072 1.7072 2.0910 2.0910 2.2613 2.2613 2.3918 2.3918 2.4009 2.4009 5.3108 5.3108 5.3198 5.3198 5.8904 5.8904 5.9124 5.9124 6.1059 6.1059 6.2250 6.2250 6.3300 6.3300 6.6353 6.6353 7.2870 7.2870 7.2938 7.2938 k = 0.0000 0.2160-0.0000 ( 5453 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.8044 -10.8044 -10.5964 -10.5964 -10.2557 -10.2557 -10.2456 -10.2456 -0.6031 -0.6031 -0.3290 -0.3290 0.8287 0.8287 1.1984 1.1984 1.2010 1.2010 1.3132 1.3132 1.6788 1.6788 1.7144 1.7144 2.0758 2.0758 2.2729 2.2729 2.3985 2.3985 2.4037 2.4037 5.3059 5.3059 5.3158 5.3158 5.8868 5.8868 5.9120 5.9120 6.0920 6.0920 6.2138 6.2138 6.3236 6.3236 6.6589 6.6589 7.2897 7.2897 7.2973 7.2973 k = 0.0000 0.2052-0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.8180 -10.8180 -10.5826 -10.5826 -10.2557 -10.2557 -10.2447 -10.2447 -0.6200 -0.6200 -0.3036 -0.3036 0.7941 0.7941 1.1993 1.1993 1.2024 1.2024 1.2847 1.2847 1.6973 1.6973 1.7511 1.7511 2.0607 2.0607 2.2841 2.2841 2.4020 2.4020 2.4114 2.4114 5.3004 5.3004 5.3110 5.3110 5.8831 5.8831 5.9114 5.9114 6.0782 6.0782 6.1963 6.1963 6.3238 6.3238 6.6810 6.6810 7.2929 7.2929 7.3012 7.3012 k = 0.0000 0.1944-0.0000 ( 5449 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8312 -10.8312 -10.5693 -10.5693 -10.2555 -10.2555 -10.2437 -10.2437 -0.6369 -0.6369 -0.2771 -0.2771 0.7632 0.7632 1.1992 1.1992 1.2041 1.2041 1.2528 1.2528 1.6933 1.6933 1.8092 1.8092 2.0459 2.0459 2.2948 2.2948 2.4032 2.4032 2.4232 2.4232 5.2946 5.2946 5.3055 5.3055 5.8792 5.8792 5.9105 5.9105 6.0646 6.0646 6.1754 6.1754 6.3281 6.3281 6.7017 6.7017 7.2964 7.2964 7.3054 7.3054 k = 0.0000 0.1836-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8439 -10.8439 -10.5566 -10.5566 -10.2552 -10.2552 -10.2427 -10.2427 -0.6539 -0.6539 -0.2496 -0.2496 0.7359 0.7359 1.1943 1.1943 1.2060 1.2060 1.2231 1.2231 1.6836 1.6836 1.8704 1.8704 2.0313 2.0313 2.3051 2.3051 2.4042 2.4042 2.4371 2.4371 5.2883 5.2883 5.2993 5.2993 5.8753 5.8753 5.9093 5.9093 6.0511 6.0511 6.1532 6.1532 6.3344 6.3344 6.7209 6.7209 7.3002 7.3002 7.3097 7.3097 k = 0.0000 0.1728-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8561 -10.8561 -10.5445 -10.5445 -10.2547 -10.2547 -10.2418 -10.2418 -0.6708 -0.6708 -0.2210 -0.2210 0.7123 0.7123 1.1694 1.1694 1.2081 1.2081 1.2115 1.2115 1.6700 1.6700 1.9317 1.9317 2.0171 2.0171 2.3149 2.3149 2.4054 2.4054 2.4525 2.4525 5.2817 5.2817 5.2925 5.2925 5.8713 5.8713 5.9078 5.9078 6.0378 6.0378 6.1308 6.1308 6.3417 6.3417 6.7386 6.7386 7.3042 7.3042 7.3143 7.3143 k = 0.0000 0.1620-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8678 -10.8678 -10.5330 -10.5330 -10.2540 -10.2540 -10.2409 -10.2409 -0.6876 -0.6876 -0.1913 -0.1913 0.6923 0.6923 1.1326 1.1326 1.2102 1.2102 1.2106 1.2106 1.6534 1.6534 1.9889 1.9889 2.0065 2.0065 2.3240 2.3240 2.4074 2.4074 2.4691 2.4691 5.2748 5.2748 5.2852 5.2852 5.8674 5.8674 5.9061 5.9061 6.0248 6.0248 6.1091 6.1091 6.3492 6.3492 6.7546 6.7546 7.3085 7.3085 7.3189 7.3189 k = 0.0000 0.1512-0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.8789 -10.8789 -10.5222 -10.5222 -10.2532 -10.2532 -10.2401 -10.2401 -0.7042 -0.7042 -0.1607 -0.1607 0.6758 0.6758 1.0931 1.0931 1.2112 1.2112 1.2127 1.2127 1.6342 1.6342 1.9879 1.9879 2.0522 2.0522 2.3320 2.3320 2.4107 2.4107 2.4865 2.4865 5.2675 5.2675 5.2773 5.2773 5.8635 5.8635 5.9042 5.9042 6.0121 6.0121 6.0884 6.0884 6.3568 6.3568 6.7690 6.7690 7.3128 7.3128 7.3235 7.3235 k = 0.0000 0.1404-0.0000 ( 5453 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.8893 -10.8893 -10.5121 -10.5121 -10.2522 -10.2522 -10.2392 -10.2392 -0.7206 -0.7206 -0.1291 -0.1291 0.6627 0.6627 1.0523 1.0523 1.2124 1.2124 1.2152 1.2152 1.6131 1.6131 1.9752 1.9752 2.1066 2.1066 2.3389 2.3389 2.4164 2.4164 2.5046 2.5046 5.2601 5.2601 5.2691 5.2691 5.8597 5.8597 5.9020 5.9020 5.9999 5.9999 6.0690 6.0690 6.3642 6.3642 6.7818 6.7818 7.3172 7.3172 7.3282 7.3282 k = 0.0000 0.1296-0.0000 ( 5445 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8991 -10.8991 -10.5028 -10.5028 -10.2510 -10.2510 -10.2385 -10.2385 -0.7366 -0.7366 -0.0966 -0.0966 0.6527 0.6527 1.0110 1.0110 1.2138 1.2138 1.2177 1.2177 1.5905 1.5905 1.9628 1.9628 2.1566 2.1566 2.3446 2.3446 2.4252 2.4252 2.5229 2.5229 5.2527 5.2527 5.2606 5.2606 5.8560 5.8560 5.8996 5.8996 5.9882 5.9882 6.0511 6.0511 6.3714 6.3714 6.7930 6.7930 7.3216 7.3216 7.3328 7.3328 k = 0.0000 0.1188-0.0000 ( 5443 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9082 -10.9082 -10.4942 -10.4942 -10.2498 -10.2498 -10.2377 -10.2377 -0.7521 -0.7521 -0.0634 -0.0634 0.6457 0.6457 0.9692 0.9692 1.2152 1.2152 1.2202 1.2202 1.5670 1.5670 1.9510 1.9510 2.2001 2.2001 2.3494 2.3494 2.4380 2.4380 2.5413 2.5413 5.2451 5.2451 5.2521 5.2521 5.8524 5.8524 5.8970 5.8970 5.9771 5.9771 6.0348 6.0348 6.3781 6.3781 6.8027 6.8027 7.3259 7.3259 7.3373 7.3373 k = 0.0000 0.1080-0.0000 ( 5441 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9166 -10.9166 -10.4865 -10.4865 -10.2484 -10.2484 -10.2371 -10.2371 -0.7669 -0.7669 -0.0295 -0.0295 0.6412 0.6412 0.9273 0.9273 1.2167 1.2167 1.2227 1.2227 1.5430 1.5430 1.9399 1.9399 2.2354 2.2354 2.3539 2.3539 2.4554 2.4554 2.5594 2.5594 5.2377 5.2377 5.2436 5.2436 5.8490 5.8490 5.8942 5.8942 5.9668 5.9668 6.0200 6.0200 6.3845 6.3845 6.8110 6.8110 7.3301 7.3301 7.3416 7.3416 k = 0.0000 0.0972-0.0000 ( 5451 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.9243 -10.9243 -10.4795 -10.4795 -10.2470 -10.2470 -10.2365 -10.2365 -0.7808 -0.7808 0.0048 0.0048 0.6390 0.6390 0.8857 0.8857 1.2180 1.2180 1.2251 1.2251 1.5191 1.5191 1.9295 1.9295 2.2615 2.2615 2.3589 2.3589 2.4773 2.4773 2.5772 2.5772 5.2303 5.2303 5.2352 5.2352 5.8458 5.8458 5.8911 5.8911 5.9575 5.9575 6.0069 6.0069 6.3903 6.3903 6.8179 6.8179 7.3340 7.3340 7.3457 7.3457 k = 0.0000 0.0864-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.9312 -10.9312 -10.4734 -10.4734 -10.2456 -10.2456 -10.2359 -10.2359 -0.7938 -0.7938 0.0394 0.0394 0.6387 0.6387 0.8445 0.8445 1.2193 1.2193 1.2275 1.2275 1.4957 1.4957 1.9200 1.9200 2.2788 2.2788 2.3645 2.3645 2.5024 2.5024 2.5946 2.5946 5.2232 5.2232 5.2273 5.2273 5.8429 5.8429 5.8878 5.8878 5.9492 5.9492 5.9953 5.9953 6.3956 6.3956 6.8236 6.8236 7.3377 7.3377 7.3495 7.3495 k = 0.0000 0.0756-0.0000 ( 5453 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9374 -10.9374 -10.4680 -10.4680 -10.2442 -10.2442 -10.2354 -10.2354 -0.8056 -0.8056 0.0739 0.0739 0.6399 0.6399 0.8041 0.8041 1.2205 1.2205 1.2297 1.2297 1.4735 1.4735 1.9115 1.9115 2.2890 2.2890 2.3705 2.3705 2.5285 2.5285 2.6115 2.6115 5.2163 5.2163 5.2199 5.2199 5.8403 5.8403 5.8844 5.8844 5.9420 5.9420 5.9853 5.9853 6.4003 6.4003 6.8282 6.8282 7.3410 7.3410 7.3530 7.3530 k = 0.0000 0.0648-0.0000 ( 5447 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9428 -10.9428 -10.4634 -10.4634 -10.2429 -10.2429 -10.2350 -10.2350 -0.8162 -0.8162 0.1078 0.1078 0.6419 0.6419 0.7652 0.7652 1.2216 1.2216 1.2318 1.2318 1.4528 1.4528 1.9039 1.9039 2.2946 2.2946 2.3763 2.3763 2.5534 2.5534 2.6280 2.6280 5.2099 5.2099 5.2134 5.2134 5.8380 5.8380 5.8810 5.8810 5.9360 5.9360 5.9767 5.9767 6.4045 6.4045 6.8318 6.8318 7.3441 7.3441 7.3562 7.3562 k = 0.0000 0.0540-0.0000 ( 5451 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9473 -10.9473 -10.4595 -10.4595 -10.2417 -10.2417 -10.2346 -10.2346 -0.8254 -0.8254 0.1406 0.1406 0.6444 0.6444 0.7285 0.7285 1.2226 1.2226 1.2336 1.2336 1.4341 1.4341 1.8974 1.8974 2.2974 2.2974 2.3815 2.3815 2.5751 2.5751 2.6440 2.6440 5.2040 5.2040 5.2076 5.2076 5.8359 5.8359 5.8778 5.8778 5.9312 5.9312 5.9694 5.9694 6.4081 6.4081 6.8345 6.8345 7.3466 7.3466 7.3589 7.3589 k = 0.0000 0.0432-0.0000 ( 5461 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9511 -10.9511 -10.4564 -10.4564 -10.2407 -10.2407 -10.2343 -10.2343 -0.8330 -0.8330 0.1713 0.1713 0.6461 0.6461 0.6956 0.6956 1.2234 1.2234 1.2351 1.2351 1.4180 1.4180 1.8920 1.8920 2.2986 2.2986 2.3857 2.3857 2.5927 2.5927 2.6589 2.6589 5.1990 5.1990 5.2028 5.2028 5.8342 5.8342 5.8748 5.8748 5.9273 5.9273 5.9636 5.9636 6.4110 6.4110 6.8366 6.8366 7.3488 7.3488 7.3611 7.3611 k = 0.0000 0.0324-0.0000 ( 5459 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9170 -36.9170 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9540 -10.9540 -10.4540 -10.4540 -10.2398 -10.2398 -10.2340 -10.2340 -0.8391 -0.8391 0.1987 0.1987 0.6437 0.6437 0.6707 0.6707 1.2241 1.2241 1.2364 1.2364 1.4049 1.4049 1.8878 1.8878 2.2990 2.2990 2.3891 2.3891 2.6059 2.6059 2.6721 2.6721 5.1949 5.1949 5.1990 5.1990 5.8328 5.8328 5.8723 5.8723 5.9245 5.9245 5.9591 5.9591 6.4133 6.4133 6.8380 6.8380 7.3505 7.3505 7.3630 7.3630 k = 0.0000 0.0216-0.0000 ( 5459 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9170 -36.9170 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9561 -10.9561 -10.4523 -10.4523 -10.2392 -10.2392 -10.2338 -10.2338 -0.8434 -0.8434 0.2208 0.2208 0.6309 0.6309 0.6618 0.6618 1.2246 1.2246 1.2374 1.2374 1.3952 1.3952 1.8847 1.8847 2.2990 2.2990 2.3914 2.3914 2.6149 2.6149 2.6823 2.6823 5.1918 5.1918 5.1962 5.1962 5.8319 5.8319 5.8705 5.8705 5.9226 5.9226 5.9558 5.9558 6.4150 6.4150 6.8390 6.8390 7.3517 7.3517 7.3643 7.3643 k = 0.0000 0.0108-0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9574 -10.9574 -10.4513 -10.4513 -10.2388 -10.2388 -10.2337 -10.2337 -0.8461 -0.8461 0.2354 0.2354 0.6176 0.6176 0.6608 0.6608 1.2249 1.2249 1.2379 1.2379 1.3893 1.3893 1.8829 1.8829 2.2990 2.2990 2.3928 2.3928 2.6201 2.6201 2.6889 2.6889 5.1900 5.1900 5.1945 5.1945 5.8313 5.8313 5.8693 5.8693 5.9215 5.9215 5.9539 5.9539 6.4160 6.4160 6.8395 6.8395 7.3525 7.3525 7.3651 7.3651 k = 0.0000 0.0000 0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9578 -10.9578 -10.4509 -10.4509 -10.2387 -10.2387 -10.2337 -10.2337 -0.8470 -0.8470 0.2406 0.2406 0.6125 0.6125 0.6609 0.6609 1.2250 1.2250 1.2381 1.2381 1.3873 1.3873 1.8822 1.8822 2.2989 2.2989 2.3933 2.3933 2.6218 2.6218 2.6911 2.6911 5.1894 5.1894 5.1939 5.1939 5.8311 5.8311 5.8689 5.8689 5.9211 5.9211 5.9533 5.9533 6.4164 6.4164 6.8397 6.8397 7.3527 7.3527 7.3654 7.3654 k = 0.0000 0.0000 0.0000 ( 5455 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9578 -10.9578 -10.4509 -10.4509 -10.2387 -10.2387 -10.2337 -10.2337 -0.8470 -0.8470 0.2406 0.2406 0.6125 0.6125 0.6609 0.6609 1.2250 1.2250 1.2381 1.2381 1.3873 1.3873 1.8822 1.8822 2.2989 2.2989 2.3933 2.3933 2.6218 2.6218 2.6911 2.6911 5.1894 5.1894 5.1939 5.1939 5.8311 5.8311 5.8689 5.8689 5.9211 5.9211 5.9533 5.9533 6.4164 6.4164 6.8397 6.8397 7.3527 7.3527 7.3654 7.3654 k = 0.0000 0.0000 0.0109 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9574 -10.9574 -10.4519 -10.4519 -10.2386 -10.2386 -10.2334 -10.2334 -0.8460 -0.8460 0.2389 0.2389 0.6137 0.6137 0.6623 0.6623 1.2250 1.2250 1.2381 1.2381 1.3884 1.3884 1.8828 1.8828 2.2976 2.2976 2.3925 2.3925 2.6195 2.6195 2.6890 2.6890 5.1901 5.1901 5.1947 5.1947 5.8314 5.8314 5.8693 5.8693 5.9215 5.9215 5.9540 5.9540 6.4159 6.4159 6.8394 6.8394 7.3525 7.3525 7.3651 7.3651 k = 0.0000 0.0000 0.0219 ( 5448 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7973 -36.7973 -36.7970 -36.7970 -10.9561 -10.9561 -10.4546 -10.4546 -10.2383 -10.2383 -10.2324 -10.2324 -0.8429 -0.8429 0.2338 0.2338 0.6174 0.6174 0.6666 0.6666 1.2249 1.2249 1.2380 1.2380 1.3916 1.3916 1.8844 1.8844 2.2934 2.2934 2.3902 2.3902 2.6122 2.6122 2.6828 2.6828 5.1925 5.1925 5.1972 5.1972 5.8323 5.8323 5.8706 5.8706 5.9229 5.9229 5.9561 5.9561 6.4147 6.4147 6.8384 6.8384 7.3519 7.3519 7.3645 7.3645 k = 0.0000 0.0000 0.0328 ( 5440 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9540 -10.9540 -10.4590 -10.4590 -10.2378 -10.2378 -10.2309 -10.2309 -0.8378 -0.8378 0.2255 0.2255 0.6236 0.6236 0.6738 0.6738 1.2248 1.2248 1.2377 1.2377 1.3968 1.3968 1.8871 1.8871 2.2866 2.2866 2.3863 2.3863 2.5995 2.5995 2.6734 2.6734 5.1963 5.1963 5.2011 5.2011 5.8339 5.8339 5.8727 5.8727 5.9252 5.9252 5.9596 5.9596 6.4126 6.4126 6.8367 6.8367 7.3509 7.3509 7.3634 7.3634 k = 0.0000 0.0000 0.0438 ( 5444 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9511 -10.9511 -10.4650 -10.4650 -10.2371 -10.2371 -10.2289 -10.2289 -0.8308 -0.8308 0.2140 0.2140 0.6323 0.6323 0.6837 0.6837 1.2247 1.2247 1.2374 1.2374 1.4039 1.4039 1.8909 1.8909 2.2771 2.2771 2.3808 2.3808 2.5810 2.5810 2.6617 2.6617 5.2015 5.2015 5.2064 5.2064 5.8360 5.8360 5.8754 5.8754 5.9284 5.9284 5.9645 5.9645 6.4097 6.4097 6.8341 6.8341 7.3496 7.3496 7.3618 7.3618 k = 0.0000 0.0000 0.0547 ( 5446 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9473 -10.9473 -10.4726 -10.4726 -10.2362 -10.2362 -10.2265 -10.2265 -0.8217 -0.8217 0.1996 0.1996 0.6437 0.6437 0.6964 0.6964 1.2245 1.2245 1.2371 1.2371 1.4124 1.4124 1.8957 1.8957 2.2652 2.2652 2.3734 2.3734 2.5565 2.5565 2.6483 2.6483 5.2079 5.2079 5.2129 5.2129 5.8387 5.8387 5.8786 5.8786 5.9328 5.9328 5.9708 5.9708 6.4060 6.4060 6.8304 6.8304 7.3478 7.3478 7.3599 7.3599 k = 0.0000 0.0000 0.0656 ( 5456 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9427 -10.9427 -10.4814 -10.4814 -10.2352 -10.2352 -10.2239 -10.2239 -0.8108 -0.8108 0.1823 0.1823 0.6576 0.6576 0.7116 0.7116 1.2244 1.2244 1.2366 1.2366 1.4222 1.4222 1.9015 1.9015 2.2511 2.2511 2.3640 2.3640 2.5265 2.5265 2.6339 2.6339 5.2154 5.2154 5.2203 5.2203 5.8419 5.8419 5.8821 5.8821 5.9385 5.9385 5.9784 5.9784 6.4014 6.4014 6.8254 6.8254 7.3458 7.3458 7.3576 7.3576 k = 0.0000 0.0000 0.0766 ( 5460 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.9373 -10.9373 -10.4915 -10.4915 -10.2340 -10.2340 -10.2211 -10.2211 -0.7979 -0.7979 0.1626 0.1626 0.6743 0.6743 0.7294 0.7294 1.2241 1.2241 1.2361 1.2361 1.4328 1.4328 1.9082 1.9082 2.2349 2.2349 2.3521 2.3521 2.4923 2.4923 2.6183 2.6183 5.2237 5.2237 5.2286 5.2286 5.8455 5.8455 5.8858 5.8858 5.9456 5.9456 5.9874 5.9874 6.3962 6.3962 6.8189 6.8189 7.3434 7.3434 7.3550 7.3550 k = 0.0000 0.0000 0.0875 ( 5444 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8938 -37.8938 -36.9169 -36.9169 -36.9165 -36.9165 -36.7972 -36.7972 -36.7970 -36.7970 -10.9311 -10.9311 -10.5026 -10.5026 -10.2327 -10.2327 -10.2183 -10.2183 -0.7833 -0.7833 0.1405 0.1405 0.6936 0.6936 0.7497 0.7497 1.2240 1.2240 1.2355 1.2355 1.4437 1.4437 1.9160 1.9160 2.2168 2.2168 2.3366 2.3366 2.4557 2.4557 2.6016 2.6016 5.2328 5.2328 5.2374 5.2374 5.8496 5.8496 5.8896 5.8896 5.9542 5.9542 5.9977 5.9977 6.3903 6.3903 6.8108 6.8108 7.3408 7.3408 7.3522 7.3522 k = 0.0000 0.0000 0.0985 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8943 -37.8943 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.9241 -10.9241 -10.5147 -10.5147 -10.2312 -10.2312 -10.2155 -10.2155 -0.7668 -0.7668 0.1163 0.1163 0.7157 0.7157 0.7722 0.7722 1.2238 1.2238 1.2349 1.2349 1.4544 1.4544 1.9245 1.9245 2.1967 2.1967 2.3158 2.3158 2.4196 2.4196 2.5838 2.5838 5.2424 5.2424 5.2466 5.2466 5.8539 5.8539 5.8931 5.8931 5.9642 5.9642 6.0092 6.0092 6.3837 6.3837 6.8007 6.8007 7.3380 7.3380 7.3490 7.3490 k = 0.0000 0.0000 0.1094 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.9164 -10.9164 -10.5275 -10.5275 -10.2297 -10.2297 -10.2129 -10.2129 -0.7487 -0.7487 0.0903 0.0903 0.7405 0.7405 0.7970 0.7970 1.2236 1.2236 1.2342 1.2342 1.4644 1.4644 1.9339 1.9339 2.1745 2.1745 2.2880 2.2880 2.3876 2.3876 2.5648 2.5648 5.2522 5.2522 5.2558 5.2558 5.8586 5.8586 5.8966 5.8966 5.9757 5.9757 6.0221 6.0221 6.3766 6.3766 6.7885 6.7885 7.3350 7.3350 7.3458 7.3458 k = 0.0000 0.0000 0.1204 ( 5460 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.9080 -10.9080 -10.5410 -10.5410 -10.2279 -10.2279 -10.2104 -10.2104 -0.7290 -0.7290 0.0627 0.0627 0.7680 0.7680 0.8240 0.8240 1.2234 1.2234 1.2336 1.2336 1.4731 1.4731 1.9440 1.9440 2.1487 2.1487 2.2540 2.2540 2.3614 2.3614 2.5448 2.5448 5.2622 5.2622 5.2651 5.2651 5.8634 5.8634 5.8998 5.8998 5.9884 5.9884 6.0364 6.0364 6.3689 6.3689 6.7741 6.7741 7.3319 7.3319 7.3423 7.3423 k = 0.0000 0.0000 0.1313 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8988 -10.8988 -10.5552 -10.5552 -10.2261 -10.2261 -10.2082 -10.2082 -0.7077 -0.7077 0.0337 0.0337 0.7980 0.7980 0.8530 0.8530 1.2233 1.2233 1.2329 1.2329 1.4797 1.4797 1.9548 1.9548 2.1169 2.1169 2.2189 2.2189 2.3397 2.3397 2.5237 2.5237 5.2719 5.2719 5.2741 5.2741 5.8684 5.8684 5.9028 5.9028 6.0021 6.0021 6.0520 6.0520 6.3609 6.3609 6.7574 6.7574 7.3287 7.3287 7.3388 7.3388 k = 0.0000 0.0000 0.1422 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8889 -10.8889 -10.5698 -10.5698 -10.2243 -10.2243 -10.2063 -10.2063 -0.6849 -0.6849 0.0035 0.0035 0.8306 0.8306 0.8841 0.8841 1.2233 1.2233 1.2322 1.2322 1.4837 1.4837 1.9659 1.9659 2.0760 2.0760 2.1893 2.1893 2.3206 2.3206 2.5017 2.5017 5.2814 5.2814 5.2829 5.2829 5.8734 5.8734 5.9055 5.9055 6.0166 6.0166 6.0691 6.0691 6.3525 6.3525 6.7385 6.7385 7.3256 7.3256 7.3353 7.3353 k = 0.0000 0.0000 0.1532 ( 5474 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.8784 -10.8784 -10.5849 -10.5849 -10.2223 -10.2223 -10.2046 -10.2046 -0.6608 -0.6608 -0.0277 -0.0277 0.8656 0.8656 0.9172 0.9172 1.2232 1.2232 1.2315 1.2315 1.4842 1.4842 1.9770 1.9770 2.0264 2.0264 2.1681 2.1681 2.3026 2.3026 2.4789 2.4789 5.2902 5.2902 5.2913 5.2913 5.8784 5.8784 5.9080 5.9080 6.0316 6.0316 6.0875 6.0875 6.3441 6.3441 6.7173 6.7173 7.3225 7.3225 7.3317 7.3317 k = 0.0000 0.0000 0.1641 ( 5480 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8939 -37.8939 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.8672 -10.8672 -10.6003 -10.6003 -10.2203 -10.2203 -10.2033 -10.2033 -0.6353 -0.6353 -0.0598 -0.0598 0.9026 0.9026 0.9524 0.9524 1.2232 1.2232 1.2309 1.2309 1.4808 1.4808 1.9651 1.9651 1.9934 1.9934 2.1545 2.1545 2.2851 2.2851 2.4554 2.4554 5.2982 5.2982 5.2995 5.2995 5.8833 5.8833 5.9102 5.9102 6.0468 6.0468 6.1071 6.1071 6.3359 6.3359 6.6940 6.6940 7.3197 7.3197 7.3283 7.3283 k = 0.0000 0.0000 0.1751 ( 5480 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7971 -36.7971 -10.8554 -10.8554 -10.6159 -10.6159 -10.2183 -10.2183 -10.2022 -10.2022 -0.6087 -0.6087 -0.0925 -0.0925 0.9414 0.9414 0.9897 0.9897 1.2232 1.2232 1.2304 1.2304 1.4731 1.4731 1.9060 1.9060 2.0040 2.0040 2.1473 2.1473 2.2677 2.2677 2.4314 2.4314 5.3054 5.3054 5.3071 5.3071 5.8880 5.8880 5.9121 5.9121 6.0621 6.0621 6.1276 6.1276 6.3285 6.3285 6.6687 6.6687 7.3169 7.3169 7.3249 7.3249 k = 0.0000 0.0000 0.1860 ( 5478 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9166 -36.9166 -36.7973 -36.7973 -36.7970 -36.7970 -10.8430 -10.8430 -10.6318 -10.6318 -10.2163 -10.2163 -10.2015 -10.2015 -0.5809 -0.5809 -0.1257 -0.1257 0.9813 0.9813 1.0294 1.0294 1.2231 1.2231 1.2303 1.2303 1.4607 1.4607 1.8428 1.8428 2.0167 2.0167 2.1456 2.1456 2.2503 2.2503 2.4070 2.4070 5.3119 5.3119 5.3140 5.3140 5.8926 5.8926 5.9137 5.9137 6.0773 6.0773 6.1479 6.1479 6.3226 6.3226 6.6416 6.6416 7.3145 7.3145 7.3218 7.3218 k = 0.0000 0.0000 0.1969 ( 5486 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.8301 -10.8301 -10.6478 -10.6478 -10.2144 -10.2144 -10.2011 -10.2011 -0.5521 -0.5521 -0.1594 -0.1594 1.0219 1.0219 1.0716 1.0716 1.2229 1.2229 1.2307 1.2307 1.4438 1.4438 1.7782 1.7782 2.0300 2.0300 2.1488 2.1488 2.2327 2.2327 2.3824 2.3824 5.3177 5.3177 5.3199 5.3199 5.8968 5.8968 5.9150 5.9150 6.0923 6.0923 6.1667 6.1667 6.3194 6.3194 6.6129 6.6129 7.3124 7.3124 7.3188 7.3188 k = 0.0000 0.0000 0.2079 ( 5484 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.8167 -10.8167 -10.6639 -10.6639 -10.2124 -10.2124 -10.2010 -10.2010 -0.5223 -0.5223 -0.1933 -0.1933 1.0623 1.0623 1.1162 1.1162 1.2225 1.2225 1.2321 1.2321 1.4226 1.4226 1.7131 1.7131 2.0439 2.0439 2.1561 2.1561 2.2153 2.2153 2.3578 2.3578 5.3228 5.3228 5.3250 5.3250 5.9007 5.9007 5.9159 5.9159 6.1071 6.1071 6.1818 6.1818 6.3212 6.3212 6.5829 6.5829 7.3106 7.3106 7.3161 7.3161 k = 0.0000 0.0000 0.2188 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.8028 -10.8028 -10.6800 -10.6800 -10.2106 -10.2106 -10.2011 -10.2011 -0.4917 -0.4917 -0.2273 -0.2273 1.1020 1.1020 1.1622 1.1622 1.2217 1.2217 1.2359 1.2359 1.3976 1.3976 1.6481 1.6481 2.0585 2.0585 2.1662 2.1662 2.1987 2.1987 2.3333 2.3333 5.3270 5.3270 5.3290 5.3290 5.9043 5.9043 5.9164 5.9164 6.1214 6.1214 6.1909 6.1909 6.3299 6.3299 6.5519 6.5519 7.3092 7.3092 7.3138 7.3138 k = 0.0000 0.0000 0.2298 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7885 -10.7885 -10.6960 -10.6960 -10.2088 -10.2088 -10.2016 -10.2016 -0.4604 -0.4604 -0.2614 -0.2614 1.1402 1.1402 1.2034 1.2034 1.2207 1.2207 1.2485 1.2485 1.3696 1.3696 1.5836 1.5836 2.0738 2.0738 2.1710 2.1710 2.1903 2.1903 2.3092 2.3092 5.3304 5.3304 5.3321 5.3321 5.9074 5.9074 5.9165 5.9165 6.1354 6.1354 6.1933 6.1933 6.3462 6.3462 6.5202 6.5202 7.3083 7.3083 7.3117 7.3117 k = 0.0000 0.0000 0.2407 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7738 -10.7738 -10.7120 -10.7120 -10.2072 -10.2072 -10.2023 -10.2023 -0.4283 -0.4283 -0.2954 -0.2954 1.1749 1.1749 1.2189 1.2189 1.2261 1.2261 1.2846 1.2846 1.3399 1.3399 1.5201 1.5201 2.0899 2.0899 2.1578 2.1578 2.2026 2.2026 2.2856 2.2856 5.3330 5.3330 5.3342 5.3342 5.9101 5.9101 5.9162 5.9162 6.1488 6.1488 6.1900 6.1900 6.3688 6.3688 6.4882 6.4882 7.3077 7.3077 7.3101 7.3101 k = 0.0000 0.0000 0.2516 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7587 -10.7587 -10.7278 -10.7278 -10.2057 -10.2057 -10.2032 -10.2032 -0.3957 -0.3957 -0.3291 -0.3291 1.2001 1.2001 1.2165 1.2165 1.2441 1.2441 1.3020 1.3020 1.3427 1.3427 1.4581 1.4581 2.1065 2.1065 2.1408 2.1408 2.2207 2.2207 2.2627 2.2627 5.3347 5.3347 5.3353 5.3353 5.9123 5.9123 5.9153 5.9153 6.1614 6.1614 6.1827 6.1827 6.3958 6.3958 6.4564 6.4564 7.3076 7.3076 7.3088 7.3088 k = 0.0000 0.0000 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7434 -10.7434 -10.7434 -10.7434 -10.2044 -10.2044 -10.2043 -10.2043 -0.3626 -0.3626 -0.3626 -0.3626 1.2116 1.2116 1.2117 1.2117 1.2717 1.2717 1.2717 1.2717 1.3981 1.3981 1.3981 1.3981 2.1235 2.1235 2.1236 2.1236 2.2410 2.2410 2.2410 2.2410 5.3354 5.3354 5.3356 5.3356 5.9139 5.9139 5.9142 5.9142 6.1728 6.1728 6.1730 6.1730 6.4253 6.4253 6.4254 6.4254 7.3079 7.3079 7.3081 7.3081 k = 0.0000 0.0000 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7434 -10.7434 -10.7434 -10.7434 -10.2044 -10.2044 -10.2043 -10.2043 -0.3626 -0.3626 -0.3626 -0.3626 1.2116 1.2116 1.2117 1.2117 1.2717 1.2717 1.2717 1.2717 1.3981 1.3981 1.3981 1.3981 2.1235 2.1235 2.1236 2.1236 2.2410 2.2410 2.2410 2.2410 5.3354 5.3354 5.3356 5.3356 5.9139 5.9139 5.9142 5.9142 6.1728 6.1728 6.1730 6.1730 6.4253 6.4253 6.4254 6.4254 7.3079 7.3079 7.3081 7.3081 k = 0.0111-0.0000 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7430 -10.7430 -10.7429 -10.7429 -10.2043 -10.2043 -10.2042 -10.2042 -0.3619 -0.3619 -0.3616 -0.3616 1.2064 1.2064 1.2094 1.2094 1.2688 1.2688 1.2772 1.2772 1.3977 1.3977 1.4003 1.4003 2.1158 2.1158 2.1257 2.1257 2.2372 2.2372 2.2446 2.2446 5.3376 5.3376 5.3378 5.3378 5.9134 5.9134 5.9146 5.9146 6.1718 6.1718 6.1730 6.1730 6.4246 6.4246 6.4254 6.4254 7.3063 7.3063 7.3069 7.3069 k = 0.0222-0.0000 0.2626 ( 5496 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8941 -37.8941 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7415 -10.7415 -10.7414 -10.7414 -10.2040 -10.2040 -10.2038 -10.2038 -0.3593 -0.3593 -0.3589 -0.3589 1.1953 1.1953 1.1992 1.1992 1.2692 1.2692 1.2836 1.2836 1.3988 1.3988 1.4038 1.4038 2.1032 2.1032 2.1218 2.1218 2.2338 2.2338 2.2474 2.2474 5.3441 5.3441 5.3445 5.3445 5.9126 5.9126 5.9150 5.9150 6.1696 6.1696 6.1720 6.1720 6.4232 6.4232 6.4246 6.4246 7.3018 7.3018 7.3030 7.3030 k = 0.0333-0.0000 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8943 -37.8943 -37.8941 -37.8941 -36.9169 -36.9169 -36.9168 -36.9168 -36.7973 -36.7973 -36.7972 -36.7972 -10.7392 -10.7392 -10.7390 -10.7390 -10.2034 -10.2034 -10.2031 -10.2031 -0.3551 -0.3551 -0.3544 -0.3544 1.1803 1.1803 1.1833 1.1833 1.2714 1.2714 1.2895 1.2895 1.4010 1.4010 1.4079 1.4079 2.0862 2.0862 2.1114 2.1114 2.2316 2.2316 2.2493 2.2493 5.3548 5.3548 5.3554 5.3554 5.9117 5.9117 5.9153 5.9153 6.1664 6.1664 6.1700 6.1700 6.4212 6.4212 6.4233 6.4233 7.2949 7.2949 7.2966 7.2966 k = 0.0444-0.0000 0.2626 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8943 -37.8943 -37.8941 -37.8941 -36.9170 -36.9170 -36.9168 -36.9168 -36.7974 -36.7974 -36.7972 -36.7972 -10.7358 -10.7358 -10.7357 -10.7357 -10.2026 -10.2026 -10.2022 -10.2022 -0.3491 -0.3491 -0.3481 -0.3481 1.1621 1.1621 1.1634 1.1634 1.2741 1.2741 1.2947 1.2947 1.4033 1.4033 1.4118 1.4118 2.0653 2.0653 2.0950 2.0950 2.2305 2.2305 2.2504 2.2504 5.3695 5.3695 5.3703 5.3703 5.9107 5.9107 5.9155 5.9155 6.1622 6.1622 6.1670 6.1670 6.4183 6.4183 6.4211 6.4211 7.2857 7.2857 7.2879 7.2879 k = 0.0556-0.0000 0.2626 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8944 -37.8944 -37.8942 -37.8942 -36.9170 -36.9170 -36.9169 -36.9169 -36.7975 -36.7975 -36.7973 -36.7973 -10.7316 -10.7316 -10.7314 -10.7314 -10.2015 -10.2015 -10.2011 -10.2011 -0.3414 -0.3414 -0.3402 -0.3402 1.1409 1.1409 1.1416 1.1416 1.2763 1.2763 1.2990 1.2990 1.4048 1.4048 1.4148 1.4148 2.0413 2.0413 2.0737 2.0737 2.2303 2.2303 2.2507 2.2507 5.3879 5.3879 5.3888 5.3888 5.9094 5.9094 5.9156 5.9156 6.1569 6.1569 6.1630 6.1630 6.4147 6.4147 6.4182 6.4182 7.2748 7.2748 7.2774 7.2774 k = 0.0667-0.0000 0.2626 ( 5496 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8944 -37.8944 -37.8942 -37.8942 -36.9171 -36.9171 -36.9169 -36.9169 -36.7976 -36.7976 -36.7974 -36.7974 -10.7264 -10.7264 -10.7262 -10.7262 -10.2003 -10.2003 -10.1998 -10.1998 -0.3320 -0.3320 -0.3305 -0.3305 1.1166 1.1166 1.1192 1.1192 1.2774 1.2774 1.3021 1.3021 1.4047 1.4047 1.4164 1.4164 2.0148 2.0148 2.0486 2.0486 2.2306 2.2306 2.2503 2.2503 5.4094 5.4094 5.4105 5.4105 5.9080 5.9080 5.9156 5.9156 6.1507 6.1507 6.1581 6.1581 6.4103 6.4103 6.4144 6.4144 7.2627 7.2627 7.2657 7.2657 k = 0.0778-0.0000 0.2626 ( 5492 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8945 -37.8945 -37.8943 -37.8943 -36.9172 -36.9172 -36.9170 -36.9170 -36.7977 -36.7977 -36.7975 -36.7975 -10.7204 -10.7204 -10.7201 -10.7201 -10.1988 -10.1988 -10.1982 -10.1982 -0.3210 -0.3210 -0.3192 -0.3192 1.0908 1.0908 1.0954 1.0954 1.2764 1.2764 1.3033 1.3033 1.4027 1.4027 1.4165 1.4165 1.9871 1.9871 2.0214 2.0214 2.2310 2.2310 2.2495 2.2495 5.4338 5.4338 5.4350 5.4350 5.9063 5.9063 5.9154 5.9154 6.1435 6.1435 6.1523 6.1523 6.4051 6.4051 6.4098 6.4098 7.2499 7.2499 7.2532 7.2532 k = 0.0889-0.0000 0.2626 ( 5484 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8945 -37.8945 -37.8944 -37.8944 -36.9173 -36.9173 -36.9171 -36.9171 -36.7978 -36.7978 -36.7976 -36.7976 -10.7134 -10.7134 -10.7131 -10.7131 -10.1971 -10.1971 -10.1964 -10.1964 -0.3083 -0.3083 -0.3063 -0.3063 1.0640 1.0640 1.0704 1.0704 1.2722 1.2722 1.3009 1.3009 1.3995 1.3995 1.4153 1.4153 1.9592 1.9592 1.9932 1.9932 2.2313 2.2313 2.2481 2.2481 5.4605 5.4605 5.4619 5.4619 5.9043 5.9043 5.9151 5.9151 6.1354 6.1354 6.1456 6.1456 6.3990 6.3990 6.4044 6.4044 7.2370 7.2370 7.2405 7.2405 k = 0.1000-0.0000 0.2626 ( 5476 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8946 -37.8946 -37.8944 -37.8944 -36.9174 -36.9174 -36.9172 -36.9172 -36.7980 -36.7980 -36.7978 -36.7978 -10.7056 -10.7056 -10.7052 -10.7052 -10.1952 -10.1952 -10.1945 -10.1945 -0.2941 -0.2941 -0.2918 -0.2918 1.0363 1.0363 1.0445 1.0445 1.2631 1.2631 1.2927 1.2927 1.3966 1.3966 1.4138 1.4138 1.9323 1.9323 1.9656 1.9656 2.2311 2.2311 2.2463 2.2463 5.4891 5.4891 5.4906 5.4906 5.9020 5.9020 5.9146 5.9146 6.1264 6.1264 6.1382 6.1382 6.3922 6.3922 6.3981 6.3981 7.2245 7.2245 7.2282 7.2282 k = 0.1111-0.0000 0.2626 ( 5464 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8947 -37.8947 -37.8945 -37.8945 -36.9175 -36.9175 -36.9173 -36.9173 -36.7981 -36.7981 -36.7979 -36.7979 -10.6970 -10.6970 -10.6966 -10.6966 -10.1931 -10.1931 -10.1923 -10.1923 -0.2783 -0.2783 -0.2757 -0.2757 1.0080 1.0080 1.0179 1.0179 1.2474 1.2474 1.2760 1.2760 1.3959 1.3959 1.4131 1.4131 1.9075 1.9075 1.9395 1.9395 2.2305 2.2305 2.2439 2.2439 5.5192 5.5192 5.5208 5.5208 5.8993 5.8993 5.9138 5.9138 6.1166 6.1166 6.1300 6.1300 6.3845 6.3845 6.3911 6.3911 7.2131 7.2131 7.2169 7.2169 k = 0.1222-0.0000 0.2626 ( 5456 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8948 -37.8948 -37.8946 -37.8946 -36.9176 -36.9176 -36.9174 -36.9174 -36.7983 -36.7983 -36.7981 -36.7981 -10.6876 -10.6876 -10.6871 -10.6871 -10.1908 -10.1908 -10.1900 -10.1900 -0.2611 -0.2611 -0.2582 -0.2582 0.9790 0.9790 0.9906 0.9906 1.2239 1.2239 1.2499 1.2499 1.3982 1.3982 1.4142 1.4142 1.8855 1.8855 1.9159 1.9159 2.2291 2.2291 2.2410 2.2410 5.5503 5.5503 5.5520 5.5520 5.8961 5.8961 5.9126 5.9126 6.1062 6.1062 6.1212 6.1212 6.3761 6.3761 6.3833 6.3833 7.2031 7.2031 7.2068 7.2068 k = 0.1333-0.0000 0.2626 ( 5464 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8949 -37.8949 -37.8947 -37.8947 -36.9177 -36.9177 -36.9175 -36.9175 -36.7985 -36.7985 -36.7983 -36.7983 -10.6774 -10.6774 -10.6769 -10.6769 -10.1884 -10.1884 -10.1875 -10.1875 -0.2424 -0.2424 -0.2393 -0.2393 0.9494 0.9494 0.9628 0.9628 1.1923 1.1923 1.2147 1.2147 1.4034 1.4034 1.4174 1.4174 1.8666 1.8666 1.8951 1.8951 2.2270 2.2270 2.2374 2.2374 5.5821 5.5821 5.5838 5.5838 5.8923 5.8923 5.9109 5.9109 6.0951 6.0951 6.1118 6.1118 6.3671 6.3671 6.3750 6.3750 7.1949 7.1949 7.1986 7.1986 k = 0.1444-0.0000 0.2626 ( 5452 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8950 -37.8950 -37.8949 -37.8949 -36.9178 -36.9178 -36.9176 -36.9176 -36.7987 -36.7987 -36.7984 -36.7984 -10.6666 -10.6666 -10.6660 -10.6660 -10.1858 -10.1858 -10.1848 -10.1848 -0.2225 -0.2225 -0.2190 -0.2190 0.9191 0.9191 0.9342 0.9342 1.1536 1.1536 1.1721 1.1721 1.4106 1.4106 1.4227 1.4227 1.8508 1.8508 1.8775 1.8775 2.2241 2.2241 2.2331 2.2331 5.6141 5.6141 5.6159 5.6159 5.8879 5.8879 5.9087 5.9087 6.0837 6.0837 6.1021 6.1021 6.3577 6.3577 6.3663 6.3663 7.1888 7.1888 7.1924 7.1924 k = 0.1556-0.0000 0.2626 ( 5450 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8952 -37.8952 -37.8950 -37.8950 -36.9180 -36.9180 -36.9178 -36.9178 -36.7989 -36.7989 -36.7986 -36.7986 -10.6550 -10.6550 -10.6544 -10.6544 -10.1831 -10.1831 -10.1821 -10.1821 -0.2013 -0.2013 -0.1975 -0.1975 0.8877 0.8877 0.9046 0.9046 1.1091 1.1091 1.1237 1.1237 1.4192 1.4192 1.4296 1.4296 1.8380 1.8380 1.8627 1.8627 2.2202 2.2202 2.2281 2.2281 5.6460 5.6460 5.6478 5.6478 5.8827 5.8827 5.9058 5.9058 6.0721 6.0721 6.0921 6.0921 6.3481 6.3481 6.3574 6.3574 7.1850 7.1850 7.1884 7.1884 k = 0.1667-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8953 -37.8953 -37.8951 -37.8951 -36.9182 -36.9182 -36.9180 -36.9180 -36.7991 -36.7991 -36.7989 -36.7989 -10.6428 -10.6428 -10.6422 -10.6422 -10.1803 -10.1803 -10.1792 -10.1792 -0.1789 -0.1789 -0.1748 -0.1748 0.8547 0.8547 0.8733 0.8733 1.0606 1.0606 1.0719 1.0719 1.4286 1.4286 1.4376 1.4376 1.8276 1.8276 1.8505 1.8505 2.2154 2.2154 2.2224 2.2224 5.6774 5.6774 5.6793 5.6793 5.8766 5.8766 5.9020 5.9020 6.0605 6.0605 6.0820 6.0820 6.3383 6.3383 6.3486 6.3486 7.1837 7.1837 7.1869 7.1869 k = 0.1778-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8955 -37.8955 -37.8953 -37.8953 -36.9183 -36.9183 -36.9181 -36.9181 -36.7993 -36.7993 -36.7991 -36.7991 -10.6300 -10.6300 -10.6294 -10.6294 -10.1773 -10.1773 -10.1762 -10.1762 -0.1555 -0.1555 -0.1511 -0.1511 0.8191 0.8191 0.8392 0.8392 1.0106 1.0106 1.0190 1.0190 1.4383 1.4383 1.4464 1.4464 1.8192 1.8192 1.8406 1.8406 2.2098 2.2098 2.2159 2.2159 5.7080 5.7080 5.7101 5.7101 5.8698 5.8698 5.8971 5.8971 6.0492 6.0492 6.0719 6.0719 6.3288 6.3288 6.3400 6.3400 7.1848 7.1848 7.1879 7.1879 k = 0.1889-0.0000 0.2626 ( 5462 PWs) bands (ev): -65.8241 -65.8241 -65.8238 -65.8238 -37.8956 -37.8956 -37.8954 -37.8954 -36.9185 -36.9185 -36.9183 -36.9183 -36.7996 -36.7996 -36.7993 -36.7993 -10.6167 -10.6167 -10.6161 -10.6161 -10.1743 -10.1743 -10.1732 -10.1732 -0.1312 -0.1312 -0.1265 -0.1265 0.7797 0.7797 0.8006 0.8006 0.9615 0.9615 0.9681 0.9681 1.4480 1.4480 1.4554 1.4554 1.8127 1.8127 1.8325 1.8325 2.2032 2.2032 2.2086 2.2086 5.7374 5.7374 5.7399 5.7399 5.8622 5.8622 5.8910 5.8910 6.0384 6.0384 6.0621 6.0621 6.3197 6.3197 6.3320 6.3320 7.1885 7.1885 7.1913 7.1913 k = 0.2000-0.0000 0.2626 ( 5464 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8958 -37.8958 -37.8956 -37.8956 -36.9187 -36.9187 -36.9185 -36.9185 -36.7998 -36.7998 -36.7996 -36.7996 -10.6029 -10.6029 -10.6023 -10.6023 -10.1713 -10.1713 -10.1700 -10.1700 -0.1061 -0.1061 -0.1011 -0.1011 0.7351 0.7351 0.7556 0.7556 0.9159 0.9159 0.9221 0.9221 1.4572 1.4572 1.4642 1.4642 1.8076 1.8076 1.8261 1.8261 2.1958 2.1958 2.2006 2.2006 5.7647 5.7647 5.7680 5.7680 5.8544 5.8544 5.8838 5.8838 6.0286 6.0286 6.0526 6.0526 6.3113 6.3113 6.3247 6.3247 7.1945 7.1945 7.1972 7.1972 k = 0.2111-0.0000 0.2626 ( 5464 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8960 -37.8960 -37.8958 -37.8958 -36.9189 -36.9189 -36.9187 -36.9187 -36.8001 -36.8001 -36.7998 -36.7998 -10.5887 -10.5887 -10.5881 -10.5881 -10.1682 -10.1682 -10.1669 -10.1669 -0.0805 -0.0805 -0.0752 -0.0752 0.6846 0.6846 0.7034 0.7034 0.8755 0.8755 0.8828 0.8828 1.4656 1.4656 1.4724 1.4724 1.8039 1.8039 1.8212 1.8212 2.1876 2.1876 2.1920 2.1920 5.7876 5.7876 5.7935 5.7935 5.8485 5.8485 5.8762 5.8762 6.0200 6.0200 6.0438 6.0438 6.3038 6.3038 6.3184 6.3184 7.2029 7.2029 7.2054 7.2054 k = 0.2222-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8240 -65.8240 -65.8237 -65.8237 -37.8961 -37.8961 -37.8959 -37.8959 -36.9191 -36.9191 -36.9189 -36.9189 -36.8003 -36.8003 -36.8000 -36.8000 -10.5741 -10.5741 -10.5735 -10.5735 -10.1650 -10.1650 -10.1637 -10.1637 -0.0545 -0.0545 -0.0489 -0.0489 0.6287 0.6287 0.6450 0.6450 0.8407 0.8407 0.8501 0.8501 1.4728 1.4728 1.4797 1.4797 1.8016 1.8016 1.8176 1.8176 2.1788 2.1788 2.1829 2.1829 5.7998 5.7998 5.8135 5.8135 5.8506 5.8506 5.8710 5.8710 6.0126 6.0126 6.0357 6.0357 6.2973 6.2973 6.3133 6.3133 7.2135 7.2135 7.2158 7.2158 k = 0.2333-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8963 -37.8963 -37.8961 -37.8961 -36.9193 -36.9193 -36.9191 -36.9191 -36.8005 -36.8005 -36.8003 -36.8003 -10.5592 -10.5592 -10.5586 -10.5586 -10.1619 -10.1619 -10.1606 -10.1606 -0.0284 -0.0284 -0.0227 -0.0227 0.5691 0.5691 0.5826 0.5826 0.8109 0.8109 0.8228 0.8228 1.4782 1.4782 1.4855 1.4855 1.8008 1.8008 1.8155 1.8155 2.1694 2.1694 2.1732 2.1732 5.7966 5.7966 5.8206 5.8206 5.8652 5.8652 5.8754 5.8754 6.0064 6.0064 6.0285 6.0285 6.2920 6.2920 6.3093 6.3093 7.2261 7.2261 7.2283 7.2283 k = 0.2444-0.0000 0.2626 ( 5458 PWs) bands (ev): -65.8239 -65.8239 -65.8236 -65.8236 -37.8964 -37.8964 -37.8963 -37.8963 -36.9195 -36.9195 -36.9193 -36.9193 -36.8008 -36.8008 -36.8005 -36.8005 -10.5441 -10.5441 -10.5434 -10.5434 -10.1588 -10.1588 -10.1575 -10.1575 -0.0028 -0.0028 0.0028 0.0028 0.5077 0.5077 0.5183 0.5183 0.7852 0.7852 0.7995 0.7995 1.4815 1.4815 1.4895 1.4895 1.8015 1.8015 1.8150 1.8150 2.1596 2.1596 2.1632 2.1632 5.7851 5.7851 5.8133 5.8133 5.8851 5.8851 5.8909 5.8909 6.0015 6.0015 6.0223 6.0223 6.2880 6.2880 6.3066 6.3066 7.2405 7.2405 7.2426 7.2426 k = 0.2556-0.0000 0.2626 ( 5458 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8966 -37.8966 -37.8964 -37.8964 -36.9197 -36.9197 -36.9195 -36.9195 -36.8010 -36.8010 -36.8008 -36.8008 -10.5287 -10.5287 -10.5281 -10.5281 -10.1557 -10.1557 -10.1544 -10.1544 0.0218 0.0218 0.0270 0.0270 0.4466 0.4466 0.4541 0.4541 0.7627 0.7627 0.7795 0.7795 1.4824 1.4824 1.4912 1.4912 1.8040 1.8040 1.8160 1.8160 2.1496 2.1496 2.1529 2.1529 5.7702 5.7702 5.7990 5.7990 5.9053 5.9053 5.9103 5.9103 5.9977 5.9977 6.0174 6.0174 6.2853 6.2853 6.3053 6.3053 7.2566 7.2566 7.2586 7.2586 k = 0.2667-0.0000 0.2626 ( 5462 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8968 -37.8968 -37.8966 -37.8966 -36.9199 -36.9199 -36.9197 -36.9197 -36.8013 -36.8013 -36.8010 -36.8010 -10.5133 -10.5133 -10.5127 -10.5127 -10.1527 -10.1527 -10.1514 -10.1514 0.0441 0.0441 0.0482 0.0482 0.3881 0.3881 0.3921 0.3921 0.7430 0.7430 0.7622 0.7622 1.4805 1.4805 1.4904 1.4904 1.8083 1.8083 1.8187 1.8187 2.1394 2.1394 2.1425 2.1425 5.7533 5.7533 5.7817 5.7817 5.9240 5.9240 5.9300 5.9300 5.9949 5.9949 6.0142 6.0142 6.2840 6.2840 6.3052 6.3052 7.2742 7.2742 7.2762 7.2762 k = 0.2778-0.0000 0.2626 ( 5462 PWs) bands (ev): -65.8238 -65.8238 -65.8235 -65.8235 -37.8969 -37.8969 -37.8968 -37.8968 -36.9201 -36.9201 -36.9199 -36.9199 -36.8015 -36.8015 -36.8013 -36.8013 -10.4978 -10.4978 -10.4972 -10.4972 -10.1498 -10.1498 -10.1485 -10.1485 0.0618 0.0618 0.0634 0.0634 0.3352 0.3352 0.3359 0.3359 0.7258 0.7258 0.7472 0.7472 1.4758 1.4758 1.4869 1.4869 1.8143 1.8143 1.8230 1.8230 2.1294 2.1294 2.1321 2.1321 5.7350 5.7350 5.7626 5.7626 5.9402 5.9402 5.9486 5.9486 5.9931 5.9931 6.0132 6.0132 6.2840 6.2840 6.3064 6.3064 7.2931 7.2931 7.2951 7.2951 k = 0.2889-0.0000 0.2626 ( 5458 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8971 -37.8971 -37.8969 -37.8969 -36.9203 -36.9203 -36.9201 -36.9201 -36.8017 -36.8017 -36.8015 -36.8015 -10.4823 -10.4823 -10.4818 -10.4818 -10.1470 -10.1470 -10.1457 -10.1457 0.0675 0.0675 0.0701 0.0701 0.2885 0.2885 0.2957 0.2957 0.7107 0.7107 0.7344 0.7344 1.4684 1.4684 1.4807 1.4807 1.8219 1.8219 1.8289 1.8289 2.1195 2.1195 2.1218 2.1218 5.7159 5.7159 5.7425 5.7425 5.9528 5.9528 5.9656 5.9656 5.9923 5.9923 6.0152 6.0152 6.2854 6.2854 6.3087 6.3087 7.3131 7.3131 7.3151 7.3151 k = 0.3000-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8973 -37.8973 -37.8971 -37.8971 -36.9205 -36.9205 -36.9203 -36.9203 -36.8020 -36.8020 -36.8017 -36.8017 -10.4669 -10.4669 -10.4664 -10.4664 -10.1444 -10.1444 -10.1431 -10.1431 0.0541 0.0541 0.0618 0.0618 0.2597 0.2597 0.2741 0.2741 0.6978 0.6978 0.7238 0.7238 1.4582 1.4582 1.4719 1.4719 1.8309 1.8309 1.8360 1.8360 2.1100 2.1100 2.1117 2.1117 5.6961 5.6961 5.7216 5.7216 5.9611 5.9611 5.9794 5.9794 5.9940 5.9940 6.0208 6.0208 6.2879 6.2879 6.3121 6.3121 7.3339 7.3339 7.3360 7.3360 k = 0.3111-0.0000 0.2626 ( 5454 PWs) bands (ev): -65.8237 -65.8237 -65.8234 -65.8234 -37.8974 -37.8974 -37.8972 -37.8972 -36.9207 -36.9207 -36.9205 -36.9205 -36.8022 -36.8022 -36.8019 -36.8019 -10.4517 -10.4517 -10.4513 -10.4513 -10.1418 -10.1418 -10.1406 -10.1406 0.0225 0.0225 0.0332 0.0332 0.2523 0.2523 0.2719 0.2719 0.6868 0.6868 0.7151 0.7151 1.4458 1.4458 1.4607 1.4607 1.8410 1.8410 1.8441 1.8441 2.1011 2.1011 2.1021 2.1021 5.6758 5.6758 5.7004 5.7004 5.9656 5.9656 5.9855 5.9855 6.0023 6.0023 6.0294 6.0294 6.2915 6.2915 6.3164 6.3164 7.3555 7.3555 7.3576 7.3576 k = 0.3222-0.0000 0.2626 ( 5462 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8976 -37.8976 -37.8974 -37.8974 -36.9209 -36.9209 -36.9207 -36.9207 -36.8024 -36.8024 -36.8021 -36.8021 -10.4367 -10.4367 -10.4363 -10.4363 -10.1395 -10.1395 -10.1383 -10.1383 -0.0205 -0.0205 -0.0091 -0.0091 0.2602 0.2602 0.2825 0.2825 0.6778 0.6778 0.7085 0.7085 1.4312 1.4312 1.4474 1.4474 1.8517 1.8517 1.8528 1.8528 2.0929 2.0929 2.0930 2.0930 5.6553 5.6553 5.6789 5.6789 5.9675 5.9675 5.9869 5.9869 6.0143 6.0143 6.0398 6.0398 6.2960 6.2960 6.3215 6.3215 7.3774 7.3774 7.3797 7.3797 k = 0.3333-0.0000 0.2626 ( 5442 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8977 -37.8977 -37.8975 -37.8975 -36.9211 -36.9211 -36.9208 -36.9208 -36.8026 -36.8026 -36.8023 -36.8023 -10.4221 -10.4221 -10.4217 -10.4217 -10.1373 -10.1373 -10.1362 -10.1362 -0.0685 -0.0685 -0.0575 -0.0575 0.2755 0.2755 0.2996 0.2996 0.6709 0.6709 0.7040 0.7040 1.4150 1.4150 1.4324 1.4324 1.8616 1.8616 1.8627 1.8627 2.0845 2.0845 2.0858 2.0858 5.6349 5.6349 5.6576 5.6576 5.9682 5.9682 5.9877 5.9877 6.0261 6.0261 6.0507 6.0507 6.3013 6.3013 6.3273 6.3273 7.3997 7.3997 7.4020 7.4020 k = 0.3444-0.0000 0.2626 ( 5442 PWs) bands (ev): -65.8236 -65.8236 -65.8233 -65.8233 -37.8978 -37.8978 -37.8977 -37.8977 -36.9212 -36.9212 -36.9210 -36.9210 -36.8028 -36.8028 -36.8025 -36.8025 -10.4078 -10.4078 -10.4075 -10.4075 -10.1354 -10.1354 -10.1343 -10.1343 -0.1177 -0.1177 -0.1073 -0.1073 0.2938 0.2938 0.3193 0.3193 0.6659 0.6659 0.7013 0.7013 1.3976 1.3976 1.4160 1.4160 1.8702 1.8702 1.8735 1.8735 2.0770 2.0770 2.0797 2.0797 5.6146 5.6146 5.6365 5.6365 5.9682 5.9682 5.9883 5.9883 6.0369 6.0369 6.0614 6.0614 6.3072 6.3072 6.3335 6.3335 7.4220 7.4220 7.4244 7.4244 k = 0.3556-0.0000 0.2626 ( 5440 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8980 -37.8980 -37.8978 -37.8978 -36.9214 -36.9214 -36.9212 -36.9212 -36.8030 -36.8030 -36.8027 -36.8027 -10.3940 -10.3940 -10.3938 -10.3938 -10.1336 -10.1336 -10.1326 -10.1326 -0.1661 -0.1661 -0.1564 -0.1564 0.3130 0.3130 0.3397 0.3397 0.6629 0.6629 0.7006 0.7006 1.3792 1.3792 1.3986 1.3986 1.8779 1.8779 1.8837 1.8837 2.0707 2.0707 2.0750 2.0750 5.5947 5.5947 5.6159 5.6159 5.9680 5.9680 5.9890 5.9890 6.0466 6.0466 6.0714 6.0714 6.3134 6.3134 6.3399 6.3399 7.4440 7.4440 7.4465 7.4465 k = 0.3667-0.0000 0.2626 ( 5432 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8981 -37.8981 -37.8979 -37.8979 -36.9216 -36.9216 -36.9213 -36.9213 -36.8031 -36.8031 -36.8028 -36.8028 -10.3807 -10.3807 -10.3806 -10.3806 -10.1321 -10.1321 -10.1311 -10.1311 -0.2127 -0.2127 -0.2035 -0.2035 0.3318 0.3318 0.3597 0.3597 0.6618 0.6618 0.7017 0.7017 1.3603 1.3603 1.3807 1.3807 1.8845 1.8845 1.8928 1.8928 2.0656 2.0656 2.0719 2.0719 5.5754 5.5754 5.5960 5.5960 5.9677 5.9677 5.9898 5.9898 6.0553 6.0553 6.0808 6.0808 6.3200 6.3200 6.3466 6.3466 7.4656 7.4656 7.4682 7.4682 k = 0.3778-0.0000 0.2626 ( 5436 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8982 -37.8982 -37.8980 -37.8980 -36.9217 -36.9217 -36.9215 -36.9215 -36.8033 -36.8033 -36.8030 -36.8030 -10.3680 -10.3680 -10.3680 -10.3680 -10.1307 -10.1307 -10.1299 -10.1299 -0.2568 -0.2568 -0.2482 -0.2482 0.3496 0.3496 0.3786 0.3786 0.6625 0.6625 0.7044 0.7044 1.3413 1.3413 1.3625 1.3625 1.8898 1.8898 1.9005 1.9005 2.0621 2.0621 2.0703 2.0703 5.5569 5.5569 5.5769 5.5769 5.9673 5.9673 5.9905 5.9905 6.0631 6.0631 6.0893 6.0893 6.3265 6.3265 6.3533 6.3533 7.4866 7.4866 7.4892 7.4892 k = 0.3889-0.0000 0.2626 ( 5428 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8983 -37.8983 -37.8981 -37.8981 -36.9219 -36.9219 -36.9216 -36.9216 -36.8035 -36.8035 -36.8031 -36.8031 -10.3561 -10.3561 -10.3560 -10.3560 -10.1296 -10.1296 -10.1289 -10.1289 -0.2980 -0.2980 -0.2898 -0.2898 0.3661 0.3661 0.3959 0.3959 0.6650 0.6650 0.7086 0.7086 1.3224 1.3224 1.3444 1.3444 1.8934 1.8934 1.9064 1.9064 2.0603 2.0603 2.0704 2.0704 5.5393 5.5393 5.5588 5.5588 5.9671 5.9671 5.9913 5.9913 6.0700 6.0700 6.0971 6.0971 6.3331 6.3331 6.3598 6.3598 7.5066 7.5066 7.5094 7.5094 k = 0.4000-0.0000 0.2626 ( 5420 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8984 -37.8984 -37.8982 -37.8982 -36.9220 -36.9220 -36.9217 -36.9217 -36.8036 -36.8036 -36.8033 -36.8033 -10.3450 -10.3450 -10.3448 -10.3448 -10.1288 -10.1288 -10.1281 -10.1281 -0.3359 -0.3359 -0.3281 -0.3281 0.3811 0.3811 0.4115 0.4115 0.6689 0.6689 0.7140 0.7140 1.3041 1.3041 1.3268 1.3268 1.8956 1.8956 1.9106 1.9106 2.0601 2.0601 2.0719 2.0719 5.5228 5.5228 5.5419 5.5419 5.9669 5.9669 5.9921 5.9921 6.0762 6.0762 6.1041 6.1041 6.3394 6.3394 6.3661 6.3661 7.5256 7.5256 7.5284 7.5284 k = 0.4111-0.0000 0.2626 ( 5418 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8985 -37.8985 -37.8983 -37.8983 -36.9221 -36.9221 -36.9218 -36.9218 -36.8037 -36.8037 -36.8034 -36.8034 -10.3348 -10.3348 -10.3345 -10.3345 -10.1281 -10.1281 -10.1275 -10.1275 -0.3704 -0.3704 -0.3628 -0.3628 0.3945 0.3945 0.4251 0.4251 0.6741 0.6741 0.7202 0.7202 1.2867 1.2867 1.3101 1.3101 1.8963 1.8963 1.9130 1.9130 2.0615 2.0615 2.0746 2.0746 5.5075 5.5075 5.5262 5.5262 5.9667 5.9667 5.9928 5.9928 6.0816 6.0816 6.1103 6.1103 6.3453 6.3453 6.3720 6.3720 7.5432 7.5432 7.5461 7.5461 k = 0.4222-0.0000 0.2626 ( 5426 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8986 -37.8986 -37.8984 -37.8984 -36.9222 -36.9222 -36.9220 -36.9220 -36.8038 -36.8038 -36.8035 -36.8035 -10.3255 -10.3255 -10.3251 -10.3251 -10.1276 -10.1276 -10.1271 -10.1271 -0.4011 -0.4011 -0.3939 -0.3939 0.4062 0.4062 0.4368 0.4368 0.6800 0.6800 0.7268 0.7268 1.2704 1.2704 1.2944 1.2944 1.8960 1.8960 1.9138 1.9138 2.0640 2.0640 2.0781 2.0781 5.4937 5.4937 5.5120 5.5120 5.9665 5.9665 5.9935 5.9935 6.0862 6.0862 6.1157 6.1157 6.3507 6.3507 6.3774 6.3774 7.5593 7.5593 7.5622 7.5622 k = 0.4333-0.0000 0.2626 ( 5422 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8987 -37.8987 -37.8985 -37.8985 -36.9223 -36.9223 -36.9220 -36.9220 -36.8039 -36.8039 -36.8036 -36.8036 -10.3172 -10.3172 -10.3167 -10.3167 -10.1273 -10.1273 -10.1269 -10.1269 -0.4281 -0.4281 -0.4210 -0.4210 0.4162 0.4162 0.4467 0.4467 0.6864 0.6864 0.7336 0.7336 1.2557 1.2557 1.2802 1.2802 1.8949 1.8949 1.9136 1.9136 2.0672 2.0672 2.0820 2.0820 5.4814 5.4814 5.4995 5.4995 5.9663 5.9663 5.9940 5.9940 6.0902 6.0902 6.1204 6.1204 6.3556 6.3556 6.3823 6.3823 7.5737 7.5737 7.5767 7.5767 k = 0.4444-0.0000 0.2626 ( 5426 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8987 -37.8987 -37.8986 -37.8986 -36.9224 -36.9224 -36.9221 -36.9221 -36.8040 -36.8040 -36.8037 -36.8037 -10.3101 -10.3101 -10.3095 -10.3095 -10.1271 -10.1271 -10.1268 -10.1268 -0.4511 -0.4511 -0.4442 -0.4442 0.4247 0.4247 0.4547 0.4547 0.6927 0.6927 0.7401 0.7401 1.2426 1.2426 1.2677 1.2677 1.8934 1.8934 1.9127 1.9127 2.0707 2.0707 2.0859 2.0859 5.4707 5.4707 5.4886 5.4886 5.9662 5.9662 5.9945 5.9945 6.0936 6.0936 6.1243 6.1243 6.3599 6.3599 6.3866 6.3866 7.5861 7.5861 7.5892 7.5892 k = 0.4556-0.0000 0.2626 ( 5434 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9225 -36.9225 -36.9222 -36.9222 -36.8041 -36.8041 -36.8038 -36.8038 -10.3041 -10.3041 -10.3034 -10.3034 -10.1270 -10.1270 -10.1268 -10.1268 -0.4700 -0.4700 -0.4633 -0.4633 0.4315 0.4315 0.4611 0.4611 0.6985 0.6985 0.7460 0.7460 1.2316 1.2316 1.2570 1.2570 1.8918 1.8918 1.9114 1.9114 2.0740 2.0740 2.0896 2.0896 5.4619 5.4619 5.4796 5.4796 5.9661 5.9661 5.9949 5.9949 6.0963 6.0963 6.1276 6.1276 6.3635 6.3635 6.3901 6.3901 7.5965 7.5965 7.5996 7.5996 k = 0.4667-0.0000 0.2626 ( 5446 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2993 -10.2993 -10.2986 -10.2986 -10.1270 -10.1270 -10.1268 -10.1268 -0.4848 -0.4848 -0.4782 -0.4782 0.4368 0.4368 0.4660 0.4660 0.7034 0.7034 0.7509 0.7509 1.2227 1.2227 1.2485 1.2485 1.8902 1.8902 1.9100 1.9100 2.0770 2.0770 2.0927 2.0927 5.4549 5.4549 5.4724 5.4724 5.9660 5.9660 5.9952 5.9952 6.0985 6.0985 6.1300 6.1300 6.3663 6.3663 6.3929 6.3929 7.6048 7.6048 7.6079 7.6079 k = 0.4778-0.0000 0.2626 ( 5446 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2959 -10.2959 -10.2951 -10.2951 -10.1270 -10.1270 -10.1269 -10.1269 -0.4954 -0.4954 -0.4889 -0.4889 0.4406 0.4406 0.4694 0.4694 0.7072 0.7072 0.7546 0.7546 1.2163 1.2163 1.2423 1.2423 1.8890 1.8890 1.9089 1.9089 2.0793 2.0793 2.0950 2.0950 5.4498 5.4498 5.4673 5.4673 5.9660 5.9660 5.9954 5.9954 6.1000 6.1000 6.1318 6.1318 6.3683 6.3683 6.3949 6.3949 7.6108 7.6108 7.6139 7.6139 k = 0.4889-0.0000 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2938 -10.2938 -10.2930 -10.2930 -10.1270 -10.1270 -10.1269 -10.1269 -0.5018 -0.5018 -0.4953 -0.4953 0.4428 0.4428 0.4714 0.4714 0.7095 0.7095 0.7569 0.7569 1.2124 1.2124 1.2386 1.2386 1.8882 1.8882 1.9081 1.9081 2.0807 2.0807 2.0965 2.0965 5.4468 5.4468 5.4642 5.4642 5.9660 5.9660 5.9955 5.9955 6.1009 6.1009 6.1329 6.1329 6.3696 6.3696 6.3961 6.3961 7.6144 7.6144 7.6175 7.6175 k = 0.5000-0.0000 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2931 -10.2931 -10.2923 -10.2923 -10.1270 -10.1270 -10.1269 -10.1269 -0.5039 -0.5039 -0.4975 -0.4975 0.4436 0.4436 0.4721 0.4721 0.7103 0.7103 0.7577 0.7577 1.2111 1.2111 1.2373 1.2373 1.8879 1.8879 1.9079 1.9079 2.0812 2.0812 2.0970 2.0970 5.4458 5.4458 5.4632 5.4632 5.9660 5.9660 5.9956 5.9956 6.1012 6.1012 6.1333 6.1333 6.3700 6.3700 6.3966 6.3966 7.6156 7.6156 7.6188 7.6188 k = 0.5000-0.0000 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2931 -10.2931 -10.2923 -10.2923 -10.1270 -10.1270 -10.1269 -10.1269 -0.5039 -0.5039 -0.4975 -0.4975 0.4436 0.4436 0.4721 0.4721 0.7103 0.7103 0.7577 0.7577 1.2111 1.2111 1.2373 1.2373 1.8879 1.8879 1.9079 1.9079 2.0812 2.0812 2.0970 2.0970 5.4458 5.4458 5.4632 5.4632 5.9660 5.9660 5.9956 5.9956 6.1012 6.1012 6.1333 6.1333 6.3700 6.3700 6.3966 6.3966 7.6156 7.6156 7.6188 7.6188 k = 0.5000 0.0108 0.2626 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2930 -10.2930 -10.2922 -10.2922 -10.1271 -10.1271 -10.1270 -10.1270 -0.5040 -0.5040 -0.4976 -0.4976 0.4433 0.4433 0.4718 0.4718 0.7101 0.7101 0.7574 0.7574 1.2110 1.2110 1.2373 1.2373 1.8872 1.8872 1.9067 1.9067 2.0835 2.0835 2.0988 2.0988 5.4461 5.4461 5.4635 5.4635 5.9661 5.9661 5.9957 5.9957 6.1011 6.1011 6.1331 6.1331 6.3698 6.3698 6.3964 6.3964 7.6150 7.6150 7.6181 7.6181 k = 0.5000 0.0216 0.2626 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2927 -10.2927 -10.2918 -10.2918 -10.1275 -10.1275 -10.1274 -10.1274 -0.5043 -0.5043 -0.4979 -0.4979 0.4424 0.4424 0.4707 0.4707 0.7095 0.7095 0.7566 0.7566 1.2110 1.2110 1.2372 1.2372 1.8851 1.8851 1.9035 1.9035 2.0899 2.0899 2.1042 2.1042 5.4472 5.4472 5.4645 5.4645 5.9664 5.9664 5.9960 5.9960 6.1009 6.1009 6.1329 6.1329 6.3694 6.3694 6.3959 6.3959 7.6129 7.6129 7.6161 7.6161 k = 0.5000 0.0324 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2921 -10.2921 -10.2913 -10.2913 -10.1280 -10.1280 -10.1279 -10.1279 -0.5047 -0.5047 -0.4984 -0.4984 0.4409 0.4409 0.4687 0.4687 0.7087 0.7087 0.7555 0.7555 1.2110 1.2110 1.2371 1.2371 1.8820 1.8820 1.8987 1.8987 2.1001 2.1001 2.1127 2.1127 5.4489 5.4489 5.4662 5.4662 5.9669 5.9669 5.9965 5.9965 6.1005 6.1005 6.1324 6.1324 6.3686 6.3686 6.3950 6.3950 7.6096 7.6096 7.6128 7.6128 k = 0.5000 0.0432 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2913 -10.2913 -10.2905 -10.2905 -10.1288 -10.1288 -10.1287 -10.1287 -0.5053 -0.5053 -0.4991 -0.4991 0.4386 0.4386 0.4657 0.4657 0.7080 0.7080 0.7542 0.7542 1.2110 1.2110 1.2370 1.2370 1.8781 1.8781 1.8929 1.8929 2.1132 2.1132 2.1239 2.1239 5.4513 5.4513 5.4685 5.4685 5.9677 5.9677 5.9971 5.9971 6.1000 6.1000 6.1317 6.1317 6.3676 6.3676 6.3939 6.3939 7.6051 7.6051 7.6082 7.6082 k = 0.5000 0.0540 0.2626 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2903 -10.2903 -10.2895 -10.2895 -10.1298 -10.1298 -10.1297 -10.1297 -0.5060 -0.5060 -0.5000 -0.5000 0.4352 0.4352 0.4614 0.4614 0.7076 0.7076 0.7530 0.7530 1.2109 1.2109 1.2368 1.2368 1.8739 1.8739 1.8868 1.8868 2.1285 2.1285 2.1374 2.1374 5.4544 5.4544 5.4715 5.4715 5.9686 5.9686 5.9979 5.9979 6.0993 6.0993 6.1308 6.1308 6.3665 6.3665 6.3926 6.3926 7.5993 7.5993 7.6023 7.6023 k = 0.5000 0.0648 0.2626 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2891 -10.2891 -10.2883 -10.2883 -10.1310 -10.1310 -10.1309 -10.1309 -0.5067 -0.5067 -0.5009 -0.5009 0.4306 0.4306 0.4557 0.4557 0.7079 0.7079 0.7522 0.7522 1.2109 1.2109 1.2366 1.2366 1.8696 1.8696 1.8806 1.8806 2.1454 2.1454 2.1526 2.1526 5.4582 5.4582 5.4751 5.4751 5.9696 5.9696 5.9987 5.9987 6.0984 6.0984 6.1297 6.1297 6.3652 6.3652 6.3911 6.3911 7.5922 7.5922 7.5952 7.5952 k = 0.5000 0.0756 0.2626 ( 5452 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2877 -10.2877 -10.2869 -10.2869 -10.1324 -10.1324 -10.1323 -10.1323 -0.5075 -0.5075 -0.5020 -0.5020 0.4246 0.4246 0.4482 0.4482 0.7091 0.7091 0.7520 0.7520 1.2108 1.2108 1.2363 1.2363 1.8654 1.8654 1.8747 1.8747 2.1635 2.1635 2.1691 2.1691 5.4625 5.4625 5.4792 5.4792 5.9707 5.9707 5.9996 5.9996 6.0974 6.0974 6.1283 6.1283 6.3638 6.3638 6.3895 6.3895 7.5839 7.5839 7.5869 7.5869 k = 0.5000 0.0864 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2861 -10.2861 -10.2853 -10.2853 -10.1340 -10.1340 -10.1339 -10.1339 -0.5083 -0.5083 -0.5030 -0.5030 0.4172 0.4172 0.4390 0.4390 0.7116 0.7116 0.7528 0.7528 1.2106 1.2106 1.2359 1.2359 1.8616 1.8616 1.8693 1.8693 2.1823 2.1823 2.1865 2.1865 5.4675 5.4675 5.4840 5.4840 5.9719 5.9719 6.0004 6.0004 6.0962 6.0962 6.1267 6.1267 6.3626 6.3626 6.3879 6.3879 7.5745 7.5745 7.5775 7.5775 k = 0.5000 0.0972 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2843 -10.2843 -10.2835 -10.2835 -10.1358 -10.1358 -10.1357 -10.1357 -0.5090 -0.5090 -0.5040 -0.5040 0.4081 0.4081 0.4280 0.4280 0.7153 0.7153 0.7546 0.7546 1.2105 1.2105 1.2354 1.2354 1.8582 1.8582 1.8645 1.8645 2.2016 2.2016 2.2044 2.2044 5.4731 5.4731 5.4893 5.4893 5.9731 5.9731 6.0011 6.0011 6.0949 6.0949 6.1248 6.1248 6.3615 6.3615 6.3864 6.3864 7.5641 7.5641 7.5671 7.5671 k = 0.5000 0.1080 0.2626 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2823 -10.2823 -10.2816 -10.2816 -10.1377 -10.1377 -10.1377 -10.1377 -0.5096 -0.5096 -0.5049 -0.5049 0.3975 0.3975 0.4154 0.4154 0.7204 0.7204 0.7576 0.7576 1.2104 1.2104 1.2349 1.2349 1.8552 1.8552 1.8603 1.8603 2.2208 2.2208 2.2226 2.2226 5.4791 5.4791 5.4951 5.4951 5.9742 5.9742 6.0016 6.0016 6.0935 6.0935 6.1226 6.1226 6.3606 6.3606 6.3850 6.3850 7.5528 7.5528 7.5557 7.5557 k = 0.5000 0.1188 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2802 -10.2802 -10.2795 -10.2795 -10.1399 -10.1399 -10.1398 -10.1398 -0.5101 -0.5101 -0.5057 -0.5057 0.3855 0.3855 0.4014 0.4014 0.7267 0.7267 0.7618 0.7618 1.2102 1.2102 1.2343 1.2343 1.8528 1.8528 1.8568 1.8568 2.2400 2.2400 2.2409 2.2409 5.4856 5.4856 5.5012 5.5012 5.9753 5.9753 6.0018 6.0018 6.0919 6.0919 6.1202 6.1202 6.3599 6.3599 6.3838 6.3838 7.5406 7.5406 7.5434 7.5434 k = 0.5000 0.1296 0.2626 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2779 -10.2779 -10.2772 -10.2772 -10.1421 -10.1421 -10.1420 -10.1420 -0.5105 -0.5105 -0.5064 -0.5064 0.3723 0.3723 0.3861 0.3861 0.7340 0.7340 0.7669 0.7669 1.2100 1.2100 1.2335 1.2335 1.8508 1.8508 1.8539 1.8539 2.2587 2.2587 2.2588 2.2588 5.4925 5.4925 5.5077 5.5077 5.9761 5.9761 6.0017 6.0017 6.0902 6.0902 6.1175 6.1175 6.3597 6.3597 6.3829 6.3829 7.5276 7.5276 7.5304 7.5304 k = 0.5000 0.1404 0.2626 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2755 -10.2755 -10.2748 -10.2748 -10.1445 -10.1445 -10.1444 -10.1444 -0.5107 -0.5107 -0.5069 -0.5069 0.3581 0.3581 0.3700 0.3700 0.7422 0.7422 0.7730 0.7730 1.2099 1.2099 1.2328 1.2328 1.8494 1.8494 1.8516 1.8516 2.2763 2.2763 2.2769 2.2769 5.4998 5.4998 5.5146 5.5146 5.9768 5.9768 6.0012 6.0012 6.0886 6.0886 6.1146 6.1146 6.3599 6.3599 6.3823 6.3823 7.5141 7.5141 7.5169 7.5169 k = 0.5000 0.1512 0.2626 ( 5452 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2730 -10.2730 -10.2723 -10.2723 -10.1470 -10.1470 -10.1469 -10.1469 -0.5107 -0.5107 -0.5072 -0.5072 0.3431 0.3431 0.3534 0.3534 0.7511 0.7511 0.7798 0.7798 1.2098 1.2098 1.2319 1.2319 1.8483 1.8483 1.8499 1.8499 2.2932 2.2932 2.2943 2.2943 5.5074 5.5074 5.5217 5.5217 5.9772 5.9772 6.0001 6.0001 6.0869 6.0869 6.1115 6.1115 6.3605 6.3605 6.3820 6.3820 7.5002 7.5002 7.5029 7.5029 k = 0.5000 0.1620 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2704 -10.2704 -10.2697 -10.2697 -10.1496 -10.1496 -10.1495 -10.1495 -0.5105 -0.5105 -0.5073 -0.5073 0.3278 0.3278 0.3365 0.3365 0.7604 0.7604 0.7870 0.7870 1.2097 1.2097 1.2310 1.2310 1.8476 1.8476 1.8486 1.8486 2.3093 2.3093 2.3108 2.3108 5.5152 5.5152 5.5289 5.5289 5.9773 5.9773 5.9985 5.9985 6.0854 6.0854 6.1083 6.1083 6.3616 6.3616 6.3821 6.3821 7.4862 7.4862 7.4887 7.4887 k = 0.5000 0.1728 0.2626 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2677 -10.2677 -10.2671 -10.2671 -10.1523 -10.1523 -10.1522 -10.1522 -0.5101 -0.5101 -0.5072 -0.5072 0.3124 0.3124 0.3197 0.3197 0.7699 0.7699 0.7945 0.7945 1.2097 1.2097 1.2299 1.2299 1.8472 1.8472 1.8478 1.8478 2.3246 2.3246 2.3262 2.3262 5.5231 5.5231 5.5361 5.5361 5.9770 5.9770 5.9964 5.9964 6.0841 6.0841 6.1051 6.1051 6.3632 6.3632 6.3826 6.3826 7.4721 7.4721 7.4745 7.4745 k = 0.5000 0.1836 0.2626 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2650 -10.2650 -10.2644 -10.2644 -10.1550 -10.1550 -10.1548 -10.1548 -0.5095 -0.5095 -0.5070 -0.5070 0.2971 0.2971 0.3033 0.3033 0.7794 0.7794 0.8020 0.8020 1.2098 1.2098 1.2289 1.2289 1.8472 1.8472 1.8473 1.8473 2.3387 2.3387 2.3406 2.3406 5.5310 5.5310 5.5434 5.5434 5.9764 5.9764 5.9937 5.9937 6.0829 6.0829 6.1019 6.1019 6.3652 6.3652 6.3833 6.3833 7.4582 7.4582 7.4605 7.4605 k = 0.5000 0.1944 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2623 -10.2623 -10.2618 -10.2618 -10.1576 -10.1576 -10.1575 -10.1575 -0.5087 -0.5087 -0.5065 -0.5065 0.2824 0.2824 0.2875 0.2875 0.7887 0.7887 0.8093 0.8093 1.2100 1.2100 1.2278 1.2278 1.8472 1.8472 1.8473 1.8473 2.3518 2.3518 2.3538 2.3538 5.5389 5.5389 5.5504 5.5504 5.9754 5.9754 5.9906 5.9906 6.0820 6.0820 6.0988 6.0988 6.3676 6.3676 6.3844 6.3844 7.4447 7.4447 7.4469 7.4469 k = 0.5000 0.2052 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2597 -10.2597 -10.2592 -10.2592 -10.1603 -10.1603 -10.1601 -10.1601 -0.5079 -0.5079 -0.5060 -0.5060 0.2684 0.2684 0.2726 0.2726 0.7977 0.7977 0.8162 0.8162 1.2102 1.2102 1.2266 1.2266 1.8473 1.8473 1.8475 1.8475 2.3637 2.3637 2.3656 2.3656 5.5465 5.5465 5.5571 5.5571 5.9741 5.9741 5.9871 5.9871 6.0813 6.0813 6.0959 6.0959 6.3703 6.3703 6.3855 6.3855 7.4318 7.4318 7.4339 7.4339 k = 0.5000 0.2160 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2571 -10.2571 -10.2566 -10.2566 -10.1628 -10.1628 -10.1627 -10.1627 -0.5070 -0.5070 -0.5053 -0.5053 0.2554 0.2554 0.2588 0.2588 0.8062 0.8062 0.8226 0.8226 1.2106 1.2106 1.2254 1.2254 1.8475 1.8475 1.8479 1.8479 2.3743 2.3743 2.3762 2.3762 5.5539 5.5539 5.5634 5.5634 5.9726 5.9726 5.9835 5.9835 6.0808 6.0808 6.0933 6.0933 6.3731 6.3731 6.3867 6.3867 7.4199 7.4199 7.4218 7.4218 k = 0.5000 0.2268 0.2626 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2547 -10.2547 -10.2543 -10.2543 -10.1652 -10.1652 -10.1651 -10.1651 -0.5060 -0.5060 -0.5046 -0.5046 0.2437 0.2437 0.2464 0.2464 0.8140 0.8140 0.8283 0.8283 1.2111 1.2111 1.2241 1.2241 1.8479 1.8479 1.8483 1.8483 2.3836 2.3836 2.3853 2.3853 5.5607 5.5607 5.5692 5.5692 5.9709 5.9709 5.9797 5.9797 6.0805 6.0805 6.0909 6.0909 6.3760 6.3760 6.3879 6.3879 7.4090 7.4090 7.4107 7.4107 k = 0.5000 0.2376 0.2626 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2525 -10.2525 -10.2521 -10.2521 -10.1674 -10.1674 -10.1673 -10.1673 -0.5051 -0.5051 -0.5039 -0.5039 0.2334 0.2334 0.2355 0.2355 0.8211 0.8211 0.8331 0.8331 1.2118 1.2118 1.2229 1.2229 1.8483 1.8483 1.8488 1.8488 2.3915 2.3915 2.3931 2.3931 5.5670 5.5670 5.5742 5.5742 5.9691 5.9691 5.9762 5.9762 6.0803 6.0803 6.0888 6.0888 6.3789 6.3789 6.3890 6.3890 7.3994 7.3994 7.4009 7.4009 k = 0.5000 0.2484 0.2626 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2505 -10.2505 -10.2502 -10.2502 -10.1693 -10.1693 -10.1692 -10.1692 -0.5042 -0.5042 -0.5033 -0.5033 0.2248 0.2248 0.2264 0.2264 0.8272 0.8272 0.8370 0.8370 1.2125 1.2125 1.2216 1.2216 1.8487 1.8487 1.8492 1.8492 2.3981 2.3981 2.3994 2.3994 5.5724 5.5724 5.5784 5.5784 5.9675 5.9675 5.9729 5.9729 6.0804 6.0804 6.0870 6.0870 6.3817 6.3817 6.3898 6.3898 7.3913 7.3913 7.3925 7.3925 k = 0.5000 0.2592 0.2626 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2489 -10.2489 -10.2486 -10.2486 -10.1709 -10.1709 -10.1708 -10.1708 -0.5035 -0.5035 -0.5028 -0.5028 0.2179 0.2179 0.2191 0.2191 0.8324 0.8324 0.8398 0.8398 1.2134 1.2134 1.2203 1.2203 1.8491 1.8491 1.8495 1.8495 2.4033 2.4033 2.4043 2.4043 5.5771 5.5771 5.5816 5.5816 5.9662 5.9662 5.9700 5.9700 6.0806 6.0806 6.0854 6.0854 6.3842 6.3842 6.3904 6.3904 7.3849 7.3849 7.3858 7.3858 k = 0.5000 0.2700 0.2626 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2476 -10.2476 -10.2474 -10.2474 -10.1721 -10.1721 -10.1720 -10.1720 -0.5029 -0.5029 -0.5024 -0.5024 0.2130 0.2130 0.2137 0.2137 0.8365 0.8365 0.8414 0.8414 1.2144 1.2144 1.2190 1.2190 1.8494 1.8494 1.8497 1.8497 2.4071 2.4071 2.4077 2.4077 5.5807 5.5807 5.5838 5.5838 5.9653 5.9653 5.9677 5.9677 6.0810 6.0810 6.0841 6.0841 6.3864 6.3864 6.3905 6.3905 7.3802 7.3802 7.3809 7.3809 k = 0.5000 0.2808 0.2626 ( 5420 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2468 -10.2468 -10.2467 -10.2467 -10.1729 -10.1729 -10.1728 -10.1728 -0.5025 -0.5025 -0.5022 -0.5022 0.2101 0.2101 0.2104 0.2104 0.8395 0.8395 0.8420 0.8420 1.2154 1.2154 1.2178 1.2178 1.8497 1.8497 1.8498 1.8498 2.4094 2.4094 2.4097 2.4097 5.5832 5.5832 5.5848 5.5848 5.9649 5.9649 5.9661 5.9661 6.0815 6.0815 6.0831 6.0831 6.3881 6.3881 6.3902 6.3902 7.3774 7.3774 7.3778 7.3778 k = 0.5000 0.2916 0.2626 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2466 -10.2466 -10.2465 -10.2465 -10.1731 -10.1731 -10.1730 -10.1730 -0.5023 -0.5023 -0.5022 -0.5022 0.2092 0.2092 0.2092 0.2092 0.8413 0.8413 0.8413 0.8413 1.2165 1.2165 1.2166 1.2166 1.8498 1.8498 1.8498 1.8498 2.4103 2.4103 2.4103 2.4103 5.5845 5.5845 5.5847 5.5847 5.9651 5.9651 5.9653 5.9653 6.0821 6.0821 6.0823 6.0823 6.3893 6.3893 6.3895 6.3895 7.3765 7.3765 7.3768 7.3768 k = 0.5000 0.2916 0.2626 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2466 -10.2466 -10.2465 -10.2465 -10.1731 -10.1731 -10.1730 -10.1730 -0.5023 -0.5023 -0.5022 -0.5022 0.2092 0.2092 0.2092 0.2092 0.8413 0.8413 0.8413 0.8413 1.2165 1.2165 1.2166 1.2166 1.8498 1.8498 1.8498 1.8498 2.4103 2.4103 2.4103 2.4103 5.5845 5.5845 5.5847 5.5847 5.9651 5.9651 5.9653 5.9653 6.0821 6.0821 6.0823 6.0823 6.3893 6.3893 6.3895 6.3895 7.3765 7.3765 7.3768 7.3768 k = 0.4889 0.2916 0.2626 ( 5420 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.2471 -10.2471 -10.2470 -10.2470 -10.1733 -10.1733 -10.1732 -10.1732 -0.5006 -0.5006 -0.5005 -0.5005 0.2094 0.2094 0.2094 0.2094 0.8407 0.8407 0.8407 0.8407 1.2180 1.2180 1.2181 1.2181 1.8495 1.8495 1.8495 1.8495 2.4095 2.4095 2.4095 2.4095 5.5854 5.5854 5.5856 5.5856 5.9647 5.9647 5.9649 5.9649 6.0808 6.0808 6.0809 6.0809 6.3903 6.3903 6.3905 6.3905 7.3754 7.3754 7.3756 7.3756 k = 0.4778 0.2916 0.2626 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.2488 -10.2488 -10.2487 -10.2487 -10.1738 -10.1738 -10.1737 -10.1737 -0.4956 -0.4956 -0.4955 -0.4955 0.2101 0.2101 0.2101 0.2101 0.8388 0.8388 0.8388 0.8388 1.2224 1.2224 1.2224 1.2224 1.8485 1.8485 1.8486 1.8486 2.4070 2.4070 2.4071 2.4071 5.5880 5.5880 5.5882 5.5882 5.9637 5.9637 5.9639 5.9639 6.0768 6.0768 6.0770 6.0770 6.3934 6.3934 6.3936 6.3936 7.3719 7.3719 7.3722 7.3722 k = 0.4667 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9223 -36.9223 -36.8041 -36.8041 -36.8039 -36.8039 -10.2515 -10.2515 -10.2514 -10.2514 -10.1745 -10.1745 -10.1745 -10.1745 -0.4873 -0.4873 -0.4872 -0.4872 0.2112 0.2112 0.2112 0.2112 0.8357 0.8357 0.8358 0.8358 1.2296 1.2296 1.2297 1.2297 1.8470 1.8470 1.8470 1.8470 2.4030 2.4030 2.4031 2.4031 5.5925 5.5925 5.5926 5.5926 5.9620 5.9620 5.9622 5.9622 6.0704 6.0704 6.0706 6.0706 6.3984 6.3984 6.3985 6.3985 7.3662 7.3662 7.3665 7.3665 k = 0.4556 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9223 -36.9223 -36.8041 -36.8041 -36.8039 -36.8039 -10.2553 -10.2553 -10.2552 -10.2552 -10.1757 -10.1757 -10.1756 -10.1756 -0.4757 -0.4757 -0.4757 -0.4757 0.2129 0.2129 0.2129 0.2129 0.8316 0.8316 0.8316 0.8316 1.2396 1.2396 1.2397 1.2397 1.8448 1.8448 1.8448 1.8448 2.3975 2.3975 2.3975 2.3975 5.5986 5.5986 5.5987 5.5987 5.9597 5.9597 5.9599 5.9599 6.0619 6.0619 6.0620 6.0620 6.4049 6.4049 6.4050 6.4050 7.3584 7.3584 7.3586 7.3586 k = 0.4444 0.2916 0.2626 ( 5448 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8988 -37.8988 -37.8986 -37.8986 -36.9224 -36.9224 -36.9222 -36.9222 -36.8040 -36.8040 -36.8038 -36.8038 -10.2601 -10.2601 -10.2600 -10.2600 -10.1771 -10.1771 -10.1770 -10.1770 -0.4612 -0.4612 -0.4611 -0.4611 0.2151 0.2151 0.2151 0.2151 0.8265 0.8265 0.8266 0.8266 1.2523 1.2523 1.2524 1.2524 1.8420 1.8420 1.8420 1.8420 2.3904 2.3904 2.3904 2.3904 5.6063 5.6063 5.6064 5.6064 5.9567 5.9567 5.9569 5.9569 6.0516 6.0516 6.0517 6.0517 6.4126 6.4126 6.4127 6.4127 7.3486 7.3486 7.3488 7.3488 k = 0.4333 0.2916 0.2626 ( 5448 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8988 -37.8988 -37.8986 -37.8986 -36.9223 -36.9223 -36.9222 -36.9222 -36.8039 -36.8039 -36.8038 -36.8038 -10.2659 -10.2659 -10.2658 -10.2658 -10.1788 -10.1788 -10.1787 -10.1787 -0.4437 -0.4437 -0.4437 -0.4437 0.2179 0.2179 0.2179 0.2179 0.8207 0.8207 0.8208 0.8208 1.2676 1.2676 1.2676 1.2676 1.8387 1.8387 1.8387 1.8387 2.3819 2.3819 2.3819 2.3819 5.6155 5.6155 5.6157 5.6157 5.9530 5.9530 5.9532 5.9532 6.0398 6.0398 6.0399 6.0399 6.4212 6.4212 6.4213 6.4213 7.3368 7.3368 7.3371 7.3371 k = 0.4222 0.2916 0.2626 ( 5452 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8987 -37.8987 -37.8985 -37.8985 -36.9222 -36.9222 -36.9221 -36.9221 -36.8038 -36.8038 -36.8037 -36.8037 -10.2727 -10.2727 -10.2726 -10.2726 -10.1808 -10.1808 -10.1807 -10.1807 -0.4236 -0.4236 -0.4235 -0.4235 0.2213 0.2213 0.2214 0.2214 0.8145 0.8145 0.8145 0.8145 1.2852 1.2852 1.2853 1.2853 1.8347 1.8347 1.8348 1.8348 2.3720 2.3720 2.3720 2.3720 5.6261 5.6261 5.6263 5.6263 5.9486 5.9486 5.9488 5.9488 6.0270 6.0270 6.0271 6.0271 6.4304 6.4304 6.4305 6.4305 7.3234 7.3234 7.3237 7.3237 k = 0.4111 0.2916 0.2626 ( 5464 PWs) bands (ev): -65.8234 -65.8234 -65.8232 -65.8232 -37.8986 -37.8986 -37.8984 -37.8984 -36.9222 -36.9222 -36.9220 -36.9220 -36.8037 -36.8037 -36.8036 -36.8036 -10.2804 -10.2804 -10.2804 -10.2804 -10.1831 -10.1831 -10.1830 -10.1830 -0.4010 -0.4010 -0.4010 -0.4010 0.2256 0.2256 0.2256 0.2256 0.8080 0.8080 0.8081 0.8081 1.3050 1.3050 1.3051 1.3051 1.8303 1.8303 1.8303 1.8303 2.3607 2.3607 2.3607 2.3607 5.6379 5.6379 5.6381 5.6381 5.9434 5.9434 5.9436 5.9436 6.0135 6.0135 6.0136 6.0136 6.4398 6.4398 6.4399 6.4399 7.3085 7.3085 7.3087 7.3087 k = 0.4000 0.2916 0.2626 ( 5468 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8985 -37.8985 -37.8983 -37.8983 -36.9220 -36.9220 -36.9219 -36.9219 -36.8036 -36.8036 -36.8034 -36.8034 -10.2891 -10.2891 -10.2890 -10.2890 -10.1856 -10.1856 -10.1855 -10.1855 -0.3764 -0.3764 -0.3764 -0.3764 0.2306 0.2306 0.2306 0.2306 0.8018 0.8018 0.8019 0.8019 1.3269 1.3269 1.3269 1.3269 1.8253 1.8253 1.8253 1.8253 2.3482 2.3482 2.3483 2.3483 5.6507 5.6507 5.6509 5.6509 5.9374 5.9374 5.9376 5.9376 5.9998 5.9998 5.9999 5.9999 6.4493 6.4493 6.4494 6.4494 7.2924 7.2924 7.2926 7.2926 k = 0.3889 0.2916 0.2626 ( 5456 PWs) bands (ev): -65.8235 -65.8235 -65.8232 -65.8232 -37.8984 -37.8984 -37.8982 -37.8982 -36.9219 -36.9219 -36.9217 -36.9217 -36.8035 -36.8035 -36.8033 -36.8033 -10.2985 -10.2985 -10.2984 -10.2984 -10.1884 -10.1884 -10.1883 -10.1883 -0.3502 -0.3502 -0.3501 -0.3501 0.2365 0.2365 0.2365 0.2365 0.7962 0.7962 0.7962 0.7962 1.3505 1.3505 1.3505 1.3505 1.8199 1.8199 1.8200 1.8200 2.3346 2.3346 2.3346 2.3346 5.6643 5.6643 5.6645 5.6645 5.9304 5.9304 5.9306 5.9306 5.9864 5.9864 5.9865 5.9865 6.4587 6.4587 6.4588 6.4588 7.2752 7.2752 7.2755 7.2755 k = 0.3778 0.2916 0.2626 ( 5444 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8983 -37.8983 -37.8981 -37.8981 -36.9217 -36.9217 -36.9215 -36.9215 -36.8033 -36.8033 -36.8031 -36.8031 -10.3088 -10.3088 -10.3087 -10.3087 -10.1915 -10.1915 -10.1914 -10.1914 -0.3227 -0.3227 -0.3226 -0.3226 0.2433 0.2433 0.2433 0.2433 0.7917 0.7917 0.7917 0.7917 1.3756 1.3756 1.3756 1.3756 1.8142 1.8142 1.8142 1.8142 2.3199 2.3199 2.3200 2.3200 5.6783 5.6783 5.6785 5.6785 5.9223 5.9223 5.9225 5.9225 5.9738 5.9738 5.9739 5.9739 6.4676 6.4676 6.4677 6.4677 7.2574 7.2574 7.2576 7.2576 k = 0.3667 0.2916 0.2626 ( 5440 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8981 -37.8981 -37.8979 -37.8979 -36.9215 -36.9215 -36.9214 -36.9214 -36.8031 -36.8031 -36.8029 -36.8029 -10.3197 -10.3197 -10.3196 -10.3196 -10.1947 -10.1947 -10.1946 -10.1946 -0.2945 -0.2945 -0.2945 -0.2945 0.2511 0.2511 0.2512 0.2512 0.7888 0.7888 0.7889 0.7889 1.4019 1.4019 1.4019 1.4019 1.8081 1.8081 1.8081 1.8081 2.3043 2.3043 2.3043 2.3043 5.6923 5.6923 5.6924 5.6924 5.9131 5.9131 5.9132 5.9132 5.9624 5.9624 5.9626 5.9626 6.4760 6.4760 6.4761 6.4761 7.2390 7.2390 7.2392 7.2392 k = 0.3556 0.2916 0.2626 ( 5440 PWs) bands (ev): -65.8235 -65.8235 -65.8233 -65.8233 -37.8980 -37.8980 -37.8978 -37.8978 -36.9214 -36.9214 -36.9212 -36.9212 -36.8029 -36.8029 -36.8028 -36.8028 -10.3313 -10.3313 -10.3312 -10.3312 -10.1982 -10.1982 -10.1981 -10.1981 -0.2663 -0.2663 -0.2662 -0.2662 0.2600 0.2600 0.2601 0.2601 0.7882 0.7882 0.7883 0.7883 1.4290 1.4290 1.4291 1.4291 1.8020 1.8020 1.8020 1.8020 2.2878 2.2878 2.2879 2.2879 5.7055 5.7055 5.7057 5.7057 5.9032 5.9032 5.9033 5.9033 5.9526 5.9526 5.9527 5.9527 6.4837 6.4837 6.4838 6.4838 7.2205 7.2205 7.2207 7.2207 k = 0.3444 0.2916 0.2626 ( 5448 PWs) bands (ev): -65.8236 -65.8236 -65.8233 -65.8233 -37.8979 -37.8979 -37.8977 -37.8977 -36.9212 -36.9212 -36.9210 -36.9210 -36.8028 -36.8028 -36.8026 -36.8026 -10.3435 -10.3435 -10.3435 -10.3435 -10.2019 -10.2019 -10.2018 -10.2018 -0.2386 -0.2386 -0.2386 -0.2386 0.2700 0.2700 0.2701 0.2701 0.7906 0.7906 0.7907 0.7907 1.4566 1.4566 1.4566 1.4566 1.7958 1.7958 1.7958 1.7958 2.2706 2.2706 2.2706 2.2706 5.7170 5.7170 5.7172 5.7172 5.8936 5.8936 5.8937 5.8937 5.9441 5.9441 5.9443 5.9443 6.4906 6.4906 6.4907 6.4907 7.2020 7.2020 7.2022 7.2022 k = 0.3333 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8977 -37.8977 -37.8975 -37.8975 -36.9210 -36.9210 -36.9208 -36.9208 -36.8025 -36.8025 -36.8024 -36.8024 -10.3563 -10.3563 -10.3562 -10.3562 -10.2057 -10.2057 -10.2056 -10.2056 -0.2123 -0.2123 -0.2123 -0.2123 0.2812 0.2812 0.2812 0.2812 0.7967 0.7967 0.7967 0.7967 1.4841 1.4841 1.4841 1.4841 1.7901 1.7901 1.7901 1.7901 2.2527 2.2527 2.2528 2.2528 5.7256 5.7256 5.7257 5.7257 5.8857 5.8857 5.8858 5.8858 5.9370 5.9370 5.9372 5.9372 6.4966 6.4966 6.4967 6.4967 7.1840 7.1840 7.1842 7.1842 k = 0.3222 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8236 -65.8236 -65.8234 -65.8234 -37.8975 -37.8975 -37.8974 -37.8974 -36.9208 -36.9208 -36.9206 -36.9206 -36.8023 -36.8023 -36.8022 -36.8022 -10.3695 -10.3695 -10.3694 -10.3694 -10.2097 -10.2097 -10.2096 -10.2096 -0.1881 -0.1881 -0.1881 -0.1881 0.2935 0.2935 0.2935 0.2935 0.8071 0.8071 0.8072 0.8072 1.5109 1.5109 1.5109 1.5109 1.7852 1.7852 1.7852 1.7852 2.2344 2.2344 2.2344 2.2344 5.7295 5.7295 5.7296 5.7296 5.8813 5.8813 5.8814 5.8814 5.9312 5.9312 5.9313 5.9313 6.5017 6.5017 6.5017 6.5017 7.1666 7.1666 7.1669 7.1669 k = 0.3111 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8237 -65.8237 -65.8234 -65.8234 -37.8974 -37.8974 -37.8972 -37.8972 -36.9206 -36.9206 -36.9205 -36.9205 -36.8021 -36.8021 -36.8019 -36.8019 -10.3830 -10.3830 -10.3830 -10.3830 -10.2138 -10.2138 -10.2137 -10.2137 -0.1666 -0.1666 -0.1666 -0.1666 0.3070 0.3070 0.3070 0.3070 0.8226 0.8226 0.8226 0.8226 1.5361 1.5361 1.5361 1.5361 1.7816 1.7816 1.7816 1.7816 2.2155 2.2155 2.2156 2.2156 5.7276 5.7276 5.7277 5.7277 5.8811 5.8811 5.8812 5.8812 5.9267 5.9267 5.9269 5.9269 6.5056 6.5056 6.5057 6.5057 7.1502 7.1502 7.1504 7.1504 k = 0.3000 0.2916 0.2626 ( 5452 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8973 -37.8973 -37.8971 -37.8971 -36.9205 -36.9205 -36.9203 -36.9203 -36.8019 -36.8019 -36.8018 -36.8018 -10.3969 -10.3969 -10.3969 -10.3969 -10.2180 -10.2180 -10.2180 -10.2180 -0.1484 -0.1484 -0.1484 -0.1484 0.3217 0.3217 0.3218 0.3218 0.8436 0.8436 0.8437 0.8437 1.5585 1.5585 1.5586 1.5586 1.7805 1.7805 1.7805 1.7805 2.1964 2.1964 2.1965 2.1965 5.7198 5.7198 5.7198 5.7198 5.8844 5.8844 5.8846 5.8846 5.9245 5.9245 5.9247 5.9247 6.5085 6.5085 6.5086 6.5086 7.1350 7.1350 7.1352 7.1352 k = 0.2889 0.2916 0.2626 ( 5452 PWs) bands (ev): -65.8237 -65.8237 -65.8235 -65.8235 -37.8971 -37.8971 -37.8969 -37.8969 -36.9203 -36.9203 -36.9201 -36.9201 -36.8017 -36.8017 -36.8015 -36.8015 -10.4111 -10.4111 -10.4110 -10.4110 -10.2223 -10.2223 -10.2223 -10.2223 -0.1339 -0.1339 -0.1339 -0.1339 0.3377 0.3377 0.3377 0.3377 0.8706 0.8706 0.8706 0.8706 1.5769 1.5769 1.5770 1.5770 1.7828 1.7828 1.7828 1.7828 2.1771 2.1771 2.1771 2.1771 5.7071 5.7071 5.7072 5.7072 5.8885 5.8885 5.8887 5.8887 5.9263 5.9263 5.9264 5.9264 6.5103 6.5103 6.5103 6.5103 7.1213 7.1213 7.1215 7.1215 k = 0.2778 0.2916 0.2626 ( 5456 PWs) bands (ev): -65.8238 -65.8238 -65.8235 -65.8235 -37.8969 -37.8969 -37.8967 -37.8967 -36.9201 -36.9201 -36.9199 -36.9199 -36.8015 -36.8015 -36.8013 -36.8013 -10.4254 -10.4254 -10.4253 -10.4253 -10.2267 -10.2267 -10.2267 -10.2267 -0.1234 -0.1234 -0.1234 -0.1234 0.3549 0.3549 0.3549 0.3549 0.9036 0.9036 0.9037 0.9037 1.5900 1.5900 1.5900 1.5900 1.7897 1.7897 1.7897 1.7897 2.1577 2.1577 2.1577 2.1577 5.6908 5.6908 5.6908 5.6908 5.8902 5.8902 5.8904 5.8904 5.9338 5.9338 5.9339 5.9339 6.5109 6.5109 6.5110 6.5110 7.1094 7.1094 7.1096 7.1096 k = 0.2667 0.2916 0.2626 ( 5452 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8968 -37.8968 -37.8966 -37.8966 -36.9199 -36.9199 -36.9197 -36.9197 -36.8012 -36.8012 -36.8010 -36.8010 -10.4398 -10.4398 -10.4397 -10.4397 -10.2312 -10.2312 -10.2311 -10.2311 -0.1169 -0.1169 -0.1168 -0.1168 0.3732 0.3732 0.3733 0.3733 0.9427 0.9427 0.9428 0.9428 1.5969 1.5969 1.5970 1.5970 1.8018 1.8018 1.8018 1.8018 2.1382 2.1382 2.1382 2.1382 5.6719 5.6719 5.6720 5.6720 5.8892 5.8892 5.8894 5.8894 5.9461 5.9461 5.9463 5.9463 6.5105 6.5105 6.5106 6.5106 7.0993 7.0993 7.0995 7.0995 k = 0.2556 0.2916 0.2626 ( 5456 PWs) bands (ev): -65.8238 -65.8238 -65.8236 -65.8236 -37.8966 -37.8966 -37.8964 -37.8964 -36.9197 -36.9197 -36.9195 -36.9195 -36.8010 -36.8010 -36.8008 -36.8008 -10.4542 -10.4542 -10.4541 -10.4541 -10.2356 -10.2356 -10.2356 -10.2356 -0.1141 -0.1141 -0.1141 -0.1141 0.3928 0.3928 0.3928 0.3928 0.9875 0.9875 0.9876 0.9876 1.5980 1.5980 1.5981 1.5981 1.8185 1.8185 1.8185 1.8185 2.1189 2.1189 2.1189 2.1189 5.6513 5.6513 5.6514 5.6514 5.8868 5.8868 5.8870 5.8870 5.9612 5.9612 5.9613 5.9613 6.5090 6.5090 6.5091 6.5091 7.0914 7.0914 7.0917 7.0917 k = 0.2444 0.2916 0.2626 ( 5448 PWs) bands (ev): -65.8239 -65.8239 -65.8236 -65.8236 -37.8964 -37.8964 -37.8962 -37.8962 -36.9194 -36.9194 -36.9193 -36.9193 -36.8007 -36.8007 -36.8006 -36.8006 -10.4685 -10.4685 -10.4685 -10.4685 -10.2401 -10.2401 -10.2400 -10.2400 -0.1148 -0.1148 -0.1148 -0.1148 0.4135 0.4135 0.4135 0.4135 1.0375 1.0375 1.0376 1.0376 1.5941 1.5941 1.5942 1.5942 1.8389 1.8389 1.8389 1.8389 2.0997 2.0997 2.0997 2.0997 5.6294 5.6294 5.6295 5.6295 5.8838 5.8838 5.8840 5.8840 5.9776 5.9776 5.9777 5.9777 6.5066 6.5066 6.5066 6.5066 7.0859 7.0859 7.0861 7.0861 k = 0.2333 0.2916 0.2626 ( 5448 PWs) bands (ev): -65.8239 -65.8239 -65.8237 -65.8237 -37.8962 -37.8962 -37.8961 -37.8961 -36.9192 -36.9192 -36.9191 -36.9191 -36.8005 -36.8005 -36.8003 -36.8003 -10.4828 -10.4828 -10.4827 -10.4827 -10.2445 -10.2445 -10.2445 -10.2445 -0.1186 -0.1186 -0.1186 -0.1186 0.4353 0.4353 0.4353 0.4353 1.0923 1.0923 1.0924 1.0924 1.5864 1.5864 1.5865 1.5865 1.8615 1.8615 1.8615 1.8615 2.0808 2.0808 2.0808 2.0808 5.6064 5.6064 5.6065 5.6065 5.8808 5.8808 5.8810 5.8810 5.9944 5.9944 5.9946 5.9946 6.5031 6.5031 6.5032 6.5032 7.0827 7.0827 7.0829 7.0829 k = 0.2222 0.2916 0.2626 ( 5460 PWs) bands (ev): -65.8240 -65.8240 -65.8237 -65.8237 -37.8961 -37.8961 -37.8959 -37.8959 -36.9191 -36.9191 -36.9189 -36.9189 -36.8002 -36.8002 -36.8001 -36.8001 -10.4969 -10.4969 -10.4968 -10.4968 -10.2489 -10.2489 -10.2489 -10.2489 -0.1250 -0.1250 -0.1249 -0.1249 0.4582 0.4582 0.4582 0.4582 1.1510 1.1510 1.1512 1.1512 1.5758 1.5758 1.5759 1.5759 1.8854 1.8854 1.8854 1.8854 2.0623 2.0623 2.0623 2.0623 5.5827 5.5827 5.5828 5.5828 5.8777 5.8777 5.8780 5.8780 6.0112 6.0112 6.0113 6.0113 6.4989 6.4989 6.4989 6.4989 7.0820 7.0820 7.0823 7.0823 k = 0.2111 0.2916 0.2626 ( 5456 PWs) bands (ev): -65.8240 -65.8240 -65.8237 -65.8237 -37.8959 -37.8959 -37.8957 -37.8957 -36.9189 -36.9189 -36.9187 -36.9187 -36.8000 -36.8000 -36.7998 -36.7998 -10.5107 -10.5107 -10.5106 -10.5106 -10.2533 -10.2533 -10.2532 -10.2532 -0.1334 -0.1334 -0.1334 -0.1334 0.4820 0.4820 0.4821 0.4821 1.2131 1.2131 1.2132 1.2132 1.5631 1.5631 1.5631 1.5631 1.9096 1.9096 1.9097 1.9097 2.0443 2.0443 2.0443 2.0443 5.5584 5.5584 5.5585 5.5585 5.8750 5.8750 5.8752 5.8752 6.0275 6.0275 6.0277 6.0277 6.4939 6.4939 6.4939 6.4939 7.0840 7.0840 7.0842 7.0842 k = 0.2000 0.2916 0.2626 ( 5468 PWs) bands (ev): -65.8240 -65.8240 -65.8238 -65.8238 -37.8958 -37.8958 -37.8956 -37.8956 -36.9187 -36.9187 -36.9185 -36.9185 -36.7998 -36.7998 -36.7996 -36.7996 -10.5242 -10.5242 -10.5241 -10.5241 -10.2575 -10.2575 -10.2575 -10.2575 -0.1435 -0.1435 -0.1435 -0.1435 0.5069 0.5069 0.5069 0.5069 1.2777 1.2777 1.2778 1.2778 1.5488 1.5488 1.5488 1.5488 1.9336 1.9336 1.9336 1.9336 2.0268 2.0268 2.0269 2.0269 5.5335 5.5335 5.5336 5.5336 5.8724 5.8724 5.8726 5.8726 6.0432 6.0432 6.0434 6.0434 6.4882 6.4882 6.4883 6.4883 7.0884 7.0884 7.0887 7.0887 k = 0.1889 0.2916 0.2626 ( 5468 PWs) bands (ev): -65.8241 -65.8241 -65.8238 -65.8238 -37.8956 -37.8956 -37.8954 -37.8954 -36.9185 -36.9185 -36.9183 -36.9183 -36.7995 -36.7995 -36.7994 -36.7994 -10.5374 -10.5374 -10.5373 -10.5373 -10.2617 -10.2617 -10.2616 -10.2616 -0.1549 -0.1549 -0.1549 -0.1549 0.5326 0.5326 0.5327 0.5327 1.3438 1.3438 1.3439 1.3439 1.5334 1.5334 1.5335 1.5335 1.9567 1.9567 1.9567 1.9567 2.0103 2.0103 2.0103 2.0103 5.5083 5.5083 5.5084 5.5084 5.8701 5.8701 5.8703 5.8703 6.0580 6.0580 6.0582 6.0582 6.4822 6.4822 6.4823 6.4823 7.0955 7.0955 7.0957 7.0957 k = 0.1778 0.2916 0.2626 ( 5472 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8955 -37.8955 -37.8953 -37.8953 -36.9183 -36.9183 -36.9182 -36.9182 -36.7993 -36.7993 -36.7991 -36.7991 -10.5501 -10.5501 -10.5500 -10.5500 -10.2657 -10.2657 -10.2657 -10.2657 -0.1671 -0.1671 -0.1671 -0.1671 0.5592 0.5592 0.5592 0.5592 1.4095 1.4095 1.4097 1.4097 1.5185 1.5185 1.5185 1.5185 1.9768 1.9768 1.9768 1.9768 1.9966 1.9966 1.9966 1.9966 5.4828 5.4828 5.4829 5.4829 5.8681 5.8681 5.8683 5.8683 6.0717 6.0717 6.0719 6.0719 6.4759 6.4759 6.4760 6.4760 7.1049 7.1049 7.1051 7.1051 k = 0.1667 0.2916 0.2626 ( 5464 PWs) bands (ev): -65.8241 -65.8241 -65.8239 -65.8239 -37.8953 -37.8953 -37.8951 -37.8951 -36.9182 -36.9182 -36.9180 -36.9180 -36.7991 -36.7991 -36.7989 -36.7989 -10.5623 -10.5623 -10.5622 -10.5622 -10.2696 -10.2696 -10.2695 -10.2695 -0.1799 -0.1799 -0.1799 -0.1799 0.5865 0.5865 0.5866 0.5866 1.4641 1.4641 1.4642 1.4642 1.5144 1.5144 1.5145 1.5145 1.9748 1.9748 1.9749 1.9749 2.0044 2.0044 2.0045 2.0045 5.4571 5.4571 5.4572 5.4572 5.8665 5.8665 5.8667 5.8667 6.0842 6.0842 6.0844 6.0844 6.4695 6.4695 6.4696 6.4696 7.1167 7.1167 7.1169 7.1169 k = 0.1556 0.2916 0.2626 ( 5472 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8952 -37.8952 -37.8950 -37.8950 -36.9180 -36.9180 -36.9178 -36.9178 -36.7989 -36.7989 -36.7987 -36.7987 -10.5740 -10.5740 -10.5739 -10.5739 -10.2733 -10.2733 -10.2733 -10.2733 -0.1929 -0.1929 -0.1929 -0.1929 0.6145 0.6145 0.6145 0.6145 1.4672 1.4672 1.4672 1.4672 1.5606 1.5606 1.5608 1.5608 1.9612 1.9612 1.9613 1.9613 2.0236 2.0236 2.0236 2.0236 5.4314 5.4314 5.4315 5.4315 5.8651 5.8651 5.8653 5.8653 6.0954 6.0954 6.0955 6.0955 6.4632 6.4632 6.4633 6.4633 7.1305 7.1305 7.1307 7.1307 k = 0.1444 0.2916 0.2626 ( 5464 PWs) bands (ev): -65.8242 -65.8242 -65.8239 -65.8239 -37.8951 -37.8951 -37.8949 -37.8949 -36.9178 -36.9178 -36.9177 -36.9177 -36.7986 -36.7986 -36.7985 -36.7985 -10.5851 -10.5851 -10.5850 -10.5850 -10.2769 -10.2769 -10.2768 -10.2768 -0.2059 -0.2059 -0.2059 -0.2059 0.6430 0.6430 0.6431 0.6431 1.4501 1.4501 1.4502 1.4502 1.6254 1.6254 1.6255 1.6255 1.9476 1.9476 1.9477 1.9477 2.0424 2.0424 2.0424 2.0424 5.4057 5.4057 5.4058 5.4058 5.8640 5.8640 5.8642 5.8642 6.1051 6.1051 6.1052 6.1052 6.4572 6.4572 6.4573 6.4573 7.1463 7.1463 7.1465 7.1465 k = 0.1333 0.2916 0.2626 ( 5456 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8949 -37.8949 -37.8947 -37.8947 -36.9177 -36.9177 -36.9175 -36.9175 -36.7984 -36.7984 -36.7983 -36.7983 -10.5956 -10.5956 -10.5955 -10.5955 -10.2803 -10.2803 -10.2802 -10.2802 -0.2187 -0.2187 -0.2187 -0.2187 0.6721 0.6721 0.6721 0.6721 1.4300 1.4300 1.4301 1.4301 1.6909 1.6909 1.6911 1.6911 1.9349 1.9349 1.9349 1.9349 2.0600 2.0600 2.0600 2.0600 5.3803 5.3803 5.3804 5.3804 5.8632 5.8632 5.8634 5.8634 6.1133 6.1133 6.1134 6.1134 6.4516 6.4516 6.4517 6.4517 7.1635 7.1635 7.1637 7.1637 k = 0.1222 0.2916 0.2626 ( 5440 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8948 -37.8948 -37.8946 -37.8946 -36.9175 -36.9175 -36.9173 -36.9173 -36.7982 -36.7982 -36.7981 -36.7981 -10.6054 -10.6054 -10.6053 -10.6053 -10.2834 -10.2834 -10.2833 -10.2833 -0.2310 -0.2310 -0.2310 -0.2310 0.7014 0.7014 0.7015 0.7015 1.4086 1.4086 1.4086 1.4086 1.7546 1.7546 1.7547 1.7547 1.9233 1.9233 1.9234 1.9234 2.0764 2.0764 2.0764 2.0764 5.3553 5.3553 5.3554 5.3554 5.8626 5.8626 5.8628 5.8628 6.1200 6.1200 6.1201 6.1201 6.4467 6.4467 6.4467 6.4467 7.1820 7.1820 7.1822 7.1822 k = 0.1111 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8242 -65.8242 -65.8240 -65.8240 -37.8946 -37.8946 -37.8945 -37.8945 -36.9174 -36.9174 -36.9172 -36.9172 -36.7980 -36.7980 -36.7979 -36.7979 -10.6145 -10.6145 -10.6144 -10.6144 -10.2863 -10.2863 -10.2863 -10.2863 -0.2428 -0.2428 -0.2427 -0.2427 0.7310 0.7310 0.7310 0.7310 1.3863 1.3863 1.3864 1.3864 1.8145 1.8145 1.8146 1.8146 1.9139 1.9139 1.9139 1.9139 2.0916 2.0916 2.0916 2.0916 5.3308 5.3308 5.3309 5.3309 5.8622 5.8622 5.8624 5.8624 6.1252 6.1252 6.1254 6.1254 6.4423 6.4423 6.4424 6.4424 7.2013 7.2013 7.2015 7.2015 k = 0.1000 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8946 -37.8946 -37.8944 -37.8944 -36.9173 -36.9173 -36.9171 -36.9171 -36.7979 -36.7979 -36.7977 -36.7977 -10.6228 -10.6228 -10.6227 -10.6227 -10.2890 -10.2890 -10.2890 -10.2890 -0.2538 -0.2538 -0.2537 -0.2537 0.7605 0.7605 0.7606 0.7606 1.3634 1.3634 1.3635 1.3635 1.8646 1.8646 1.8647 1.8647 1.9115 1.9115 1.9115 1.9115 2.1058 2.1058 2.1058 2.1058 5.3073 5.3073 5.3074 5.3074 5.8619 5.8619 5.8622 5.8622 6.1291 6.1291 6.1292 6.1292 6.4387 6.4387 6.4388 6.4388 7.2209 7.2209 7.2211 7.2211 k = 0.0889 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8243 -65.8243 -65.8240 -65.8240 -37.8945 -37.8945 -37.8943 -37.8943 -36.9172 -36.9172 -36.9170 -36.9170 -36.7978 -36.7978 -36.7976 -36.7976 -10.6303 -10.6303 -10.6303 -10.6303 -10.2915 -10.2915 -10.2914 -10.2914 -0.2639 -0.2639 -0.2639 -0.2639 0.7900 0.7900 0.7900 0.7900 1.3401 1.3401 1.3402 1.3402 1.8807 1.8807 1.8808 1.8808 1.9397 1.9397 1.9398 1.9398 2.1192 2.1192 2.1192 2.1192 5.2849 5.2849 5.2850 5.2850 5.8619 5.8619 5.8621 5.8621 6.1317 6.1317 6.1318 6.1318 6.4358 6.4358 6.4359 6.4359 7.2403 7.2403 7.2405 7.2405 k = 0.0778 0.2916 0.2626 ( 5428 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8944 -37.8944 -37.8942 -37.8942 -36.9171 -36.9171 -36.9169 -36.9169 -36.7976 -36.7976 -36.7975 -36.7975 -10.6371 -10.6371 -10.6370 -10.6370 -10.2937 -10.2937 -10.2936 -10.2936 -0.2731 -0.2731 -0.2730 -0.2730 0.8189 0.8189 0.8190 0.8190 1.3166 1.3166 1.3167 1.3167 1.8767 1.8767 1.8767 1.8767 1.9835 1.9835 1.9836 1.9836 2.1322 2.1322 2.1322 2.1322 5.2639 5.2639 5.2641 5.2641 5.8619 5.8619 5.8621 5.8621 6.1333 6.1333 6.1334 6.1334 6.4336 6.4336 6.4336 6.4336 7.2591 7.2591 7.2593 7.2593 k = 0.0667 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8943 -37.8943 -37.8941 -37.8941 -36.9170 -36.9170 -36.9168 -36.9168 -36.7975 -36.7975 -36.7973 -36.7973 -10.6429 -10.6429 -10.6429 -10.6429 -10.2956 -10.2956 -10.2955 -10.2955 -0.2812 -0.2812 -0.2812 -0.2812 0.8471 0.8471 0.8472 0.8472 1.2933 1.2933 1.2934 1.2934 1.8707 1.8707 1.8707 1.8707 2.0235 2.0235 2.0236 2.0236 2.1454 2.1454 2.1454 2.1454 5.2448 5.2448 5.2449 5.2449 5.8620 5.8620 5.8622 5.8622 6.1340 6.1340 6.1342 6.1342 6.4319 6.4319 6.4320 6.4320 7.2768 7.2768 7.2770 7.2770 k = 0.0556 0.2916 0.2626 ( 5424 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8942 -37.8942 -37.8941 -37.8941 -36.9169 -36.9169 -36.9167 -36.9167 -36.7974 -36.7974 -36.7972 -36.7972 -10.6480 -10.6480 -10.6479 -10.6479 -10.2972 -10.2972 -10.2971 -10.2971 -0.2882 -0.2882 -0.2881 -0.2881 0.8741 0.8741 0.8742 0.8742 1.2705 1.2705 1.2706 1.2706 1.8650 1.8650 1.8650 1.8650 2.0562 2.0562 2.0564 2.0564 2.1594 2.1594 2.1595 2.1595 5.2278 5.2278 5.2280 5.2280 5.8621 5.8621 5.8624 5.8624 6.1342 6.1342 6.1343 6.1343 6.4308 6.4308 6.4309 6.4309 7.2927 7.2927 7.2929 7.2929 k = 0.0444 0.2916 0.2626 ( 5432 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7972 -36.7972 -10.6521 -10.6521 -10.6520 -10.6520 -10.2986 -10.2986 -10.2985 -10.2985 -0.2940 -0.2940 -0.2939 -0.2939 0.8992 0.8992 0.8992 0.8992 1.2489 1.2489 1.2491 1.2491 1.8602 1.8602 1.8602 1.8602 2.0806 2.0806 2.0807 2.0807 2.1743 2.1743 2.1743 2.1743 5.2134 5.2134 5.2135 5.2135 5.8623 5.8623 5.8625 5.8625 6.1340 6.1340 6.1341 6.1341 6.4301 6.4301 6.4302 6.4302 7.3066 7.3066 7.3068 7.3068 k = 0.0333 0.2916 0.2626 ( 5420 PWs) bands (ev): -65.8243 -65.8243 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6553 -10.6553 -10.6552 -10.6552 -10.2996 -10.2996 -10.2995 -10.2995 -0.2986 -0.2986 -0.2985 -0.2985 0.9214 0.9214 0.9214 0.9214 1.2295 1.2295 1.2296 1.2296 1.8564 1.8564 1.8564 1.8564 2.0971 2.0971 2.0972 2.0972 2.1889 2.1889 2.1890 2.1890 5.2018 5.2018 5.2019 5.2019 5.8625 5.8625 5.8627 5.8627 6.1336 6.1336 6.1337 6.1337 6.4297 6.4297 6.4298 6.4298 7.3179 7.3179 7.3181 7.3181 k = 0.0222 0.2916 0.2626 ( 5428 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6576 -10.6576 -10.6576 -10.6576 -10.3004 -10.3004 -10.3003 -10.3003 -0.3018 -0.3018 -0.3018 -0.3018 0.9394 0.9394 0.9394 0.9394 1.2135 1.2135 1.2136 1.2136 1.8536 1.8536 1.8536 1.8536 2.1074 2.1074 2.1074 2.1074 2.2013 2.2013 2.2013 2.2013 5.1932 5.1932 5.1933 5.1933 5.8626 5.8626 5.8628 5.8628 6.1331 6.1331 6.1332 6.1332 6.4294 6.4294 6.4295 6.4295 7.3262 7.3262 7.3264 7.3264 k = 0.0111 0.2916 0.2626 ( 5428 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6590 -10.6590 -10.6590 -10.6590 -10.3008 -10.3008 -10.3008 -10.3008 -0.3038 -0.3038 -0.3038 -0.3038 0.9513 0.9513 0.9513 0.9513 1.2028 1.2028 1.2029 1.2029 1.8519 1.8519 1.8520 1.8520 2.1129 2.1129 2.1129 2.1129 2.2094 2.2094 2.2095 2.2095 5.1880 5.1880 5.1881 5.1881 5.8626 5.8626 5.8629 5.8629 6.1328 6.1328 6.1329 6.1329 6.4293 6.4293 6.4294 6.4294 7.3313 7.3313 7.3315 7.3315 k = 0.0000 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6595 -10.6595 -10.6594 -10.6594 -10.3010 -10.3010 -10.3009 -10.3009 -0.3045 -0.3045 -0.3044 -0.3044 0.9555 0.9555 0.9555 0.9555 1.1990 1.1990 1.1991 1.1991 1.8514 1.8514 1.8514 1.8514 2.1146 2.1146 2.1147 2.1147 2.2123 2.2123 2.2124 2.2124 5.1863 5.1863 5.1864 5.1864 5.8627 5.8627 5.8629 5.8629 6.1327 6.1327 6.1328 6.1328 6.4293 6.4293 6.4294 6.4294 7.3330 7.3330 7.3332 7.3332 k = 0.0000 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6595 -10.6595 -10.6594 -10.6594 -10.3010 -10.3010 -10.3009 -10.3009 -0.3045 -0.3045 -0.3044 -0.3044 0.9555 0.9555 0.9555 0.9555 1.1990 1.1990 1.1991 1.1991 1.8514 1.8514 1.8514 1.8514 2.1146 2.1146 2.1147 2.1147 2.2123 2.2123 2.2124 2.2124 5.1863 5.1863 5.1864 5.1864 5.8627 5.8627 5.8629 5.8629 6.1327 6.1327 6.1328 6.1328 6.4293 6.4293 6.4294 6.4294 7.3330 7.3330 7.3332 7.3332 k = 0.0000 0.2808 0.2626 ( 5428 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6599 -10.6599 -10.6598 -10.6598 -10.3006 -10.3006 -10.3005 -10.3005 -0.3048 -0.3048 -0.3047 -0.3047 0.9567 0.9567 0.9567 0.9567 1.1990 1.1990 1.1992 1.1992 1.8478 1.8478 1.8479 1.8479 2.1162 2.1162 2.1163 2.1163 2.2128 2.2128 2.2129 2.2129 5.1868 5.1868 5.1870 5.1870 5.8628 5.8628 5.8631 5.8631 6.1329 6.1329 6.1331 6.1331 6.4290 6.4290 6.4291 6.4291 7.3329 7.3329 7.3331 7.3331 k = 0.0000 0.2700 0.2626 ( 5428 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6609 -10.6609 -10.6608 -10.6608 -10.2994 -10.2994 -10.2993 -10.2993 -0.3055 -0.3055 -0.3055 -0.3055 0.9601 0.9601 0.9601 0.9601 1.1993 1.1993 1.1994 1.1994 1.8377 1.8377 1.8377 1.8377 2.1206 2.1206 2.1206 2.1206 2.2143 2.2143 2.2144 2.2144 5.1885 5.1885 5.1887 5.1887 5.8634 5.8634 5.8636 5.8636 6.1337 6.1337 6.1338 6.1338 6.4283 6.4283 6.4284 6.4284 7.3327 7.3327 7.3329 7.3329 k = 0.0000 0.2592 0.2626 ( 5422 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6627 -10.6627 -10.6626 -10.6626 -10.2974 -10.2974 -10.2973 -10.2973 -0.3068 -0.3068 -0.3068 -0.3068 0.9657 0.9657 0.9657 0.9657 1.1996 1.1996 1.1998 1.1998 1.8218 1.8218 1.8219 1.8219 2.1266 2.1266 2.1267 2.1267 2.2171 2.2171 2.2172 2.2172 5.1914 5.1914 5.1915 5.1915 5.8642 5.8642 5.8644 5.8644 6.1349 6.1349 6.1350 6.1350 6.4270 6.4270 6.4271 6.4271 7.3323 7.3323 7.3325 7.3325 k = 0.0000 0.2484 0.2626 ( 5438 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6651 -10.6651 -10.6650 -10.6650 -10.2947 -10.2947 -10.2947 -10.2947 -0.3086 -0.3086 -0.3085 -0.3085 0.9735 0.9735 0.9735 0.9735 1.2002 1.2002 1.2003 1.2003 1.8016 1.8016 1.8016 1.8016 2.1331 2.1331 2.1332 2.1332 2.2211 2.2211 2.2211 2.2211 5.1952 5.1952 5.1953 5.1953 5.8654 5.8654 5.8656 5.8656 6.1365 6.1365 6.1366 6.1366 6.4253 6.4253 6.4254 6.4254 7.3317 7.3317 7.3319 7.3319 k = 0.0000 0.2376 0.2626 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6680 -10.6680 -10.6679 -10.6679 -10.2914 -10.2914 -10.2913 -10.2913 -0.3108 -0.3108 -0.3107 -0.3107 0.9833 0.9833 0.9833 0.9833 1.2008 1.2008 1.2009 1.2009 1.7780 1.7780 1.7780 1.7780 2.1390 2.1390 2.1391 2.1391 2.2264 2.2264 2.2264 2.2264 5.2000 5.2000 5.2001 5.2001 5.8669 5.8669 5.8671 5.8671 6.1386 6.1386 6.1387 6.1387 6.4232 6.4232 6.4233 6.4233 7.3310 7.3310 7.3312 7.3312 k = 0.0000 0.2268 0.2626 ( 5432 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6715 -10.6715 -10.6714 -10.6714 -10.2875 -10.2875 -10.2874 -10.2874 -0.3133 -0.3133 -0.3132 -0.3132 0.9951 0.9951 0.9951 0.9951 1.2016 1.2016 1.2017 1.2017 1.7520 1.7520 1.7520 1.7520 2.1437 2.1437 2.1438 2.1438 2.2328 2.2328 2.2328 2.2328 5.2057 5.2057 5.2059 5.2059 5.8686 5.8686 5.8689 5.8689 6.1411 6.1411 6.1412 6.1412 6.4209 6.4209 6.4210 6.4210 7.3301 7.3301 7.3304 7.3304 k = 0.0000 0.2160 0.2626 ( 5424 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6754 -10.6754 -10.6753 -10.6753 -10.2831 -10.2831 -10.2830 -10.2830 -0.3162 -0.3162 -0.3161 -0.3161 1.0086 1.0086 1.0086 1.0086 1.2025 1.2025 1.2026 1.2026 1.7244 1.7244 1.7244 1.7244 2.1469 2.1469 2.1471 2.1471 2.2399 2.2399 2.2399 2.2399 5.2123 5.2123 5.2124 5.2124 5.8707 5.8707 5.8709 5.8709 6.1439 6.1439 6.1440 6.1440 6.4184 6.4184 6.4185 6.4185 7.3292 7.3292 7.3294 7.3294 k = 0.0000 0.2052 0.2626 ( 5430 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6796 -10.6796 -10.6796 -10.6796 -10.2783 -10.2783 -10.2782 -10.2782 -0.3193 -0.3193 -0.3192 -0.3192 1.0238 1.0238 1.0238 1.0238 1.2035 1.2035 1.2036 1.2036 1.6957 1.6957 1.6958 1.6958 2.1489 2.1489 2.1490 2.1490 2.2471 2.2471 2.2472 2.2472 5.2195 5.2195 5.2197 5.2197 5.8729 5.8729 5.8731 5.8731 6.1469 6.1469 6.1470 6.1470 6.4158 6.4158 6.4158 6.4158 7.3281 7.3281 7.3283 7.3283 k = 0.0000 0.1944 0.2626 ( 5434 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6842 -10.6842 -10.6841 -10.6841 -10.2731 -10.2731 -10.2731 -10.2731 -0.3226 -0.3226 -0.3225 -0.3225 1.0404 1.0404 1.0404 1.0404 1.2046 1.2046 1.2047 1.2047 1.6666 1.6666 1.6666 1.6666 2.1497 2.1497 2.1498 2.1498 2.2541 2.2541 2.2541 2.2541 5.2273 5.2273 5.2275 5.2275 5.8754 5.8754 5.8756 5.8756 6.1501 6.1501 6.1503 6.1503 6.4132 6.4132 6.4132 6.4132 7.3269 7.3269 7.3271 7.3271 k = 0.0000 0.1836 0.2626 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6889 -10.6889 -10.6888 -10.6888 -10.2677 -10.2677 -10.2677 -10.2677 -0.3260 -0.3260 -0.3259 -0.3259 1.0583 1.0583 1.0583 1.0583 1.2058 1.2058 1.2059 1.2059 1.6374 1.6374 1.6374 1.6374 2.1496 2.1496 2.1498 2.1498 2.2603 2.2603 2.2604 2.2604 5.2356 5.2356 5.2357 5.2357 5.8780 5.8780 5.8782 5.8782 6.1535 6.1535 6.1536 6.1536 6.4107 6.4107 6.4108 6.4108 7.3255 7.3255 7.3258 7.3258 k = 0.0000 0.1728 0.2626 ( 5448 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6937 -10.6937 -10.6937 -10.6937 -10.2622 -10.2622 -10.2622 -10.2622 -0.3295 -0.3295 -0.3294 -0.3294 1.0771 1.0771 1.0771 1.0771 1.2071 1.2071 1.2072 1.2072 1.6084 1.6084 1.6084 1.6084 2.1489 2.1489 2.1491 2.1491 2.2656 2.2656 2.2656 2.2656 5.2441 5.2441 5.2443 5.2443 5.8808 5.8808 5.8810 5.8810 6.1568 6.1568 6.1569 6.1569 6.4085 6.4085 6.4086 6.4086 7.3242 7.3242 7.3244 7.3244 k = 0.0000 0.1620 0.2626 ( 5456 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7970 -36.7970 -10.6986 -10.6986 -10.6986 -10.6986 -10.2566 -10.2566 -10.2566 -10.2566 -0.3330 -0.3330 -0.3329 -0.3329 1.0966 1.0966 1.0966 1.0966 1.2084 1.2084 1.2085 1.2085 1.5800 1.5800 1.5800 1.5800 2.1477 2.1477 2.1479 2.1479 2.2696 2.2696 2.2696 2.2696 5.2529 5.2529 5.2530 5.2530 5.8837 5.8837 5.8839 5.8839 6.1600 6.1600 6.1601 6.1601 6.4068 6.4068 6.4068 6.4068 7.3228 7.3228 7.3230 7.3230 k = 0.0000 0.1512 0.2626 ( 5454 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7970 -36.7970 -10.7035 -10.7035 -10.7034 -10.7034 -10.2510 -10.2510 -10.2510 -10.2510 -0.3364 -0.3364 -0.3364 -0.3364 1.1166 1.1166 1.1166 1.1166 1.2099 1.2099 1.2100 1.2100 1.5525 1.5525 1.5526 1.5526 2.1462 2.1462 2.1463 2.1463 2.2723 2.2723 2.2723 2.2723 5.2617 5.2617 5.2618 5.2618 5.8867 5.8867 5.8869 5.8869 6.1630 6.1630 6.1632 6.1632 6.4055 6.4055 6.4056 6.4056 7.3213 7.3213 7.3215 7.3215 k = 0.0000 0.1404 0.2626 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7083 -10.7083 -10.7082 -10.7082 -10.2455 -10.2455 -10.2455 -10.2455 -0.3398 -0.3398 -0.3397 -0.3397 1.1366 1.1366 1.1366 1.1366 1.2114 1.2114 1.2116 1.2116 1.5263 1.5263 1.5263 1.5263 2.1443 2.1443 2.1445 2.1445 2.2737 2.2737 2.2737 2.2737 5.2704 5.2704 5.2705 5.2705 5.8896 5.8896 5.8899 5.8899 6.1658 6.1658 6.1659 6.1659 6.4048 6.4048 6.4049 6.4049 7.3199 7.3199 7.3201 7.3201 k = 0.0000 0.1296 0.2626 ( 5458 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7970 -36.7970 -10.7129 -10.7129 -10.7128 -10.7128 -10.2401 -10.2401 -10.2401 -10.2401 -0.3430 -0.3430 -0.3429 -0.3429 1.1562 1.1562 1.1562 1.1562 1.2133 1.2133 1.2134 1.2134 1.5016 1.5016 1.5016 1.5016 2.1423 2.1423 2.1424 2.1424 2.2738 2.2738 2.2738 2.2738 5.2789 5.2789 5.2790 5.2790 5.8926 5.8926 5.8929 5.8929 6.1681 6.1681 6.1683 6.1683 6.4048 6.4048 6.4049 6.4049 7.3184 7.3184 7.3186 7.3186 k = 0.0000 0.1188 0.2626 ( 5452 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.7173 -10.7173 -10.7173 -10.7173 -10.2350 -10.2350 -10.2349 -10.2349 -0.3460 -0.3460 -0.3459 -0.3459 1.1747 1.1747 1.1747 1.1747 1.2156 1.2156 1.2158 1.2158 1.4786 1.4786 1.4787 1.4787 2.1401 2.1401 2.1403 2.1403 2.2728 2.2728 2.2728 2.2728 5.2871 5.2871 5.2872 5.2872 5.8956 5.8956 5.8958 5.8958 6.1701 6.1701 6.1703 6.1703 6.4054 6.4054 6.4055 6.4055 7.3170 7.3170 7.3172 7.3172 k = 0.0000 0.1080 0.2626 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7215 -10.7215 -10.7215 -10.7215 -10.2301 -10.2301 -10.2300 -10.2300 -0.3488 -0.3488 -0.3487 -0.3487 1.1907 1.1907 1.1907 1.1907 1.2195 1.2195 1.2196 1.2196 1.4579 1.4579 1.4579 1.4579 2.1379 2.1379 2.1381 2.1381 2.2707 2.2707 2.2707 2.2707 5.2949 5.2949 5.2950 5.2950 5.8984 5.8984 5.8986 5.8986 6.1716 6.1716 6.1718 6.1718 6.4066 6.4066 6.4067 6.4067 7.3156 7.3156 7.3158 7.3158 k = 0.0000 0.0972 0.2626 ( 5460 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.7255 -10.7255 -10.7254 -10.7254 -10.2255 -10.2255 -10.2254 -10.2254 -0.3514 -0.3514 -0.3513 -0.3513 1.2017 1.2017 1.2018 1.2018 1.2268 1.2268 1.2269 1.2269 1.4397 1.4397 1.4397 1.4397 2.1357 2.1357 2.1359 2.1359 2.2678 2.2678 2.2678 2.2678 5.3022 5.3022 5.3023 5.3023 5.9011 5.9011 5.9013 5.9013 6.1727 6.1727 6.1729 6.1729 6.4084 6.4084 6.4085 6.4085 7.3143 7.3143 7.3145 7.3145 k = 0.0000 0.0864 0.2626 ( 5472 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7291 -10.7291 -10.7290 -10.7290 -10.2213 -10.2213 -10.2212 -10.2212 -0.3537 -0.3537 -0.3537 -0.3537 1.2072 1.2072 1.2072 1.2072 1.2375 1.2375 1.2376 1.2376 1.4243 1.4243 1.4243 1.4243 2.1336 2.1336 2.1337 2.1337 2.2642 2.2642 2.2642 2.2642 5.3088 5.3088 5.3090 5.3090 5.9035 5.9035 5.9038 5.9038 6.1734 6.1734 6.1735 6.1735 6.4105 6.4105 6.4106 6.4106 7.3130 7.3130 7.3133 7.3133 k = 0.0000 0.0756 0.2626 ( 5476 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7323 -10.7323 -10.7323 -10.7323 -10.2175 -10.2175 -10.2174 -10.2174 -0.3558 -0.3558 -0.3557 -0.3557 1.2097 1.2097 1.2098 1.2098 1.2486 1.2486 1.2486 1.2486 1.4122 1.4122 1.4123 1.4123 2.1315 2.1315 2.1317 2.1317 2.2603 2.2603 2.2603 2.2603 5.3149 5.3149 5.3150 5.3150 5.9058 5.9058 5.9061 5.9061 6.1737 6.1737 6.1739 6.1739 6.4130 6.4130 6.4131 6.4131 7.3119 7.3119 7.3121 7.3121 k = 0.0000 0.0648 0.2626 ( 5472 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7352 -10.7352 -10.7351 -10.7351 -10.2141 -10.2141 -10.2140 -10.2140 -0.3576 -0.3576 -0.3576 -0.3576 1.2109 1.2109 1.2110 1.2110 1.2579 1.2579 1.2579 1.2579 1.4037 1.4037 1.4037 1.4037 2.1296 2.1296 2.1297 2.1297 2.2562 2.2562 2.2562 2.2562 5.3202 5.3202 5.3204 5.3204 5.9079 5.9079 5.9081 5.9081 6.1738 6.1738 6.1740 6.1740 6.4156 6.4156 6.4157 6.4157 7.3109 7.3109 7.3111 7.3111 k = 0.0000 0.0540 0.2626 ( 5480 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7377 -10.7377 -10.7376 -10.7376 -10.2112 -10.2112 -10.2111 -10.2111 -0.3592 -0.3592 -0.3591 -0.3591 1.2115 1.2115 1.2116 1.2116 1.2645 1.2645 1.2645 1.2645 1.3986 1.3986 1.3986 1.3986 2.1279 2.1279 2.1280 2.1280 2.2521 2.2521 2.2522 2.2522 5.3248 5.3248 5.3249 5.3249 5.9097 5.9097 5.9099 5.9099 6.1737 6.1737 6.1739 6.1739 6.4182 6.4182 6.4183 6.4183 7.3100 7.3100 7.3102 7.3102 k = 0.0000 0.0432 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7397 -10.7397 -10.7397 -10.7397 -10.2088 -10.2088 -10.2087 -10.2087 -0.3604 -0.3604 -0.3604 -0.3604 1.2118 1.2118 1.2119 1.2119 1.2686 1.2686 1.2686 1.2686 1.3964 1.3964 1.3964 1.3964 2.1264 2.1264 2.1265 2.1265 2.2485 2.2485 2.2485 2.2485 5.3286 5.3286 5.3287 5.3287 5.9112 5.9112 5.9114 5.9114 6.1734 6.1734 6.1736 6.1736 6.4205 6.4205 6.4206 6.4206 7.3092 7.3092 7.3095 7.3095 k = 0.0000 0.0324 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7413 -10.7413 -10.7413 -10.7413 -10.2068 -10.2068 -10.2068 -10.2068 -0.3614 -0.3614 -0.3613 -0.3613 1.2118 1.2118 1.2119 1.2119 1.2706 1.2706 1.2707 1.2707 1.3962 1.3962 1.3962 1.3962 2.1251 2.1251 2.1253 2.1253 2.2453 2.2453 2.2454 2.2454 5.3316 5.3316 5.3317 5.3317 5.9124 5.9124 5.9126 5.9126 6.1732 6.1732 6.1734 6.1734 6.4225 6.4225 6.4226 6.4226 7.3087 7.3087 7.3089 7.3089 k = 0.0000 0.0216 0.2626 ( 5494 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7425 -10.7425 -10.7424 -10.7424 -10.2055 -10.2055 -10.2054 -10.2054 -0.3621 -0.3621 -0.3620 -0.3620 1.2117 1.2117 1.2118 1.2118 1.2714 1.2714 1.2715 1.2715 1.3969 1.3969 1.3970 1.3970 2.1242 2.1242 2.1244 2.1244 2.2430 2.2430 2.2430 2.2430 5.3337 5.3337 5.3338 5.3338 5.9132 5.9132 5.9135 5.9135 6.1730 6.1730 6.1732 6.1732 6.4240 6.4240 6.4241 6.4241 7.3082 7.3082 7.3084 7.3084 k = 0.0000 0.0108 0.2626 ( 5492 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7432 -10.7432 -10.7431 -10.7431 -10.2047 -10.2047 -10.2046 -10.2046 -0.3625 -0.3625 -0.3624 -0.3624 1.2117 1.2117 1.2118 1.2118 1.2716 1.2716 1.2717 1.2717 1.3978 1.3978 1.3978 1.3978 2.1237 2.1237 2.1238 2.1238 2.2415 2.2415 2.2415 2.2415 5.3350 5.3350 5.3351 5.3351 5.9138 5.9138 5.9140 5.9140 6.1728 6.1728 6.1730 6.1730 6.4249 6.4249 6.4251 6.4251 7.3080 7.3080 7.3082 7.3082 k = 0.0000 0.0000 0.2626 ( 5488 PWs) bands (ev): -65.8244 -65.8244 -65.8242 -65.8242 -37.8942 -37.8942 -37.8940 -37.8940 -36.9169 -36.9169 -36.9167 -36.9167 -36.7973 -36.7973 -36.7971 -36.7971 -10.7434 -10.7434 -10.7434 -10.7434 -10.2044 -10.2044 -10.2043 -10.2043 -0.3626 -0.3626 -0.3626 -0.3626 1.2116 1.2116 1.2117 1.2117 1.2717 1.2717 1.2717 1.2717 1.3981 1.3981 1.3981 1.3981 2.1235 2.1235 2.1236 2.1236 2.2410 2.2410 2.2410 2.2410 5.3354 5.3354 5.3356 5.3356 5.9139 5.9139 5.9142 5.9142 6.1728 6.1728 6.1730 6.1730 6.4253 6.4253 6.4254 6.4254 7.3079 7.3079 7.3081 7.3081 k = 0.0000 0.2916-0.0000 ( 5462 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9167 -36.9167 -36.7972 -36.7972 -36.7971 -36.7971 -10.7007 -10.7007 -10.7007 -10.7007 -10.2522 -10.2522 -10.2522 -10.2522 -0.4803 -0.4803 -0.4802 -0.4802 1.1485 1.1485 1.1485 1.1485 1.2023 1.2023 1.2024 1.2024 1.6227 1.6227 1.6227 1.6227 2.1816 2.1816 2.1817 2.1817 2.3849 2.3849 2.3849 2.3849 5.3278 5.3278 5.3280 5.3280 5.9070 5.9070 5.9072 5.9072 6.1860 6.1860 6.1862 6.1862 6.4736 6.4736 6.4737 6.4737 7.2810 7.2810 7.2812 7.2812 k = 0.0000 0.2916 0.0109 ( 5446 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.7006 -10.7006 -10.7005 -10.7005 -10.2524 -10.2524 -10.2524 -10.2524 -0.4796 -0.4796 -0.4795 -0.4795 1.1476 1.1476 1.1477 1.1477 1.2021 1.2021 1.2022 1.2022 1.6238 1.6238 1.6238 1.6238 2.1815 2.1815 2.1817 2.1817 2.3840 2.3840 2.3840 2.3840 5.3274 5.3274 5.3275 5.3275 5.9068 5.9068 5.9070 5.9070 6.1858 6.1858 6.1860 6.1860 6.4732 6.4732 6.4733 6.4733 7.2812 7.2812 7.2814 7.2814 k = 0.0000 0.2916 0.0219 ( 5454 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.7001 -10.7001 -10.7001 -10.7001 -10.2530 -10.2530 -10.2530 -10.2530 -0.4776 -0.4776 -0.4775 -0.4775 1.1450 1.1450 1.1451 1.1451 1.2017 1.2017 1.2018 1.2018 1.6272 1.6272 1.6272 1.6272 2.1814 2.1814 2.1816 2.1816 2.3813 2.3813 2.3813 2.3813 5.3257 5.3257 5.3259 5.3259 5.9062 5.9062 5.9064 5.9064 6.1853 6.1853 6.1854 6.1854 6.4720 6.4720 6.4721 6.4721 7.2819 7.2819 7.2821 7.2821 k = 0.0000 0.2916 0.0328 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6993 -10.6993 -10.6993 -10.6993 -10.2539 -10.2539 -10.2539 -10.2539 -0.4743 -0.4743 -0.4742 -0.4742 1.1408 1.1408 1.1408 1.1408 1.2011 1.2011 1.2012 1.2012 1.6326 1.6326 1.6326 1.6326 2.1812 2.1812 2.1814 2.1814 2.3769 2.3769 2.3769 2.3769 5.3231 5.3231 5.3233 5.3233 5.9052 5.9052 5.9055 5.9055 6.1843 6.1843 6.1845 6.1845 6.4700 6.4700 6.4702 6.4702 7.2830 7.2830 7.2832 7.2832 k = 0.0000 0.2916 0.0438 ( 5454 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6983 -10.6983 -10.6982 -10.6982 -10.2552 -10.2552 -10.2552 -10.2552 -0.4697 -0.4697 -0.4696 -0.4696 1.1348 1.1348 1.1348 1.1348 1.2004 1.2004 1.2005 1.2005 1.6399 1.6399 1.6399 1.6399 2.1810 2.1810 2.1811 2.1811 2.3708 2.3708 2.3708 2.3708 5.3195 5.3195 5.3196 5.3196 5.9039 5.9039 5.9041 5.9041 6.1830 6.1830 6.1832 6.1832 6.4675 6.4675 6.4676 6.4676 7.2846 7.2846 7.2848 7.2848 k = 0.0000 0.2916 0.0547 ( 5446 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6969 -10.6969 -10.6968 -10.6968 -10.2569 -10.2569 -10.2568 -10.2568 -0.4639 -0.4639 -0.4638 -0.4638 1.1273 1.1273 1.1273 1.1273 1.1998 1.1998 1.1999 1.1999 1.6489 1.6489 1.6489 1.6489 2.1806 2.1806 2.1807 2.1807 2.3632 2.3632 2.3632 2.3632 5.3148 5.3148 5.3150 5.3150 5.9022 5.9022 5.9025 5.9025 6.1814 6.1814 6.1815 6.1815 6.4645 6.4645 6.4646 6.4646 7.2865 7.2865 7.2867 7.2867 k = 0.0000 0.2916 0.0656 ( 5448 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6953 -10.6953 -10.6952 -10.6952 -10.2588 -10.2588 -10.2588 -10.2588 -0.4569 -0.4569 -0.4569 -0.4569 1.1185 1.1185 1.1185 1.1185 1.1992 1.1992 1.1994 1.1994 1.6593 1.6593 1.6594 1.6594 2.1801 2.1801 2.1802 2.1802 2.3541 2.3541 2.3541 2.3541 5.3093 5.3093 5.3094 5.3094 5.9003 5.9003 5.9005 5.9005 6.1793 6.1793 6.1795 6.1795 6.4611 6.4611 6.4612 6.4612 7.2888 7.2888 7.2890 7.2890 k = 0.0000 0.2916 0.0766 ( 5448 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6934 -10.6934 -10.6933 -10.6933 -10.2611 -10.2611 -10.2610 -10.2610 -0.4489 -0.4489 -0.4489 -0.4489 1.1084 1.1084 1.1085 1.1085 1.1988 1.1988 1.1989 1.1989 1.6710 1.6710 1.6710 1.6710 2.1795 2.1795 2.1796 2.1796 2.3438 2.3438 2.3438 2.3438 5.3028 5.3028 5.3030 5.3030 5.8980 5.8980 5.8983 5.8983 6.1769 6.1769 6.1770 6.1770 6.4574 6.4574 6.4575 6.4575 7.2914 7.2914 7.2917 7.2917 k = 0.0000 0.2916 0.0875 ( 5456 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8942 -37.8942 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6913 -10.6913 -10.6912 -10.6912 -10.2636 -10.2636 -10.2635 -10.2635 -0.4400 -0.4400 -0.4399 -0.4399 1.0975 1.0975 1.0975 1.0975 1.1985 1.1985 1.1986 1.1986 1.6836 1.6836 1.6836 1.6836 2.1786 2.1786 2.1788 2.1788 2.3324 2.3324 2.3324 2.3324 5.2956 5.2956 5.2957 5.2957 5.8956 5.8956 5.8958 5.8958 6.1741 6.1741 6.1743 6.1743 6.4537 6.4537 6.4538 6.4538 7.2943 7.2943 7.2945 7.2945 k = 0.0000 0.2916 0.0985 ( 5448 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6890 -10.6890 -10.6889 -10.6889 -10.2663 -10.2663 -10.2662 -10.2662 -0.4302 -0.4302 -0.4302 -0.4302 1.0858 1.0858 1.0859 1.0859 1.1983 1.1983 1.1984 1.1984 1.6969 1.6969 1.6969 1.6969 2.1776 2.1776 2.1778 2.1778 2.3202 2.3202 2.3202 2.3202 5.2877 5.2877 5.2879 5.2879 5.8929 5.8929 5.8932 5.8932 6.1711 6.1711 6.1713 6.1713 6.4502 6.4502 6.4502 6.4502 7.2974 7.2974 7.2976 7.2976 k = 0.0000 0.2916 0.1094 ( 5440 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6866 -10.6866 -10.6865 -10.6865 -10.2692 -10.2692 -10.2691 -10.2691 -0.4198 -0.4198 -0.4197 -0.4197 1.0737 1.0737 1.0737 1.0737 1.1982 1.1982 1.1983 1.1983 1.7107 1.7107 1.7107 1.7107 2.1763 2.1763 2.1765 2.1765 2.3074 2.3074 2.3075 2.3075 5.2792 5.2792 5.2794 5.2794 5.8902 5.8902 5.8904 5.8904 6.1679 6.1679 6.1680 6.1680 6.4468 6.4468 6.4468 6.4468 7.3007 7.3007 7.3009 7.3009 k = 0.0000 0.2916 0.1204 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6840 -10.6840 -10.6839 -10.6839 -10.2722 -10.2722 -10.2722 -10.2722 -0.4089 -0.4089 -0.4088 -0.4088 1.0613 1.0613 1.0613 1.0613 1.1981 1.1981 1.1982 1.1982 1.7248 1.7248 1.7248 1.7248 2.1747 2.1747 2.1748 2.1748 2.2944 2.2944 2.2944 2.2944 5.2703 5.2703 5.2705 5.2705 5.8873 5.8873 5.8875 5.8875 6.1644 6.1644 6.1645 6.1645 6.4436 6.4436 6.4437 6.4437 7.3040 7.3040 7.3042 7.3042 k = 0.0000 0.2916 0.1313 ( 5450 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8940 -37.8940 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7971 -36.7971 -10.6813 -10.6813 -10.6813 -10.6813 -10.2754 -10.2754 -10.2753 -10.2753 -0.3975 -0.3975 -0.3975 -0.3975 1.0489 1.0489 1.0489 1.0489 1.1981 1.1981 1.1982 1.1982 1.7390 1.7390 1.7390 1.7390 2.1726 2.1726 2.1727 2.1727 2.2814 2.2814 2.2814 2.2814 5.2611 5.2611 5.2612 5.2612 5.8844 5.8844 5.8846 5.8846 6.1608 6.1608 6.1609 6.1609 6.4408 6.4408 6.4408 6.4408 7.3074 7.3074 7.3076 7.3076 k = 0.0000 0.2916 0.1422 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6786 -10.6786 -10.6786 -10.6786 -10.2786 -10.2786 -10.2785 -10.2785 -0.3861 -0.3861 -0.3860 -0.3860 1.0365 1.0365 1.0365 1.0365 1.1981 1.1981 1.1983 1.1983 1.7531 1.7531 1.7531 1.7531 2.1698 2.1698 2.1700 2.1700 2.2688 2.2688 2.2689 2.2689 5.2518 5.2518 5.2519 5.2519 5.8815 5.8815 5.8817 5.8817 6.1572 6.1572 6.1573 6.1573 6.4383 6.4383 6.4384 6.4384 7.3108 7.3108 7.3110 7.3110 k = 0.0000 0.2916 0.1532 ( 5434 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6760 -10.6760 -10.6759 -10.6759 -10.2817 -10.2817 -10.2817 -10.2817 -0.3746 -0.3746 -0.3745 -0.3745 1.0245 1.0245 1.0245 1.0245 1.1982 1.1982 1.1984 1.1984 1.7669 1.7669 1.7670 1.7670 2.1663 2.1663 2.1664 2.1664 2.2571 2.2571 2.2571 2.2571 5.2425 5.2425 5.2426 5.2426 5.8787 5.8787 5.8789 5.8789 6.1536 6.1536 6.1537 6.1537 6.4362 6.4362 6.4363 6.4363 7.3141 7.3141 7.3143 7.3143 k = 0.0000 0.2916 0.1641 ( 5430 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6733 -10.6733 -10.6733 -10.6733 -10.2848 -10.2848 -10.2848 -10.2848 -0.3634 -0.3634 -0.3633 -0.3633 1.0129 1.0129 1.0130 1.0130 1.1983 1.1983 1.1985 1.1985 1.7804 1.7804 1.7804 1.7804 2.1618 2.1618 2.1620 2.1620 2.2465 2.2465 2.2466 2.2466 5.2334 5.2334 5.2335 5.2335 5.8760 5.8760 5.8762 5.8762 6.1501 6.1501 6.1502 6.1502 6.4345 6.4345 6.4346 6.4346 7.3173 7.3173 7.3175 7.3175 k = 0.0000 0.2916 0.1751 ( 5426 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6708 -10.6708 -10.6707 -10.6707 -10.2878 -10.2878 -10.2878 -10.2878 -0.3525 -0.3525 -0.3525 -0.3525 1.0020 1.0020 1.0020 1.0020 1.1984 1.1984 1.1985 1.1985 1.7932 1.7932 1.7932 1.7932 2.1564 2.1564 2.1565 2.1565 2.2375 2.2375 2.2375 2.2375 5.2246 5.2246 5.2247 5.2247 5.8735 5.8735 5.8737 5.8737 6.1467 6.1467 6.1469 6.1469 6.4331 6.4331 6.4332 6.4332 7.3203 7.3203 7.3205 7.3205 k = 0.0000 0.2916 0.1860 ( 5424 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6684 -10.6684 -10.6683 -10.6683 -10.2906 -10.2906 -10.2905 -10.2905 -0.3424 -0.3424 -0.3423 -0.3423 0.9919 0.9919 0.9920 0.9920 1.1985 1.1985 1.1987 1.1987 1.8052 1.8052 1.8053 1.8053 2.1500 2.1500 2.1501 2.1501 2.2301 2.2301 2.2302 2.2302 5.2164 5.2164 5.2166 5.2166 5.8711 5.8711 5.8713 5.8713 6.1437 6.1437 6.1438 6.1438 6.4320 6.4320 6.4320 6.4320 7.3231 7.3231 7.3233 7.3233 k = 0.0000 0.2916 0.1969 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6662 -10.6662 -10.6661 -10.6661 -10.2932 -10.2932 -10.2931 -10.2931 -0.3330 -0.3330 -0.3330 -0.3330 0.9828 0.9828 0.9828 0.9828 1.1986 1.1986 1.1987 1.1987 1.8163 1.8163 1.8164 1.8164 2.1430 2.1430 2.1431 2.1431 2.2244 2.2244 2.2244 2.2244 5.2089 5.2089 5.2091 5.2091 5.8689 5.8689 5.8692 5.8692 6.1409 6.1409 6.1410 6.1410 6.4311 6.4311 6.4312 6.4312 7.3256 7.3256 7.3258 7.3258 k = 0.0000 0.2916 0.2079 ( 5430 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6643 -10.6643 -10.6642 -10.6642 -10.2954 -10.2954 -10.2954 -10.2954 -0.3247 -0.3247 -0.3247 -0.3247 0.9748 0.9748 0.9748 0.9748 1.1987 1.1987 1.1988 1.1988 1.8263 1.8263 1.8263 1.8263 2.1358 2.1358 2.1359 2.1359 2.2201 2.2201 2.2202 2.2202 5.2023 5.2023 5.2025 5.2025 5.8671 5.8671 5.8673 5.8673 6.1385 6.1385 6.1386 6.1386 6.4305 6.4305 6.4305 6.4305 7.3278 7.3278 7.3280 7.3280 k = 0.0000 0.2916 0.2188 ( 5438 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6626 -10.6626 -10.6625 -10.6625 -10.2974 -10.2974 -10.2973 -10.2973 -0.3177 -0.3177 -0.3176 -0.3176 0.9680 0.9680 0.9680 0.9680 1.1988 1.1988 1.1989 1.1989 1.8349 1.8349 1.8349 1.8349 2.1290 2.1290 2.1291 2.1291 2.2170 2.2170 2.2170 2.2170 5.1967 5.1967 5.1968 5.1968 5.8655 5.8655 5.8657 5.8657 6.1364 6.1364 6.1365 6.1365 6.4300 6.4300 6.4301 6.4301 7.3296 7.3296 7.3298 7.3298 k = 0.0000 0.2916 0.2298 ( 5430 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6613 -10.6613 -10.6612 -10.6612 -10.2989 -10.2989 -10.2988 -10.2988 -0.3120 -0.3120 -0.3120 -0.3120 0.9626 0.9626 0.9626 0.9626 1.1989 1.1989 1.1990 1.1990 1.8419 1.8419 1.8419 1.8419 2.1231 2.1231 2.1231 2.1231 2.2148 2.2148 2.2149 2.2149 5.1922 5.1922 5.1923 5.1923 5.8643 5.8643 5.8645 5.8645 6.1348 6.1348 6.1349 6.1349 6.4297 6.4297 6.4297 6.4297 7.3311 7.3311 7.3313 7.3313 k = 0.0000 0.2916 0.2407 ( 5432 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6603 -10.6603 -10.6602 -10.6602 -10.3000 -10.3000 -10.3000 -10.3000 -0.3079 -0.3079 -0.3078 -0.3078 0.9587 0.9587 0.9587 0.9587 1.1989 1.1989 1.1990 1.1990 1.8471 1.8471 1.8471 1.8471 2.1185 2.1185 2.1186 2.1186 2.2133 2.2133 2.2134 2.2134 5.1889 5.1889 5.1891 5.1891 5.8634 5.8634 5.8636 5.8636 6.1336 6.1336 6.1337 6.1337 6.4294 6.4294 6.4295 6.4295 7.3321 7.3321 7.3323 7.3323 k = 0.0000 0.2916 0.2516 ( 5428 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6597 -10.6597 -10.6596 -10.6596 -10.3007 -10.3007 -10.3007 -10.3007 -0.3053 -0.3053 -0.3053 -0.3053 0.9563 0.9563 0.9563 0.9563 1.1989 1.1989 1.1991 1.1991 1.8503 1.8503 1.8503 1.8503 2.1156 2.1156 2.1157 2.1157 2.2125 2.2125 2.2126 2.2126 5.1869 5.1869 5.1871 5.1871 5.8629 5.8629 5.8631 5.8631 6.1330 6.1330 6.1331 6.1331 6.4293 6.4293 6.4294 6.4294 7.3328 7.3328 7.3330 7.3330 k = 0.0000 0.2916 0.2626 ( 5436 PWs) bands (ev): -65.8244 -65.8244 -65.8241 -65.8241 -37.8941 -37.8941 -37.8939 -37.8939 -36.9168 -36.9168 -36.9166 -36.9166 -36.7972 -36.7972 -36.7970 -36.7970 -10.6595 -10.6595 -10.6594 -10.6594 -10.3010 -10.3010 -10.3009 -10.3009 -0.3045 -0.3045 -0.3044 -0.3044 0.9555 0.9555 0.9555 0.9555 1.1990 1.1990 1.1991 1.1991 1.8514 1.8514 1.8514 1.8514 2.1146 2.1146 2.1147 2.1147 2.2123 2.2123 2.2124 2.2124 5.1863 5.1863 5.1864 5.1864 5.8627 5.8627 5.8629 5.8629 6.1327 6.1327 6.1328 6.1328 6.4293 6.4293 6.4294 6.4294 7.3330 7.3330 7.3332 7.3332 k = 0.5000-0.0000 0.2626 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2931 -10.2931 -10.2923 -10.2923 -10.1270 -10.1270 -10.1269 -10.1269 -0.5039 -0.5039 -0.4975 -0.4975 0.4436 0.4436 0.4721 0.4721 0.7103 0.7103 0.7577 0.7577 1.2111 1.2111 1.2373 1.2373 1.8879 1.8879 1.9079 1.9079 2.0812 2.0812 2.0970 2.0970 5.4458 5.4458 5.4632 5.4632 5.9660 5.9660 5.9956 5.9956 6.1012 6.1012 6.1333 6.1333 6.3700 6.3700 6.3966 6.3966 7.6156 7.6156 7.6188 7.6188 k = 0.5000-0.0000 0.2516 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2931 -10.2931 -10.2923 -10.2923 -10.1270 -10.1270 -10.1269 -10.1269 -0.5033 -0.5033 -0.4969 -0.4969 0.4437 0.4437 0.4723 0.4723 0.7097 0.7097 0.7570 0.7570 1.2111 1.2111 1.2373 1.2373 1.8877 1.8877 1.9076 1.9076 2.0806 2.0806 2.0964 2.0964 5.4465 5.4465 5.4639 5.4639 5.9662 5.9662 5.9959 5.9959 6.1012 6.1012 6.1333 6.1333 6.3697 6.3697 6.3962 6.3962 7.6143 7.6143 7.6174 7.6174 k = 0.5000-0.0000 0.2407 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2932 -10.2932 -10.2924 -10.2924 -10.1269 -10.1269 -10.1268 -10.1268 -0.5015 -0.5015 -0.4951 -0.4951 0.4442 0.4442 0.4727 0.4727 0.7079 0.7079 0.7551 0.7551 1.2113 1.2113 1.2374 1.2374 1.8871 1.8871 1.9069 1.9069 2.0789 2.0789 2.0947 2.0947 5.4487 5.4487 5.4660 5.4660 5.9668 5.9668 5.9967 5.9967 6.1012 6.1012 6.1333 6.1333 6.3689 6.3689 6.3953 6.3953 7.6103 7.6103 7.6135 7.6135 k = 0.5000-0.0000 0.2298 ( 5442 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2934 -10.2934 -10.2926 -10.2926 -10.1267 -10.1267 -10.1266 -10.1266 -0.4985 -0.4985 -0.4920 -0.4920 0.4449 0.4449 0.4735 0.4735 0.7049 0.7049 0.7520 0.7520 1.2117 1.2117 1.2374 1.2374 1.8862 1.8862 1.9056 1.9056 2.0761 2.0761 2.0918 2.0918 5.4524 5.4524 5.4695 5.4695 5.9678 5.9678 5.9980 5.9980 6.1011 6.1011 6.1335 6.1335 6.3675 6.3675 6.3939 6.3939 7.6038 7.6038 7.6071 7.6071 k = 0.5000-0.0000 0.2188 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2936 -10.2936 -10.2929 -10.2929 -10.1265 -10.1265 -10.1264 -10.1264 -0.4943 -0.4943 -0.4879 -0.4879 0.4460 0.4460 0.4746 0.4746 0.7008 0.7008 0.7477 0.7477 1.2121 1.2121 1.2375 1.2375 1.8850 1.8850 1.9039 1.9039 2.0723 2.0723 2.0879 2.0879 5.4574 5.4574 5.4742 5.4742 5.9692 5.9692 5.9998 5.9998 6.1011 6.1011 6.1337 6.1337 6.3657 6.3657 6.3919 6.3919 7.5950 7.5950 7.5984 7.5984 k = 0.5000-0.0000 0.2079 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2939 -10.2939 -10.2932 -10.2932 -10.1262 -10.1262 -10.1261 -10.1261 -0.4889 -0.4889 -0.4826 -0.4826 0.4473 0.4473 0.4760 0.4760 0.6956 0.6956 0.7422 0.7422 1.2126 1.2126 1.2376 1.2376 1.8834 1.8834 1.9018 1.9018 2.0675 2.0675 2.0829 2.0829 5.4636 5.4636 5.4802 5.4802 5.9709 5.9709 6.0021 6.0021 6.1011 6.1011 6.1340 6.1340 6.3633 6.3633 6.3893 6.3893 7.5840 7.5840 7.5876 7.5876 k = 0.5000-0.0000 0.1969 ( 5422 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2943 -10.2943 -10.2935 -10.2935 -10.1259 -10.1259 -10.1258 -10.1258 -0.4825 -0.4825 -0.4762 -0.4762 0.4489 0.4489 0.4777 0.4777 0.6893 0.6893 0.7356 0.7356 1.2131 1.2131 1.2375 1.2375 1.8816 1.8816 1.8993 1.8993 2.0618 2.0618 2.0771 2.0771 5.4710 5.4710 5.4872 5.4872 5.9730 5.9730 6.0048 6.0048 6.1011 6.1011 6.1343 6.1343 6.3605 6.3605 6.3862 6.3862 7.5713 7.5713 7.5750 7.5750 k = 0.5000-0.0000 0.1860 ( 5426 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2947 -10.2947 -10.2940 -10.2940 -10.1255 -10.1255 -10.1254 -10.1254 -0.4751 -0.4751 -0.4689 -0.4689 0.4507 0.4507 0.4796 0.4796 0.6820 0.6820 0.7280 0.7280 1.2136 1.2136 1.2374 1.2374 1.8797 1.8797 1.8966 1.8966 2.0553 2.0553 2.0705 2.0705 5.4794 5.4794 5.4951 5.4951 5.9755 5.9755 6.0079 6.0079 6.1011 6.1011 6.1346 6.1346 6.3572 6.3572 6.3826 6.3826 7.5571 7.5571 7.5609 7.5609 k = 0.5000-0.0000 0.1751 ( 5426 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2951 -10.2951 -10.2944 -10.2944 -10.1251 -10.1251 -10.1250 -10.1250 -0.4668 -0.4668 -0.4607 -0.4607 0.4528 0.4528 0.4817 0.4817 0.6739 0.6739 0.7194 0.7194 1.2141 1.2141 1.2372 1.2372 1.8776 1.8776 1.8936 1.8936 2.0482 2.0482 2.0632 2.0632 5.4886 5.4886 5.5038 5.5038 5.9783 5.9783 6.0114 6.0114 6.1012 6.1012 6.1351 6.1351 6.3535 6.3535 6.3785 6.3785 7.5417 7.5417 7.5456 7.5456 k = 0.5000-0.0000 0.1641 ( 5420 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2956 -10.2956 -10.2949 -10.2949 -10.1247 -10.1247 -10.1246 -10.1246 -0.4577 -0.4577 -0.4517 -0.4517 0.4550 0.4550 0.4840 0.4840 0.6650 0.6650 0.7100 0.7100 1.2146 1.2146 1.2368 1.2368 1.8756 1.8756 1.8906 1.8906 2.0407 2.0407 2.0554 2.0554 5.4985 5.4985 5.5131 5.5131 5.9814 5.9814 6.0152 6.0152 6.1013 6.1013 6.1355 6.1355 6.3495 6.3495 6.3740 6.3740 7.5254 7.5254 7.5295 7.5295 k = 0.5000-0.0000 0.1532 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2961 -10.2961 -10.2954 -10.2954 -10.1242 -10.1242 -10.1241 -10.1241 -0.4479 -0.4479 -0.4420 -0.4420 0.4574 0.4574 0.4865 0.4865 0.6553 0.6553 0.6997 0.6997 1.2150 1.2150 1.2362 1.2362 1.8735 1.8735 1.8874 1.8874 2.0327 2.0327 2.0471 2.0471 5.5088 5.5088 5.5228 5.5228 5.9847 5.9847 6.0193 6.0193 6.1015 6.1015 6.1359 6.1359 6.3452 6.3452 6.3691 6.3691 7.5087 7.5087 7.5128 7.5128 k = 0.5000-0.0000 0.1422 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2966 -10.2966 -10.2960 -10.2960 -10.1237 -10.1237 -10.1236 -10.1236 -0.4375 -0.4375 -0.4317 -0.4317 0.4600 0.4600 0.4892 0.4892 0.6451 0.6451 0.6889 0.6889 1.2153 1.2153 1.2354 1.2354 1.8715 1.8715 1.8843 1.8843 2.0245 2.0245 2.0386 2.0386 5.5195 5.5195 5.5327 5.5327 5.9883 5.9883 6.0234 6.0234 6.1018 6.1018 6.1364 6.1364 6.3406 6.3406 6.3638 6.3638 7.4918 7.4918 7.4960 7.4960 k = 0.5000-0.0000 0.1313 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2971 -10.2971 -10.2965 -10.2965 -10.1232 -10.1232 -10.1232 -10.1232 -0.4266 -0.4266 -0.4211 -0.4211 0.4627 0.4627 0.4920 0.4920 0.6344 0.6344 0.6775 0.6775 1.2155 1.2155 1.2345 1.2345 1.8697 1.8697 1.8813 1.8813 2.0162 2.0162 2.0298 2.0298 5.5303 5.5303 5.5428 5.5428 5.9922 5.9922 6.0276 6.0276 6.1023 6.1023 6.1368 6.1368 6.3360 6.3360 6.3583 6.3583 7.4751 7.4751 7.4792 7.4792 k = 0.5000-0.0000 0.1204 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2976 -10.2976 -10.2971 -10.2971 -10.1228 -10.1228 -10.1227 -10.1227 -0.4155 -0.4155 -0.4102 -0.4102 0.4655 0.4655 0.4949 0.4949 0.6233 0.6233 0.6657 0.6657 1.2156 1.2156 1.2334 1.2334 1.8681 1.8681 1.8784 1.8784 2.0079 2.0079 2.0211 2.0211 5.5410 5.5410 5.5526 5.5526 5.9962 5.9962 6.0317 6.0317 6.1030 6.1030 6.1373 6.1373 6.3312 6.3312 6.3526 6.3526 7.4588 7.4588 7.4628 7.4628 k = 0.5000-0.0000 0.1094 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8039 -36.8039 -10.2981 -10.2981 -10.2976 -10.2976 -10.1223 -10.1223 -10.1222 -10.1222 -0.4043 -0.4043 -0.3993 -0.3993 0.4684 0.4684 0.4979 0.4979 0.6121 0.6121 0.6536 0.6536 1.2157 1.2157 1.2322 1.2322 1.8668 1.8668 1.8758 1.8758 1.9998 1.9998 2.0124 2.0124 5.5515 5.5515 5.5622 5.5622 6.0004 6.0004 6.0356 6.0356 6.1040 6.1040 6.1376 6.1376 6.3265 6.3265 6.3468 6.3468 7.4431 7.4431 7.4471 7.4471 k = 0.5000-0.0000 0.0985 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2985 -10.2985 -10.2981 -10.2981 -10.1218 -10.1218 -10.1218 -10.1218 -0.3932 -0.3932 -0.3885 -0.3885 0.4714 0.4714 0.5010 0.5010 0.6008 0.6008 0.6414 0.6414 1.2158 1.2158 1.2309 1.2309 1.8657 1.8657 1.8735 1.8735 1.9921 1.9921 2.0040 2.0040 5.5616 5.5616 5.5713 5.5713 6.0047 6.0047 6.0391 6.0391 6.1053 6.1053 6.1379 6.1379 6.3219 6.3219 6.3408 6.3408 7.4284 7.4284 7.4322 7.4322 k = 0.5000-0.0000 0.0875 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2990 -10.2990 -10.2986 -10.2986 -10.1214 -10.1214 -10.1213 -10.1213 -0.3824 -0.3824 -0.3780 -0.3780 0.4746 0.4746 0.5042 0.5042 0.5897 0.5897 0.6293 0.6293 1.2158 1.2158 1.2294 1.2294 1.8648 1.8648 1.8714 1.8714 1.9847 1.9847 1.9959 1.9959 5.5711 5.5711 5.5798 5.5798 6.0090 6.0090 6.0421 6.0421 6.1070 6.1070 6.1381 6.1381 6.3175 6.3175 6.3350 6.3350 7.4147 7.4147 7.4183 7.4183 k = 0.5000-0.0000 0.0766 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2994 -10.2994 -10.2990 -10.2990 -10.1210 -10.1210 -10.1210 -10.1210 -0.3722 -0.3722 -0.3682 -0.3682 0.4778 0.4778 0.5074 0.5074 0.5790 0.5790 0.6174 0.6174 1.2159 1.2159 1.2280 1.2280 1.8643 1.8643 1.8697 1.8697 1.9780 1.9780 1.9882 1.9882 5.5799 5.5799 5.5876 5.5876 6.0134 6.0134 6.0444 6.0444 6.1092 6.1092 6.1381 6.1381 6.3135 6.3135 6.3292 6.3292 7.4024 7.4024 7.4056 7.4056 k = 0.5000-0.0000 0.0656 ( 5426 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.2997 -10.2997 -10.2994 -10.2994 -10.1207 -10.1207 -10.1206 -10.1206 -0.3626 -0.3626 -0.3591 -0.3591 0.4812 0.4812 0.5106 0.5106 0.5688 0.5688 0.6058 0.6058 1.2160 1.2160 1.2265 1.2265 1.8639 1.8639 1.8682 1.8682 1.9719 1.9719 1.9811 1.9811 5.5879 5.5879 5.5945 5.5945 6.0177 6.0177 6.0460 6.0460 6.1117 6.1117 6.1379 6.1379 6.3098 6.3098 6.3238 6.3238 7.3914 7.3914 7.3943 7.3943 k = 0.5000-0.0000 0.0547 ( 5434 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.3001 -10.3001 -10.2998 -10.2998 -10.1204 -10.1204 -10.1203 -10.1203 -0.3540 -0.3540 -0.3510 -0.3510 0.4849 0.4849 0.5135 0.5135 0.5596 0.5596 0.5948 0.5948 1.2161 1.2161 1.2250 1.2250 1.8638 1.8638 1.8671 1.8671 1.9667 1.9667 1.9746 1.9746 5.5949 5.5949 5.6005 5.6005 6.0220 6.0220 6.0467 6.0467 6.1146 6.1146 6.1374 6.1374 6.3067 6.3067 6.3186 6.3186 7.3820 7.3820 7.3845 7.3845 k = 0.5000-0.0000 0.0438 ( 5434 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.3003 -10.3003 -10.3001 -10.3001 -10.1201 -10.1201 -10.1200 -10.1200 -0.3466 -0.3466 -0.3441 -0.3441 0.4887 0.4887 0.5159 0.5159 0.5520 0.5520 0.5845 0.5845 1.2164 1.2164 1.2236 1.2236 1.8638 1.8638 1.8663 1.8663 1.9624 1.9624 1.9690 1.9690 5.6009 5.6009 5.6053 5.6053 6.0261 6.0261 6.0468 6.0468 6.1177 6.1177 6.1366 6.1366 6.3042 6.3042 6.3140 6.3140 7.3742 7.3742 7.3763 7.3763 k = 0.5000-0.0000 0.0328 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.3005 -10.3005 -10.3003 -10.3003 -10.1199 -10.1199 -10.1198 -10.1198 -0.3405 -0.3405 -0.3386 -0.3386 0.4929 0.4929 0.5169 0.5169 0.5469 0.5469 0.5749 0.5749 1.2168 1.2168 1.2222 1.2222 1.8639 1.8639 1.8656 1.8656 1.9591 1.9591 1.9642 1.9642 5.6057 5.6057 5.6091 5.6091 6.0301 6.0301 6.0461 6.0461 6.1209 6.1209 6.1355 6.1355 6.3024 6.3024 6.3099 6.3099 7.3682 7.3682 7.3698 7.3698 k = 0.5000-0.0000 0.0219 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.3007 -10.3007 -10.3005 -10.3005 -10.1198 -10.1198 -10.1197 -10.1197 -0.3359 -0.3359 -0.3346 -0.3346 0.4973 0.4973 0.5155 0.5155 0.5455 0.5455 0.5663 0.5663 1.2174 1.2174 1.2210 1.2210 1.8641 1.8641 1.8652 1.8652 1.9570 1.9570 1.9605 1.9605 5.6094 5.6094 5.6117 5.6117 6.0338 6.0338 6.0447 6.0447 6.1241 6.1241 6.1340 6.1340 6.3015 6.3015 6.3065 6.3065 7.3639 7.3639 7.3650 7.3650 k = 0.5000-0.0000 0.0109 ( 5430 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8041 -36.8041 -36.8040 -36.8040 -10.3007 -10.3007 -10.3006 -10.3006 -10.1197 -10.1197 -10.1196 -10.1196 -0.3330 -0.3330 -0.3323 -0.3323 0.5021 0.5021 0.5118 0.5118 0.5477 0.5477 0.5587 0.5587 1.2180 1.2180 1.2199 1.2199 1.8643 1.8643 1.8648 1.8648 1.9560 1.9560 1.9578 1.9578 5.6119 5.6119 5.6130 5.6130 6.0371 6.0371 6.0427 6.0427 6.1270 6.1270 6.1321 6.1321 6.3014 6.3014 6.3040 6.3040 7.3614 7.3614 7.3620 7.3620 k = 0.5000-0.0000-0.0000 ( 5418 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9225 -36.9225 -36.9224 -36.9224 -36.8041 -36.8041 -36.8039 -36.8039 -10.3008 -10.3008 -10.3007 -10.3007 -10.1196 -10.1196 -10.1196 -10.1196 -0.3318 -0.3318 -0.3318 -0.3318 0.5070 0.5070 0.5070 0.5070 0.5523 0.5523 0.5524 0.5524 1.2189 1.2189 1.2189 1.2189 1.8645 1.8645 1.8646 1.8646 1.9563 1.9563 1.9563 1.9563 5.6130 5.6130 5.6132 5.6132 6.0401 6.0401 6.0402 6.0402 6.1296 6.1296 6.1298 6.1298 6.3022 6.3022 6.3024 6.3024 7.3607 7.3607 7.3609 7.3609 k = 0.5000 0.2916-0.0000 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2431 -10.2431 -10.2419 -10.2419 -10.1787 -10.1787 -10.1786 -10.1786 -0.3427 -0.3427 -0.3387 -0.3387 0.2846 0.2846 0.3052 0.3052 0.7907 0.7907 0.8350 0.8350 1.1402 1.1402 1.1581 1.1581 1.4842 1.4842 1.4994 1.4994 2.4464 2.4464 2.4664 2.4664 5.5404 5.5404 5.5469 5.5469 5.8450 5.8450 5.8811 5.8811 6.0894 6.0894 6.1098 6.1098 6.4227 6.4227 6.4243 6.4243 7.6371 7.6371 7.6373 7.6373 k = 0.5000 0.2916 0.0109 ( 5440 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8042 -36.8042 -36.8038 -36.8038 -10.2431 -10.2431 -10.2419 -10.2419 -10.1787 -10.1787 -10.1786 -10.1786 -0.3436 -0.3436 -0.3395 -0.3395 0.2844 0.2844 0.3050 0.3050 0.7904 0.7904 0.8347 0.8347 1.1409 1.1409 1.1588 1.1588 1.4856 1.4856 1.5009 1.5009 2.4463 2.4463 2.4663 2.4663 5.5406 5.5406 5.5471 5.5471 5.8453 5.8453 5.8815 5.8815 6.0893 6.0893 6.1098 6.1098 6.4226 6.4226 6.4242 6.4242 7.6361 7.6361 7.6363 7.6363 k = 0.5000 0.2916 0.0219 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2432 -10.2432 -10.2420 -10.2420 -10.1786 -10.1786 -10.1785 -10.1785 -0.3460 -0.3460 -0.3420 -0.3420 0.2839 0.2839 0.3045 0.3045 0.7895 0.7895 0.8336 0.8336 1.1428 1.1428 1.1607 1.1607 1.4899 1.4899 1.5053 1.5053 2.4460 2.4460 2.4661 2.4661 5.5411 5.5411 5.5477 5.5477 5.8461 5.8461 5.8825 5.8825 6.0892 6.0892 6.1097 6.1097 6.4220 6.4220 6.4237 6.4237 7.6332 7.6332 7.6333 7.6333 k = 0.5000 0.2916 0.0328 ( 5456 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9227 -36.9227 -36.9223 -36.9223 -36.8043 -36.8043 -36.8039 -36.8039 -10.2433 -10.2433 -10.2421 -10.2421 -10.1785 -10.1785 -10.1784 -10.1784 -0.3500 -0.3500 -0.3461 -0.3461 0.2830 0.2830 0.3035 0.3035 0.7882 0.7882 0.8320 0.8320 1.1458 1.1458 1.1638 1.1638 1.4969 1.4969 1.5125 1.5125 2.4456 2.4456 2.4656 2.4656 5.5419 5.5419 5.5487 5.5487 5.8475 5.8475 5.8843 5.8843 6.0889 6.0889 6.1096 6.1096 6.4211 6.4211 6.4229 6.4229 7.6282 7.6282 7.6284 7.6284 k = 0.5000 0.2916 0.0438 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8038 -36.8038 -10.2434 -10.2434 -10.2422 -10.2422 -10.1783 -10.1783 -10.1782 -10.1782 -0.3555 -0.3555 -0.3515 -0.3515 0.2817 0.2817 0.3020 0.3020 0.7868 0.7868 0.8301 0.8301 1.1496 1.1496 1.1677 1.1677 1.5067 1.5067 1.5225 1.5225 2.4450 2.4450 2.4649 2.4649 5.5431 5.5431 5.5500 5.5500 5.8495 5.8495 5.8868 5.8868 6.0885 6.0885 6.1095 6.1095 6.4198 6.4198 6.4219 6.4219 7.6214 7.6214 7.6216 7.6216 k = 0.5000 0.2916 0.0547 ( 5448 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9223 -36.9223 -36.8043 -36.8043 -36.8039 -36.8039 -10.2435 -10.2435 -10.2424 -10.2424 -10.1781 -10.1781 -10.1780 -10.1780 -0.3622 -0.3622 -0.3584 -0.3584 0.2799 0.2799 0.2999 0.2999 0.7855 0.7855 0.8281 0.8281 1.1541 1.1541 1.1722 1.1722 1.5190 1.5190 1.5352 1.5352 2.4442 2.4442 2.4639 2.4639 5.5446 5.5446 5.5517 5.5517 5.8521 5.8521 5.8899 5.8899 6.0880 6.0880 6.1093 6.1093 6.4183 6.4183 6.4206 6.4206 7.6128 7.6128 7.6131 7.6131 k = 0.5000 0.2916 0.0656 ( 5468 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8990 -37.8990 -37.8988 -37.8988 -36.9227 -36.9227 -36.9224 -36.9224 -36.8043 -36.8043 -36.8039 -36.8039 -10.2437 -10.2437 -10.2426 -10.2426 -10.1779 -10.1779 -10.1778 -10.1778 -0.3701 -0.3701 -0.3663 -0.3663 0.2775 0.2775 0.2971 0.2971 0.7845 0.7845 0.8263 0.8263 1.1589 1.1589 1.1770 1.1770 1.5338 1.5338 1.5502 1.5502 2.4432 2.4432 2.4628 2.4628 5.5463 5.5463 5.5537 5.5537 5.8552 5.8552 5.8937 5.8937 6.0874 6.0874 6.1090 6.1090 6.4164 6.4164 6.4189 6.4189 7.6025 7.6025 7.6028 7.6028 k = 0.5000 0.2916 0.0766 ( 5468 PWs) bands (ev): -65.8234 -65.8234 -65.8231 -65.8231 -37.8990 -37.8990 -37.8988 -37.8988 -36.9227 -36.9227 -36.9224 -36.9224 -36.8043 -36.8043 -36.8039 -36.8039 -10.2439 -10.2439 -10.2428 -10.2428 -10.1776 -10.1776 -10.1775 -10.1775 -0.3789 -0.3789 -0.3752 -0.3752 0.2745 0.2745 0.2937 0.2937 0.7842 0.7842 0.8249 0.8249 1.1639 1.1639 1.1818 1.1818 1.5508 1.5508 1.5674 1.5674 2.4420 2.4420 2.4613 2.4613 5.5483 5.5483 5.5559 5.5559 5.8589 5.8589 5.8981 5.8981 6.0867 6.0867 6.1087 6.1087 6.4143 6.4143 6.4172 6.4172 7.5906 7.5906 7.5910 7.5910 k = 0.5000 0.2916 0.0875 ( 5456 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8043 -36.8043 -36.8039 -36.8039 -10.2441 -10.2441 -10.2431 -10.2431 -10.1773 -10.1773 -10.1772 -10.1772 -0.3885 -0.3885 -0.3848 -0.3848 0.2710 0.2710 0.2895 0.2895 0.7846 0.7846 0.8241 0.8241 1.1689 1.1689 1.1866 1.1866 1.5698 1.5698 1.5864 1.5864 2.4406 2.4406 2.4596 2.4596 5.5505 5.5505 5.5584 5.5584 5.8632 5.8632 5.9031 5.9031 6.0859 6.0859 6.1084 6.1084 6.4121 6.4121 6.4153 6.4153 7.5774 7.5774 7.5779 7.5779 k = 0.5000 0.2916 0.0985 ( 5456 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8043 -36.8043 -36.8039 -36.8039 -10.2443 -10.2443 -10.2433 -10.2433 -10.1769 -10.1769 -10.1768 -10.1768 -0.3985 -0.3985 -0.3950 -0.3950 0.2668 0.2668 0.2846 0.2846 0.7858 0.7858 0.8238 0.8238 1.1737 1.1737 1.1911 1.1911 1.5904 1.5904 1.6070 1.6070 2.4389 2.4389 2.4576 2.4576 5.5529 5.5529 5.5610 5.5610 5.8679 5.8679 5.9086 5.9086 6.0849 6.0849 6.1079 6.1079 6.4097 6.4097 6.4133 6.4133 7.5629 7.5629 7.5635 7.5635 k = 0.5000 0.2916 0.1094 ( 5444 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2446 -10.2446 -10.2436 -10.2436 -10.1766 -10.1766 -10.1765 -10.1765 -0.4089 -0.4089 -0.4055 -0.4055 0.2622 0.2622 0.2791 0.2791 0.7879 0.7879 0.8242 0.8242 1.1784 1.1784 1.1953 1.1953 1.6123 1.6123 1.6287 1.6287 2.4371 2.4371 2.4554 2.4554 5.5555 5.5555 5.5637 5.5637 5.8733 5.8733 5.9146 5.9146 6.0839 6.0839 6.1074 6.1074 6.4073 6.4073 6.4112 6.4112 7.5474 7.5474 7.5481 7.5481 k = 0.5000 0.2916 0.1204 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2448 -10.2448 -10.2439 -10.2439 -10.1762 -10.1762 -10.1761 -10.1761 -0.4194 -0.4194 -0.4162 -0.4162 0.2571 0.2571 0.2730 0.2730 0.7907 0.7907 0.8252 0.8252 1.1828 1.1828 1.1992 1.1992 1.6351 1.6351 1.6513 1.6513 2.4349 2.4349 2.4528 2.4528 5.5581 5.5581 5.5665 5.5665 5.8791 5.8791 5.9209 5.9209 6.0828 6.0828 6.1067 6.1067 6.4048 6.4048 6.4090 6.4090 7.5311 7.5311 7.5319 7.5319 k = 0.5000 0.2916 0.1313 ( 5432 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2450 -10.2450 -10.2442 -10.2442 -10.1758 -10.1758 -10.1758 -10.1758 -0.4298 -0.4298 -0.4267 -0.4267 0.2517 0.2517 0.2666 0.2666 0.7943 0.7943 0.8268 0.8268 1.1870 1.1870 1.2026 1.2026 1.6585 1.6585 1.6743 1.6743 2.4326 2.4326 2.4498 2.4498 5.5608 5.5608 5.5692 5.5692 5.8853 5.8853 5.9275 5.9275 6.0815 6.0815 6.1059 6.1059 6.4023 6.4023 6.4068 6.4068 7.5143 7.5143 7.5152 7.5152 k = 0.5000 0.2916 0.1422 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2452 -10.2452 -10.2445 -10.2445 -10.1755 -10.1755 -10.1754 -10.1754 -0.4400 -0.4400 -0.4371 -0.4371 0.2462 0.2462 0.2599 0.2599 0.7984 0.7984 0.8287 0.8287 1.1909 1.1909 1.2057 1.2057 1.6820 1.6820 1.6973 1.6973 2.4300 2.4300 2.4466 2.4466 5.5635 5.5635 5.5718 5.5718 5.8920 5.8920 5.9342 5.9342 6.0802 6.0802 6.1050 6.1050 6.3999 6.3999 6.4047 6.4047 7.4972 7.4972 7.4982 7.4982 k = 0.5000 0.2916 0.1532 ( 5420 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2455 -10.2455 -10.2448 -10.2448 -10.1751 -10.1751 -10.1750 -10.1750 -0.4498 -0.4498 -0.4471 -0.4471 0.2406 0.2406 0.2531 0.2531 0.8029 0.8029 0.8309 0.8309 1.1945 1.1945 1.2084 1.2084 1.7053 1.7053 1.7200 1.7200 2.4273 2.4273 2.4431 2.4431 5.5662 5.5662 5.5744 5.5744 5.8990 5.8990 5.9409 5.9409 6.0790 6.0790 6.1039 6.1039 6.3977 6.3977 6.4026 6.4026 7.4802 7.4802 7.4812 7.4812 k = 0.5000 0.2916 0.1641 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8039 -36.8039 -10.2457 -10.2457 -10.2450 -10.2450 -10.1748 -10.1748 -10.1747 -10.1747 -0.4591 -0.4591 -0.4566 -0.4566 0.2351 0.2351 0.2464 0.2464 0.8077 0.8077 0.8332 0.8332 1.1979 1.1979 1.2107 1.2107 1.7281 1.7281 1.7420 1.7420 2.4245 2.4245 2.4394 2.4394 5.5688 5.5688 5.5766 5.5766 5.9062 5.9062 5.9474 5.9474 6.0777 6.0777 6.1025 6.1025 6.3956 6.3956 6.4006 6.4006 7.4635 7.4635 7.4646 7.4646 k = 0.5000 0.2916 0.1751 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2459 -10.2459 -10.2453 -10.2453 -10.1745 -10.1745 -10.1744 -10.1744 -0.4677 -0.4677 -0.4655 -0.4655 0.2298 0.2298 0.2398 0.2398 0.8126 0.8126 0.8355 0.8355 1.2011 1.2011 1.2127 1.2127 1.7499 1.7499 1.7628 1.7628 2.4216 2.4216 2.4355 2.4355 5.5713 5.5713 5.5787 5.5787 5.9137 5.9137 5.9535 5.9535 6.0765 6.0765 6.1010 6.1010 6.3938 6.3938 6.3987 6.3987 7.4474 7.4474 7.4485 7.4485 k = 0.5000 0.2916 0.1860 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2460 -10.2460 -10.2455 -10.2455 -10.1742 -10.1742 -10.1741 -10.1741 -0.4755 -0.4755 -0.4736 -0.4736 0.2250 0.2250 0.2337 0.2337 0.8175 0.8175 0.8377 0.8377 1.2039 1.2039 1.2143 1.2143 1.7703 1.7703 1.7822 1.7822 2.4188 2.4188 2.4315 2.4315 5.5737 5.5737 5.5806 5.5806 5.9212 5.9212 5.9590 5.9590 6.0756 6.0756 6.0993 6.0993 6.3922 6.3922 6.3970 6.3970 7.4323 7.4323 7.4334 7.4334 k = 0.5000 0.2916 0.1969 ( 5436 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8988 -37.8988 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2462 -10.2462 -10.2458 -10.2458 -10.1739 -10.1739 -10.1738 -10.1738 -0.4825 -0.4825 -0.4808 -0.4808 0.2206 0.2206 0.2280 0.2280 0.8222 0.8222 0.8397 0.8397 1.2066 1.2066 1.2156 1.2156 1.7892 1.7892 1.7998 1.7998 2.4162 2.4162 2.4275 2.4275 5.5760 5.5760 5.5821 5.5821 5.9287 5.9287 5.9637 5.9637 6.0750 6.0750 6.0973 6.0973 6.3910 6.3910 6.3954 6.3954 7.4185 7.4185 7.4195 7.4195 k = 0.5000 0.2916 0.2079 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2463 -10.2463 -10.2460 -10.2460 -10.1737 -10.1737 -10.1736 -10.1736 -0.4885 -0.4885 -0.4871 -0.4871 0.2168 0.2168 0.2230 0.2230 0.8266 0.8266 0.8412 0.8412 1.2089 1.2089 1.2166 1.2166 1.8060 1.8060 1.8152 1.8152 2.4138 2.4138 2.4236 2.4236 5.5780 5.5780 5.5833 5.5833 5.9360 5.9360 5.9673 5.9673 6.0749 6.0749 6.0951 6.0951 6.3900 6.3900 6.3940 6.3940 7.4063 7.4063 7.4072 7.4072 k = 0.5000 0.2916 0.2188 ( 5428 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2464 -10.2464 -10.2461 -10.2461 -10.1735 -10.1735 -10.1734 -10.1734 -0.4935 -0.4935 -0.4923 -0.4923 0.2136 0.2136 0.2186 0.2186 0.8306 0.8306 0.8424 0.8424 1.2110 1.2110 1.2172 1.2172 1.8204 1.8204 1.8280 1.8280 2.4118 2.4118 2.4199 2.4199 5.5798 5.5798 5.5842 5.5842 5.9431 5.9431 5.9697 5.9697 6.0753 6.0753 6.0927 6.0927 6.3894 6.3894 6.3928 6.3928 7.3959 7.3959 7.3967 7.3967 k = 0.5000 0.2916 0.2298 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2465 -10.2465 -10.2463 -10.2463 -10.1733 -10.1733 -10.1732 -10.1732 -0.4974 -0.4974 -0.4965 -0.4965 0.2113 0.2113 0.2150 0.2150 0.8341 0.8341 0.8430 0.8430 1.2128 1.2128 1.2175 1.2175 1.8323 1.8323 1.8382 1.8382 2.4104 2.4104 2.4167 2.4167 5.5815 5.5815 5.5848 5.5848 5.9497 5.9497 5.9706 5.9706 6.0763 6.0763 6.0902 6.0902 6.3890 6.3890 6.3916 6.3916 7.3875 7.3875 7.3882 7.3882 k = 0.5000 0.2916 0.2407 ( 5420 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2465 -10.2465 -10.2464 -10.2464 -10.1732 -10.1732 -10.1731 -10.1731 -0.5002 -0.5002 -0.4996 -0.4996 0.2097 0.2097 0.2122 0.2122 0.8371 0.8371 0.8431 0.8431 1.2144 1.2144 1.2175 1.2175 1.8413 1.8413 1.8453 1.8453 2.4096 2.4096 2.4139 2.4139 5.5828 5.5828 5.5851 5.5851 5.9557 5.9557 5.9702 5.9702 6.0778 6.0778 6.0875 6.0875 6.3889 6.3889 6.3907 6.3907 7.3814 7.3814 7.3819 7.3819 k = 0.5000 0.2916 0.2516 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2466 -10.2466 -10.2465 -10.2465 -10.1731 -10.1731 -10.1731 -10.1731 -0.5018 -0.5018 -0.5015 -0.5015 0.2090 0.2090 0.2102 0.2102 0.8395 0.8395 0.8425 0.8425 1.2156 1.2156 1.2172 1.2172 1.8471 1.8471 1.8492 1.8492 2.4096 2.4096 2.4117 2.4117 5.5838 5.5838 5.5850 5.5850 5.9609 5.9609 5.9683 5.9683 6.0798 6.0798 6.0848 6.0848 6.3890 6.3890 6.3900 6.3900 7.3777 7.3777 7.3781 7.3781 k = 0.5000 0.2916 0.2626 ( 5424 PWs) bands (ev): -65.8233 -65.8233 -65.8231 -65.8231 -37.8989 -37.8989 -37.8987 -37.8987 -36.9226 -36.9226 -36.9224 -36.9224 -36.8042 -36.8042 -36.8040 -36.8040 -10.2466 -10.2466 -10.2465 -10.2465 -10.1731 -10.1731 -10.1730 -10.1730 -0.5023 -0.5023 -0.5022 -0.5022 0.2092 0.2092 0.2092 0.2092 0.8413 0.8413 0.8413 0.8413 1.2165 1.2165 1.2166 1.2166 1.8498 1.8498 1.8498 1.8498 2.4103 2.4103 2.4103 2.4103 5.5845 5.5845 5.5847 5.5847 5.9651 5.9651 5.9653 5.9653 6.0821 6.0821 6.0823 6.0823 6.3893 6.3893 6.3895 6.3895 7.3765 7.3765 7.3768 7.3768 Writing output data file CrCl2.save init_run : 0.79s CPU 1.10s WALL ( 1 calls) electrons : 593.01s CPU 598.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.09s WALL ( 1 calls) potinit : 0.04s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 593.00s CPU 598.01s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.04s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.03s WALL ( 1 calls) newd : 0.38s CPU 0.39s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.09s WALL ( 396 calls) cegterg : 559.77s CPU 564.22s WALL ( 396 calls) Called by sum_band: Called by *egterg: h_psi : 333.23s CPU 339.98s WALL ( 8004 calls) s_psi : 40.53s CPU 40.54s WALL ( 8004 calls) g_psi : 0.88s CPU 0.95s WALL ( 7212 calls) cdiaghg : 128.23s CPU 125.63s WALL ( 7608 calls) cegterg:over : 36.15s CPU 34.14s WALL ( 7212 calls) cegterg:upda : 15.97s CPU 18.31s WALL ( 7212 calls) cegterg:last : 14.12s CPU 14.94s WALL ( 1980 calls) Called by h_psi: h_psi:vloc : 284.98s CPU 289.10s WALL ( 8004 calls) h_psi:vnl : 48.08s CPU 50.31s WALL ( 8004 calls) add_vuspsi : 25.69s CPU 28.51s WALL ( 8004 calls) General routines calbec : 22.38s CPU 21.77s WALL ( 8004 calls) fft : 0.04s CPU 0.08s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 279.25s CPU 274.99s WALL ( 1751888 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.05s CPU 0.22s WALL ( 792 calls) Parallel routines fft_scatter : 248.83s CPU 190.07s WALL ( 1751911 calls) PWSCF : 10m39.43s CPU 10m58.36s WALL This run was terminated on: 16:30: 8 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=