Program PWSCF v.5.1.1 starts on 14Dec2015 at 7:56: 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./LiSi2N3.save/ 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 59 59 16 2299 2299 336 Max 60 60 17 2304 2304 339 Sum 2849 2849 793 110399 110399 16195 bravais-lattice index = 14 lattice parameter (alat) = 10.0215 a.u. unit-cell volume = 784.8687 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 411.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.021509 celldm(2)= 1.000000 celldm(3)= 0.900596 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500218 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500218 0.865900 0.000000 ) a(3) = ( 0.000000 0.000000 0.900596 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577686 -0.000000 ) b(2) = ( 0.000000 1.154868 -0.000000 ) b(3) = ( 0.000000 0.000000 1.110376 ) PseudoPot. # 1 for Li read from file: /home/autes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Li 3.00 6.94100 Li( 1.00) Si 4.00 28.08550 Si( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.4502980 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 374 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 2) = ( 0.0083321 0.0144358 -0.0000000), wk = 0.0026738 k( 3) = ( 0.0166642 0.0288717 -0.0000000), wk = 0.0026738 k( 4) = ( 0.0249964 0.0433076 -0.0000000), wk = 0.0026738 k( 5) = ( 0.0333285 0.0577434 -0.0000000), wk = 0.0026738 k( 6) = ( 0.0416606 0.0721793 -0.0000000), wk = 0.0026738 k( 7) = ( 0.0499927 0.0866151 -0.0000000), wk = 0.0026738 k( 8) = ( 0.0583249 0.1010510 -0.0000000), wk = 0.0026738 k( 9) = ( 0.0666570 0.1154868 -0.0000000), wk = 0.0026738 k( 10) = ( 0.0749891 0.1299227 -0.0000000), wk = 0.0026738 k( 11) = ( 0.0833212 0.1443585 -0.0000000), wk = 0.0026738 k( 12) = ( 0.0916534 0.1587944 -0.0000000), wk = 0.0026738 k( 13) = ( 0.0999855 0.1732302 -0.0000000), wk = 0.0026738 k( 14) = ( 0.1083176 0.1876661 -0.0000000), wk = 0.0026738 k( 15) = ( 0.1166497 0.2021019 -0.0000000), wk = 0.0026738 k( 16) = ( 0.1249819 0.2165378 -0.0000000), wk = 0.0026738 k( 17) = ( 0.1333140 0.2309736 -0.0000000), wk = 0.0026738 k( 18) = ( 0.1416461 0.2454095 -0.0000000), wk = 0.0026738 k( 19) = ( 0.1499782 0.2598453 -0.0000000), wk = 0.0026738 k( 20) = ( 0.1583104 0.2742812 -0.0000000), wk = 0.0026738 k( 21) = ( 0.1666425 0.2887171 -0.0000000), wk = 0.0026738 k( 22) = ( 0.1749746 0.3031529 -0.0000000), wk = 0.0026738 k( 23) = ( 0.1833067 0.3175888 -0.0000000), wk = 0.0026738 k( 24) = ( 0.1916388 0.3320246 -0.0000000), wk = 0.0026738 k( 25) = ( 0.1999710 0.3464605 -0.0000000), wk = 0.0026738 k( 26) = ( 0.2083031 0.3608963 -0.0000000), wk = 0.0026738 k( 27) = ( 0.2166352 0.3753322 -0.0000000), wk = 0.0026738 k( 28) = ( 0.2249674 0.3897680 -0.0000000), wk = 0.0026738 k( 29) = ( 0.2332995 0.4042039 -0.0000000), wk = 0.0026738 k( 30) = ( 0.2416316 0.4186397 -0.0000000), wk = 0.0026738 k( 31) = ( 0.2499637 0.4330756 -0.0000000), wk = 0.0026738 k( 32) = ( 0.2582958 0.4475114 -0.0000000), wk = 0.0026738 k( 33) = ( 0.2666280 0.4619473 -0.0000000), wk = 0.0026738 k( 34) = ( 0.2749601 0.4763831 -0.0000000), wk = 0.0026738 k( 35) = ( 0.2832922 0.4908190 -0.0000000), wk = 0.0026738 k( 36) = ( 0.2916243 0.5052548 -0.0000000), wk = 0.0026738 k( 37) = ( 0.2999565 0.5196907 -0.0000000), wk = 0.0026738 k( 38) = ( 0.3082886 0.5341266 -0.0000000), wk = 0.0026738 k( 39) = ( 0.3166207 0.5485624 -0.0000000), wk = 0.0026738 k( 40) = ( 0.3249528 0.5629982 -0.0000000), wk = 0.0026738 k( 41) = ( 0.3332850 0.5774341 -0.0000000), wk = 0.0026738 k( 42) = ( 0.3332850 0.5774341 -0.0000000), wk = 0.0026738 k( 43) = ( 0.3166207 0.5774341 -0.0000000), wk = 0.0026738 k( 44) = ( 0.2999565 0.5774341 -0.0000000), wk = 0.0026738 k( 45) = ( 0.2832922 0.5774341 -0.0000000), wk = 0.0026738 k( 46) = ( 0.2666280 0.5774341 -0.0000000), wk = 0.0026738 k( 47) = ( 0.2499637 0.5774341 -0.0000000), wk = 0.0026738 k( 48) = ( 0.2332995 0.5774341 -0.0000000), wk = 0.0026738 k( 49) = ( 0.2166352 0.5774341 -0.0000000), wk = 0.0026738 k( 50) = ( 0.1999710 0.5774341 -0.0000000), wk = 0.0026738 k( 51) = ( 0.1833067 0.5774341 -0.0000000), wk = 0.0026738 k( 52) = ( 0.1666425 0.5774341 -0.0000000), wk = 0.0026738 k( 53) = ( 0.1499782 0.5774341 -0.0000000), wk = 0.0026738 k( 54) = ( 0.1333140 0.5774341 -0.0000000), wk = 0.0026738 k( 55) = ( 0.1166497 0.5774341 -0.0000000), wk = 0.0026738 k( 56) = ( 0.0999855 0.5774341 -0.0000000), wk = 0.0026738 k( 57) = ( 0.0833212 0.5774341 -0.0000000), wk = 0.0026738 k( 58) = ( 0.0666570 0.5774341 -0.0000000), wk = 0.0026738 k( 59) = ( 0.0499927 0.5774341 -0.0000000), wk = 0.0026738 k( 60) = ( 0.0333285 0.5774341 -0.0000000), wk = 0.0026738 k( 61) = ( 0.0166642 0.5774341 -0.0000000), wk = 0.0026738 k( 62) = ( 0.0000000 0.5774341 -0.0000000), wk = 0.0026738 k( 63) = ( 0.0000000 0.5774341 -0.0000000), wk = 0.0026738 k( 64) = ( 0.0000000 0.5774341 0.0168239), wk = 0.0026738 k( 65) = ( 0.0000000 0.5774341 0.0336478), wk = 0.0026738 k( 66) = ( 0.0000000 0.5774341 0.0504716), wk = 0.0026738 k( 67) = ( 0.0000000 0.5774341 0.0672955), wk = 0.0026738 k( 68) = ( 0.0000000 0.5774341 0.0841194), wk = 0.0026738 k( 69) = ( 0.0000000 0.5774341 0.1009433), wk = 0.0026738 k( 70) = ( 0.0000000 0.5774341 0.1177671), wk = 0.0026738 k( 71) = ( 0.0000000 0.5774341 0.1345910), wk = 0.0026738 k( 72) = ( 0.0000000 0.5774341 0.1514149), wk = 0.0026738 k( 73) = ( 0.0000000 0.5774341 0.1682388), wk = 0.0026738 k( 74) = ( 0.0000000 0.5774341 0.1850626), wk = 0.0026738 k( 75) = ( 0.0000000 0.5774341 0.2018865), wk = 0.0026738 k( 76) = ( 0.0000000 0.5774341 0.2187104), wk = 0.0026738 k( 77) = ( 0.0000000 0.5774341 0.2355343), wk = 0.0026738 k( 78) = ( 0.0000000 0.5774341 0.2523581), wk = 0.0026738 k( 79) = ( 0.0000000 0.5774341 0.2691820), wk = 0.0026738 k( 80) = ( 0.0000000 0.5774341 0.2860059), wk = 0.0026738 k( 81) = ( 0.0000000 0.5774341 0.3028298), wk = 0.0026738 k( 82) = ( 0.0000000 0.5774341 0.3196536), wk = 0.0026738 k( 83) = ( 0.0000000 0.5774341 0.3364775), wk = 0.0026738 k( 84) = ( 0.0000000 0.5774341 0.3533014), wk = 0.0026738 k( 85) = ( 0.0000000 0.5774341 0.3701253), wk = 0.0026738 k( 86) = ( 0.0000000 0.5774341 0.3869491), wk = 0.0026738 k( 87) = ( 0.0000000 0.5774341 0.4037730), wk = 0.0026738 k( 88) = ( 0.0000000 0.5774341 0.4205969), wk = 0.0026738 k( 89) = ( 0.0000000 0.5774341 0.4374208), wk = 0.0026738 k( 90) = ( 0.0000000 0.5774341 0.4542446), wk = 0.0026738 k( 91) = ( 0.0000000 0.5774341 0.4710685), wk = 0.0026738 k( 92) = ( 0.0000000 0.5774341 0.4878924), wk = 0.0026738 k( 93) = ( 0.0000000 0.5774341 0.5047163), wk = 0.0026738 k( 94) = ( 0.0000000 0.5774341 0.5215401), wk = 0.0026738 k( 95) = ( 0.0000000 0.5774341 0.5383640), wk = 0.0026738 k( 96) = ( 0.0000000 0.5774341 0.5551879), wk = 0.0026738 k( 97) = ( 0.0000000 0.5774341 0.5551879), wk = 0.0026738 k( 98) = ( 0.0166642 0.5774341 0.5551879), wk = 0.0026738 k( 99) = ( 0.0333285 0.5774341 0.5551879), wk = 0.0026738 k( 100) = ( 0.0499927 0.5774341 0.5551879), wk = 0.0026738 k( 101) = ( 0.0666570 0.5774341 0.5551879), wk = 0.0026738 k( 102) = ( 0.0833212 0.5774341 0.5551879), wk = 0.0026738 k( 103) = ( 0.0999855 0.5774341 0.5551879), wk = 0.0026738 k( 104) = ( 0.1166497 0.5774341 0.5551879), wk = 0.0026738 k( 105) = ( 0.1333140 0.5774341 0.5551879), wk = 0.0026738 k( 106) = ( 0.1499782 0.5774341 0.5551879), wk = 0.0026738 k( 107) = ( 0.1666425 0.5774341 0.5551879), wk = 0.0026738 k( 108) = ( 0.1833067 0.5774341 0.5551879), wk = 0.0026738 k( 109) = ( 0.1999710 0.5774341 0.5551879), wk = 0.0026738 k( 110) = ( 0.2166352 0.5774341 0.5551879), wk = 0.0026738 k( 111) = ( 0.2332995 0.5774341 0.5551879), wk = 0.0026738 k( 112) = ( 0.2499637 0.5774341 0.5551879), wk = 0.0026738 k( 113) = ( 0.2666280 0.5774341 0.5551879), wk = 0.0026738 k( 114) = ( 0.2832922 0.5774341 0.5551879), wk = 0.0026738 k( 115) = ( 0.2999565 0.5774341 0.5551879), wk = 0.0026738 k( 116) = ( 0.3166207 0.5774341 0.5551879), wk = 0.0026738 k( 117) = ( 0.3332850 0.5774341 0.5551879), wk = 0.0026738 k( 118) = ( 0.3332850 0.5774341 0.5551879), wk = 0.0026738 k( 119) = ( 0.3249528 0.5629982 0.5551879), wk = 0.0026738 k( 120) = ( 0.3166207 0.5485624 0.5551879), wk = 0.0026738 k( 121) = ( 0.3082886 0.5341266 0.5551879), wk = 0.0026738 k( 122) = ( 0.2999565 0.5196907 0.5551879), wk = 0.0026738 k( 123) = ( 0.2916243 0.5052548 0.5551879), wk = 0.0026738 k( 124) = ( 0.2832922 0.4908190 0.5551879), wk = 0.0026738 k( 125) = ( 0.2749601 0.4763831 0.5551879), wk = 0.0026738 k( 126) = ( 0.2666280 0.4619473 0.5551879), wk = 0.0026738 k( 127) = ( 0.2582958 0.4475114 0.5551879), wk = 0.0026738 k( 128) = ( 0.2499637 0.4330756 0.5551879), wk = 0.0026738 k( 129) = ( 0.2416316 0.4186397 0.5551879), wk = 0.0026738 k( 130) = ( 0.2332995 0.4042039 0.5551879), wk = 0.0026738 k( 131) = ( 0.2249674 0.3897680 0.5551879), wk = 0.0026738 k( 132) = ( 0.2166352 0.3753322 0.5551879), wk = 0.0026738 k( 133) = ( 0.2083031 0.3608963 0.5551879), wk = 0.0026738 k( 134) = ( 0.1999710 0.3464605 0.5551879), wk = 0.0026738 k( 135) = ( 0.1916388 0.3320246 0.5551879), wk = 0.0026738 k( 136) = ( 0.1833067 0.3175888 0.5551879), wk = 0.0026738 k( 137) = ( 0.1749746 0.3031529 0.5551879), wk = 0.0026738 k( 138) = ( 0.1666425 0.2887171 0.5551879), wk = 0.0026738 k( 139) = ( 0.1583104 0.2742812 0.5551879), wk = 0.0026738 k( 140) = ( 0.1499782 0.2598453 0.5551879), wk = 0.0026738 k( 141) = ( 0.1416461 0.2454095 0.5551879), wk = 0.0026738 k( 142) = ( 0.1333140 0.2309736 0.5551879), wk = 0.0026738 k( 143) = ( 0.1249819 0.2165378 0.5551879), wk = 0.0026738 k( 144) = ( 0.1166497 0.2021019 0.5551879), wk = 0.0026738 k( 145) = ( 0.1083176 0.1876661 0.5551879), wk = 0.0026738 k( 146) = ( 0.0999855 0.1732302 0.5551879), wk = 0.0026738 k( 147) = ( 0.0916534 0.1587944 0.5551879), wk = 0.0026738 k( 148) = ( 0.0833212 0.1443585 0.5551879), wk = 0.0026738 k( 149) = ( 0.0749891 0.1299227 0.5551879), wk = 0.0026738 k( 150) = ( 0.0666570 0.1154868 0.5551879), wk = 0.0026738 k( 151) = ( 0.0583249 0.1010510 0.5551879), wk = 0.0026738 k( 152) = ( 0.0499927 0.0866151 0.5551879), wk = 0.0026738 k( 153) = ( 0.0416606 0.0721793 0.5551879), wk = 0.0026738 k( 154) = ( 0.0333285 0.0577434 0.5551879), wk = 0.0026738 k( 155) = ( 0.0249964 0.0433076 0.5551879), wk = 0.0026738 k( 156) = ( 0.0166642 0.0288717 0.5551879), wk = 0.0026738 k( 157) = ( 0.0083321 0.0144358 0.5551879), wk = 0.0026738 k( 158) = ( 0.0000000 0.0000000 0.5551879), wk = 0.0026738 k( 159) = ( 0.0000000 0.0000000 0.5551879), wk = 0.0026738 k( 160) = ( 0.0000000 0.0000000 0.5383640), wk = 0.0026738 k( 161) = ( 0.0000000 0.0000000 0.5215401), wk = 0.0026738 k( 162) = ( 0.0000000 0.0000000 0.5047163), wk = 0.0026738 k( 163) = ( 0.0000000 0.0000000 0.4878924), wk = 0.0026738 k( 164) = ( 0.0000000 0.0000000 0.4710685), wk = 0.0026738 k( 165) = ( 0.0000000 0.0000000 0.4542446), wk = 0.0026738 k( 166) = ( 0.0000000 0.0000000 0.4374208), wk = 0.0026738 k( 167) = ( 0.0000000 0.0000000 0.4205969), wk = 0.0026738 k( 168) = ( 0.0000000 0.0000000 0.4037730), wk = 0.0026738 k( 169) = ( 0.0000000 0.0000000 0.3869491), wk = 0.0026738 k( 170) = ( 0.0000000 0.0000000 0.3701253), wk = 0.0026738 k( 171) = ( 0.0000000 0.0000000 0.3533014), wk = 0.0026738 k( 172) = ( 0.0000000 0.0000000 0.3364775), wk = 0.0026738 k( 173) = ( 0.0000000 0.0000000 0.3196536), wk = 0.0026738 k( 174) = ( 0.0000000 0.0000000 0.3028298), wk = 0.0026738 k( 175) = ( 0.0000000 0.0000000 0.2860059), wk = 0.0026738 k( 176) = ( 0.0000000 0.0000000 0.2691820), wk = 0.0026738 k( 177) = ( 0.0000000 0.0000000 0.2523581), wk = 0.0026738 k( 178) = ( 0.0000000 0.0000000 0.2355343), wk = 0.0026738 k( 179) = ( 0.0000000 0.0000000 0.2187104), wk = 0.0026738 k( 180) = ( 0.0000000 0.0000000 0.2018865), wk = 0.0026738 k( 181) = ( 0.0000000 0.0000000 0.1850626), wk = 0.0026738 k( 182) = ( 0.0000000 0.0000000 0.1682388), wk = 0.0026738 k( 183) = ( 0.0000000 0.0000000 0.1514149), wk = 0.0026738 k( 184) = ( 0.0000000 0.0000000 0.1345910), wk = 0.0026738 k( 185) = ( 0.0000000 0.0000000 0.1177671), wk = 0.0026738 k( 186) = ( 0.0000000 0.0000000 0.1009433), wk = 0.0026738 k( 187) = ( 0.0000000 0.0000000 0.0841194), wk = 0.0026738 k( 188) = ( 0.0000000 0.0000000 0.0672955), wk = 0.0026738 k( 189) = ( 0.0000000 0.0000000 0.0504716), wk = 0.0026738 k( 190) = ( 0.0000000 0.0000000 0.0336478), wk = 0.0026738 k( 191) = ( 0.0000000 0.0000000 0.0168239), wk = 0.0026738 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 193) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 194) = ( -0.0142857 0.0082455 0.0000000), wk = 0.0026738 k( 195) = ( -0.0285714 0.0164909 0.0000000), wk = 0.0026738 k( 196) = ( -0.0428571 0.0247364 0.0000000), wk = 0.0026738 k( 197) = ( -0.0571429 0.0329819 0.0000000), wk = 0.0026738 k( 198) = ( -0.0714286 0.0412273 0.0000000), wk = 0.0026738 k( 199) = ( -0.0857143 0.0494728 0.0000000), wk = 0.0026738 k( 200) = ( -0.1000000 0.0577183 0.0000000), wk = 0.0026738 k( 201) = ( -0.1142857 0.0659637 0.0000000), wk = 0.0026738 k( 202) = ( -0.1285714 0.0742092 0.0000000), wk = 0.0026738 k( 203) = ( -0.1428571 0.0824547 0.0000000), wk = 0.0026738 k( 204) = ( -0.1571429 0.0907001 0.0000000), wk = 0.0026738 k( 205) = ( -0.1714286 0.0989456 0.0000000), wk = 0.0026738 k( 206) = ( -0.1857143 0.1071911 0.0000000), wk = 0.0026738 k( 207) = ( -0.2000000 0.1154365 0.0000000), wk = 0.0026738 k( 208) = ( -0.2142857 0.1236820 0.0000000), wk = 0.0026738 k( 209) = ( -0.2285714 0.1319275 0.0000000), wk = 0.0026738 k( 210) = ( -0.2428571 0.1401729 0.0000000), wk = 0.0026738 k( 211) = ( -0.2571429 0.1484184 0.0000000), wk = 0.0026738 k( 212) = ( -0.2714286 0.1566639 0.0000000), wk = 0.0026738 k( 213) = ( -0.2857143 0.1649093 0.0000000), wk = 0.0026738 k( 214) = ( -0.3000000 0.1731548 0.0000000), wk = 0.0026738 k( 215) = ( -0.3142857 0.1814003 0.0000000), wk = 0.0026738 k( 216) = ( -0.3285714 0.1896457 0.0000000), wk = 0.0026738 k( 217) = ( -0.3428571 0.1978912 0.0000000), wk = 0.0026738 k( 218) = ( -0.3571429 0.2061367 0.0000000), wk = 0.0026738 k( 219) = ( -0.3714286 0.2143821 0.0000000), wk = 0.0026738 k( 220) = ( -0.3857143 0.2226276 0.0000000), wk = 0.0026738 k( 221) = ( -0.4000000 0.2308731 0.0000000), wk = 0.0026738 k( 222) = ( -0.4142857 0.2391185 0.0000000), wk = 0.0026738 k( 223) = ( -0.4285714 0.2473640 0.0000000), wk = 0.0026738 k( 224) = ( -0.4428571 0.2556095 0.0000000), wk = 0.0026738 k( 225) = ( -0.4571429 0.2638549 0.0000000), wk = 0.0026738 k( 226) = ( -0.4714286 0.2721004 0.0000000), wk = 0.0026738 k( 227) = ( -0.4857143 0.2803459 0.0000000), wk = 0.0026738 k( 228) = ( -0.5000000 0.2885913 0.0000000), wk = 0.0026738 k( 229) = ( -0.5000000 0.2885913 0.0000000), wk = 0.0026738 k( 230) = ( -0.4916643 0.3030335 -0.0000000), wk = 0.0026738 k( 231) = ( -0.4833285 0.3174756 -0.0000000), wk = 0.0026738 k( 232) = ( -0.4749927 0.3319178 -0.0000000), wk = 0.0026738 k( 233) = ( -0.4666570 0.3463599 -0.0000000), wk = 0.0026738 k( 234) = ( -0.4583212 0.3608020 -0.0000000), wk = 0.0026738 k( 235) = ( -0.4499855 0.3752442 -0.0000000), wk = 0.0026738 k( 236) = ( -0.4416497 0.3896863 -0.0000000), wk = 0.0026738 k( 237) = ( -0.4333140 0.4041284 -0.0000000), wk = 0.0026738 k( 238) = ( -0.4249782 0.4185706 -0.0000000), wk = 0.0026738 k( 239) = ( -0.4166425 0.4330127 -0.0000000), wk = 0.0026738 k( 240) = ( -0.4083067 0.4474549 -0.0000000), wk = 0.0026738 k( 241) = ( -0.3999710 0.4618970 -0.0000000), wk = 0.0026738 k( 242) = ( -0.3916352 0.4763391 -0.0000000), wk = 0.0026738 k( 243) = ( -0.3832995 0.4907813 -0.0000000), wk = 0.0026738 k( 244) = ( -0.3749637 0.5052234 -0.0000000), wk = 0.0026738 k( 245) = ( -0.3666280 0.5196655 -0.0000000), wk = 0.0026738 k( 246) = ( -0.3582922 0.5341077 -0.0000000), wk = 0.0026738 k( 247) = ( -0.3499565 0.5485498 -0.0000000), wk = 0.0026738 k( 248) = ( -0.3416207 0.5629920 -0.0000000), wk = 0.0026738 k( 249) = ( -0.3332850 0.5774341 -0.0000000), wk = 0.0026738 k( 250) = ( -0.3332850 0.5774341 -0.0000000), wk = 0.0026738 k( 251) = ( -0.3332850 0.5774341 0.0168239), wk = 0.0026738 k( 252) = ( -0.3332850 0.5774341 0.0336478), wk = 0.0026738 k( 253) = ( -0.3332850 0.5774341 0.0504716), wk = 0.0026738 k( 254) = ( -0.3332850 0.5774341 0.0672955), wk = 0.0026738 k( 255) = ( -0.3332850 0.5774341 0.0841194), wk = 0.0026738 k( 256) = ( -0.3332850 0.5774341 0.1009433), wk = 0.0026738 k( 257) = ( -0.3332850 0.5774341 0.1177671), wk = 0.0026738 k( 258) = ( -0.3332850 0.5774341 0.1345910), wk = 0.0026738 k( 259) = ( -0.3332850 0.5774341 0.1514149), wk = 0.0026738 k( 260) = ( -0.3332850 0.5774341 0.1682388), wk = 0.0026738 k( 261) = ( -0.3332850 0.5774341 0.1850626), wk = 0.0026738 k( 262) = ( -0.3332850 0.5774341 0.2018865), wk = 0.0026738 k( 263) = ( -0.3332850 0.5774341 0.2187104), wk = 0.0026738 k( 264) = ( -0.3332850 0.5774341 0.2355343), wk = 0.0026738 k( 265) = ( -0.3332850 0.5774341 0.2523581), wk = 0.0026738 k( 266) = ( -0.3332850 0.5774341 0.2691820), wk = 0.0026738 k( 267) = ( -0.3332850 0.5774341 0.2860059), wk = 0.0026738 k( 268) = ( -0.3332850 0.5774341 0.3028298), wk = 0.0026738 k( 269) = ( -0.3332850 0.5774341 0.3196536), wk = 0.0026738 k( 270) = ( -0.3332850 0.5774341 0.3364775), wk = 0.0026738 k( 271) = ( -0.3332850 0.5774341 0.3533014), wk = 0.0026738 k( 272) = ( -0.3332850 0.5774341 0.3701253), wk = 0.0026738 k( 273) = ( -0.3332850 0.5774341 0.3869491), wk = 0.0026738 k( 274) = ( -0.3332850 0.5774341 0.4037730), wk = 0.0026738 k( 275) = ( -0.3332850 0.5774341 0.4205969), wk = 0.0026738 k( 276) = ( -0.3332850 0.5774341 0.4374208), wk = 0.0026738 k( 277) = ( -0.3332850 0.5774341 0.4542446), wk = 0.0026738 k( 278) = ( -0.3332850 0.5774341 0.4710685), wk = 0.0026738 k( 279) = ( -0.3332850 0.5774341 0.4878924), wk = 0.0026738 k( 280) = ( -0.3332850 0.5774341 0.5047163), wk = 0.0026738 k( 281) = ( -0.3332850 0.5774341 0.5215401), wk = 0.0026738 k( 282) = ( -0.3332850 0.5774341 0.5383640), wk = 0.0026738 k( 283) = ( -0.3332850 0.5774341 0.5551879), wk = 0.0026738 k( 284) = ( -0.3332850 0.5774341 0.5551879), wk = 0.0026738 k( 285) = ( -0.3416207 0.5629920 0.5551879), wk = 0.0026738 k( 286) = ( -0.3499565 0.5485498 0.5551879), wk = 0.0026738 k( 287) = ( -0.3582922 0.5341077 0.5551879), wk = 0.0026738 k( 288) = ( -0.3666280 0.5196655 0.5551879), wk = 0.0026738 k( 289) = ( -0.3749637 0.5052234 0.5551879), wk = 0.0026738 k( 290) = ( -0.3832995 0.4907813 0.5551879), wk = 0.0026738 k( 291) = ( -0.3916352 0.4763391 0.5551879), wk = 0.0026738 k( 292) = ( -0.3999710 0.4618970 0.5551879), wk = 0.0026738 k( 293) = ( -0.4083067 0.4474549 0.5551879), wk = 0.0026738 k( 294) = ( -0.4166425 0.4330127 0.5551879), wk = 0.0026738 k( 295) = ( -0.4249782 0.4185706 0.5551879), wk = 0.0026738 k( 296) = ( -0.4333140 0.4041284 0.5551879), wk = 0.0026738 k( 297) = ( -0.4416497 0.3896863 0.5551879), wk = 0.0026738 k( 298) = ( -0.4499855 0.3752442 0.5551879), wk = 0.0026738 k( 299) = ( -0.4583212 0.3608020 0.5551879), wk = 0.0026738 k( 300) = ( -0.4666570 0.3463599 0.5551879), wk = 0.0026738 k( 301) = ( -0.4749927 0.3319178 0.5551879), wk = 0.0026738 k( 302) = ( -0.4833285 0.3174756 0.5551879), wk = 0.0026738 k( 303) = ( -0.4916643 0.3030335 0.5551879), wk = 0.0026738 k( 304) = ( -0.5000000 0.2885913 0.5551879), wk = 0.0026738 k( 305) = ( -0.5000000 0.2885913 0.5551879), wk = 0.0026738 k( 306) = ( -0.5000000 0.2885913 0.5383640), wk = 0.0026738 k( 307) = ( -0.5000000 0.2885913 0.5215401), wk = 0.0026738 k( 308) = ( -0.5000000 0.2885913 0.5047163), wk = 0.0026738 k( 309) = ( -0.5000000 0.2885913 0.4878924), wk = 0.0026738 k( 310) = ( -0.5000000 0.2885913 0.4710685), wk = 0.0026738 k( 311) = ( -0.5000000 0.2885913 0.4542446), wk = 0.0026738 k( 312) = ( -0.5000000 0.2885913 0.4374208), wk = 0.0026738 k( 313) = ( -0.5000000 0.2885913 0.4205969), wk = 0.0026738 k( 314) = ( -0.5000000 0.2885913 0.4037730), wk = 0.0026738 k( 315) = ( -0.5000000 0.2885913 0.3869491), wk = 0.0026738 k( 316) = ( -0.5000000 0.2885913 0.3701253), wk = 0.0026738 k( 317) = ( -0.5000000 0.2885913 0.3533014), wk = 0.0026738 k( 318) = ( -0.5000000 0.2885913 0.3364775), wk = 0.0026738 k( 319) = ( -0.5000000 0.2885913 0.3196536), wk = 0.0026738 k( 320) = ( -0.5000000 0.2885913 0.3028298), wk = 0.0026738 k( 321) = ( -0.5000000 0.2885913 0.2860059), wk = 0.0026738 k( 322) = ( -0.5000000 0.2885913 0.2691820), wk = 0.0026738 k( 323) = ( -0.5000000 0.2885913 0.2523581), wk = 0.0026738 k( 324) = ( -0.5000000 0.2885913 0.2355343), wk = 0.0026738 k( 325) = ( -0.5000000 0.2885913 0.2187104), wk = 0.0026738 k( 326) = ( -0.5000000 0.2885913 0.2018865), wk = 0.0026738 k( 327) = ( -0.5000000 0.2885913 0.1850626), wk = 0.0026738 k( 328) = ( -0.5000000 0.2885913 0.1682388), wk = 0.0026738 k( 329) = ( -0.5000000 0.2885913 0.1514149), wk = 0.0026738 k( 330) = ( -0.5000000 0.2885913 0.1345910), wk = 0.0026738 k( 331) = ( -0.5000000 0.2885913 0.1177671), wk = 0.0026738 k( 332) = ( -0.5000000 0.2885913 0.1009433), wk = 0.0026738 k( 333) = ( -0.5000000 0.2885913 0.0841194), wk = 0.0026738 k( 334) = ( -0.5000000 0.2885913 0.0672955), wk = 0.0026738 k( 335) = ( -0.5000000 0.2885913 0.0504716), wk = 0.0026738 k( 336) = ( -0.5000000 0.2885913 0.0336478), wk = 0.0026738 k( 337) = ( -0.5000000 0.2885913 0.0168239), wk = 0.0026738 k( 338) = ( -0.5000000 0.2885913 0.0000000), wk = 0.0026738 k( 339) = ( 0.0000000 0.0000000 0.5551879), wk = 0.0026738 k( 340) = ( -0.0142857 0.0082455 0.5551879), wk = 0.0026738 k( 341) = ( -0.0285714 0.0164909 0.5551879), wk = 0.0026738 k( 342) = ( -0.0428571 0.0247364 0.5551879), wk = 0.0026738 k( 343) = ( -0.0571429 0.0329819 0.5551879), wk = 0.0026738 k( 344) = ( -0.0714286 0.0412273 0.5551879), wk = 0.0026738 k( 345) = ( -0.0857143 0.0494728 0.5551879), wk = 0.0026738 k( 346) = ( -0.1000000 0.0577183 0.5551879), wk = 0.0026738 k( 347) = ( -0.1142857 0.0659637 0.5551879), wk = 0.0026738 k( 348) = ( -0.1285714 0.0742092 0.5551879), wk = 0.0026738 k( 349) = ( -0.1428571 0.0824547 0.5551879), wk = 0.0026738 k( 350) = ( -0.1571429 0.0907001 0.5551879), wk = 0.0026738 k( 351) = ( -0.1714286 0.0989456 0.5551879), wk = 0.0026738 k( 352) = ( -0.1857143 0.1071911 0.5551879), wk = 0.0026738 k( 353) = ( -0.2000000 0.1154365 0.5551879), wk = 0.0026738 k( 354) = ( -0.2142857 0.1236820 0.5551879), wk = 0.0026738 k( 355) = ( -0.2285714 0.1319275 0.5551879), wk = 0.0026738 k( 356) = ( -0.2428571 0.1401729 0.5551879), wk = 0.0026738 k( 357) = ( -0.2571429 0.1484184 0.5551879), wk = 0.0026738 k( 358) = ( -0.2714286 0.1566639 0.5551879), wk = 0.0026738 k( 359) = ( -0.2857143 0.1649093 0.5551879), wk = 0.0026738 k( 360) = ( -0.3000000 0.1731548 0.5551879), wk = 0.0026738 k( 361) = ( -0.3142857 0.1814003 0.5551879), wk = 0.0026738 k( 362) = ( -0.3285714 0.1896457 0.5551879), wk = 0.0026738 k( 363) = ( -0.3428571 0.1978912 0.5551879), wk = 0.0026738 k( 364) = ( -0.3571429 0.2061367 0.5551879), wk = 0.0026738 k( 365) = ( -0.3714286 0.2143821 0.5551879), wk = 0.0026738 k( 366) = ( -0.3857143 0.2226276 0.5551879), wk = 0.0026738 k( 367) = ( -0.4000000 0.2308731 0.5551879), wk = 0.0026738 k( 368) = ( -0.4142857 0.2391185 0.5551879), wk = 0.0026738 k( 369) = ( -0.4285714 0.2473640 0.5551879), wk = 0.0026738 k( 370) = ( -0.4428571 0.2556095 0.5551879), wk = 0.0026738 k( 371) = ( -0.4571429 0.2638549 0.5551879), wk = 0.0026738 k( 372) = ( -0.4714286 0.2721004 0.5551879), wk = 0.0026738 k( 373) = ( -0.4857143 0.2803459 0.5551879), wk = 0.0026738 k( 374) = ( -0.5000000 0.2885913 0.5551879), wk = 0.0026738 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 2) = ( 0.0083321 0.0083321 0.0000000), wk = 0.0026738 k( 3) = ( 0.0166642 0.0166642 0.0000000), wk = 0.0026738 k( 4) = ( 0.0249964 0.0249964 0.0000000), wk = 0.0026738 k( 5) = ( 0.0333285 0.0333285 0.0000000), wk = 0.0026738 k( 6) = ( 0.0416606 0.0416606 0.0000000), wk = 0.0026738 k( 7) = ( 0.0499927 0.0499927 0.0000000), wk = 0.0026738 k( 8) = ( 0.0583249 0.0583249 0.0000000), wk = 0.0026738 k( 9) = ( 0.0666570 0.0666570 0.0000000), wk = 0.0026738 k( 10) = ( 0.0749891 0.0749891 0.0000000), wk = 0.0026738 k( 11) = ( 0.0833212 0.0833212 0.0000000), wk = 0.0026738 k( 12) = ( 0.0916534 0.0916534 0.0000000), wk = 0.0026738 k( 13) = ( 0.0999855 0.0999855 0.0000000), wk = 0.0026738 k( 14) = ( 0.1083176 0.1083176 0.0000000), wk = 0.0026738 k( 15) = ( 0.1166497 0.1166497 0.0000000), wk = 0.0026738 k( 16) = ( 0.1249819 0.1249819 0.0000000), wk = 0.0026738 k( 17) = ( 0.1333140 0.1333140 0.0000000), wk = 0.0026738 k( 18) = ( 0.1416461 0.1416461 -0.0000000), wk = 0.0026738 k( 19) = ( 0.1499782 0.1499782 0.0000000), wk = 0.0026738 k( 20) = ( 0.1583104 0.1583104 0.0000000), wk = 0.0026738 k( 21) = ( 0.1666425 0.1666425 0.0000000), wk = 0.0026738 k( 22) = ( 0.1749746 0.1749746 0.0000000), wk = 0.0026738 k( 23) = ( 0.1833067 0.1833067 0.0000000), wk = 0.0026738 k( 24) = ( 0.1916388 0.1916388 0.0000000), wk = 0.0026738 k( 25) = ( 0.1999710 0.1999710 0.0000000), wk = 0.0026738 k( 26) = ( 0.2083031 0.2083031 0.0000000), wk = 0.0026738 k( 27) = ( 0.2166352 0.2166352 0.0000000), wk = 0.0026738 k( 28) = ( 0.2249674 0.2249674 -0.0000000), wk = 0.0026738 k( 29) = ( 0.2332995 0.2332995 0.0000000), wk = 0.0026738 k( 30) = ( 0.2416316 0.2416316 0.0000000), wk = 0.0026738 k( 31) = ( 0.2499637 0.2499637 0.0000000), wk = 0.0026738 k( 32) = ( 0.2582958 0.2582958 0.0000000), wk = 0.0026738 k( 33) = ( 0.2666280 0.2666280 0.0000000), wk = 0.0026738 k( 34) = ( 0.2749601 0.2749601 0.0000000), wk = 0.0026738 k( 35) = ( 0.2832922 0.2832922 0.0000000), wk = 0.0026738 k( 36) = ( 0.2916243 0.2916243 -0.0000000), wk = 0.0026738 k( 37) = ( 0.2999565 0.2999565 0.0000000), wk = 0.0026738 k( 38) = ( 0.3082886 0.3082886 0.0000000), wk = 0.0026738 k( 39) = ( 0.3166207 0.3166207 0.0000000), wk = 0.0026738 k( 40) = ( 0.3249528 0.3249528 0.0000000), wk = 0.0026738 k( 41) = ( 0.3332850 0.3332850 0.0000000), wk = 0.0026738 k( 42) = ( 0.3332850 0.3332850 0.0000000), wk = 0.0026738 k( 43) = ( 0.3166207 0.3416207 0.0000000), wk = 0.0026738 k( 44) = ( 0.2999565 0.3499565 0.0000000), wk = 0.0026738 k( 45) = ( 0.2832922 0.3582922 0.0000000), wk = 0.0026738 k( 46) = ( 0.2666280 0.3666280 0.0000000), wk = 0.0026738 k( 47) = ( 0.2499637 0.3749637 0.0000000), wk = 0.0026738 k( 48) = ( 0.2332995 0.3832995 0.0000000), wk = 0.0026738 k( 49) = ( 0.2166352 0.3916352 0.0000000), wk = 0.0026738 k( 50) = ( 0.1999710 0.3999710 0.0000000), wk = 0.0026738 k( 51) = ( 0.1833067 0.4083067 0.0000000), wk = 0.0026738 k( 52) = ( 0.1666425 0.4166425 0.0000000), wk = 0.0026738 k( 53) = ( 0.1499782 0.4249782 -0.0000000), wk = 0.0026738 k( 54) = ( 0.1333140 0.4333140 0.0000000), wk = 0.0026738 k( 55) = ( 0.1166497 0.4416497 -0.0000000), wk = 0.0026738 k( 56) = ( 0.0999855 0.4499855 0.0000000), wk = 0.0026738 k( 57) = ( 0.0833212 0.4583212 0.0000000), wk = 0.0026738 k( 58) = ( 0.0666570 0.4666570 0.0000000), wk = 0.0026738 k( 59) = ( 0.0499927 0.4749927 -0.0000000), wk = 0.0026738 k( 60) = ( 0.0333285 0.4833285 0.0000000), wk = 0.0026738 k( 61) = ( 0.0166642 0.4916643 0.0000000), wk = 0.0026738 k( 62) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026738 k( 63) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026738 k( 64) = ( 0.0000000 0.5000000 0.0151515), wk = 0.0026738 k( 65) = ( 0.0000000 0.5000000 0.0303030), wk = 0.0026738 k( 66) = ( 0.0000000 0.5000000 0.0454546), wk = 0.0026738 k( 67) = ( 0.0000000 0.5000000 0.0606061), wk = 0.0026738 k( 68) = ( 0.0000000 0.5000000 0.0757576), wk = 0.0026738 k( 69) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0026738 k( 70) = ( 0.0000000 0.5000000 0.1060606), wk = 0.0026738 k( 71) = ( 0.0000000 0.5000000 0.1212121), wk = 0.0026738 k( 72) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0026738 k( 73) = ( 0.0000000 0.5000000 0.1515151), wk = 0.0026738 k( 74) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0026738 k( 75) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0026738 k( 76) = ( 0.0000000 0.5000000 0.1969697), wk = 0.0026738 k( 77) = ( 0.0000000 0.5000000 0.2121212), wk = 0.0026738 k( 78) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0026738 k( 79) = ( 0.0000000 0.5000000 0.2424242), wk = 0.0026738 k( 80) = ( 0.0000000 0.5000000 0.2575758), wk = 0.0026738 k( 81) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0026738 k( 82) = ( 0.0000000 0.5000000 0.2878788), wk = 0.0026738 k( 83) = ( 0.0000000 0.5000000 0.3030303), wk = 0.0026738 k( 84) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0026738 k( 85) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0026738 k( 86) = ( 0.0000000 0.5000000 0.3484849), wk = 0.0026738 k( 87) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0026738 k( 88) = ( 0.0000000 0.5000000 0.3787879), wk = 0.0026738 k( 89) = ( 0.0000000 0.5000000 0.3939394), wk = 0.0026738 k( 90) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0026738 k( 91) = ( 0.0000000 0.5000000 0.4242424), wk = 0.0026738 k( 92) = ( 0.0000000 0.5000000 0.4393939), wk = 0.0026738 k( 93) = ( 0.0000000 0.5000000 0.4545455), wk = 0.0026738 k( 94) = ( 0.0000000 0.5000000 0.4696970), wk = 0.0026738 k( 95) = ( 0.0000000 0.5000000 0.4848485), wk = 0.0026738 k( 96) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026738 k( 97) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026738 k( 98) = ( 0.0166642 0.4916643 0.5000000), wk = 0.0026738 k( 99) = ( 0.0333285 0.4833285 0.5000000), wk = 0.0026738 k( 100) = ( 0.0499927 0.4749927 0.5000000), wk = 0.0026738 k( 101) = ( 0.0666570 0.4666570 0.5000000), wk = 0.0026738 k( 102) = ( 0.0833212 0.4583212 0.5000000), wk = 0.0026738 k( 103) = ( 0.0999855 0.4499855 0.5000000), wk = 0.0026738 k( 104) = ( 0.1166497 0.4416497 0.5000000), wk = 0.0026738 k( 105) = ( 0.1333140 0.4333140 0.5000000), wk = 0.0026738 k( 106) = ( 0.1499782 0.4249782 0.5000000), wk = 0.0026738 k( 107) = ( 0.1666425 0.4166425 0.5000000), wk = 0.0026738 k( 108) = ( 0.1833067 0.4083067 0.5000000), wk = 0.0026738 k( 109) = ( 0.1999710 0.3999710 0.5000000), wk = 0.0026738 k( 110) = ( 0.2166352 0.3916352 0.5000000), wk = 0.0026738 k( 111) = ( 0.2332995 0.3832995 0.5000000), wk = 0.0026738 k( 112) = ( 0.2499637 0.3749637 0.5000000), wk = 0.0026738 k( 113) = ( 0.2666280 0.3666280 0.5000000), wk = 0.0026738 k( 114) = ( 0.2832922 0.3582922 0.5000000), wk = 0.0026738 k( 115) = ( 0.2999565 0.3499565 0.5000000), wk = 0.0026738 k( 116) = ( 0.3166207 0.3416207 0.5000000), wk = 0.0026738 k( 117) = ( 0.3332850 0.3332850 0.5000000), wk = 0.0026738 k( 118) = ( 0.3332850 0.3332850 0.5000000), wk = 0.0026738 k( 119) = ( 0.3249528 0.3249528 0.5000000), wk = 0.0026738 k( 120) = ( 0.3166207 0.3166207 0.5000000), wk = 0.0026738 k( 121) = ( 0.3082886 0.3082886 0.5000000), wk = 0.0026738 k( 122) = ( 0.2999565 0.2999565 0.5000000), wk = 0.0026738 k( 123) = ( 0.2916243 0.2916243 0.5000000), wk = 0.0026738 k( 124) = ( 0.2832922 0.2832922 0.5000000), wk = 0.0026738 k( 125) = ( 0.2749601 0.2749601 0.5000000), wk = 0.0026738 k( 126) = ( 0.2666280 0.2666280 0.5000000), wk = 0.0026738 k( 127) = ( 0.2582958 0.2582958 0.5000000), wk = 0.0026738 k( 128) = ( 0.2499637 0.2499637 0.5000000), wk = 0.0026738 k( 129) = ( 0.2416316 0.2416316 0.5000000), wk = 0.0026738 k( 130) = ( 0.2332995 0.2332995 0.5000000), wk = 0.0026738 k( 131) = ( 0.2249674 0.2249674 0.5000000), wk = 0.0026738 k( 132) = ( 0.2166352 0.2166352 0.5000000), wk = 0.0026738 k( 133) = ( 0.2083031 0.2083031 0.5000000), wk = 0.0026738 k( 134) = ( 0.1999710 0.1999710 0.5000000), wk = 0.0026738 k( 135) = ( 0.1916388 0.1916388 0.5000000), wk = 0.0026738 k( 136) = ( 0.1833067 0.1833067 0.5000000), wk = 0.0026738 k( 137) = ( 0.1749746 0.1749746 0.5000000), wk = 0.0026738 k( 138) = ( 0.1666425 0.1666425 0.5000000), wk = 0.0026738 k( 139) = ( 0.1583104 0.1583104 0.5000000), wk = 0.0026738 k( 140) = ( 0.1499782 0.1499782 0.5000000), wk = 0.0026738 k( 141) = ( 0.1416461 0.1416461 0.5000000), wk = 0.0026738 k( 142) = ( 0.1333140 0.1333140 0.5000000), wk = 0.0026738 k( 143) = ( 0.1249819 0.1249819 0.5000000), wk = 0.0026738 k( 144) = ( 0.1166497 0.1166497 0.5000000), wk = 0.0026738 k( 145) = ( 0.1083176 0.1083176 0.5000000), wk = 0.0026738 k( 146) = ( 0.0999855 0.0999855 0.5000000), wk = 0.0026738 k( 147) = ( 0.0916534 0.0916534 0.5000000), wk = 0.0026738 k( 148) = ( 0.0833212 0.0833212 0.5000000), wk = 0.0026738 k( 149) = ( 0.0749891 0.0749891 0.5000000), wk = 0.0026738 k( 150) = ( 0.0666570 0.0666570 0.5000000), wk = 0.0026738 k( 151) = ( 0.0583249 0.0583249 0.5000000), wk = 0.0026738 k( 152) = ( 0.0499927 0.0499927 0.5000000), wk = 0.0026738 k( 153) = ( 0.0416606 0.0416606 0.5000000), wk = 0.0026738 k( 154) = ( 0.0333285 0.0333285 0.5000000), wk = 0.0026738 k( 155) = ( 0.0249964 0.0249964 0.5000000), wk = 0.0026738 k( 156) = ( 0.0166642 0.0166642 0.5000000), wk = 0.0026738 k( 157) = ( 0.0083321 0.0083321 0.5000000), wk = 0.0026738 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026738 k( 159) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026738 k( 160) = ( 0.0000000 0.0000000 0.4848485), wk = 0.0026738 k( 161) = ( 0.0000000 0.0000000 0.4696970), wk = 0.0026738 k( 162) = ( 0.0000000 0.0000000 0.4545454), wk = 0.0026738 k( 163) = ( 0.0000000 0.0000000 0.4393939), wk = 0.0026738 k( 164) = ( 0.0000000 0.0000000 0.4242424), wk = 0.0026738 k( 165) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0026738 k( 166) = ( 0.0000000 0.0000000 0.3939394), wk = 0.0026738 k( 167) = ( 0.0000000 0.0000000 0.3787879), wk = 0.0026738 k( 168) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0026738 k( 169) = ( 0.0000000 0.0000000 0.3484849), wk = 0.0026738 k( 170) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0026738 k( 171) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0026738 k( 172) = ( 0.0000000 0.0000000 0.3030303), wk = 0.0026738 k( 173) = ( 0.0000000 0.0000000 0.2878788), wk = 0.0026738 k( 174) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0026738 k( 175) = ( 0.0000000 0.0000000 0.2575758), wk = 0.0026738 k( 176) = ( 0.0000000 0.0000000 0.2424242), wk = 0.0026738 k( 177) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0026738 k( 178) = ( 0.0000000 0.0000000 0.2121212), wk = 0.0026738 k( 179) = ( 0.0000000 0.0000000 0.1969697), wk = 0.0026738 k( 180) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0026738 k( 181) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0026738 k( 182) = ( 0.0000000 0.0000000 0.1515151), wk = 0.0026738 k( 183) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0026738 k( 184) = ( 0.0000000 0.0000000 0.1212121), wk = 0.0026738 k( 185) = ( 0.0000000 0.0000000 0.1060606), wk = 0.0026738 k( 186) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0026738 k( 187) = ( 0.0000000 0.0000000 0.0757576), wk = 0.0026738 k( 188) = ( 0.0000000 0.0000000 0.0606061), wk = 0.0026738 k( 189) = ( 0.0000000 0.0000000 0.0454545), wk = 0.0026738 k( 190) = ( 0.0000000 0.0000000 0.0303030), wk = 0.0026738 k( 191) = ( 0.0000000 0.0000000 0.0151515), wk = 0.0026738 k( 192) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 193) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026738 k( 194) = ( -0.0142857 0.0142857 0.0000000), wk = 0.0026738 k( 195) = ( -0.0285714 0.0285714 -0.0000000), wk = 0.0026738 k( 196) = ( -0.0428571 0.0428571 0.0000000), wk = 0.0026738 k( 197) = ( -0.0571429 0.0571429 -0.0000000), wk = 0.0026738 k( 198) = ( -0.0714286 0.0714286 0.0000000), wk = 0.0026738 k( 199) = ( -0.0857143 0.0857143 0.0000000), wk = 0.0026738 k( 200) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0026738 k( 201) = ( -0.1142857 0.1142857 0.0000000), wk = 0.0026738 k( 202) = ( -0.1285714 0.1285714 0.0000000), wk = 0.0026738 k( 203) = ( -0.1428571 0.1428571 0.0000000), wk = 0.0026738 k( 204) = ( -0.1571429 0.1571429 0.0000000), wk = 0.0026738 k( 205) = ( -0.1714286 0.1714286 0.0000000), wk = 0.0026738 k( 206) = ( -0.1857143 0.1857143 0.0000000), wk = 0.0026738 k( 207) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0026738 k( 208) = ( -0.2142857 0.2142857 0.0000000), wk = 0.0026738 k( 209) = ( -0.2285714 0.2285714 0.0000000), wk = 0.0026738 k( 210) = ( -0.2428571 0.2428571 -0.0000000), wk = 0.0026738 k( 211) = ( -0.2571429 0.2571429 0.0000000), wk = 0.0026738 k( 212) = ( -0.2714286 0.2714286 0.0000000), wk = 0.0026738 k( 213) = ( -0.2857143 0.2857143 0.0000000), wk = 0.0026738 k( 214) = ( -0.3000000 0.3000000 0.0000000), wk = 0.0026738 k( 215) = ( -0.3142857 0.3142857 0.0000000), wk = 0.0026738 k( 216) = ( -0.3285714 0.3285714 0.0000000), wk = 0.0026738 k( 217) = ( -0.3428571 0.3428571 0.0000000), wk = 0.0026738 k( 218) = ( -0.3571429 0.3571429 0.0000000), wk = 0.0026738 k( 219) = ( -0.3714286 0.3714286 0.0000000), wk = 0.0026738 k( 220) = ( -0.3857143 0.3857143 0.0000000), wk = 0.0026738 k( 221) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0026738 k( 222) = ( -0.4142857 0.4142857 0.0000000), wk = 0.0026738 k( 223) = ( -0.4285714 0.4285714 0.0000000), wk = 0.0026738 k( 224) = ( -0.4428571 0.4428571 0.0000000), wk = 0.0026738 k( 225) = ( -0.4571429 0.4571429 0.0000000), wk = 0.0026738 k( 226) = ( -0.4714286 0.4714286 0.0000000), wk = 0.0026738 k( 227) = ( -0.4857143 0.4857143 0.0000000), wk = 0.0026738 k( 228) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0026738 k( 229) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0026738 k( 230) = ( -0.4916643 0.5083357 0.0000000), wk = 0.0026738 k( 231) = ( -0.4833285 0.5166715 0.0000000), wk = 0.0026738 k( 232) = ( -0.4749927 0.5250073 0.0000000), wk = 0.0026738 k( 233) = ( -0.4666570 0.5333430 0.0000000), wk = 0.0026738 k( 234) = ( -0.4583212 0.5416788 0.0000000), wk = 0.0026738 k( 235) = ( -0.4499855 0.5500145 -0.0000000), wk = 0.0026738 k( 236) = ( -0.4416497 0.5583503 -0.0000000), wk = 0.0026738 k( 237) = ( -0.4333140 0.5666860 0.0000000), wk = 0.0026738 k( 238) = ( -0.4249782 0.5750218 -0.0000000), wk = 0.0026738 k( 239) = ( -0.4166425 0.5833575 0.0000000), wk = 0.0026738 k( 240) = ( -0.4083067 0.5916933 0.0000000), wk = 0.0026738 k( 241) = ( -0.3999710 0.6000290 0.0000000), wk = 0.0026738 k( 242) = ( -0.3916352 0.6083648 -0.0000000), wk = 0.0026738 k( 243) = ( -0.3832995 0.6167005 0.0000000), wk = 0.0026738 k( 244) = ( -0.3749637 0.6250363 0.0000000), wk = 0.0026738 k( 245) = ( -0.3666280 0.6333720 0.0000000), wk = 0.0026738 k( 246) = ( -0.3582922 0.6417078 0.0000000), wk = 0.0026738 k( 247) = ( -0.3499565 0.6500435 0.0000000), wk = 0.0026738 k( 248) = ( -0.3416207 0.6583793 0.0000000), wk = 0.0026738 k( 249) = ( -0.3332850 0.6667150 0.0000000), wk = 0.0026738 k( 250) = ( -0.3332850 0.6667150 0.0000000), wk = 0.0026738 k( 251) = ( -0.3332850 0.6667150 0.0151515), wk = 0.0026738 k( 252) = ( -0.3332850 0.6667150 0.0303030), wk = 0.0026738 k( 253) = ( -0.3332850 0.6667150 0.0454545), wk = 0.0026738 k( 254) = ( -0.3332850 0.6667150 0.0606061), wk = 0.0026738 k( 255) = ( -0.3332850 0.6667150 0.0757576), wk = 0.0026738 k( 256) = ( -0.3332850 0.6667150 0.0909091), wk = 0.0026738 k( 257) = ( -0.3332850 0.6667150 0.1060606), wk = 0.0026738 k( 258) = ( -0.3332850 0.6667150 0.1212121), wk = 0.0026738 k( 259) = ( -0.3332850 0.6667150 0.1363636), wk = 0.0026738 k( 260) = ( -0.3332850 0.6667150 0.1515151), wk = 0.0026738 k( 261) = ( -0.3332850 0.6667150 0.1666667), wk = 0.0026738 k( 262) = ( -0.3332850 0.6667150 0.1818182), wk = 0.0026738 k( 263) = ( -0.3332850 0.6667150 0.1969697), wk = 0.0026738 k( 264) = ( -0.3332850 0.6667150 0.2121212), wk = 0.0026738 k( 265) = ( -0.3332850 0.6667150 0.2272727), wk = 0.0026738 k( 266) = ( -0.3332850 0.6667150 0.2424242), wk = 0.0026738 k( 267) = ( -0.3332850 0.6667150 0.2575758), wk = 0.0026738 k( 268) = ( -0.3332850 0.6667150 0.2727273), wk = 0.0026738 k( 269) = ( -0.3332850 0.6667150 0.2878788), wk = 0.0026738 k( 270) = ( -0.3332850 0.6667150 0.3030303), wk = 0.0026738 k( 271) = ( -0.3332850 0.6667150 0.3181818), wk = 0.0026738 k( 272) = ( -0.3332850 0.6667150 0.3333333), wk = 0.0026738 k( 273) = ( -0.3332850 0.6667150 0.3484849), wk = 0.0026738 k( 274) = ( -0.3332850 0.6667150 0.3636364), wk = 0.0026738 k( 275) = ( -0.3332850 0.6667150 0.3787879), wk = 0.0026738 k( 276) = ( -0.3332850 0.6667150 0.3939394), wk = 0.0026738 k( 277) = ( -0.3332850 0.6667150 0.4090909), wk = 0.0026738 k( 278) = ( -0.3332850 0.6667150 0.4242424), wk = 0.0026738 k( 279) = ( -0.3332850 0.6667150 0.4393939), wk = 0.0026738 k( 280) = ( -0.3332850 0.6667150 0.4545454), wk = 0.0026738 k( 281) = ( -0.3332850 0.6667150 0.4696970), wk = 0.0026738 k( 282) = ( -0.3332850 0.6667150 0.4848485), wk = 0.0026738 k( 283) = ( -0.3332850 0.6667150 0.5000000), wk = 0.0026738 k( 284) = ( -0.3332850 0.6667150 0.5000000), wk = 0.0026738 k( 285) = ( -0.3416207 0.6583793 0.5000000), wk = 0.0026738 k( 286) = ( -0.3499565 0.6500435 0.5000000), wk = 0.0026738 k( 287) = ( -0.3582922 0.6417078 0.5000000), wk = 0.0026738 k( 288) = ( -0.3666280 0.6333720 0.5000000), wk = 0.0026738 k( 289) = ( -0.3749637 0.6250363 0.5000000), wk = 0.0026738 k( 290) = ( -0.3832995 0.6167005 0.5000000), wk = 0.0026738 k( 291) = ( -0.3916352 0.6083648 0.5000000), wk = 0.0026738 k( 292) = ( -0.3999710 0.6000290 0.5000000), wk = 0.0026738 k( 293) = ( -0.4083067 0.5916933 0.5000000), wk = 0.0026738 k( 294) = ( -0.4166425 0.5833575 0.5000000), wk = 0.0026738 k( 295) = ( -0.4249782 0.5750218 0.5000000), wk = 0.0026738 k( 296) = ( -0.4333140 0.5666860 0.5000000), wk = 0.0026738 k( 297) = ( -0.4416497 0.5583503 0.5000000), wk = 0.0026738 k( 298) = ( -0.4499855 0.5500145 0.5000000), wk = 0.0026738 k( 299) = ( -0.4583212 0.5416788 0.5000000), wk = 0.0026738 k( 300) = ( -0.4666570 0.5333430 0.5000000), wk = 0.0026738 k( 301) = ( -0.4749927 0.5250073 0.5000000), wk = 0.0026738 k( 302) = ( -0.4833285 0.5166715 0.5000000), wk = 0.0026738 k( 303) = ( -0.4916643 0.5083357 0.5000000), wk = 0.0026738 k( 304) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026738 k( 305) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026738 k( 306) = ( -0.5000000 0.5000000 0.4848485), wk = 0.0026738 k( 307) = ( -0.5000000 0.5000000 0.4696970), wk = 0.0026738 k( 308) = ( -0.5000000 0.5000000 0.4545454), wk = 0.0026738 k( 309) = ( -0.5000000 0.5000000 0.4393939), wk = 0.0026738 k( 310) = ( -0.5000000 0.5000000 0.4242424), wk = 0.0026738 k( 311) = ( -0.5000000 0.5000000 0.4090909), wk = 0.0026738 k( 312) = ( -0.5000000 0.5000000 0.3939394), wk = 0.0026738 k( 313) = ( -0.5000000 0.5000000 0.3787879), wk = 0.0026738 k( 314) = ( -0.5000000 0.5000000 0.3636364), wk = 0.0026738 k( 315) = ( -0.5000000 0.5000000 0.3484849), wk = 0.0026738 k( 316) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0026738 k( 317) = ( -0.5000000 0.5000000 0.3181818), wk = 0.0026738 k( 318) = ( -0.5000000 0.5000000 0.3030303), wk = 0.0026738 k( 319) = ( -0.5000000 0.5000000 0.2878788), wk = 0.0026738 k( 320) = ( -0.5000000 0.5000000 0.2727273), wk = 0.0026738 k( 321) = ( -0.5000000 0.5000000 0.2575758), wk = 0.0026738 k( 322) = ( -0.5000000 0.5000000 0.2424242), wk = 0.0026738 k( 323) = ( -0.5000000 0.5000000 0.2272727), wk = 0.0026738 k( 324) = ( -0.5000000 0.5000000 0.2121212), wk = 0.0026738 k( 325) = ( -0.5000000 0.5000000 0.1969697), wk = 0.0026738 k( 326) = ( -0.5000000 0.5000000 0.1818182), wk = 0.0026738 k( 327) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0026738 k( 328) = ( -0.5000000 0.5000000 0.1515151), wk = 0.0026738 k( 329) = ( -0.5000000 0.5000000 0.1363636), wk = 0.0026738 k( 330) = ( -0.5000000 0.5000000 0.1212121), wk = 0.0026738 k( 331) = ( -0.5000000 0.5000000 0.1060606), wk = 0.0026738 k( 332) = ( -0.5000000 0.5000000 0.0909091), wk = 0.0026738 k( 333) = ( -0.5000000 0.5000000 0.0757576), wk = 0.0026738 k( 334) = ( -0.5000000 0.5000000 0.0606061), wk = 0.0026738 k( 335) = ( -0.5000000 0.5000000 0.0454545), wk = 0.0026738 k( 336) = ( -0.5000000 0.5000000 0.0303030), wk = 0.0026738 k( 337) = ( -0.5000000 0.5000000 0.0151515), wk = 0.0026738 k( 338) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0026738 k( 339) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026738 k( 340) = ( -0.0142857 0.0142857 0.5000000), wk = 0.0026738 k( 341) = ( -0.0285714 0.0285714 0.5000000), wk = 0.0026738 k( 342) = ( -0.0428571 0.0428571 0.5000000), wk = 0.0026738 k( 343) = ( -0.0571429 0.0571429 0.5000000), wk = 0.0026738 k( 344) = ( -0.0714286 0.0714286 0.5000000), wk = 0.0026738 k( 345) = ( -0.0857143 0.0857143 0.5000000), wk = 0.0026738 k( 346) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0026738 k( 347) = ( -0.1142857 0.1142857 0.5000000), wk = 0.0026738 k( 348) = ( -0.1285714 0.1285714 0.5000000), wk = 0.0026738 k( 349) = ( -0.1428571 0.1428571 0.5000000), wk = 0.0026738 k( 350) = ( -0.1571429 0.1571429 0.5000000), wk = 0.0026738 k( 351) = ( -0.1714286 0.1714286 0.5000000), wk = 0.0026738 k( 352) = ( -0.1857143 0.1857143 0.5000000), wk = 0.0026738 k( 353) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0026738 k( 354) = ( -0.2142857 0.2142857 0.5000000), wk = 0.0026738 k( 355) = ( -0.2285714 0.2285714 0.5000000), wk = 0.0026738 k( 356) = ( -0.2428571 0.2428571 0.5000000), wk = 0.0026738 k( 357) = ( -0.2571429 0.2571429 0.5000000), wk = 0.0026738 k( 358) = ( -0.2714286 0.2714286 0.5000000), wk = 0.0026738 k( 359) = ( -0.2857143 0.2857143 0.5000000), wk = 0.0026738 k( 360) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0026738 k( 361) = ( -0.3142857 0.3142857 0.5000000), wk = 0.0026738 k( 362) = ( -0.3285714 0.3285714 0.5000000), wk = 0.0026738 k( 363) = ( -0.3428571 0.3428571 0.5000000), wk = 0.0026738 k( 364) = ( -0.3571429 0.3571429 0.5000000), wk = 0.0026738 k( 365) = ( -0.3714286 0.3714286 0.5000000), wk = 0.0026738 k( 366) = ( -0.3857143 0.3857143 0.5000000), wk = 0.0026738 k( 367) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0026738 k( 368) = ( -0.4142857 0.4142857 0.5000000), wk = 0.0026738 k( 369) = ( -0.4285714 0.4285714 0.5000000), wk = 0.0026738 k( 370) = ( -0.4428571 0.4428571 0.5000000), wk = 0.0026738 k( 371) = ( -0.4571429 0.4571429 0.5000000), wk = 0.0026738 k( 372) = ( -0.4714286 0.4714286 0.5000000), wk = 0.0026738 k( 373) = ( -0.4857143 0.4857143 0.5000000), wk = 0.0026738 k( 374) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026738 Dense grid: 110399 G-vectors FFT dimensions: ( 72, 72, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.56 Mb ( 596, 62) NL pseudopotentials 1.13 Mb ( 298, 248) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2304) G-vector shells 0.01 Mb ( 1138) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.26 Mb ( 596, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.47 Mb ( 248, 2, 62) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./LiSi2N3.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 43.9 secs Computing kpt #: 2 total cpu time spent up to now is 48.3 secs Computing kpt #: 3 total cpu time spent up to now is 52.8 secs Computing kpt #: 4 total cpu time spent up to now is 57.7 secs Computing kpt #: 5 total cpu time spent up to now is 62.1 secs Computing kpt #: 6 total cpu time spent up to now is 66.4 secs Computing kpt #: 7 total cpu time spent up to now is 70.8 secs Computing kpt #: 8 total cpu time spent up to now is 75.3 secs Computing kpt #: 9 total cpu time spent up to now is 79.7 secs Computing kpt #: 10 total cpu time spent up to now is 84.0 secs Computing kpt #: 11 total cpu time spent up to now is 88.6 secs Computing kpt #: 12 total cpu time spent up to now is 93.1 secs Computing kpt #: 13 total cpu time spent up to now is 97.6 secs Computing kpt #: 14 total cpu time spent up to now is 102.3 secs Computing kpt #: 15 total cpu time spent up to now is 107.2 secs Computing kpt #: 16 total cpu time spent up to now is 111.6 secs Computing kpt #: 17 total cpu time spent up to now is 116.1 secs Computing kpt #: 18 total cpu time spent up to now is 120.7 secs Computing kpt #: 19 total cpu time spent up to now is 125.1 secs Computing kpt #: 20 total cpu time spent up to now is 129.5 secs Computing kpt #: 21 total cpu time spent up to now is 134.0 secs Computing kpt #: 22 total cpu time spent up to now is 138.7 secs Computing kpt #: 23 total cpu time spent up to now is 143.3 secs Computing kpt #: 24 total cpu time spent up to now is 147.6 secs Computing kpt #: 25 total cpu time spent up to now is 152.0 secs Computing kpt #: 26 total cpu time spent up to now is 156.4 secs Computing kpt #: 27 total cpu time spent up to now is 160.8 secs Computing kpt #: 28 total cpu time spent up to now is 165.1 secs Computing kpt #: 29 total cpu time spent up to now is 169.6 secs Computing kpt #: 30 total cpu time spent up to now is 174.1 secs Computing kpt #: 31 total cpu time spent up to now is 178.7 secs Computing kpt #: 32 total cpu time spent up to now is 183.2 secs Computing kpt #: 33 total cpu time spent up to now is 187.7 secs Computing kpt #: 34 total cpu time spent up to now is 192.4 secs Computing kpt #: 35 total cpu time spent up to now is 196.9 secs Computing kpt #: 36 total cpu time spent up to now is 201.8 secs Computing kpt #: 37 total cpu time spent up to now is 209.0 secs Computing kpt #: 38 total cpu time spent up to now is 214.1 secs Computing kpt #: 39 total cpu time spent up to now is 218.9 secs Computing kpt #: 40 total cpu time spent up to now is 223.6 secs Computing kpt #: 41 total cpu time spent up to now is 228.3 secs Computing kpt #: 42 total cpu time spent up to now is 233.1 secs Computing kpt #: 43 total cpu time spent up to now is 237.9 secs Computing kpt #: 44 total cpu time spent up to now is 242.9 secs Computing kpt #: 45 total cpu time spent up to now is 247.6 secs Computing kpt #: 46 total cpu time spent up to now is 252.3 secs Computing kpt #: 47 total cpu time spent up to now is 256.9 secs Computing kpt #: 48 total cpu time spent up to now is 261.6 secs Computing kpt #: 49 total cpu time spent up to now is 266.3 secs Computing kpt #: 50 total cpu time spent up to now is 271.1 secs Computing kpt #: 51 total cpu time spent up to now is 275.8 secs Computing kpt #: 52 total cpu time spent up to now is 280.6 secs Computing kpt #: 53 total cpu time spent up to now is 285.3 secs Computing kpt #: 54 total cpu time spent up to now is 289.9 secs Computing kpt #: 55 total cpu time spent up to now is 294.6 secs Computing kpt #: 56 total cpu time spent up to now is 299.4 secs Computing kpt #: 57 total cpu time spent up to now is 304.0 secs Computing kpt #: 58 total cpu time spent up to now is 308.8 secs Computing kpt #: 59 total cpu time spent up to now is 313.4 secs Computing kpt #: 60 total cpu time spent up to now is 318.1 secs Computing kpt #: 61 total cpu time spent up to now is 322.7 secs Computing kpt #: 62 total cpu time spent up to now is 327.4 secs Computing kpt #: 63 total cpu time spent up to now is 332.1 secs Computing kpt #: 64 total cpu time spent up to now is 337.1 secs Computing kpt #: 65 total cpu time spent up to now is 342.1 secs Computing kpt #: 66 total cpu time spent up to now is 346.7 secs Computing kpt #: 67 total cpu time spent up to now is 351.3 secs Computing kpt #: 68 total cpu time spent up to now is 355.7 secs Computing kpt #: 69 total cpu time spent up to now is 360.1 secs Computing kpt #: 70 total cpu time spent up to now is 364.8 secs Computing kpt #: 71 total cpu time spent up to now is 369.5 secs Computing kpt #: 72 total cpu time spent up to now is 374.4 secs Computing kpt #: 73 total cpu time spent up to now is 378.9 secs Computing kpt #: 74 total cpu time spent up to now is 383.3 secs Computing kpt #: 75 total cpu time spent up to now is 387.8 secs Computing kpt #: 76 total cpu time spent up to now is 392.3 secs Computing kpt #: 77 total cpu time spent up to now is 396.8 secs Computing kpt #: 78 total cpu time spent up to now is 401.3 secs Computing kpt #: 79 total cpu time spent up to now is 405.9 secs Computing kpt #: 80 total cpu time spent up to now is 410.5 secs Computing kpt #: 81 total cpu time spent up to now is 415.1 secs Computing kpt #: 82 total cpu time spent up to now is 419.7 secs Computing kpt #: 83 total cpu time spent up to now is 424.3 secs Computing kpt #: 84 total cpu time spent up to now is 428.9 secs Computing kpt #: 85 total cpu time spent up to now is 434.3 secs Computing kpt #: 86 total cpu time spent up to now is 439.1 secs Computing kpt #: 87 total cpu time spent up to now is 445.0 secs Computing kpt #: 88 total cpu time spent up to now is 449.7 secs Computing kpt #: 89 total cpu time spent up to now is 454.6 secs Computing kpt #: 90 total cpu time spent up to now is 459.3 secs Computing kpt #: 91 total cpu time spent up to now is 464.1 secs Computing kpt #: 92 total cpu time spent up to now is 468.9 secs Computing kpt #: 93 total cpu time spent up to now is 473.5 secs Computing kpt #: 94 total cpu time spent up to now is 478.2 secs Computing kpt #: 95 total cpu time spent up to now is 482.9 secs Computing kpt #: 96 total cpu time spent up to now is 487.3 secs Computing kpt #: 97 total cpu time spent up to now is 491.7 secs Computing kpt #: 98 total cpu time spent up to now is 496.4 secs Computing kpt #: 99 total cpu time spent up to now is 501.2 secs Computing kpt #: 100 total cpu time spent up to now is 508.1 secs Computing kpt #: 101 total cpu time spent up to now is 513.1 secs Computing kpt #: 102 total cpu time spent up to now is 517.8 secs Computing kpt #: 103 total cpu time spent up to now is 522.5 secs Computing kpt #: 104 total cpu time spent up to now is 527.2 secs Computing kpt #: 105 total cpu time spent up to now is 532.1 secs Computing kpt #: 106 total cpu time spent up to now is 536.8 secs Computing kpt #: 107 total cpu time spent up to now is 541.4 secs Computing kpt #: 108 total cpu time spent up to now is 545.9 secs Computing kpt #: 109 total cpu time spent up to now is 550.4 secs Computing kpt #: 110 total cpu time spent up to now is 555.0 secs Computing kpt #: 111 total cpu time spent up to now is 559.4 secs Computing kpt #: 112 total cpu time spent up to now is 563.8 secs Computing kpt #: 113 total cpu time spent up to now is 568.3 secs Computing kpt #: 114 total cpu time spent up to now is 573.1 secs Computing kpt #: 115 total cpu time spent up to now is 577.6 secs Computing kpt #: 116 total cpu time spent up to now is 581.9 secs Computing kpt #: 117 total cpu time spent up to now is 586.3 secs Computing kpt #: 118 total cpu time spent up to now is 590.7 secs Computing kpt #: 119 total cpu time spent up to now is 595.1 secs Computing kpt #: 120 total cpu time spent up to now is 599.8 secs Computing kpt #: 121 total cpu time spent up to now is 604.5 secs Computing kpt #: 122 total cpu time spent up to now is 608.9 secs Computing kpt #: 123 total cpu time spent up to now is 613.3 secs Computing kpt #: 124 total cpu time spent up to now is 617.7 secs Computing kpt #: 125 total cpu time spent up to now is 622.4 secs Computing kpt #: 126 total cpu time spent up to now is 626.9 secs Computing kpt #: 127 total cpu time spent up to now is 631.4 secs Computing kpt #: 128 total cpu time spent up to now is 635.8 secs Computing kpt #: 129 total cpu time spent up to now is 640.3 secs Computing kpt #: 130 total cpu time spent up to now is 644.9 secs Computing kpt #: 131 total cpu time spent up to now is 649.3 secs Computing kpt #: 132 total cpu time spent up to now is 653.8 secs Computing kpt #: 133 total cpu time spent up to now is 658.2 secs Computing kpt #: 134 total cpu time spent up to now is 663.1 secs Computing kpt #: 135 total cpu time spent up to now is 667.9 secs Computing kpt #: 136 total cpu time spent up to now is 672.7 secs Computing kpt #: 137 total cpu time spent up to now is 677.4 secs Computing kpt #: 138 total cpu time spent up to now is 682.6 secs Computing kpt #: 139 total cpu time spent up to now is 689.1 secs Computing kpt #: 140 total cpu time spent up to now is 693.8 secs Computing kpt #: 141 total cpu time spent up to now is 698.8 secs Computing kpt #: 142 total cpu time spent up to now is 704.2 secs Computing kpt #: 143 total cpu time spent up to now is 709.2 secs Computing kpt #: 144 total cpu time spent up to now is 714.3 secs Computing kpt #: 145 total cpu time spent up to now is 719.1 secs Computing kpt #: 146 total cpu time spent up to now is 723.8 secs Computing kpt #: 147 total cpu time spent up to now is 728.7 secs Computing kpt #: 148 total cpu time spent up to now is 733.8 secs Computing kpt #: 149 total cpu time spent up to now is 738.5 secs Computing kpt #: 150 total cpu time spent up to now is 743.4 secs Computing kpt #: 151 total cpu time spent up to now is 748.2 secs Computing kpt #: 152 total cpu time spent up to now is 753.1 secs Computing kpt #: 153 total cpu time spent up to now is 758.1 secs Computing kpt #: 154 total cpu time spent up to now is 763.4 secs Computing kpt #: 155 total cpu time spent up to now is 768.4 secs Computing kpt #: 156 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 777.2 secs Computing kpt #: 157 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 786.7 secs Computing kpt #: 158 total cpu time spent up to now is 791.1 secs Computing kpt #: 159 total cpu time spent up to now is 795.8 secs Computing kpt #: 160 total cpu time spent up to now is 801.4 secs Computing kpt #: 161 total cpu time spent up to now is 809.3 secs Computing kpt #: 162 total cpu time spent up to now is 814.9 secs Computing kpt #: 163 total cpu time spent up to now is 820.4 secs Computing kpt #: 164 total cpu time spent up to now is 825.9 secs Computing kpt #: 165 total cpu time spent up to now is 832.6 secs Computing kpt #: 166 total cpu time spent up to now is 837.5 secs Computing kpt #: 167 total cpu time spent up to now is 842.3 secs Computing kpt #: 168 total cpu time spent up to now is 846.9 secs Computing kpt #: 169 total cpu time spent up to now is 851.5 secs Computing kpt #: 170 total cpu time spent up to now is 856.1 secs Computing kpt #: 171 total cpu time spent up to now is 860.8 secs Computing kpt #: 172 total cpu time spent up to now is 865.3 secs Computing kpt #: 173 total cpu time spent up to now is 869.9 secs Computing kpt #: 174 total cpu time spent up to now is 874.4 secs Computing kpt #: 175 total cpu time spent up to now is 878.7 secs Computing kpt #: 176 total cpu time spent up to now is 882.9 secs Computing kpt #: 177 total cpu time spent up to now is 887.2 secs Computing kpt #: 178 total cpu time spent up to now is 891.3 secs Computing kpt #: 179 total cpu time spent up to now is 895.6 secs Computing kpt #: 180 total cpu time spent up to now is 899.9 secs Computing kpt #: 181 total cpu time spent up to now is 904.2 secs Computing kpt #: 182 total cpu time spent up to now is 908.4 secs Computing kpt #: 183 total cpu time spent up to now is 912.7 secs Computing kpt #: 184 total cpu time spent up to now is 917.0 secs Computing kpt #: 185 total cpu time spent up to now is 921.5 secs Computing kpt #: 186 total cpu time spent up to now is 926.0 secs Computing kpt #: 187 total cpu time spent up to now is 930.5 secs Computing kpt #: 188 total cpu time spent up to now is 935.0 secs Computing kpt #: 189 total cpu time spent up to now is 939.5 secs Computing kpt #: 190 total cpu time spent up to now is 943.9 secs Computing kpt #: 191 total cpu time spent up to now is 948.3 secs Computing kpt #: 192 total cpu time spent up to now is 952.6 secs Computing kpt #: 193 total cpu time spent up to now is 956.9 secs Computing kpt #: 194 total cpu time spent up to now is 961.3 secs Computing kpt #: 195 total cpu time spent up to now is 965.8 secs Computing kpt #: 196 total cpu time spent up to now is 970.4 secs Computing kpt #: 197 total cpu time spent up to now is 974.9 secs Computing kpt #: 198 total cpu time spent up to now is 979.2 secs Computing kpt #: 199 total cpu time spent up to now is 983.5 secs Computing kpt #: 200 total cpu time spent up to now is 987.8 secs Computing kpt #: 201 total cpu time spent up to now is 992.2 secs Computing kpt #: 202 total cpu time spent up to now is 996.4 secs Computing kpt #: 203 total cpu time spent up to now is 1000.7 secs Computing kpt #: 204 total cpu time spent up to now is 1005.1 secs Computing kpt #: 205 total cpu time spent up to now is 1009.4 secs Computing kpt #: 206 total cpu time spent up to now is 1013.7 secs Computing kpt #: 207 total cpu time spent up to now is 1018.1 secs Computing kpt #: 208 total cpu time spent up to now is 1022.6 secs Computing kpt #: 209 total cpu time spent up to now is 1027.1 secs Computing kpt #: 210 total cpu time spent up to now is 1031.6 secs Computing kpt #: 211 total cpu time spent up to now is 1036.1 secs Computing kpt #: 212 total cpu time spent up to now is 1040.8 secs Computing kpt #: 213 total cpu time spent up to now is 1045.5 secs Computing kpt #: 214 total cpu time spent up to now is 1050.1 secs Computing kpt #: 215 total cpu time spent up to now is 1054.8 secs Computing kpt #: 216 total cpu time spent up to now is 1059.4 secs Computing kpt #: 217 total cpu time spent up to now is 1064.2 secs Computing kpt #: 218 total cpu time spent up to now is 1068.9 secs Computing kpt #: 219 total cpu time spent up to now is 1073.6 secs Computing kpt #: 220 total cpu time spent up to now is 1078.3 secs Computing kpt #: 221 total cpu time spent up to now is 1083.4 secs Computing kpt #: 222 total cpu time spent up to now is 1087.9 secs Computing kpt #: 223 total cpu time spent up to now is 1092.6 secs Computing kpt #: 224 total cpu time spent up to now is 1097.0 secs Computing kpt #: 225 total cpu time spent up to now is 1101.4 secs Computing kpt #: 226 total cpu time spent up to now is 1107.0 secs Computing kpt #: 227 total cpu time spent up to now is 1111.8 secs Computing kpt #: 228 total cpu time spent up to now is 1116.7 secs Computing kpt #: 229 total cpu time spent up to now is 1121.4 secs Computing kpt #: 230 total cpu time spent up to now is 1126.2 secs Computing kpt #: 231 total cpu time spent up to now is 1131.0 secs Computing kpt #: 232 total cpu time spent up to now is 1135.6 secs Computing kpt #: 233 total cpu time spent up to now is 1140.1 secs Computing kpt #: 234 total cpu time spent up to now is 1144.5 secs Computing kpt #: 235 total cpu time spent up to now is 1149.0 secs Computing kpt #: 236 total cpu time spent up to now is 1153.4 secs Computing kpt #: 237 total cpu time spent up to now is 1157.9 secs Computing kpt #: 238 total cpu time spent up to now is 1162.4 secs Computing kpt #: 239 total cpu time spent up to now is 1167.3 secs Computing kpt #: 240 total cpu time spent up to now is 1171.9 secs Computing kpt #: 241 total cpu time spent up to now is 1176.5 secs Computing kpt #: 242 total cpu time spent up to now is 1181.2 secs Computing kpt #: 243 total cpu time spent up to now is 1185.9 secs Computing kpt #: 244 total cpu time spent up to now is 1190.5 secs Computing kpt #: 245 total cpu time spent up to now is 1195.1 secs Computing kpt #: 246 total cpu time spent up to now is 1199.8 secs Computing kpt #: 247 total cpu time spent up to now is 1204.5 secs Computing kpt #: 248 total cpu time spent up to now is 1209.2 secs Computing kpt #: 249 total cpu time spent up to now is 1214.0 secs Computing kpt #: 250 total cpu time spent up to now is 1218.8 secs Computing kpt #: 251 total cpu time spent up to now is 1223.5 secs Computing kpt #: 252 total cpu time spent up to now is 1228.2 secs Computing kpt #: 253 total cpu time spent up to now is 1234.3 secs Computing kpt #: 254 total cpu time spent up to now is 1239.0 secs Computing kpt #: 255 total cpu time spent up to now is 1243.7 secs Computing kpt #: 256 total cpu time spent up to now is 1248.4 secs Computing kpt #: 257 total cpu time spent up to now is 1253.2 secs Computing kpt #: 258 total cpu time spent up to now is 1257.7 secs Computing kpt #: 259 total cpu time spent up to now is 1262.2 secs Computing kpt #: 260 total cpu time spent up to now is 1267.0 secs Computing kpt #: 261 total cpu time spent up to now is 1271.6 secs Computing kpt #: 262 total cpu time spent up to now is 1276.1 secs Computing kpt #: 263 total cpu time spent up to now is 1280.7 secs Computing kpt #: 264 total cpu time spent up to now is 1285.2 secs Computing kpt #: 265 total cpu time spent up to now is 1289.6 secs Computing kpt #: 266 total cpu time spent up to now is 1294.0 secs Computing kpt #: 267 total cpu time spent up to now is 1299.0 secs Computing kpt #: 268 total cpu time spent up to now is 1303.3 secs Computing kpt #: 269 total cpu time spent up to now is 1307.6 secs Computing kpt #: 270 total cpu time spent up to now is 1312.0 secs Computing kpt #: 271 total cpu time spent up to now is 1316.3 secs Computing kpt #: 272 total cpu time spent up to now is 1320.6 secs Computing kpt #: 273 total cpu time spent up to now is 1324.9 secs Computing kpt #: 274 total cpu time spent up to now is 1329.4 secs Computing kpt #: 275 total cpu time spent up to now is 1333.7 secs Computing kpt #: 276 total cpu time spent up to now is 1338.0 secs Computing kpt #: 277 total cpu time spent up to now is 1342.4 secs Computing kpt #: 278 total cpu time spent up to now is 1346.6 secs Computing kpt #: 279 total cpu time spent up to now is 1350.9 secs Computing kpt #: 280 total cpu time spent up to now is 1355.2 secs Computing kpt #: 281 total cpu time spent up to now is 1359.5 secs Computing kpt #: 282 total cpu time spent up to now is 1363.8 secs Computing kpt #: 283 total cpu time spent up to now is 1368.3 secs Computing kpt #: 284 total cpu time spent up to now is 1372.7 secs Computing kpt #: 285 total cpu time spent up to now is 1377.1 secs Computing kpt #: 286 total cpu time spent up to now is 1381.5 secs Computing kpt #: 287 total cpu time spent up to now is 1386.0 secs Computing kpt #: 288 total cpu time spent up to now is 1390.6 secs Computing kpt #: 289 total cpu time spent up to now is 1395.0 secs Computing kpt #: 290 total cpu time spent up to now is 1399.4 secs Computing kpt #: 291 total cpu time spent up to now is 1404.7 secs Computing kpt #: 292 total cpu time spent up to now is 1411.8 secs Computing kpt #: 293 total cpu time spent up to now is 1416.8 secs Computing kpt #: 294 total cpu time spent up to now is 1421.2 secs Computing kpt #: 295 total cpu time spent up to now is 1425.7 secs Computing kpt #: 296 total cpu time spent up to now is 1432.2 secs Computing kpt #: 297 total cpu time spent up to now is 1438.7 secs Computing kpt #: 298 total cpu time spent up to now is 1445.3 secs Computing kpt #: 299 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1453.6 secs Computing kpt #: 300 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1462.1 secs Computing kpt #: 301 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1470.5 secs Computing kpt #: 302 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1479.3 secs Computing kpt #: 303 total cpu time spent up to now is 1483.8 secs Computing kpt #: 304 total cpu time spent up to now is 1488.2 secs Computing kpt #: 305 total cpu time spent up to now is 1492.6 secs Computing kpt #: 306 total cpu time spent up to now is 1497.2 secs Computing kpt #: 307 total cpu time spent up to now is 1501.7 secs Computing kpt #: 308 total cpu time spent up to now is 1506.1 secs Computing kpt #: 309 total cpu time spent up to now is 1510.4 secs Computing kpt #: 310 total cpu time spent up to now is 1514.9 secs Computing kpt #: 311 total cpu time spent up to now is 1519.3 secs Computing kpt #: 312 total cpu time spent up to now is 1523.7 secs Computing kpt #: 313 total cpu time spent up to now is 1528.3 secs Computing kpt #: 314 total cpu time spent up to now is 1532.8 secs Computing kpt #: 315 total cpu time spent up to now is 1537.1 secs Computing kpt #: 316 total cpu time spent up to now is 1541.6 secs Computing kpt #: 317 total cpu time spent up to now is 1546.4 secs Computing kpt #: 318 total cpu time spent up to now is 1551.2 secs Computing kpt #: 319 total cpu time spent up to now is 1555.7 secs Computing kpt #: 320 total cpu time spent up to now is 1560.6 secs Computing kpt #: 321 total cpu time spent up to now is 1565.4 secs Computing kpt #: 322 total cpu time spent up to now is 1574.6 secs Computing kpt #: 323 total cpu time spent up to now is 1581.9 secs Computing kpt #: 324 total cpu time spent up to now is 1588.4 secs Computing kpt #: 325 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1597.2 secs Computing kpt #: 326 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1605.8 secs Computing kpt #: 327 total cpu time spent up to now is 1611.2 secs Computing kpt #: 328 total cpu time spent up to now is 1616.0 secs Computing kpt #: 329 total cpu time spent up to now is 1620.8 secs Computing kpt #: 330 total cpu time spent up to now is 1626.1 secs Computing kpt #: 331 total cpu time spent up to now is 1630.9 secs Computing kpt #: 332 total cpu time spent up to now is 1635.7 secs Computing kpt #: 333 total cpu time spent up to now is 1640.4 secs Computing kpt #: 334 total cpu time spent up to now is 1645.2 secs Computing kpt #: 335 total cpu time spent up to now is 1650.0 secs Computing kpt #: 336 total cpu time spent up to now is 1654.8 secs Computing kpt #: 337 total cpu time spent up to now is 1659.5 secs Computing kpt #: 338 total cpu time spent up to now is 1664.6 secs Computing kpt #: 339 total cpu time spent up to now is 1669.1 secs Computing kpt #: 340 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1677.8 secs Computing kpt #: 341 total cpu time spent up to now is 1684.5 secs Computing kpt #: 342 total cpu time spent up to now is 1689.9 secs Computing kpt #: 343 total cpu time spent up to now is 1694.8 secs Computing kpt #: 344 total cpu time spent up to now is 1699.6 secs Computing kpt #: 345 total cpu time spent up to now is 1705.2 secs Computing kpt #: 346 total cpu time spent up to now is 1710.4 secs Computing kpt #: 347 total cpu time spent up to now is 1715.1 secs Computing kpt #: 348 total cpu time spent up to now is 1719.9 secs Computing kpt #: 349 total cpu time spent up to now is 1724.7 secs Computing kpt #: 350 total cpu time spent up to now is 1729.5 secs Computing kpt #: 351 total cpu time spent up to now is 1734.3 secs Computing kpt #: 352 total cpu time spent up to now is 1739.1 secs Computing kpt #: 353 total cpu time spent up to now is 1743.8 secs Computing kpt #: 354 total cpu time spent up to now is 1748.7 secs Computing kpt #: 355 total cpu time spent up to now is 1753.5 secs Computing kpt #: 356 total cpu time spent up to now is 1758.1 secs Computing kpt #: 357 total cpu time spent up to now is 1762.8 secs Computing kpt #: 358 total cpu time spent up to now is 1767.6 secs Computing kpt #: 359 total cpu time spent up to now is 1772.3 secs Computing kpt #: 360 total cpu time spent up to now is 1777.1 secs Computing kpt #: 361 total cpu time spent up to now is 1781.8 secs Computing kpt #: 362 total cpu time spent up to now is 1786.5 secs Computing kpt #: 363 total cpu time spent up to now is 1791.3 secs Computing kpt #: 364 total cpu time spent up to now is 1796.2 secs Computing kpt #: 365 total cpu time spent up to now is 1800.9 secs Computing kpt #: 366 total cpu time spent up to now is 1806.4 secs Computing kpt #: 367 total cpu time spent up to now is 1811.2 secs Computing kpt #: 368 total cpu time spent up to now is 1816.2 secs Computing kpt #: 369 total cpu time spent up to now is 1821.8 secs Computing kpt #: 370 total cpu time spent up to now is 1826.5 secs Computing kpt #: 371 total cpu time spent up to now is 1831.4 secs Computing kpt #: 372 total cpu time spent up to now is 1836.1 secs Computing kpt #: 373 total cpu time spent up to now is 1841.4 secs Computing kpt #: 374 total cpu time spent up to now is 1845.8 secs ethr = 1.92E-11, avg # of iterations = 34.6 total cpu time spent up to now is 1845.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13901 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1401 -10.1401 -7.4080 -7.4080 -7.3036 -7.3036 -7.2506 -7.2506 -6.1121 -6.1121 -5.7487 -5.7487 -0.9481 -0.9481 -0.5320 -0.5320 -0.4672 -0.4672 0.9096 0.9096 1.2851 1.2851 2.0498 2.0498 2.8871 2.8871 3.4521 3.4521 3.6241 3.6241 4.0372 4.0372 5.1741 5.1741 5.7755 5.7755 5.8615 5.8615 5.8722 5.8722 6.1413 6.1413 6.3170 6.3170 6.7405 6.7405 7.1549 7.1549 12.4777 12.4777 12.5738 12.5738 12.8087 12.8087 13.9659 13.9659 15.2775 15.2775 k = 0.0083 0.0144-0.0000 ( 13897 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1392 -10.1392 -7.4237 -7.4217 -7.3031 -7.3029 -7.2388 -7.2365 -6.1128 -6.1128 -5.7487 -5.7486 -0.9473 -0.9471 -0.5588 -0.5584 -0.4387 -0.4380 0.9108 0.9111 1.2849 1.2852 2.0442 2.0449 2.8925 2.8933 3.4531 3.4533 3.6203 3.6218 4.0363 4.0379 5.1738 5.1740 5.7750 5.7751 5.8428 5.8447 5.8872 5.8888 6.1411 6.1411 6.3175 6.3180 6.7392 6.7395 7.1539 7.1541 12.4807 12.4807 12.5752 12.5752 12.8108 12.8108 13.9678 13.9678 15.2773 15.2779 k = 0.0167 0.0289-0.0000 ( 13891 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1365 -10.1364 -7.4593 -7.4563 -7.3015 -7.3011 -7.2095 -7.2059 -6.1146 -6.1146 -5.7484 -5.7483 -0.9447 -0.9443 -0.6014 -0.6012 -0.3893 -0.3883 0.9150 0.9156 1.2845 1.2850 2.0287 2.0301 2.9093 2.9108 3.4563 3.4567 3.6105 3.6135 4.0351 4.0383 5.1731 5.1734 5.7737 5.7738 5.8192 5.8213 5.9051 5.9066 6.1403 6.1403 6.3195 6.3204 6.7357 6.7363 7.1511 7.1516 12.4896 12.4896 12.5792 12.5793 12.8171 12.8171 13.9735 13.9736 15.2774 15.2785 k = 0.0250 0.0433-0.0000 ( 13885 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1319 -10.1319 -7.5040 -7.5008 -7.2988 -7.2982 -7.1737 -7.1696 -6.1177 -6.1176 -5.7479 -5.7478 -0.9402 -0.9397 -0.6444 -0.6443 -0.3350 -0.3338 0.9219 0.9228 1.2838 1.2845 2.0047 2.0066 2.9360 2.9381 3.4616 3.4623 3.5950 3.5993 4.0334 4.0381 5.1719 5.1724 5.7713 5.7716 5.7945 5.7967 5.9204 5.9216 6.1390 6.1390 6.3229 6.3242 6.7302 6.7312 7.1465 7.1474 12.5044 12.5045 12.5860 12.5860 12.8276 12.8277 13.9829 13.9830 15.2774 15.2792 k = 0.0333 0.0577-0.0000 ( 13875 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1256 -10.1256 -7.5535 -7.5502 -7.2949 -7.2941 -7.1364 -7.1319 -6.1220 -6.1219 -5.7473 -5.7472 -0.9340 -0.9332 -0.6857 -0.6856 -0.2780 -0.2766 0.9314 0.9326 1.2829 1.2839 1.9741 1.9764 2.9710 2.9735 3.4692 3.4702 3.5743 3.5798 4.0307 4.0367 5.1703 5.1710 5.7655 5.7659 5.7720 5.7736 5.9324 5.9335 6.1371 6.1371 6.3276 6.3293 6.7231 6.7244 7.1405 7.1416 12.5251 12.5251 12.5953 12.5954 12.8421 12.8422 13.9958 13.9960 15.2772 15.2795 k = 0.0417 0.0722-0.0000 ( 13867 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1175 -10.1175 -7.6057 -7.6025 -7.2899 -7.2889 -7.0996 -7.0948 -6.1275 -6.1273 -5.7465 -5.7464 -0.9259 -0.9250 -0.7248 -0.7245 -0.2189 -0.2173 0.9431 0.9447 1.2816 1.2829 1.9389 1.9414 3.0124 3.0150 3.4791 3.4804 3.5488 3.5552 4.0267 4.0337 5.1682 5.1690 5.7412 5.7434 5.7663 5.7663 5.9409 5.9419 6.1347 6.1347 6.3333 6.3354 6.7148 6.7166 7.1331 7.1345 12.5514 12.5515 12.6073 12.6074 12.8605 12.8605 14.0120 14.0122 15.2763 15.2792 k = 0.0500 0.0866-0.0000 ( 13871 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1076 -10.1075 -7.6599 -7.6568 -7.2839 -7.2827 -7.0640 -7.0591 -6.1341 -6.1339 -5.7455 -5.7454 -0.9160 -0.9149 -0.7614 -0.7609 -0.1579 -0.1562 0.9568 0.9588 1.2800 1.2815 1.9010 1.9036 3.0583 3.0610 3.4914 3.4930 3.5190 3.5261 4.0208 4.0287 5.1658 5.1667 5.7143 5.7167 5.7619 5.7621 5.9457 5.9466 6.1318 6.1318 6.3395 6.3420 6.7061 6.7083 7.1247 7.1264 12.5833 12.5833 12.6217 12.6219 12.8824 12.8824 14.0312 14.0314 15.2741 15.2776 k = 0.0583 0.1011-0.0000 ( 13869 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0959 -10.0958 -7.7156 -7.7126 -7.2767 -7.2753 -7.0303 -7.0251 -6.1419 -6.1417 -5.7445 -5.7443 -0.9043 -0.9031 -0.7954 -0.7947 -0.0953 -0.0934 0.9719 0.9743 1.2780 1.2797 1.8623 1.8648 3.1075 3.1100 3.4851 3.4930 3.5061 3.5085 4.0125 4.0211 5.1630 5.1640 5.6866 5.6892 5.7572 5.7574 5.9469 5.9479 6.1284 6.1284 6.3457 6.3484 6.6975 6.7002 7.1155 7.1176 12.6205 12.6206 12.6385 12.6387 12.9076 12.9076 14.0528 14.0531 15.2700 15.2741 k = 0.0667 0.1155-0.0000 ( 13871 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0824 -10.0823 -7.7725 -7.7697 -7.2685 -7.2669 -6.9985 -6.9932 -6.1507 -6.1505 -5.7432 -5.7430 -0.8908 -0.8894 -0.8267 -0.8258 -0.0312 -0.0291 0.9876 0.9906 1.2755 1.2775 1.8245 1.8267 3.1584 3.1605 3.4480 3.4562 3.5236 3.5265 4.0014 4.0106 5.1600 5.1610 5.6580 5.6607 5.7521 5.7524 5.9448 5.9459 6.1245 6.1245 6.3513 6.3540 6.6898 6.6930 7.1061 7.1086 12.6575 12.6577 12.6631 12.6631 12.9358 12.9359 14.0765 14.0769 15.2633 15.2679 k = 0.0750 0.1299-0.0000 ( 13871 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -10.0671 -10.0670 -7.8303 -7.8276 -7.2592 -7.2574 -6.9689 -6.9634 -6.1605 -6.1603 -5.7419 -5.7417 -0.8756 -0.8739 -0.8553 -0.8543 0.0342 0.0364 1.0031 1.0067 1.2724 1.2746 1.7891 1.7910 3.2098 3.2114 3.4077 3.4162 3.5441 3.5478 3.9872 3.9968 5.1567 5.1578 5.6283 5.6312 5.7467 5.7471 5.9397 5.9410 6.1201 6.1202 6.3555 6.3582 6.6836 6.6872 7.0968 7.0997 12.6786 12.6788 12.7104 12.7105 12.9667 12.9668 14.1017 14.1022 15.2530 15.2582 k = 0.0833 0.1444-0.0000 ( 13877 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -10.0501 -10.0500 -7.8889 -7.8863 -7.2489 -7.2469 -6.9416 -6.9360 -6.1714 -6.1711 -5.7405 -5.7403 -0.8812 -0.8801 -0.8585 -0.8566 0.1007 0.1031 1.0173 1.0215 1.2686 1.2711 1.7581 1.7595 3.2607 3.2615 3.3645 3.3733 3.5680 3.5726 3.9697 3.9796 5.1532 5.1544 5.5974 5.6003 5.7412 5.7417 5.9320 5.9335 6.1153 6.1153 6.3580 6.3603 6.6791 6.6830 7.0882 7.0915 12.7016 12.7018 12.7625 12.7626 12.9999 13.0000 14.1279 14.1284 15.2384 15.2440 k = 0.0917 0.1588-0.0000 ( 13877 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -10.0313 -10.0312 -7.9481 -7.9456 -7.2376 -7.2354 -6.9167 -6.9109 -6.1832 -6.1829 -5.7391 -5.7388 -0.9044 -0.9031 -0.8396 -0.8376 0.1683 0.1708 1.0287 1.0336 1.2641 1.2668 1.7333 1.7341 3.3093 3.3094 3.3193 3.3282 3.5957 3.6014 3.9487 3.9588 5.1495 5.1508 5.5650 5.5679 5.7357 5.7362 5.9219 5.9239 6.1100 6.1101 6.3585 6.3604 6.6764 6.6805 7.0808 7.0845 12.7262 12.7265 12.8191 12.8191 13.0351 13.0352 14.1543 14.1549 15.2185 15.2244 k = 0.1000 0.1732-0.0000 ( 13868 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -10.0108 -10.0107 -8.0077 -8.0053 -7.2254 -7.2229 -6.8942 -6.8883 -6.1959 -6.1956 -5.7375 -5.7373 -0.9250 -0.9236 -0.8190 -0.8168 0.2367 0.2393 1.0359 1.0416 1.2586 1.2615 1.7164 1.7166 3.2705 3.2794 3.3552 3.3566 3.6278 3.6347 3.9242 3.9344 5.1452 5.1466 5.5313 5.5341 5.7303 5.7308 5.9100 5.9124 6.1044 6.1045 6.3574 6.3586 6.6748 6.6791 7.0752 7.0793 12.7524 12.7527 12.8797 12.8797 13.0718 13.0719 14.1803 14.1811 15.1920 15.1981 k = 0.1083 0.1877-0.0000 ( 13868 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.9886 -9.9885 -8.0676 -8.0654 -7.2122 -7.2096 -6.8741 -6.8681 -6.2094 -6.2091 -5.7360 -5.7357 -0.9431 -0.9415 -0.7966 -0.7943 0.3057 0.3085 1.0378 1.0441 1.2521 1.2553 1.7087 1.7092 3.2202 3.2291 3.3970 3.3994 3.6645 3.6725 3.8963 3.9065 5.1397 5.1414 5.4965 5.4992 5.7251 5.7257 5.8965 5.8993 6.0984 6.0986 6.3551 6.3554 6.6738 6.6781 7.0718 7.0763 12.7797 12.7800 12.9440 12.9440 13.1096 13.1098 14.2051 14.2060 15.1578 15.1640 k = 0.1166 0.2021-0.0000 ( 13870 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.9646 -9.9645 -8.1277 -8.1256 -7.1981 -7.1953 -6.8564 -6.8504 -6.2237 -6.2234 -5.7344 -5.7341 -0.9586 -0.9569 -0.7725 -0.7699 0.3753 0.3782 1.0334 1.0403 1.2445 1.2479 1.7115 1.7125 3.1678 3.1767 3.4350 3.4384 3.7058 3.7149 3.8651 3.8754 5.1324 5.1344 5.4614 5.4638 5.7205 5.7211 5.8817 5.8849 6.0922 6.0924 6.3516 6.3522 6.6724 6.6767 7.0712 7.0760 12.8080 12.8084 13.0117 13.0117 13.1483 13.1484 14.2281 14.2292 15.1142 15.1203 k = 0.1250 0.2165-0.0000 ( 13858 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -9.9390 -9.9389 -8.1878 -8.1858 -7.1833 -7.1802 -6.8412 -6.8350 -6.2387 -6.2384 -5.7329 -5.7325 -0.9718 -0.9700 -0.7466 -0.7439 0.4452 0.4482 1.0228 1.0302 1.2357 1.2393 1.7254 1.7268 3.1134 3.1222 3.4691 3.4733 3.7513 3.7613 3.8311 3.8413 5.1218 5.1242 5.4269 5.4290 5.7164 5.7171 5.8659 5.8695 6.0859 6.0860 6.3479 6.3494 6.6699 6.6741 7.0735 7.0786 12.8369 12.8374 13.0823 13.0824 13.1872 13.1874 14.2486 14.2499 15.0598 15.0655 k = 0.1333 0.2310-0.0000 ( 13828 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.9117 -9.9116 -8.2479 -8.2460 -7.1676 -7.1644 -6.8283 -6.8221 -6.2544 -6.2541 -5.7313 -5.7310 -0.9828 -0.9808 -0.7190 -0.7161 0.5151 0.5183 1.0068 1.0144 1.2254 1.2293 1.7498 1.7514 3.0573 3.0659 3.4997 3.5045 3.7944 3.8002 3.8045 3.8109 5.1064 5.1092 5.3946 5.3962 5.7131 5.7138 5.8495 5.8535 6.0794 6.0795 6.3448 6.3472 6.6656 6.6697 7.0786 7.0840 12.8662 12.8667 13.1552 13.1553 13.2262 13.2265 14.2659 14.2674 14.9936 14.9989 k = 0.1416 0.2454-0.0000 ( 13850 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -9.8828 -9.8826 -8.3079 -8.3061 -7.1512 -7.1478 -6.8178 -6.8115 -6.2707 -6.2704 -5.7298 -5.7294 -0.9917 -0.9896 -0.6897 -0.6867 0.5847 0.5881 0.9867 0.9945 1.2137 1.2177 1.7837 1.7855 2.9993 3.0078 3.5273 3.5326 3.7554 3.7655 3.8517 3.8628 5.0844 5.0876 5.3659 5.3669 5.7107 5.7115 5.8331 5.8374 6.0729 6.0730 6.3427 6.3460 6.6594 6.6633 7.0865 7.0920 12.8955 12.8961 13.2293 13.2293 13.2654 13.2659 14.2796 14.2814 14.9157 14.9202 k = 0.1500 0.2598-0.0000 ( 13838 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -9.8522 -9.8520 -8.3675 -8.3658 -7.1342 -7.1306 -6.8095 -6.8032 -6.2875 -6.2872 -5.7284 -5.7280 -0.9987 -0.9965 -0.6588 -0.6555 0.6531 0.6568 0.9647 0.9723 1.2002 1.2045 1.8259 1.8278 2.9397 2.9480 3.5523 3.5579 3.7147 3.7246 3.9048 3.9163 5.0547 5.0584 5.3415 5.3420 5.7093 5.7102 5.8172 5.8217 6.0666 6.0667 6.3419 6.3460 6.6511 6.6549 7.0965 7.1022 12.9246 12.9253 13.2944 13.2950 13.3134 13.3145 14.2896 14.2916 14.8270 14.8307 k = 0.1583 0.2743-0.0000 ( 13830 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.8200 -9.8198 -8.4269 -8.4252 -7.1166 -7.1128 -6.8034 -6.7971 -6.3047 -6.3044 -5.7270 -5.7266 -1.0040 -1.0018 -0.6261 -0.6227 0.7187 0.7228 0.9436 0.9509 1.1851 1.1895 1.8751 1.8770 2.8786 2.8867 3.5750 3.5809 3.6725 3.6823 3.9589 3.9707 5.0174 5.0212 5.3212 5.3213 5.7092 5.7102 5.8026 5.8072 6.0605 6.0606 6.3425 6.3472 6.6411 6.6447 7.1081 7.1138 12.9531 12.9540 13.3343 13.3346 13.3866 13.3874 14.2962 14.2983 14.7293 14.7322 k = 0.1666 0.2887-0.0000 ( 13846 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.7863 -9.7861 -8.4857 -8.4842 -7.0985 -7.0945 -6.7994 -6.7931 -6.3222 -6.3220 -5.7257 -5.7253 -1.0078 -1.0056 -0.5919 -0.5883 0.7760 0.7810 0.9300 0.9363 1.1680 1.1727 1.9301 1.9320 2.8159 2.8238 3.5954 3.6016 3.6292 3.6391 4.0134 4.0253 4.9733 4.9772 5.3034 5.3035 5.7105 5.7115 5.7901 5.7948 6.0549 6.0549 6.3443 6.3496 6.6296 6.6330 7.1206 7.1264 12.9808 12.9818 13.3686 13.3688 13.4629 13.4637 14.3000 14.3023 14.6247 14.6269 k = 0.1750 0.3032-0.0000 ( 13842 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.7510 -9.7507 -8.5441 -8.5426 -7.0800 -7.0758 -6.7975 -6.7911 -6.3401 -6.3399 -5.7246 -5.7241 -1.0105 -1.0082 -0.5560 -0.5523 0.8096 0.8165 0.9401 0.9447 1.1490 1.1539 1.9900 1.9918 2.7519 2.7595 3.5851 3.5939 3.6151 3.6204 4.0677 4.0798 4.9240 4.9278 5.2864 5.2867 5.7132 5.7142 5.7805 5.7852 6.0498 6.0499 6.3472 6.3528 6.6171 6.6204 7.1335 7.1392 13.0074 13.0086 13.4000 13.4003 13.5383 13.5392 14.3026 14.3050 14.5151 14.5168 k = 0.1833 0.3176-0.0000 ( 13842 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.7142 -9.7139 -8.6018 -8.6004 -7.0612 -7.0569 -6.7974 -6.7911 -6.3581 -6.3579 -5.7236 -5.7231 -1.0121 -1.0098 -0.5186 -0.5148 0.8103 0.8182 0.9841 0.9875 1.1280 1.1330 2.0539 2.0556 2.6866 2.6940 3.5408 3.5499 3.6310 3.6370 4.1215 4.1338 4.8709 4.8746 5.2686 5.2690 5.7174 5.7185 5.7744 5.7790 6.0455 6.0456 6.3507 6.3566 6.6041 6.6073 7.1459 7.1517 13.0328 13.0341 13.4283 13.4286 13.6112 13.6122 14.3060 14.3084 14.4024 14.4036 k = 0.1916 0.3320-0.0000 ( 13840 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.6759 -9.6756 -8.6588 -8.6575 -7.0423 -7.0378 -6.7991 -6.7928 -6.3761 -6.3759 -5.7227 -5.7222 -1.0131 -1.0108 -0.4797 -0.4757 0.7956 0.8037 1.0449 1.0481 1.1049 1.1101 2.1211 2.1227 2.6201 2.6273 3.4963 3.5054 3.6455 3.6516 4.1744 4.1868 4.8153 4.8188 5.2487 5.2492 5.7232 5.7244 5.7722 5.7767 6.0421 6.0423 6.3544 6.3605 6.5912 6.5943 7.1576 7.1634 13.0566 13.0581 13.4532 13.4536 13.6800 13.6812 14.2881 14.2890 14.3129 14.3152 k = 0.2000 0.3465-0.0000 ( 13844 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.6361 -9.6358 -8.7150 -8.7138 -7.0235 -7.0187 -6.8025 -6.7963 -6.3939 -6.3939 -5.7220 -5.7215 -1.0137 -1.0113 -0.4393 -0.4352 0.7775 0.7855 1.0796 1.0849 1.1112 1.1144 2.1910 2.1925 2.5526 2.5596 3.4518 3.4608 3.6579 3.6641 4.2260 4.2386 4.7583 4.7616 5.2261 5.2266 5.7306 5.7319 5.7739 5.7782 6.0400 6.0403 6.3578 6.3640 6.5790 6.5822 7.1679 7.1737 13.0789 13.0806 13.4744 13.4750 13.7431 13.7446 14.1734 14.1740 14.3258 14.3280 k = 0.2083 0.3609-0.0000 ( 13842 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.5950 -9.5946 -8.7704 -8.7693 -7.0048 -6.9998 -6.8075 -6.8013 -6.4116 -6.4115 -5.7216 -5.7210 -1.0141 -1.0117 -0.3975 -0.3932 0.7600 0.7679 1.0523 1.0578 1.1793 1.1825 2.2630 2.2644 2.4842 2.4909 3.4075 3.4165 3.6683 3.6745 4.2762 4.2888 4.7008 4.7038 5.2005 5.2010 5.7397 5.7410 5.7793 5.7834 6.0393 6.0397 6.3603 6.3663 6.5683 6.5717 7.1765 7.1823 13.0995 13.1015 13.4917 13.4924 13.7993 13.8011 14.0593 14.0597 14.3468 14.3487 k = 0.2166 0.3753-0.0000 ( 13834 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.5524 -9.5520 -8.8249 -8.8238 -6.9866 -6.9814 -6.8139 -6.8078 -6.4287 -6.4287 -5.7213 -5.7208 -1.0147 -1.0123 -0.3544 -0.3499 0.7447 0.7525 1.0229 1.0285 1.2479 1.2512 2.3366 2.3380 2.4151 2.4215 3.3636 3.3725 3.6764 3.6827 4.3246 4.3374 4.6433 4.6461 5.1719 5.1725 5.7503 5.7516 5.7877 5.7915 6.0402 6.0407 6.3611 6.3668 6.5598 6.5636 7.1831 7.1889 13.1184 13.1207 13.5051 13.5060 13.8480 13.8500 13.9468 13.9470 14.3768 14.3785 k = 0.2250 0.3898-0.0000 ( 13836 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.5085 -9.5081 -8.8784 -8.8774 -6.9691 -6.9637 -6.8216 -6.8156 -6.4451 -6.4451 -5.7213 -5.7208 -1.0156 -1.0132 -0.3100 -0.3054 0.7326 0.7402 0.9915 0.9972 1.3166 1.3198 2.3452 2.3515 2.4114 2.4127 3.3200 3.3289 3.6824 3.6887 4.3710 4.3839 4.5866 4.5891 5.1409 5.1416 5.7624 5.7638 5.7984 5.8020 6.0431 6.0438 6.3597 6.3650 6.5543 6.5586 7.1874 7.1932 13.1358 13.1383 13.5149 13.5159 13.8363 13.8364 13.8898 13.8921 14.4151 14.4166 k = 0.2333 0.4042-0.0000 ( 13828 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4633 -9.4629 -8.9309 -8.9299 -6.9526 -6.9471 -6.8305 -6.8245 -6.4606 -6.4605 -5.7216 -5.7210 -1.0172 -1.0148 -0.2644 -0.2596 0.7241 0.7316 0.9583 0.9642 1.3849 1.3882 2.2749 2.2809 2.4868 2.4880 3.2769 3.2858 3.6862 3.6925 4.4151 4.4282 4.5310 4.5332 5.1079 5.1086 5.7759 5.7773 5.8106 5.8139 6.0481 6.0489 6.3559 6.3606 6.5522 6.5572 7.1892 7.1951 13.1516 13.1544 13.5215 13.5227 13.7289 13.7290 13.9258 13.9283 14.4596 14.4608 k = 0.2416 0.4186-0.0000 ( 13842 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4169 -9.4164 -8.9822 -8.9814 -6.9376 -6.9319 -6.8404 -6.8346 -6.4746 -6.4745 -5.7222 -5.7216 -1.0196 -1.0173 -0.2177 -0.2128 0.7196 0.7270 0.9235 0.9294 1.4527 1.4559 2.2041 2.2099 2.5625 2.5636 3.2341 3.2430 3.6879 3.6942 4.4564 4.4700 4.4773 4.4788 5.0734 5.0741 5.7908 5.7922 5.8234 5.8264 6.0555 6.0565 6.3498 6.3538 6.5537 6.5592 7.1885 7.1944 13.1660 13.1691 13.5256 13.5269 13.6250 13.6250 13.9582 13.9608 14.5073 14.5083 k = 0.2500 0.4331-0.0000 ( 13856 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3692 -9.3687 -9.0324 -9.0316 -6.9244 -6.9186 -6.8513 -6.8456 -6.4869 -6.4868 -5.7231 -5.7224 -1.0231 -1.0208 -0.1701 -0.1651 0.7195 0.7268 0.8873 0.8933 1.5198 1.5230 2.1330 2.1386 2.6379 2.6389 3.1918 3.2007 3.6875 3.6938 4.4244 4.4263 4.4961 4.5093 5.0379 5.0386 5.8069 5.8083 5.8358 5.8386 6.0652 6.0664 6.3420 6.3453 6.5583 6.5644 7.1852 7.1911 13.1790 13.1825 13.5231 13.5249 13.5296 13.5299 13.9884 13.9911 14.5554 14.5562 k = 0.2583 0.4475-0.0000 ( 13850 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3205 -9.3199 -9.0814 -9.0807 -6.9136 -6.9078 -6.8630 -6.8574 -6.4969 -6.4968 -5.7243 -5.7237 -1.0277 -1.0254 -0.1217 -0.1166 0.7239 0.7310 0.8501 0.8561 1.5860 1.5892 2.0616 2.0671 2.7125 2.7135 3.1498 3.1587 3.6852 3.6916 4.3742 4.3758 4.5323 4.5457 5.0020 5.0027 5.8243 5.8256 5.8470 5.8494 6.0775 6.0789 6.3334 6.3360 6.5655 6.5722 7.1793 7.1853 13.1907 13.1945 13.4299 13.4301 13.5294 13.5307 14.0179 14.0206 14.6016 14.6023 k = 0.2666 0.4619-0.0000 ( 13858 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.2706 -9.2700 -9.1292 -9.1285 -6.9057 -6.8998 -6.8754 -6.8699 -6.5042 -6.5042 -5.7259 -5.7252 -1.0335 -1.0313 -0.0727 -0.0675 0.7328 0.7399 0.8123 0.8183 1.6513 1.6544 1.9901 1.9954 2.7857 2.7866 3.1081 3.1171 3.6813 3.6877 4.3263 4.3276 4.5656 4.5791 4.9659 4.9667 5.8429 5.8439 5.8561 5.8582 6.0923 6.0939 6.3249 6.3269 6.5748 6.5819 7.1708 7.1769 13.2004 13.2045 13.3411 13.3414 13.5302 13.5317 14.0477 14.0503 14.6441 14.6448 k = 0.2750 0.4764-0.0000 ( 13870 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.2197 -9.2190 -9.1756 -9.1750 -6.9011 -6.8953 -6.8884 -6.8830 -6.5086 -6.5084 -5.7280 -5.7272 -1.0406 -1.0384 -0.0236 -0.0183 0.7462 0.7534 0.7746 0.7804 1.7154 1.7185 1.9186 1.9237 2.8569 2.8578 3.0666 3.0757 3.6761 3.6825 4.2806 4.2818 4.5958 4.6094 4.9303 4.9310 5.8618 5.8621 5.8627 5.8656 6.1093 6.1112 6.3175 6.3189 6.5857 6.5931 7.1600 7.1662 13.2019 13.2053 13.2657 13.2663 13.5313 13.5329 14.0782 14.0808 14.6819 14.6826 k = 0.2833 0.4908-0.0000 ( 13858 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.2207 -9.2201 -9.1678 -9.1671 -6.9018 -6.9002 -6.8966 -6.8945 -6.5096 -6.5092 -5.7304 -5.7296 -1.0490 -1.0468 0.0254 0.0307 0.7363 0.7430 0.7653 0.7715 1.7783 1.7813 1.8470 1.8519 2.9252 2.9261 3.0255 3.0345 3.6701 3.6766 4.2373 4.2383 4.6230 4.6366 4.8953 4.8961 5.8645 5.8653 5.8835 5.8847 6.1286 6.1308 6.3120 6.3128 6.5975 6.6053 7.1470 7.1533 13.1586 13.1589 13.2404 13.2443 13.5330 13.5347 14.1099 14.1124 14.7137 14.7147 k = 0.2916 0.5053-0.0000 ( 13858 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.2644 -9.2639 -9.1149 -9.1142 -6.9156 -6.9105 -6.9032 -6.8977 -6.5071 -6.5066 -5.7333 -5.7325 -1.0586 -1.0565 0.0736 0.0789 0.7005 0.7071 0.7878 0.7942 1.7754 1.7803 1.8400 1.8428 2.9825 2.9904 2.9918 2.9939 3.6641 3.6706 4.1963 4.1971 4.6470 4.6607 4.8614 4.8623 5.8628 5.8631 5.9056 5.9065 6.1497 6.1522 6.3088 6.3090 6.6100 6.6181 7.1321 7.1385 13.0895 13.0899 13.2467 13.2515 13.5356 13.5374 14.1429 14.1453 14.7381 14.7396 k = 0.3000 0.5197-0.0000 ( 13858 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3067 -9.3062 -9.0613 -9.0605 -6.9297 -6.9247 -6.9100 -6.9047 -6.5014 -6.5005 -5.7366 -5.7358 -1.0694 -1.0673 0.1200 0.1252 0.6672 0.6738 0.8150 0.8213 1.7041 1.7087 1.9001 1.9028 2.9434 2.9528 3.0496 3.0503 3.6591 3.6658 4.1576 4.1582 4.6678 4.6816 4.8290 4.8299 5.8565 5.8566 5.9289 5.9295 6.1724 6.1751 6.3078 6.3081 6.6227 6.6311 7.1157 7.1222 13.0227 13.0234 13.2577 13.2630 13.5394 13.5413 14.1775 14.1798 14.7527 14.7550 k = 0.3083 0.5341-0.0000 ( 13862 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3475 -9.3470 -9.0069 -9.0060 -6.9439 -6.9391 -6.9203 -6.9152 -6.4927 -6.4915 -5.7404 -5.7396 -1.0811 -1.0791 0.1631 0.1683 0.6381 0.6449 0.8465 0.8527 1.6330 1.6374 1.9586 1.9613 2.9028 2.9122 3.1024 3.1031 3.6567 3.6635 4.1209 4.1214 4.6857 4.6996 4.7982 4.7992 5.8455 5.8461 5.9533 5.9537 6.1963 6.1993 6.3090 6.3098 6.6354 6.6440 7.0980 7.1047 12.9616 12.9625 13.2705 13.2762 13.5443 13.5464 14.2136 14.2157 14.7549 14.7581 k = 0.3166 0.5486-0.0000 ( 13850 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3868 -9.3864 -8.9517 -8.9508 -6.9581 -6.9535 -6.9338 -6.9290 -6.4814 -6.4799 -5.7448 -5.7438 -1.0938 -1.0918 0.2009 0.2058 0.6157 0.6228 0.8821 0.8881 1.5622 1.5664 2.0154 2.0179 2.8623 2.8717 3.1465 3.1472 3.6586 3.6655 4.0862 4.0867 4.7007 4.7146 4.7693 4.7704 5.8306 5.8316 5.9788 5.9789 6.2210 6.2243 6.3122 6.3135 6.6476 6.6564 7.0796 7.0864 12.9069 12.9082 13.2850 13.2910 13.5506 13.5527 14.2511 14.2531 14.7427 14.7470 k = 0.3250 0.5630-0.0000 ( 13852 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4246 -9.4242 -8.8960 -8.8950 -6.9723 -6.9679 -6.9502 -6.9456 -6.4680 -6.4663 -5.7496 -5.7486 -1.1071 -1.1052 0.2304 0.2349 0.6032 0.6106 0.9216 0.9274 1.4919 1.4960 2.0703 2.0728 2.8218 2.8313 3.1798 3.1806 3.6668 3.6738 4.0533 4.0537 4.7129 4.7267 4.7427 4.7438 5.8122 5.8136 6.0050 6.0052 6.2462 6.2497 6.3170 6.3186 6.6591 6.6681 7.0610 7.0680 12.8592 12.8607 13.3013 13.3075 13.5580 13.5603 14.2900 14.2918 14.7169 14.7222 k = 0.3333 0.5774-0.0000 ( 13852 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4608 -9.4604 -8.8397 -8.8387 -6.9864 -6.9822 -6.9690 -6.9647 -6.4529 -6.4510 -5.7549 -5.7538 -1.1211 -1.1192 0.2485 0.2527 0.6036 0.6115 0.9647 0.9704 1.4224 1.4262 2.1233 2.1256 2.7815 2.7910 3.2007 3.2014 3.6829 3.6900 4.0220 4.0223 4.7180 4.7195 4.7226 4.7367 5.7909 5.7926 6.0319 6.0324 6.2715 6.2753 6.3228 6.3246 6.6694 6.6785 7.0429 7.0500 12.8187 12.8204 13.3196 13.3261 13.5667 13.5691 14.3299 14.3315 14.6809 14.6868 k = 0.3333 0.5774-0.0000 ( 13852 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4608 -9.4604 -8.8397 -8.8387 -6.9864 -6.9822 -6.9690 -6.9647 -6.4529 -6.4510 -5.7549 -5.7538 -1.1211 -1.1192 0.2485 0.2527 0.6036 0.6115 0.9647 0.9704 1.4224 1.4262 2.1233 2.1256 2.7815 2.7910 3.2007 3.2014 3.6829 3.6900 4.0220 4.0223 4.7180 4.7195 4.7226 4.7367 5.7909 5.7926 6.0319 6.0324 6.2715 6.2753 6.3228 6.3246 6.6694 6.6785 7.0429 7.0500 12.8187 12.8204 13.3196 13.3261 13.5667 13.5691 14.3299 14.3315 14.6809 14.6868 k = 0.3166 0.5774-0.0000 ( 13844 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4436 -9.4432 -8.8672 -8.8663 -6.9796 -6.9752 -6.9589 -6.9545 -6.4599 -6.4581 -5.7528 -5.7518 -1.1135 -1.1116 0.2388 0.2431 0.6016 0.6093 0.9437 0.9495 1.4574 1.4613 2.0941 2.0965 2.8050 2.8144 3.1923 3.1929 3.6712 3.6783 4.0400 4.0404 4.7104 4.7198 4.7376 4.7438 5.8008 5.8023 6.0184 6.0192 6.2558 6.2595 6.3215 6.3234 6.6661 6.6751 7.0513 7.0584 12.8389 12.8405 13.3103 13.3166 13.5646 13.5670 14.3099 14.3116 14.6955 14.7010 k = 0.3000 0.5774-0.0000 ( 13848 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4276 -9.4271 -8.8933 -8.8923 -6.9730 -6.9686 -6.9487 -6.9441 -6.4651 -6.4634 -5.7522 -5.7511 -1.1049 -1.1029 0.2218 0.2262 0.6022 0.6097 0.9264 0.9321 1.4930 1.4970 2.0603 2.0628 2.8336 2.8430 3.1817 3.1825 3.6568 3.6638 4.0630 4.0635 4.6984 4.7091 4.7571 4.7617 5.8068 5.8081 6.0066 6.0081 6.2348 6.2385 6.3224 6.3244 6.6658 6.6747 7.0589 7.0659 12.8628 12.8642 13.3017 13.3079 13.5678 13.5700 14.2912 14.2929 14.7001 14.7053 k = 0.2833 0.5774-0.0000 ( 13862 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4126 -9.4122 -8.9178 -8.9168 -6.9668 -6.9623 -6.9386 -6.9338 -6.4683 -6.4667 -5.7531 -5.7521 -1.0950 -1.0931 0.1988 0.2032 0.6039 0.6111 0.9133 0.9189 1.5287 1.5328 2.0243 2.0270 2.8649 2.8741 3.1701 3.1709 3.6399 3.6467 4.0900 4.0907 4.6852 4.6964 4.7776 4.7816 5.8072 5.8085 5.9986 6.0009 6.2098 6.2136 6.3242 6.3264 6.6683 6.6770 7.0657 7.0725 12.8901 12.8914 13.2936 13.2996 13.5760 13.5780 14.2750 14.2768 14.6968 14.7015 k = 0.2666 0.5774-0.0000 ( 13860 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3989 -9.3985 -8.9407 -8.9398 -6.9608 -6.9562 -6.9287 -6.9238 -6.4693 -6.4679 -5.7556 -5.7545 -1.0839 -1.0819 0.1707 0.1751 0.6051 0.6120 0.9046 0.9100 1.5640 1.5682 1.9884 1.9913 2.8962 2.9051 3.1588 3.1598 3.6210 3.6276 4.1203 4.1212 4.6712 4.6826 4.7991 4.8026 5.8008 5.8024 5.9957 5.9988 6.1815 6.1854 6.3262 6.3286 6.6733 6.6817 7.0716 7.0784 12.9208 12.9220 13.2858 13.2916 13.5891 13.5910 14.2621 14.2639 14.6877 14.6921 k = 0.2500 0.5774-0.0000 ( 13860 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3865 -9.3860 -8.9620 -8.9611 -6.9551 -6.9504 -6.9192 -6.9142 -6.4682 -6.4668 -5.7597 -5.7587 -1.0714 -1.0694 0.1387 0.1430 0.6050 0.6115 0.9003 0.9054 1.5983 1.6026 1.9547 1.9578 2.9244 2.9328 3.1502 3.1516 3.6006 3.6069 4.1530 4.1542 4.6566 4.6679 4.8214 4.8245 5.7876 5.7898 5.9980 6.0019 6.1504 6.1545 6.3283 6.3308 6.6804 6.6885 7.0768 7.0834 12.9548 12.9559 13.2782 13.2838 13.6069 13.6086 14.2530 14.2548 14.6753 14.6793 k = 0.2333 0.5774-0.0000 ( 13856 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3753 -9.3749 -8.9815 -8.9807 -6.9497 -6.9449 -6.9104 -6.9052 -6.4648 -6.4635 -5.7654 -5.7644 -1.0573 -1.0553 0.1036 0.1077 0.6031 0.6091 0.8997 0.9043 1.6305 1.6350 1.9251 1.9284 2.9453 2.9529 3.1478 3.1501 3.5789 3.5850 4.1872 4.1886 4.6417 4.6529 4.8442 4.8471 5.7690 5.7715 6.0045 6.0090 6.1171 6.1214 6.3302 6.3328 6.6891 6.6969 7.0814 7.0877 12.9917 12.9927 13.2708 13.2761 13.6290 13.6305 14.2478 14.2495 14.6615 14.6652 k = 0.2166 0.5774-0.0000 ( 13853 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3654 -9.3650 -8.9994 -8.9986 -6.9445 -6.9397 -6.9023 -6.8969 -6.4590 -6.4578 -5.7727 -5.7717 -1.0417 -1.0397 0.0660 0.0699 0.5995 0.6050 0.9018 0.9059 1.6594 1.6638 1.9018 1.9053 2.9551 2.9613 3.1554 3.1588 3.5565 3.5624 4.2218 4.2236 4.6274 4.6383 4.8674 4.8700 5.7463 5.7491 6.0135 6.0185 6.0825 6.0868 6.3320 6.3345 6.6989 6.7064 7.0852 7.0914 13.0313 13.0323 13.2634 13.2685 13.6549 13.6563 14.2462 14.2478 14.6481 14.6515 k = 0.2000 0.5774-0.0000 ( 13860 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3569 -9.3564 -9.0156 -9.0148 -6.9396 -6.9348 -6.8951 -6.8896 -6.4509 -6.4498 -5.7816 -5.7807 -1.0245 -1.0225 0.0265 0.0302 0.5946 0.5997 0.9055 0.9091 1.6826 1.6869 1.8878 1.8913 2.9523 2.9572 3.1738 3.1783 3.5338 3.5393 4.2556 4.2578 4.6145 4.6250 4.8906 4.8931 5.7208 5.7240 6.0214 6.0272 6.0490 6.0532 6.3335 6.3361 6.7095 6.7165 7.0885 7.0944 13.0731 13.0742 13.2560 13.2608 13.6844 13.6855 14.2475 14.2491 14.6368 14.6400 k = 0.1833 0.5774-0.0000 ( 13864 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3496 -9.3491 -9.0300 -9.0292 -6.9350 -6.9302 -6.8889 -6.8834 -6.4406 -6.4396 -5.7920 -5.7910 -1.0057 -1.0036 -0.0144 -0.0109 0.5889 0.5935 0.9097 0.9129 1.6981 1.7019 1.8856 1.8887 2.9396 2.9435 3.2004 3.2056 3.5112 3.5164 4.2871 4.2898 4.6045 4.6143 4.9136 4.9160 5.6937 5.6972 6.0034 6.0084 6.0422 6.0458 6.3349 6.3375 6.7204 6.7271 7.0913 7.0969 13.1167 13.1178 13.2488 13.2533 13.7168 13.7178 14.2506 14.2522 14.6293 14.6322 k = 0.1666 0.5774-0.0000 ( 13866 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3435 -9.3430 -9.0426 -9.0419 -6.9307 -6.9259 -6.8836 -6.8781 -6.4283 -6.4273 -5.8037 -5.8028 -0.9853 -0.9832 -0.0562 -0.0530 0.5828 0.5869 0.9137 0.9165 1.7053 1.7083 1.8956 1.8982 2.9205 2.9236 3.2314 3.2370 3.4890 3.4939 4.3140 4.3173 4.5994 4.6084 4.9360 4.9383 5.6659 5.6696 5.9672 5.9721 6.0524 6.0564 6.3360 6.3386 6.7313 6.7376 7.0936 7.0988 13.1614 13.1625 13.2418 13.2460 13.7517 13.7527 14.2543 14.2559 14.6271 14.6296 k = 0.1500 0.5774-0.0000 ( 13868 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3386 -9.3382 -9.0536 -9.0530 -6.9266 -6.9220 -6.8793 -6.8739 -6.4143 -6.4134 -5.8165 -5.8156 -0.9634 -0.9614 -0.0985 -0.0955 0.5768 0.5804 0.9170 0.9193 1.7065 1.7086 1.9151 1.9170 2.8976 2.9002 3.2639 3.2697 3.4679 3.4725 4.3340 4.3380 4.6016 4.6094 4.9572 4.9595 5.6382 5.6421 5.9296 5.9344 6.0636 6.0676 6.3370 6.3395 6.7420 6.7478 7.0955 7.1004 13.2062 13.2075 13.2353 13.2390 13.7886 13.7897 14.2570 14.2587 14.6311 14.6331 k = 0.1333 0.5774-0.0000 ( 13862 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3347 -9.3343 -9.0630 -9.0624 -6.9229 -6.9184 -6.8758 -6.8706 -6.3989 -6.3981 -5.8302 -5.8294 -0.9403 -0.9383 -0.1407 -0.1379 0.5710 0.5742 0.9192 0.9211 1.7049 1.7063 1.9401 1.9415 2.8727 2.8749 3.2961 3.3017 3.4486 3.4527 4.3455 4.3501 4.6126 4.6191 4.9767 4.9791 5.6113 5.6154 5.8921 5.8970 6.0744 6.0783 6.3379 6.3403 6.7522 6.7575 7.0970 7.1016 13.2285 13.2320 13.2515 13.2521 13.8270 13.8284 14.2578 14.2597 14.6408 14.6421 k = 0.1166 0.5774-0.0000 ( 13866 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3318 -9.3315 -9.0709 -9.0703 -6.9194 -6.9151 -6.8731 -6.8682 -6.3827 -6.3820 -5.8445 -5.8437 -0.9161 -0.9142 -0.1822 -0.1797 0.5656 0.5684 0.9202 0.9219 1.7027 1.7036 1.9674 1.9686 2.8471 2.8490 3.3258 3.3310 3.4319 3.4358 4.3486 4.3537 4.6322 4.6374 4.9937 4.9962 5.5863 5.5906 5.8556 5.8603 6.0844 6.0880 6.3386 6.3408 6.7617 6.7664 7.0983 7.1024 13.2230 13.2261 13.2942 13.2949 13.8664 13.8681 14.2561 14.2583 14.6533 14.6538 k = 0.1000 0.5774-0.0000 ( 13859 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3297 -9.3294 -9.0773 -9.0768 -6.9162 -6.9122 -6.8711 -6.8665 -6.3662 -6.3656 -5.8588 -5.8581 -0.8914 -0.8896 -0.2225 -0.2201 0.5609 0.5633 0.9203 0.9216 1.7010 1.7016 1.9950 1.9961 2.8218 2.8234 3.3500 3.3546 3.4205 3.4243 4.3453 4.3504 4.6582 4.6624 5.0075 5.0100 5.5641 5.5685 5.8204 5.8251 6.0934 6.0967 6.3392 6.3412 6.7703 6.7744 7.0994 7.1030 13.2179 13.2206 13.3344 13.3352 13.9063 13.9083 14.2524 14.2548 14.6619 14.6620 k = 0.0833 0.5774-0.0000 ( 13868 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3283 -9.3280 -9.0825 -9.0821 -6.9134 -6.9098 -6.8696 -6.8655 -6.3502 -6.3497 -5.8728 -5.8722 -0.8668 -0.8651 -0.2605 -0.2584 0.5569 0.5588 0.9197 0.9207 1.7002 1.7005 2.0214 2.0224 2.7977 2.7991 3.3627 3.3664 3.4197 3.4238 4.3382 4.3430 4.6879 4.6914 5.0173 5.0199 5.5456 5.5500 5.7875 5.7920 6.1013 6.1041 6.3397 6.3415 6.7779 6.7814 7.1003 7.1033 13.2136 13.2158 13.3710 13.3717 13.9458 13.9480 14.2471 14.2498 14.6588 14.6591 k = 0.0667 0.5774-0.0000 ( 13872 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3273 -9.3271 -9.0865 -9.0862 -6.9109 -6.9078 -6.8684 -6.8650 -6.3352 -6.3348 -5.8858 -5.8853 -0.8433 -0.8417 -0.2953 -0.2935 0.5535 0.5551 0.9186 0.9194 1.7001 1.7003 2.0454 2.0461 2.7760 2.7771 3.3623 3.3650 3.4311 3.4349 4.3296 4.3338 4.7185 4.7213 5.0228 5.0254 5.5316 5.5359 5.7577 5.7618 6.1079 6.1102 6.3401 6.3416 6.7843 6.7872 7.1010 7.1035 13.2100 13.2118 13.4027 13.4033 13.9837 13.9862 14.2412 14.2441 14.6432 14.6436 k = 0.0500 0.5774-0.0000 ( 13882 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3268 -9.3266 -9.0895 -9.0892 -6.9088 -6.9063 -6.8676 -6.8648 -6.3223 -6.3220 -5.8971 -5.8967 -0.8219 -0.8207 -0.3254 -0.3239 0.5510 0.5522 0.9174 0.9180 1.7005 1.7006 2.0656 2.0662 2.7576 2.7584 3.3568 3.3587 3.4460 3.4491 4.3213 4.3247 4.7472 4.7494 5.0243 5.0265 5.5224 5.5261 5.7321 5.7356 6.1131 6.1150 6.3405 6.3416 6.7895 6.7917 7.1016 7.1035 13.2073 13.2086 13.4286 13.4290 14.0183 14.0209 14.2354 14.2383 14.6209 14.6214 k = 0.0333 0.5774-0.0000 ( 13872 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3264 -9.3263 -9.0915 -9.0913 -6.9071 -6.9054 -6.8669 -6.8650 -6.3122 -6.3120 -5.9059 -5.9056 -0.8045 -0.8036 -0.3489 -0.3479 0.5492 0.5500 0.9164 0.9168 1.7011 1.7012 2.0811 2.0815 2.7435 2.7441 3.3514 3.3527 3.4587 3.4608 4.3146 4.3170 4.7713 4.7729 5.0228 5.0246 5.5175 5.5204 5.7122 5.7148 6.1170 6.1183 6.3408 6.3416 6.7934 6.7948 7.1022 7.1034 13.2053 13.2063 13.4477 13.4480 14.0473 14.0495 14.2305 14.2330 14.5991 14.5995 k = 0.0167 0.5774-0.0000 ( 13878 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3262 -9.3262 -9.0927 -9.0926 -6.9059 -6.9050 -6.8663 -6.8653 -6.3058 -6.3057 -5.9115 -5.9114 -0.7929 -0.7924 -0.3641 -0.3635 0.5482 0.5486 0.9157 0.9159 1.7016 1.7016 2.0909 2.0911 2.7347 2.7350 3.3480 3.3486 3.4671 3.4682 4.3106 4.3118 4.7878 4.7887 5.0206 5.0216 5.5158 5.5174 5.6995 5.7010 6.1195 6.1201 6.3411 6.3415 6.7959 6.7966 7.1026 7.1032 13.2043 13.2047 13.4595 13.4596 14.0672 14.0686 14.2273 14.2289 14.5834 14.5836 k = 0.0000 0.5774-0.0000 ( 13880 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3262 -9.3262 -9.0930 -9.0930 -6.9052 -6.9052 -6.8658 -6.8658 -6.3036 -6.3036 -5.9134 -5.9134 -0.7886 -0.7886 -0.3691 -0.3691 0.5480 0.5480 0.9155 0.9155 1.7018 1.7018 2.0943 2.0943 2.7317 2.7317 3.3470 3.3470 3.4703 3.4703 4.3096 4.3096 4.7940 4.7940 5.0198 5.0198 5.5160 5.5160 5.6956 5.6956 6.1206 6.1206 6.3413 6.3413 6.7970 6.7970 7.1029 7.1029 13.2041 13.2041 13.4635 13.4635 14.0749 14.0749 14.2268 14.2268 14.5777 14.5777 k = 0.0000 0.5774-0.0000 ( 13880 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3262 -9.3262 -9.0930 -9.0930 -6.9052 -6.9052 -6.8658 -6.8658 -6.3036 -6.3036 -5.9134 -5.9134 -0.7886 -0.7886 -0.3691 -0.3691 0.5480 0.5480 0.9155 0.9155 1.7018 1.7018 2.0943 2.0943 2.7317 2.7317 3.3470 3.3470 3.4703 3.4703 4.3096 4.3096 4.7940 4.7940 5.0198 5.0198 5.5160 5.5160 5.6956 5.6956 6.1206 6.1206 6.3413 6.3413 6.7970 6.7970 7.1029 7.1029 13.2041 13.2041 13.4635 13.4635 14.0749 14.0749 14.2268 14.2268 14.5777 14.5777 k = 0.0000 0.5774 0.0168 ( 13884 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3252 -9.3252 -9.0921 -9.0921 -6.9080 -6.9078 -6.8677 -6.8676 -6.3026 -6.3024 -5.9134 -5.9134 -0.7892 -0.7892 -0.3685 -0.3682 0.5519 0.5519 0.9172 0.9173 1.6993 1.6996 2.0921 2.0924 2.7334 2.7337 3.3472 3.3477 3.4703 3.4706 4.3098 4.3099 4.7926 4.7927 5.0205 5.0207 5.5148 5.5149 5.6940 5.6943 6.1218 6.1220 6.3420 6.3420 6.7988 6.7988 7.1025 7.1025 13.1980 13.1982 13.4624 13.4624 14.0734 14.0735 14.2271 14.2271 14.5757 14.5757 k = 0.0000 0.5774 0.0336 ( 13888 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.3224 -9.3224 -9.0893 -9.0893 -6.9162 -6.9158 -6.8733 -6.8732 -6.2996 -6.2991 -5.9133 -5.9133 -0.7909 -0.7908 -0.3665 -0.3658 0.5635 0.5636 0.9221 0.9223 1.6922 1.6929 2.0859 2.0865 2.7386 2.7392 3.3484 3.3494 3.4705 3.4711 4.3107 4.3107 4.7885 4.7887 5.0228 5.0232 5.5113 5.5114 5.6896 5.6901 6.1257 6.1262 6.3440 6.3441 6.8042 6.8044 7.1012 7.1012 13.1804 13.1807 13.4592 13.4592 14.0690 14.0690 14.2277 14.2278 14.5700 14.5700 k = 0.0000 0.5774 0.0505 ( 13872 PWs) bands (ev): -35.7720 -35.7720 -35.7618 -35.7618 -9.3177 -9.3177 -9.0848 -9.0847 -6.9296 -6.9291 -6.8827 -6.8825 -6.2946 -6.2939 -5.9133 -5.9133 -0.7936 -0.7935 -0.3629 -0.3619 0.5826 0.5828 0.9300 0.9303 1.6811 1.6821 2.0758 2.0767 2.7472 2.7481 3.3505 3.3519 3.4709 3.4717 4.3119 4.3120 4.7817 4.7820 5.0265 5.0271 5.5054 5.5055 5.6827 5.6835 6.1320 6.1326 6.3474 6.3475 6.8133 6.8135 7.0991 7.0991 13.1523 13.1527 13.4538 13.4539 14.0614 14.0615 14.2276 14.2279 14.5612 14.5613 k = 0.0000 0.5774 0.0673 ( 13886 PWs) bands (ev): -35.7719 -35.7719 -35.7618 -35.7618 -9.3112 -9.3112 -9.0783 -9.0783 -6.9479 -6.9473 -6.8957 -6.8954 -6.2880 -6.2871 -5.9133 -5.9132 -0.7970 -0.7968 -0.3579 -0.3567 0.6089 0.6092 0.9406 0.9410 1.6668 1.6681 2.0620 2.0633 2.7589 2.7601 3.3533 3.3551 3.4716 3.4727 4.3133 4.3133 4.7725 4.7728 5.0316 5.0323 5.4972 5.4974 5.6739 5.6749 6.1401 6.1409 6.3521 6.3523 6.8257 6.8260 7.0960 7.0961 13.1152 13.1158 13.4466 13.4467 14.0507 14.0508 14.2258 14.2262 14.5506 14.5507 k = 0.0000 0.5774 0.0841 ( 13882 PWs) bands (ev): -35.7719 -35.7719 -35.7619 -35.7619 -9.3027 -9.3027 -9.0701 -9.0700 -6.9708 -6.9700 -6.9122 -6.9119 -6.2799 -6.2788 -5.9133 -5.9132 -0.8009 -0.8007 -0.3516 -0.3500 0.6420 0.6423 0.9531 0.9535 1.6505 1.6520 2.0449 2.0464 2.7734 2.7748 3.3567 3.3589 3.4727 3.4741 4.3145 4.3145 4.7610 4.7613 5.0378 5.0387 5.4868 5.4871 5.6636 5.6648 6.1498 6.1507 6.3581 6.3583 6.8413 6.8416 7.0922 7.0923 13.0710 13.0718 13.4376 13.4376 14.0366 14.0367 14.2210 14.2214 14.5393 14.5393 k = 0.0000 0.5774 0.1009 ( 13880 PWs) bands (ev): -35.7718 -35.7718 -35.7619 -35.7619 -9.2925 -9.2924 -9.0600 -9.0599 -6.9978 -6.9970 -6.9321 -6.9317 -6.2707 -6.2695 -5.9133 -5.9132 -0.8050 -0.8047 -0.3440 -0.3422 0.6812 0.6815 0.9667 0.9671 1.6334 1.6353 2.0247 2.0265 2.7904 2.7920 3.3603 3.3629 3.4744 3.4760 4.3149 4.3150 4.7475 4.7478 5.0449 5.0460 5.4743 5.4746 5.6525 5.6538 6.1605 6.1615 6.3654 6.3656 6.8597 6.8601 7.0875 7.0876 13.0215 13.0224 13.4271 13.4271 14.0192 14.0193 14.2123 14.2129 14.5284 14.5284 k = 0.0000 0.5774 0.1178 ( 13874 PWs) bands (ev): -35.7717 -35.7717 -35.7620 -35.7620 -9.2803 -9.2803 -9.0481 -9.0480 -7.0287 -7.0278 -6.9553 -6.9549 -6.2607 -6.2593 -5.9134 -5.9134 -0.8090 -0.8087 -0.3352 -0.3331 0.7260 0.7264 0.9800 0.9804 1.6175 1.6196 2.0020 2.0040 2.8094 2.8112 3.3640 3.3669 3.4769 3.4787 4.3140 4.3142 4.7324 4.7326 5.0527 5.0539 5.4597 5.4600 5.6408 5.6422 6.1719 6.1730 6.3739 6.3742 6.8806 6.8811 7.0821 7.0821 12.9683 12.9693 13.4152 13.4154 13.9987 13.9987 14.1996 14.2002 14.5187 14.5189 k = 0.0000 0.5774 0.1346 ( 13866 PWs) bands (ev): -35.7716 -35.7716 -35.7621 -35.7621 -9.2664 -9.2663 -9.0344 -9.0343 -7.0630 -7.0620 -6.9816 -6.9812 -6.2500 -6.2486 -5.9136 -5.9136 -0.8125 -0.8122 -0.3254 -0.3231 0.7757 0.7761 0.9915 0.9918 1.6048 1.6071 1.9772 1.9794 2.8303 2.8322 3.3672 3.3703 3.4805 3.4823 4.3113 4.3116 4.7161 4.7163 5.0607 5.0620 5.4432 5.4435 5.6290 5.6305 6.1838 6.1849 6.3837 6.3840 6.9036 6.9041 7.0758 7.0759 12.9131 12.9142 13.4023 13.4026 13.9754 13.9754 14.1827 14.1834 14.5111 14.5114 k = 0.0000 0.5774 0.1514 ( 13870 PWs) bands (ev): -35.7715 -35.7715 -35.7622 -35.7622 -9.2505 -9.2505 -9.0189 -9.0188 -7.1003 -7.0994 -7.0110 -7.0105 -6.2389 -6.2374 -5.9140 -5.9139 -0.8153 -0.8149 -0.3146 -0.3121 0.8294 0.8299 0.9993 0.9996 1.5976 1.6002 1.9509 1.9533 2.8527 2.8547 3.3696 3.3728 3.4855 3.4873 4.3060 4.3065 4.6992 4.6992 5.0685 5.0699 5.4250 5.4253 5.6171 5.6187 6.1961 6.1971 6.3948 6.3951 6.9283 6.9289 7.0688 7.0689 12.8571 12.8583 13.3887 13.3892 13.9497 13.9499 14.1622 14.1629 14.5058 14.5063 k = 0.0000 0.5774 0.1682 ( 13856 PWs) bands (ev): -35.7714 -35.7714 -35.7623 -35.7623 -9.2329 -9.2329 -9.0016 -9.0015 -7.1405 -7.1395 -7.0431 -7.0426 -6.2275 -6.2260 -5.9145 -5.9145 -0.8171 -0.8168 -0.3030 -0.3004 0.8863 0.8868 1.0016 1.0019 1.5982 1.6009 1.9240 1.9266 2.8764 2.8785 3.3709 3.3740 3.4923 3.4939 4.2975 4.2982 4.6821 4.6824 5.0756 5.0771 5.4051 5.4054 5.6052 5.6069 6.2085 6.2095 6.4072 6.4074 6.9542 6.9549 7.0610 7.0611 12.8016 12.8029 13.3747 13.3754 13.9224 13.9227 14.1387 14.1394 14.5031 14.5037 k = 0.0000 0.5774 0.1851 ( 13864 PWs) bands (ev): -35.7713 -35.7713 -35.7624 -35.7624 -9.2135 -9.2135 -8.9826 -8.9825 -7.1831 -7.1822 -7.0779 -7.0774 -6.2160 -6.2144 -5.9152 -5.9151 -0.8178 -0.8174 -0.2908 -0.2880 0.9451 0.9456 0.9971 0.9973 1.6083 1.6111 1.8974 1.9001 2.9012 2.9035 3.3707 3.3737 3.5008 3.5023 4.2851 4.2860 4.6655 4.6660 5.0815 5.0831 5.3839 5.3842 5.5932 5.5950 6.2212 6.2221 6.4209 6.4212 6.9810 6.9817 7.0525 7.0526 12.7477 12.7490 13.3605 13.3614 13.8941 13.8945 14.1128 14.1134 14.5029 14.5036 k = 0.0000 0.5774 0.2019 ( 13852 PWs) bands (ev): -35.7712 -35.7712 -35.7625 -35.7625 -9.1923 -9.1923 -8.9619 -8.9617 -7.2280 -7.2271 -7.1151 -7.1146 -6.2045 -6.2029 -5.9161 -5.9160 -0.8171 -0.8166 -0.2782 -0.2752 0.9849 0.9850 1.0047 1.0053 1.6287 1.6317 1.8722 1.8751 2.9272 2.9295 3.3690 3.3718 3.5113 3.5126 4.2685 4.2696 4.6499 4.6507 5.0857 5.0872 5.3615 5.3618 5.5810 5.5829 6.2342 6.2350 6.4361 6.4363 7.0080 7.0088 7.0434 7.0434 12.6962 12.6976 13.3465 13.3476 13.8655 13.8661 14.0852 14.0858 14.5050 14.5059 k = 0.0000 0.5774 0.2187 ( 13854 PWs) bands (ev): -35.7710 -35.7710 -35.7627 -35.7627 -9.1693 -9.1693 -8.9394 -8.9392 -7.2749 -7.2740 -7.1546 -7.1541 -6.1930 -6.1913 -5.9172 -5.9171 -0.8148 -0.8144 -0.2653 -0.2623 0.9660 0.9661 1.0628 1.0635 1.6594 1.6624 1.8503 1.8533 2.9540 2.9564 3.3657 3.3682 3.5236 3.5246 4.2472 4.2486 4.6357 4.6367 5.0874 5.0890 5.3382 5.3385 5.5684 5.5703 6.2474 6.2482 6.4528 6.4529 7.0305 7.0318 7.0376 7.0379 12.6480 12.6495 13.3329 13.3343 13.8372 13.8380 14.0567 14.0572 14.5094 14.5104 k = 0.0000 0.5774 0.2355 ( 13858 PWs) bands (ev): -35.7709 -35.7709 -35.7628 -35.7628 -9.1446 -9.1445 -8.9153 -8.9151 -7.3235 -7.3226 -7.1962 -7.1956 -6.1816 -6.1799 -5.9186 -5.9185 -0.8109 -0.8104 -0.2523 -0.2493 0.9412 0.9412 1.1174 1.1182 1.6994 1.7023 1.8338 1.8368 2.9818 2.9842 3.3610 3.3632 3.5376 3.5382 4.2214 4.2230 4.6229 4.6242 5.0861 5.0876 5.3145 5.3146 5.5550 5.5571 6.2610 6.2617 6.4711 6.4712 7.0221 7.0225 7.0624 7.0630 12.6038 12.6054 13.3197 13.3214 13.8099 13.8108 14.0278 14.0282 14.5157 14.5168 k = 0.0000 0.5774 0.2524 ( 13860 PWs) bands (ev): -35.7707 -35.7707 -35.7630 -35.7630 -9.1181 -9.1181 -8.8894 -8.8892 -7.3737 -7.3728 -7.2396 -7.2390 -6.1703 -6.1686 -5.9202 -5.9201 -0.8052 -0.8048 -0.2397 -0.2366 0.9119 0.9120 1.1654 1.1663 1.7473 1.7503 1.8255 1.8286 3.0104 3.0128 3.3549 3.3569 3.5529 3.5533 4.1911 4.1929 4.6115 4.6131 5.0811 5.0825 5.2907 5.2907 5.5407 5.5429 6.2750 6.2755 6.4910 6.4910 7.0110 7.0114 7.0880 7.0888 12.5642 12.5658 13.3072 13.3091 13.7841 13.7853 13.9991 13.9994 14.5236 14.5247 k = 0.0000 0.5774 0.2692 ( 13854 PWs) bands (ev): -35.7706 -35.7706 -35.7631 -35.7631 -9.0900 -9.0899 -8.8620 -8.8618 -7.4252 -7.4244 -7.2847 -7.2842 -6.1592 -6.1575 -5.9222 -5.9220 -0.7977 -0.7972 -0.2276 -0.2245 0.8798 0.8799 1.2033 1.2044 1.8018 1.8048 1.8290 1.8320 3.0398 3.0423 3.3476 3.3494 3.5694 3.5697 4.1567 4.1586 4.6014 4.6031 5.0719 5.0732 5.2670 5.2672 5.5252 5.5274 6.2894 6.2899 6.5126 6.5127 6.9992 6.9996 7.1126 7.1133 12.5298 12.5314 13.2952 13.2973 13.7606 13.7619 13.9712 13.9713 14.5327 14.5339 k = 0.0000 0.5774 0.2860 ( 13846 PWs) bands (ev): -35.7704 -35.7704 -35.7633 -35.7633 -9.0602 -9.0601 -8.8329 -8.8327 -7.4778 -7.4771 -7.3314 -7.3308 -6.1482 -6.1466 -5.9244 -5.9242 -0.7884 -0.7879 -0.2163 -0.2133 0.8463 0.8465 1.2281 1.2295 1.8461 1.8483 1.8631 1.8654 3.0701 3.0726 3.3391 3.3408 3.5868 3.5870 4.1186 4.1206 4.5922 4.5941 5.0579 5.0590 5.2441 5.2445 5.5082 5.5105 6.3043 6.3047 6.5357 6.5359 6.9869 6.9874 7.1355 7.1363 12.5009 12.5025 13.2835 13.2857 13.7399 13.7413 13.9444 13.9445 14.5425 14.5438 k = 0.0000 0.5774 0.3028 ( 13852 PWs) bands (ev): -35.7702 -35.7702 -35.7635 -35.7635 -9.0287 -9.0286 -8.8023 -8.8021 -7.5315 -7.5307 -7.3794 -7.3788 -6.1375 -6.1359 -5.9269 -5.9267 -0.7771 -0.7766 -0.2064 -0.2035 0.8127 0.8130 1.2384 1.2401 1.8795 1.8818 1.9270 1.9296 3.1012 3.1037 3.3297 3.3313 3.6050 3.6050 4.0773 4.0793 4.5837 4.5858 5.0389 5.0399 5.2223 5.2229 5.4895 5.4919 6.3198 6.3201 6.5603 6.5606 6.9744 6.9750 7.1566 7.1574 12.4779 12.4795 13.2716 13.2740 13.7227 13.7242 13.9191 13.9194 14.5525 14.5536 k = 0.0000 0.5774 0.3197 ( 13854 PWs) bands (ev): -35.7700 -35.7700 -35.7637 -35.7637 -8.9956 -8.9956 -8.7702 -8.7700 -7.5859 -7.5852 -7.4285 -7.4279 -6.1269 -6.1253 -5.9297 -5.9294 -0.7639 -0.7635 -0.1983 -0.1955 0.7802 0.7806 1.2351 1.2372 1.9271 1.9293 1.9946 1.9971 3.1332 3.1357 3.3194 3.3208 3.6236 3.6236 4.0332 4.0351 4.5758 4.5779 5.0150 5.0158 5.2016 5.2025 5.4691 5.4716 6.3358 6.3360 6.5860 6.5864 6.9618 6.9625 7.1756 7.1764 12.4611 12.4627 13.2589 13.2614 13.7098 13.7113 13.8958 13.8963 14.5616 14.5627 k = 0.0000 0.5774 0.3365 ( 13860 PWs) bands (ev): -35.7698 -35.7698 -35.7639 -35.7639 -8.9610 -8.9609 -8.7366 -8.7364 -7.6408 -7.6402 -7.4786 -7.4780 -6.1165 -6.1150 -5.9329 -5.9325 -0.7489 -0.7484 -0.1924 -0.1897 0.7498 0.7504 1.2207 1.2230 1.9866 1.9885 2.0646 2.0671 3.1660 3.1684 3.3082 3.3095 3.6424 3.6424 3.9866 3.9885 4.5683 4.5704 4.9865 4.9871 5.1823 5.1834 5.4469 5.4494 6.3524 6.3525 6.6123 6.6129 6.9496 6.9503 7.1920 7.1928 12.4506 12.4522 13.2449 13.2473 13.7019 13.7033 13.8749 13.8756 14.5688 14.5695 k = 0.0000 0.5774 0.3533 ( 13874 PWs) bands (ev): -35.7696 -35.7696 -35.7641 -35.7641 -8.9248 -8.9247 -8.7017 -8.7014 -7.6962 -7.6956 -7.5294 -7.5289 -6.1064 -6.1049 -5.9363 -5.9359 -0.7319 -0.7315 -0.1892 -0.1867 0.7226 0.7234 1.1979 1.2004 2.0547 2.0565 2.1362 2.1385 3.1997 3.2021 3.2963 3.2975 3.6610 3.6611 3.9379 3.9397 4.5610 4.5631 4.9539 4.9545 5.1642 5.1655 5.4228 5.4255 6.3696 6.3696 6.6385 6.6393 6.9383 6.9392 7.2058 7.2066 12.4465 12.4481 13.2288 13.2311 13.6994 13.7006 13.8566 13.8575 14.5721 14.5723 k = 0.0000 0.5774 0.3701 ( 13868 PWs) bands (ev): -35.7694 -35.7694 -35.7643 -35.7643 -8.8871 -8.8870 -8.6654 -8.6651 -7.7519 -7.7513 -7.5810 -7.5804 -6.0964 -6.0950 -5.9401 -5.9397 -0.7132 -0.7127 -0.1892 -0.1870 0.6994 0.7005 1.1692 1.1719 2.1289 2.1305 2.2084 2.2106 3.2341 3.2364 3.2836 3.2847 3.6792 3.6793 3.8875 3.8891 4.5540 4.5560 4.9180 4.9185 5.1473 5.1488 5.3972 5.3999 6.3872 6.3873 6.6634 6.6645 6.9289 6.9299 7.2166 7.2175 12.4489 12.4503 13.2100 13.2121 13.7028 13.7037 13.8413 13.8424 14.5686 14.5691 k = 0.0000 0.5774 0.3869 ( 13858 PWs) bands (ev): -35.7692 -35.7692 -35.7645 -35.7645 -8.8480 -8.8479 -8.6279 -8.6276 -7.8075 -7.8070 -7.6329 -7.6324 -6.0867 -6.0853 -5.9441 -5.9437 -0.6926 -0.6922 -0.1929 -0.1909 0.6809 0.6822 1.1365 1.1394 2.2068 2.2082 2.2804 2.2825 3.2680 3.2688 3.2717 3.2736 3.6963 3.6966 3.8356 3.8370 4.5472 4.5491 4.8794 4.8799 5.1318 5.1334 5.3700 5.3729 6.4055 6.4056 6.6855 6.6867 6.9228 6.9240 7.2244 7.2252 12.4575 12.4589 13.1880 13.1899 13.7121 13.7127 13.8292 13.8305 14.5555 14.5568 k = 0.0000 0.5774 0.4038 ( 13858 PWs) bands (ev): -35.7690 -35.7690 -35.7647 -35.7647 -8.8075 -8.8074 -8.5893 -8.5889 -7.8630 -7.8625 -7.6852 -7.6846 -6.0772 -6.0758 -5.9485 -5.9480 -0.6704 -0.6699 -0.2005 -0.1988 0.6677 0.6693 1.1012 1.1042 2.2866 2.2880 2.3515 2.3534 3.2559 3.2572 3.3049 3.3071 3.7119 3.7124 3.7829 3.7839 4.5408 4.5426 4.8389 4.8394 5.1179 5.1196 5.3418 5.3447 6.4242 6.4244 6.7024 6.7039 6.9220 6.9233 7.2290 7.2298 12.4721 12.4735 13.1626 13.1642 13.7269 13.7271 13.8204 13.8220 14.5309 14.5330 k = 0.0000 0.5774 0.4206 ( 13868 PWs) bands (ev): -35.7687 -35.7687 -35.7649 -35.7649 -8.7657 -8.7656 -8.5497 -8.5494 -7.9180 -7.9176 -7.7376 -7.7370 -6.0679 -6.0665 -5.9533 -5.9527 -0.6465 -0.6460 -0.2121 -0.2107 0.6601 0.6619 1.0642 1.0673 2.3670 2.3682 2.4207 2.4225 3.2415 3.2429 3.3403 3.3422 3.7248 3.7253 3.7307 3.7313 4.5349 4.5365 4.7975 4.7980 5.1058 5.1077 5.3127 5.3158 6.4435 6.4438 6.7124 6.7139 6.9281 6.9296 7.2302 7.2310 12.4926 12.4939 13.1336 13.1350 13.7464 13.7466 13.8151 13.8170 14.4954 14.4980 k = 0.0000 0.5774 0.4374 ( 13850 PWs) bands (ev): -35.7685 -35.7685 -35.7651 -35.7651 -8.7227 -8.7226 -8.5096 -8.5093 -7.9722 -7.9718 -7.7899 -7.7894 -6.0588 -6.0575 -5.9583 -5.9577 -0.6211 -0.6206 -0.2277 -0.2265 0.6581 0.6602 1.0264 1.0296 2.4463 2.4474 2.4874 2.4890 3.2271 3.2285 3.3743 3.3757 3.6778 3.6779 3.7363 3.7375 4.5297 4.5311 4.7559 4.7566 5.0960 5.0979 5.2834 5.2865 6.4633 6.4636 6.7144 6.7159 6.9419 6.9433 7.2280 7.2288 12.5185 12.5197 13.1013 13.1024 13.7695 13.7702 13.8134 13.8156 14.4524 14.4552 k = 0.0000 0.5774 0.4542 ( 13842 PWs) bands (ev): -35.7683 -35.7683 -35.7654 -35.7654 -8.6786 -8.6784 -8.4694 -8.4691 -8.0251 -8.0247 -7.8420 -7.8415 -6.0500 -6.0487 -5.9636 -5.9630 -0.5942 -0.5938 -0.2470 -0.2461 0.6618 0.6641 0.9884 0.9916 2.5232 2.5241 2.5506 2.5520 3.2131 3.2146 3.4040 3.4045 3.6295 3.6304 3.7436 3.7451 4.5255 4.5267 4.7153 4.7160 5.0887 5.0908 5.2542 5.2573 6.4834 6.4838 6.7093 6.7107 6.9621 6.9634 7.2224 7.2232 12.5493 12.5504 13.0657 13.0666 13.7951 13.7961 13.8153 13.8179 14.4067 14.4093 k = 0.0000 0.5774 0.4711 ( 13852 PWs) bands (ev): -35.7680 -35.7680 -35.7656 -35.7656 -8.6335 -8.6333 -8.4300 -8.4297 -8.0755 -8.0752 -7.8937 -7.8932 -6.0413 -6.0401 -5.9693 -5.9686 -0.5661 -0.5657 -0.2696 -0.2689 0.6707 0.6733 0.9506 0.9538 2.5957 2.5964 2.6095 2.6106 3.2006 3.2022 3.4204 3.4214 3.5928 3.5955 3.7465 3.7484 4.5226 4.5235 4.6767 4.6775 5.0843 5.0865 5.2258 5.2289 6.5040 6.5044 6.6988 6.7001 6.9868 6.9880 7.2135 7.2143 12.5845 12.5855 13.0271 13.0278 13.8206 13.8210 13.8213 13.8254 14.3628 14.3651 k = 0.0000 0.5774 0.4879 ( 13860 PWs) bands (ev): -35.7678 -35.7678 -35.7658 -35.7658 -8.5875 -8.5874 -8.3936 -8.3933 -8.1213 -8.1211 -7.9446 -7.9442 -6.0330 -6.0318 -5.9752 -5.9745 -0.5369 -0.5365 -0.2949 -0.2944 0.6845 0.6872 0.9134 0.9167 2.6598 2.6604 2.6647 2.6650 3.1912 3.1929 3.4108 3.4132 3.5815 3.5857 3.7444 3.7466 4.5214 4.5220 4.6413 4.6421 5.0831 5.0854 5.1987 5.2018 6.5248 6.5253 6.6845 6.6856 7.0140 7.0151 7.2013 7.2020 12.6235 12.6244 12.9858 12.9864 13.8292 13.8319 13.8455 13.8482 14.3250 14.3268 k = 0.0000 0.5774 0.5047 ( 13854 PWs) bands (ev): -35.7675 -35.7675 -35.7661 -35.7661 -8.5411 -8.5409 -8.3653 -8.3651 -8.1574 -8.1573 -7.9946 -7.9941 -6.0248 -6.0237 -5.9815 -5.9807 -0.5067 -0.5064 -0.3225 -0.3222 0.7027 0.7056 0.8773 0.8806 2.7080 2.7090 2.7181 2.7190 3.1876 3.1895 3.3762 3.3790 3.5962 3.6007 3.7367 3.7393 4.5225 4.5228 4.6098 4.6107 5.0853 5.0878 5.1734 5.1766 6.5459 6.5464 6.6676 6.6686 7.0422 7.0431 7.1859 7.1866 12.6656 12.6664 12.9422 12.9428 13.8402 13.8434 13.8651 13.8683 14.2971 14.2983 k = 0.0000 0.5774 0.5215 ( 13842 PWs) bands (ev): -35.7673 -35.7673 -35.7663 -35.7663 -8.4947 -8.4945 -8.3556 -8.3555 -8.1733 -8.1732 -8.0429 -8.0425 -6.0169 -6.0158 -5.9880 -5.9871 -0.4759 -0.4756 -0.3517 -0.3515 0.7248 0.7277 0.8425 0.8458 2.7463 2.7470 2.7595 2.7602 3.1934 3.1954 3.3308 3.3333 3.6227 3.6270 3.7231 3.7261 4.5265 4.5265 4.5832 4.5840 5.0912 5.0938 5.1506 5.1537 6.5670 6.5676 6.6491 6.6500 7.0702 7.0711 7.1675 7.1683 12.7101 12.7108 12.8969 12.8974 13.8529 13.8564 13.8773 13.8809 14.2823 14.2830 k = 0.0000 0.5774 0.5384 ( 13834 PWs) bands (ev): -35.7671 -35.7671 -35.7666 -35.7666 -8.4492 -8.4490 -8.3721 -8.3720 -8.1615 -8.1613 -8.0888 -8.0884 -6.0093 -6.0083 -5.9948 -5.9939 -0.4446 -0.4444 -0.3821 -0.3820 0.7502 0.7533 0.8095 0.8127 2.7737 2.7741 2.7830 2.7834 3.2116 3.2137 3.2842 3.2865 3.6519 3.6559 3.7039 3.7073 4.5338 4.5341 4.5617 4.5623 5.1007 5.1035 5.1307 5.1336 6.5881 6.5888 6.6294 6.6302 7.0973 7.0982 7.1464 7.1472 12.7562 12.7568 12.8503 12.8509 13.8655 13.8693 13.8805 13.8844 14.2820 14.2822 k = 0.0000 0.5774 0.5552 ( 13840 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4067 -8.4067 -8.4065 -8.4065 -8.1299 -8.1299 -8.1296 -8.1296 -6.0019 -6.0019 -6.0009 -6.0009 -0.4132 -0.4132 -0.4131 -0.4131 0.7786 0.7786 0.7818 0.7818 2.7872 2.7872 2.7872 2.7872 3.2429 3.2429 3.2451 3.2451 3.6797 3.6797 3.6834 3.6834 4.5453 4.5453 4.5458 4.5458 5.1139 5.1139 5.1168 5.1168 6.6089 6.6089 6.6097 6.6097 7.1229 7.1229 7.1237 7.1237 12.8032 12.8032 12.8038 12.8038 13.8757 13.8757 13.8797 13.8797 14.2949 14.2949 k = 0.0000 0.5774 0.5552 ( 13840 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4067 -8.4067 -8.4065 -8.4065 -8.1299 -8.1299 -8.1296 -8.1296 -6.0019 -6.0019 -6.0009 -6.0009 -0.4132 -0.4132 -0.4131 -0.4131 0.7786 0.7786 0.7818 0.7818 2.7872 2.7872 2.7872 2.7872 3.2429 3.2429 3.2451 3.2451 3.6797 3.6797 3.6834 3.6834 4.5453 4.5453 4.5458 4.5458 5.1139 5.1139 5.1168 5.1168 6.6089 6.6089 6.6097 6.6097 7.1229 7.1229 7.1237 7.1237 12.8032 12.8032 12.8038 12.8038 13.8757 13.8757 13.8797 13.8797 14.2949 14.2949 k = 0.0167 0.5774 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4064 -8.4064 -8.4062 -8.4062 -8.1300 -8.1300 -8.1297 -8.1297 -6.0025 -6.0025 -6.0015 -6.0015 -0.4112 -0.4112 -0.4111 -0.4111 0.7765 0.7765 0.7797 0.7797 2.7875 2.7875 2.7878 2.7878 3.2425 3.2425 3.2448 3.2448 3.6802 3.6802 3.6840 3.6840 4.5429 4.5429 4.5434 4.5434 5.1179 5.1179 5.1208 5.1208 6.6082 6.6082 6.6090 6.6090 7.1222 7.1222 7.1230 7.1230 12.8033 12.8033 12.8040 12.8040 13.8684 13.8684 13.8724 13.8724 14.2929 14.2929 k = 0.0333 0.5774 0.5552 ( 13822 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4055 -8.4055 -8.4053 -8.4053 -8.1303 -8.1303 -8.1299 -8.1299 -6.0041 -6.0041 -6.0032 -6.0032 -0.4053 -0.4053 -0.4049 -0.4049 0.7703 0.7703 0.7734 0.7734 2.7885 2.7885 2.7891 2.7891 3.2415 3.2415 3.2440 3.2440 3.6818 3.6818 3.6856 3.6856 4.5359 4.5359 4.5364 4.5364 5.1297 5.1297 5.1325 5.1325 6.6059 6.6059 6.6068 6.6068 7.1202 7.1202 7.1210 7.1210 12.8037 12.8037 12.8046 12.8046 13.8473 13.8473 13.8512 13.8512 14.2877 14.2877 k = 0.0500 0.5774 0.5552 ( 13826 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4041 -8.4041 -8.4039 -8.4039 -8.1308 -8.1308 -8.1303 -8.1303 -6.0069 -6.0069 -6.0059 -6.0059 -0.3953 -0.3953 -0.3948 -0.3948 0.7599 0.7599 0.7631 0.7631 2.7903 2.7903 2.7912 2.7912 3.2399 3.2399 3.2427 3.2427 3.6843 3.6843 3.6883 3.6883 4.5249 4.5249 4.5255 4.5255 5.1485 5.1485 5.1512 5.1512 6.6021 6.6021 6.6030 6.6030 7.1168 7.1168 7.1178 7.1178 12.8044 12.8044 12.8055 12.8055 13.8141 13.8141 13.8179 13.8179 14.2795 14.2795 k = 0.0667 0.5774 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4023 -8.4023 -8.4019 -8.4019 -8.1313 -8.1313 -8.1307 -8.1307 -6.0107 -6.0107 -6.0097 -6.0097 -0.3814 -0.3814 -0.3808 -0.3808 0.7456 0.7456 0.7487 0.7487 2.7928 2.7928 2.7940 2.7940 3.2377 3.2377 3.2409 3.2409 3.6878 3.6878 3.6919 3.6919 4.5109 4.5109 4.5115 4.5115 5.1733 5.1733 5.1760 5.1760 6.5966 6.5966 6.5977 6.5977 7.1123 7.1123 7.1133 7.1133 12.8054 12.8054 12.8069 12.8069 13.7713 13.7713 13.7752 13.7752 14.2685 14.2685 k = 0.0833 0.5774 0.5552 ( 13846 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4001 -8.4001 -8.3997 -8.3997 -8.1317 -8.1317 -8.1311 -8.1311 -6.0154 -6.0154 -6.0145 -6.0145 -0.3638 -0.3638 -0.3630 -0.3630 0.7274 0.7274 0.7305 0.7305 2.7959 2.7959 2.7974 2.7974 3.2351 3.2351 3.2386 3.2386 3.6921 3.6921 3.6964 3.6964 4.4948 4.4948 4.4955 4.4955 5.2032 5.2032 5.2058 5.2058 6.5894 6.5894 6.5907 6.5907 7.1066 7.1066 7.1078 7.1078 12.8070 12.8070 12.8087 12.8087 13.7216 13.7216 13.7254 13.7254 14.2552 14.2552 k = 0.1000 0.5774 0.5552 ( 13836 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3977 -8.3977 -8.3972 -8.3972 -8.1320 -8.1320 -8.1313 -8.1313 -6.0211 -6.0211 -6.0202 -6.0202 -0.3425 -0.3425 -0.3415 -0.3415 0.7055 0.7055 0.7086 0.7086 2.7996 2.7996 2.8014 2.8014 3.2321 3.2321 3.2359 3.2359 3.6971 3.6971 3.7016 3.7016 4.4776 4.4776 4.4784 4.4784 5.2371 5.2371 5.2396 5.2396 6.5804 6.5804 6.5818 6.5818 7.1001 7.1001 7.1014 7.1014 12.8090 12.8090 12.8111 12.8111 13.6671 13.6671 13.6710 13.6710 14.2398 14.2398 k = 0.1166 0.5774 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3953 -8.3953 -8.3947 -8.3947 -8.1320 -8.1320 -8.1312 -8.1312 -6.0275 -6.0275 -6.0266 -6.0266 -0.3177 -0.3177 -0.3166 -0.3166 0.6802 0.6802 0.6833 0.6833 2.8037 2.8037 2.8057 2.8057 3.2287 3.2287 3.2328 3.2328 3.7027 3.7027 3.7074 3.7074 4.4600 4.4600 4.4609 4.4609 5.2741 5.2741 5.2765 5.2765 6.5696 6.5696 6.5711 6.5711 7.0928 7.0928 7.0942 7.0942 12.8117 12.8117 12.8140 12.8140 13.6099 13.6099 13.6138 13.6138 14.2228 14.2228 k = 0.1333 0.5774 0.5552 ( 13840 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3931 -8.3931 -8.3924 -8.3924 -8.1314 -8.1314 -8.1305 -8.1305 -6.0347 -6.0347 -6.0338 -6.0338 -0.2896 -0.2896 -0.2883 -0.2883 0.6517 0.6517 0.6548 0.6548 2.8082 2.8082 2.8105 2.8105 3.2252 3.2252 3.2294 3.2294 3.7088 3.7088 3.7136 3.7136 4.4428 4.4428 4.4437 4.4437 5.3134 5.3134 5.3157 5.3157 6.5567 6.5567 6.5584 6.5584 7.0849 7.0849 7.0864 7.0864 12.8151 12.8151 12.8177 12.8177 13.5515 13.5515 13.5554 13.5554 14.2047 14.2047 k = 0.1500 0.5774 0.5552 ( 13846 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3913 -8.3913 -8.3906 -8.3906 -8.1299 -8.1299 -8.1290 -8.1290 -6.0425 -6.0425 -6.0416 -6.0416 -0.2585 -0.2585 -0.2570 -0.2570 0.6202 0.6202 0.6233 0.6233 2.8129 2.8129 2.8154 2.8154 3.2215 3.2215 3.2258 3.2258 3.7151 3.7151 3.7200 3.7200 4.4263 4.4263 4.4272 4.4272 5.3543 5.3543 5.3565 5.3565 6.5419 6.5419 6.5436 6.5436 7.0766 7.0766 7.0782 7.0782 12.8194 12.8194 12.8223 12.8223 13.4931 13.4931 13.4970 13.4970 14.1860 14.1860 k = 0.1666 0.5774 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3904 -8.3904 -8.3895 -8.3895 -8.1275 -8.1275 -8.1265 -8.1265 -6.0507 -6.0507 -6.0499 -6.0499 -0.2246 -0.2246 -0.2230 -0.2230 0.5861 0.5861 0.5892 0.5892 2.8179 2.8179 2.8206 2.8206 3.2177 3.2177 3.2221 3.2221 3.7216 3.7216 3.7266 3.7266 4.4110 4.4110 4.4120 4.4120 5.3961 5.3961 5.3982 5.3982 6.5251 6.5251 6.5269 6.5269 7.0681 7.0681 7.0697 7.0697 12.8246 12.8246 12.8278 12.8278 13.4356 13.4356 13.4396 13.4396 14.1670 14.1670 k = 0.1833 0.5774 0.5552 ( 13836 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3904 -8.3904 -8.3895 -8.3895 -8.1236 -8.1236 -8.1226 -8.1226 -6.0593 -6.0593 -6.0585 -6.0585 -0.1883 -0.1883 -0.1865 -0.1865 0.5497 0.5497 0.5528 0.5528 2.8229 2.8229 2.8258 2.8258 3.2139 3.2139 3.2182 3.2182 3.7281 3.7281 3.7331 3.7331 4.3972 4.3972 4.3983 4.3983 5.4382 5.4382 5.4402 5.4402 6.5064 6.5064 6.5082 6.5082 7.0596 7.0596 7.0612 7.0612 12.8310 12.8310 12.8344 12.8344 13.3799 13.3799 13.3839 13.3839 14.1483 14.1483 k = 0.2000 0.5774 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3917 -8.3917 -8.3908 -8.3908 -8.1183 -8.1183 -8.1172 -8.1172 -6.0681 -6.0681 -6.0674 -6.0674 -0.1499 -0.1499 -0.1480 -0.1480 0.5115 0.5115 0.5145 0.5145 2.8281 2.8281 2.8311 2.8311 3.2101 3.2101 3.2143 3.2143 3.7343 3.7343 3.7393 3.7393 4.3852 4.3852 4.3863 4.3863 5.4799 5.4799 5.4818 5.4818 6.4860 6.4860 6.4878 6.4878 7.0512 7.0512 7.0528 7.0528 12.8386 12.8386 12.8422 12.8422 13.3265 13.3265 13.3306 13.3306 14.1303 14.1303 k = 0.2166 0.5774 0.5552 ( 13854 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3946 -8.3946 -8.3936 -8.3936 -8.1111 -8.1111 -8.1099 -8.1099 -6.0770 -6.0770 -6.0764 -6.0764 -0.1101 -0.1101 -0.1080 -0.1080 0.4718 0.4718 0.4748 0.4748 2.8332 2.8332 2.8363 2.8363 3.2065 3.2065 3.2104 3.2104 3.7402 3.7402 3.7451 3.7451 4.3751 4.3751 4.3762 4.3762 5.5208 5.5208 5.5225 5.5225 6.4641 6.4641 6.4659 6.4659 7.0430 7.0430 7.0446 7.0446 12.8474 12.8474 12.8514 12.8514 13.2760 13.2760 13.2800 13.2800 14.1134 14.1134 k = 0.2333 0.5774 0.5552 ( 13850 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3991 -8.3991 -8.3981 -8.3981 -8.1020 -8.1020 -8.1008 -8.1008 -6.0859 -6.0859 -6.0853 -6.0853 -0.0696 -0.0696 -0.0673 -0.0673 0.4314 0.4314 0.4345 0.4345 2.8383 2.8383 2.8414 2.8414 3.2030 3.2030 3.2066 3.2066 3.7455 3.7455 3.7503 3.7503 4.3671 4.3671 4.3682 4.3682 5.5599 5.5599 5.5616 5.5616 6.4412 6.4412 6.4430 6.4430 7.0352 7.0352 7.0367 7.0367 12.8576 12.8576 12.8618 12.8618 13.2287 13.2287 13.2328 13.2328 14.0980 14.0980 k = 0.2500 0.5774 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4054 -8.4054 -8.4044 -8.4044 -8.0909 -8.0909 -8.0898 -8.0898 -6.0946 -6.0946 -6.0941 -6.0941 -0.0294 -0.0294 -0.0271 -0.0271 0.3915 0.3915 0.3946 0.3946 2.8432 2.8432 2.8464 2.8464 3.1998 3.1998 3.2030 3.2030 3.7500 3.7500 3.7548 3.7548 4.3612 4.3612 4.3624 4.3624 5.5967 5.5967 5.5983 5.5983 6.4179 6.4179 6.4197 6.4197 7.0279 7.0279 7.0293 7.0293 12.8690 12.8690 12.8733 12.8733 13.1853 13.1853 13.1893 13.1893 14.0845 14.0845 k = 0.2666 0.5774 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4134 -8.4134 -8.4124 -8.4124 -8.0779 -8.0779 -8.0767 -8.0767 -6.1030 -6.1030 -6.1026 -6.1026 0.0082 0.0082 0.0107 0.0107 0.3541 0.3541 0.3571 0.3571 2.8479 2.8479 2.8511 2.8511 3.1969 3.1969 3.1998 3.1998 3.7537 3.7537 3.7583 3.7583 4.3576 4.3576 4.3588 4.3588 5.6304 5.6304 5.6317 5.6317 6.3948 6.3948 6.3965 6.3965 7.0212 7.0212 7.0225 7.0225 12.8813 12.8813 12.8858 12.8858 13.1464 13.1464 13.1502 13.1502 14.0731 14.0731 k = 0.2833 0.5774 0.5552 ( 13826 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4232 -8.4232 -8.4222 -8.4222 -8.0629 -8.0629 -8.0618 -8.0618 -6.1111 -6.1111 -6.1107 -6.1107 0.0397 0.0397 0.0421 0.0421 0.3228 0.3228 0.3256 0.3256 2.8523 2.8523 2.8554 2.8554 3.1945 3.1945 3.1971 3.1971 3.7564 3.7564 3.7608 3.7608 4.3563 4.3563 4.3575 4.3575 5.6599 5.6599 5.6611 5.6611 6.3727 6.3727 6.3743 6.3743 7.0153 7.0153 7.0165 7.0165 12.8938 12.8938 12.8984 12.8984 13.1128 13.1128 13.1164 13.1164 14.0641 14.0641 k = 0.3000 0.5774 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4346 -8.4346 -8.4336 -8.4336 -8.0462 -8.0462 -8.0450 -8.0450 -6.1186 -6.1186 -6.1184 -6.1184 0.0584 0.0584 0.0603 0.0603 0.3044 0.3044 0.3067 0.3067 2.8562 2.8562 2.8593 2.8593 3.1927 3.1927 3.1950 3.1950 3.7578 3.7578 3.7621 3.7621 4.3572 4.3572 4.3585 4.3585 5.6844 5.6844 5.6855 5.6855 6.3524 6.3524 6.3539 6.3539 7.0102 7.0102 7.0113 7.0113 12.9052 12.9052 12.9098 12.9098 13.0862 13.0862 13.0893 13.0893 14.0577 14.0577 k = 0.3166 0.5774 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4475 -8.4475 -8.4465 -8.4465 -8.0277 -8.0277 -8.0266 -8.0266 -6.1255 -6.1255 -6.1254 -6.1254 0.0570 0.0570 0.0579 0.0579 0.3063 0.3063 0.3077 0.3077 2.8595 2.8595 2.8625 2.8625 3.1916 3.1916 3.1937 3.1937 3.7580 3.7580 3.7620 3.7620 4.3605 4.3605 4.3618 4.3618 5.7030 5.7030 5.7040 5.7040 6.3347 6.3347 6.3361 6.3361 7.0062 7.0062 7.0072 7.0072 12.9133 12.9133 12.9178 12.9178 13.0687 13.0687 13.0711 13.0711 14.0543 14.0543 k = 0.3333 0.5774 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4618 -8.4618 -8.4609 -8.4609 -8.0078 -8.0078 -8.0066 -8.0066 -6.1318 -6.1318 -6.1318 -6.1318 0.0349 0.0349 0.0350 0.0350 0.3280 0.3280 0.3291 0.3291 2.8620 2.8620 2.8649 2.8649 3.1912 3.1912 3.1934 3.1934 3.7568 3.7568 3.7606 3.7606 4.3660 4.3660 4.3673 4.3673 5.7149 5.7149 5.7159 5.7159 6.3202 6.3202 6.3216 6.3216 7.0035 7.0035 7.0045 7.0045 12.9156 12.9156 12.9199 12.9199 13.0627 13.0627 13.0648 13.0648 14.0539 14.0539 k = 0.3333 0.5774 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4618 -8.4618 -8.4609 -8.4609 -8.0078 -8.0078 -8.0066 -8.0066 -6.1318 -6.1318 -6.1318 -6.1318 0.0349 0.0349 0.0350 0.0350 0.3280 0.3280 0.3291 0.3291 2.8620 2.8620 2.8649 2.8649 3.1912 3.1912 3.1934 3.1934 3.7568 3.7568 3.7606 3.7606 4.3660 4.3660 4.3673 4.3673 5.7149 5.7149 5.7159 5.7159 6.3202 6.3202 6.3216 6.3216 7.0035 7.0035 7.0045 7.0045 12.9156 12.9156 12.9199 12.9199 13.0627 13.0627 13.0648 13.0648 14.0539 14.0539 k = 0.3250 0.5630 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4313 -8.4313 -8.4303 -8.4303 -8.0494 -8.0494 -8.0482 -8.0482 -6.1199 -6.1199 -6.1199 -6.1199 0.0966 0.0966 0.0968 0.0968 0.2685 0.2685 0.2695 0.2695 2.8580 2.8580 2.8611 2.8611 3.1904 3.1904 3.1923 3.1923 3.7600 3.7600 3.7642 3.7642 4.3536 4.3536 4.3549 4.3549 5.6984 5.6984 5.6994 5.6994 6.3440 6.3440 6.3455 6.3455 7.0080 7.0080 7.0091 7.0091 12.9199 12.9199 12.9245 12.9245 13.0623 13.0623 13.0643 13.0643 14.0546 14.0546 k = 0.3166 0.5486 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3995 -8.3995 -8.3985 -8.3985 -8.0912 -8.0912 -8.0901 -8.0901 -6.1080 -6.1080 -6.1080 -6.1080 0.1589 0.1589 0.1593 0.1593 0.2080 0.2080 0.2089 0.2089 2.8539 2.8539 2.8572 2.8572 3.1881 3.1881 3.1897 3.1897 3.7621 3.7621 3.7667 3.7667 4.3435 4.3435 4.3447 4.3447 5.6832 5.6832 5.6841 5.6841 6.3643 6.3643 6.3658 6.3658 7.0140 7.0140 7.0151 7.0151 12.9279 12.9279 12.9327 12.9327 13.0617 13.0617 13.0636 13.0636 14.0617 14.0617 k = 0.3083 0.5341 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3667 -8.3667 -8.3656 -8.3656 -8.1332 -8.1332 -8.1321 -8.1321 -6.0960 -6.0960 -6.0960 -6.0960 0.1464 0.1464 0.1474 0.1474 0.2219 0.2219 0.2222 0.2222 2.8497 2.8497 2.8532 2.8532 3.1839 3.1839 3.1851 3.1851 3.7633 3.7633 3.7683 3.7683 4.3358 4.3358 4.3370 4.3370 5.6694 5.6694 5.6704 5.6704 6.3805 6.3805 6.3821 6.3821 7.0218 7.0218 7.0228 7.0228 12.9391 12.9391 12.9441 12.9441 13.0613 13.0613 13.0631 13.0631 14.0749 14.0749 k = 0.3000 0.5197 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3328 -8.3328 -8.3317 -8.3317 -8.1752 -8.1752 -8.1741 -8.1741 -6.0841 -6.0841 -6.0841 -6.0841 0.0844 0.0844 0.0853 0.0853 0.2848 0.2848 0.2852 0.2852 2.8452 2.8452 2.8489 2.8489 3.1771 3.1771 3.1780 3.1780 3.7641 3.7641 3.7695 3.7695 4.3308 4.3308 4.3319 4.3319 5.6575 5.6575 5.6584 5.6584 6.3923 6.3923 6.3939 6.3939 7.0315 7.0315 7.0326 7.0326 12.9531 12.9531 12.9583 12.9583 13.0617 13.0617 13.0634 13.0634 14.0939 14.0939 k = 0.2916 0.5053 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.2978 -8.2978 -8.2967 -8.2967 -8.2171 -8.2171 -8.2160 -8.2160 -6.0722 -6.0722 -6.0722 -6.0722 0.0218 0.0218 0.0226 0.0226 0.3476 0.3476 0.3481 0.3481 2.8404 2.8404 2.8443 2.8443 3.1675 3.1675 3.1681 3.1681 3.7649 3.7649 3.7706 3.7706 4.3286 4.3286 4.3297 4.3297 5.6474 5.6474 5.6483 5.6483 6.3993 6.3993 6.4010 6.4010 7.0434 7.0434 7.0444 7.0444 12.9693 12.9693 12.9747 12.9747 13.0635 13.0635 13.0651 13.0651 14.1183 14.1183 k = 0.2833 0.4908 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.2621 -8.2621 -8.2608 -8.2608 -8.2587 -8.2587 -8.2576 -8.2576 -6.0603 -6.0603 -6.0603 -6.0603 -0.0412 -0.0412 -0.0405 -0.0405 0.4101 0.4101 0.4107 0.4107 2.8351 2.8351 2.8392 2.8392 3.1544 3.1544 3.1547 3.1547 3.7662 3.7662 3.7722 3.7722 4.3295 4.3295 4.3305 4.3305 5.6394 5.6394 5.6403 5.6403 6.4016 6.4016 6.4032 6.4032 7.0575 7.0575 7.0585 7.0585 12.9872 12.9872 12.9927 12.9927 13.0673 13.0673 13.0687 13.0687 14.1478 14.1478 k = 0.2750 0.4764 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3002 -8.3002 -8.2991 -8.2991 -8.2251 -8.2251 -8.2240 -8.2240 -6.0485 -6.0485 -6.0485 -6.0485 -0.1045 -0.1045 -0.1038 -0.1038 0.4721 0.4721 0.4729 0.4729 2.8292 2.8292 2.8335 2.8335 3.1376 3.1376 3.1377 3.1377 3.7684 3.7684 3.7746 3.7746 4.3336 4.3336 4.3345 4.3345 5.6336 5.6336 5.6344 5.6344 6.3991 6.3991 6.4007 6.4007 7.0737 7.0737 7.0746 7.0746 13.0063 13.0063 13.0119 13.0119 13.0734 13.0734 13.0746 13.0746 14.1821 14.1821 k = 0.2666 0.4619 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3412 -8.3412 -8.3401 -8.3401 -8.1875 -8.1875 -8.1863 -8.1863 -6.0368 -6.0368 -6.0368 -6.0368 -0.1680 -0.1680 -0.1674 -0.1674 0.5335 0.5335 0.5344 0.5344 2.8227 2.8227 2.8273 2.8273 3.1168 3.1168 3.1169 3.1169 3.7719 3.7719 3.7782 3.7782 4.3409 4.3409 4.3417 4.3417 5.6300 5.6300 5.6307 5.6307 6.3920 6.3920 6.3935 6.3935 7.0918 7.0918 7.0926 7.0926 13.0260 13.0260 13.0317 13.0317 13.0822 13.0822 13.0833 13.0833 14.2207 14.2207 k = 0.2583 0.4475 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.3817 -8.3817 -8.3806 -8.3806 -8.1492 -8.1492 -8.1480 -8.1480 -6.0252 -6.0252 -6.0252 -6.0252 -0.2315 -0.2315 -0.2310 -0.2310 0.5941 0.5941 0.5951 0.5951 2.8154 2.8154 2.8202 2.8202 3.0918 3.0918 3.0920 3.0920 3.7769 3.7769 3.7833 3.7833 4.3515 4.3515 4.3523 4.3523 5.6286 5.6286 5.6293 5.6293 6.3808 6.3808 6.3822 6.3822 7.1115 7.1115 7.1122 7.1122 13.0456 13.0456 13.0515 13.0515 13.0942 13.0942 13.0952 13.0952 14.2633 14.2633 k = 0.2500 0.4331 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4216 -8.4216 -8.4205 -8.4205 -8.1101 -8.1101 -8.1089 -8.1089 -6.0138 -6.0138 -6.0137 -6.0137 -0.2950 -0.2950 -0.2945 -0.2945 0.6537 0.6537 0.6548 0.6548 2.8074 2.8074 2.8124 2.8124 3.0629 3.0629 3.0632 3.0632 3.7836 3.7836 3.7900 3.7900 4.3654 4.3654 4.3661 4.3661 5.6293 5.6293 5.6300 5.6300 6.3657 6.3657 6.3671 6.3671 7.1324 7.1324 7.1330 7.1330 13.0648 13.0648 13.0707 13.0707 13.1095 13.1095 13.1103 13.1103 14.3097 14.3097 k = 0.2416 0.4186 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4608 -8.4608 -8.4597 -8.4597 -8.0705 -8.0705 -8.0693 -8.0693 -6.0024 -6.0024 -6.0024 -6.0024 -0.3583 -0.3583 -0.3579 -0.3579 0.7123 0.7123 0.7136 0.7136 2.7985 2.7985 2.8037 2.8037 3.0302 3.0302 3.0305 3.0305 3.7920 3.7920 3.7984 3.7984 4.3825 4.3825 4.3830 4.3830 5.6321 5.6321 5.6327 5.6327 6.3474 6.3474 6.3487 6.3487 7.1542 7.1542 7.1546 7.1546 13.0829 13.0829 13.0888 13.0888 13.1283 13.1283 13.1290 13.1290 14.3595 14.3595 k = 0.2333 0.4042 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4994 -8.4994 -8.4983 -8.4983 -8.0304 -8.0304 -8.0292 -8.0292 -5.9912 -5.9912 -5.9912 -5.9912 -0.4214 -0.4214 -0.4210 -0.4210 0.7697 0.7697 0.7711 0.7711 2.7887 2.7887 2.7941 2.7941 2.9940 2.9940 2.9943 2.9943 3.8022 3.8022 3.8085 3.8085 4.4026 4.4026 4.4031 4.4031 5.6368 5.6368 5.6374 5.6374 6.3263 6.3263 6.3275 6.3275 7.1764 7.1764 7.1768 7.1768 13.0996 13.0996 13.1056 13.1056 13.1508 13.1508 13.1513 13.1513 14.4124 14.4124 k = 0.2250 0.3898 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5371 -8.5371 -8.5360 -8.5360 -7.9899 -7.9899 -7.9887 -7.9887 -5.9802 -5.9802 -5.9802 -5.9802 -0.4840 -0.4840 -0.4837 -0.4837 0.8259 0.8259 0.8274 0.8274 2.7780 2.7780 2.7836 2.7836 2.9547 2.9547 2.9550 2.9550 3.8139 3.8139 3.8201 3.8201 4.4256 4.4256 4.4259 4.4259 5.6433 5.6433 5.6438 5.6438 6.3031 6.3031 6.3042 6.3042 7.1988 7.1988 7.1991 7.1991 13.1145 13.1145 13.1204 13.1204 13.1768 13.1768 13.1772 13.1772 14.4682 14.4682 k = 0.2166 0.3753 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5739 -8.5739 -8.5729 -8.5729 -7.9491 -7.9491 -7.9479 -7.9479 -5.9694 -5.9694 -5.9694 -5.9694 -0.5462 -0.5462 -0.5459 -0.5459 0.8807 0.8807 0.8824 0.8824 2.7664 2.7664 2.7721 2.7721 2.9128 2.9128 2.9131 2.9131 3.8271 3.8271 3.8331 3.8331 4.4510 4.4510 4.4513 4.4513 5.6515 5.6515 5.6520 5.6520 6.2782 6.2782 6.2792 6.2792 7.2211 7.2211 7.2213 7.2213 13.1273 13.1273 13.1331 13.1331 13.2064 13.2064 13.2067 13.2067 14.5265 14.5265 k = 0.2083 0.3609 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6098 -8.6098 -8.6088 -8.6088 -7.9081 -7.9081 -7.9068 -7.9068 -5.9588 -5.9588 -5.9588 -5.9588 -0.6077 -0.6077 -0.6075 -0.6075 0.9343 0.9343 0.9361 0.9361 2.7539 2.7539 2.7599 2.7599 2.8687 2.8687 2.8689 2.8689 3.8415 3.8415 3.8473 3.8473 4.4787 4.4787 4.4788 4.4788 5.6612 5.6612 5.6616 5.6616 6.2523 6.2523 6.2533 6.2533 7.2430 7.2430 7.2430 7.2430 13.1376 13.1376 13.1434 13.1434 13.2395 13.2395 13.2397 13.2397 14.5871 14.5871 k = 0.2000 0.3465 0.5552 ( 13822 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6447 -8.6447 -8.6437 -8.6437 -7.8670 -7.8670 -7.8658 -7.8658 -5.9484 -5.9484 -5.9484 -5.9484 -0.6685 -0.6685 -0.6684 -0.6684 0.9864 0.9864 0.9884 0.9884 2.7406 2.7406 2.7468 2.7468 2.8228 2.8228 2.8231 2.8231 3.8569 3.8569 3.8626 3.8626 4.5080 4.5080 4.5080 4.5080 5.6721 5.6721 5.6725 5.6725 6.2260 6.2260 6.2269 6.2269 7.2642 7.2642 7.2642 7.2642 13.1455 13.1455 13.1511 13.1511 13.2759 13.2759 13.2759 13.2759 14.6495 14.6495 k = 0.1916 0.3320 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6785 -8.6785 -8.6776 -8.6776 -7.8259 -7.8259 -7.8247 -7.8247 -5.9383 -5.9383 -5.9383 -5.9383 -0.7285 -0.7285 -0.7284 -0.7284 1.0372 1.0372 1.0393 1.0393 2.7265 2.7265 2.7329 2.7329 2.7758 2.7758 2.7761 2.7761 3.8733 3.8733 3.8787 3.8787 4.5385 4.5385 4.5386 4.5386 5.6842 5.6842 5.6846 5.6846 6.1999 6.1999 6.2006 6.2006 7.2845 7.2845 7.2846 7.2846 13.1508 13.1508 13.1563 13.1563 13.3152 13.3152 13.3153 13.3153 14.7132 14.7132 k = 0.1833 0.3176 0.5552 ( 13850 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7113 -8.7113 -8.7103 -8.7103 -7.7850 -7.7850 -7.7838 -7.7838 -5.9284 -5.9284 -5.9284 -5.9284 -0.7875 -0.7875 -0.7874 -0.7874 1.0865 1.0865 1.0888 1.0888 2.7112 2.7112 2.7181 2.7181 2.7281 2.7281 2.7287 2.7287 3.8902 3.8902 3.8954 3.8954 4.5696 4.5696 4.5698 4.5698 5.6973 5.6973 5.6976 5.6976 6.1746 6.1746 6.1752 6.1752 7.3038 7.3038 7.3040 7.3040 13.1536 13.1536 13.1589 13.1589 13.3572 13.3572 13.3574 13.3574 14.7774 14.7774 k = 0.1750 0.3032 0.5552 ( 13858 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7429 -8.7429 -8.7420 -8.7420 -7.7444 -7.7444 -7.7431 -7.7431 -5.9189 -5.9189 -5.9188 -5.9188 -0.8454 -0.8454 -0.8454 -0.8454 1.1345 1.1345 1.1369 1.1369 2.6788 2.6788 2.6795 2.6795 2.6976 2.6976 2.7032 2.7032 3.9077 3.9077 3.9127 3.9127 4.6007 4.6007 4.6011 4.6011 5.7111 5.7111 5.7114 5.7114 6.1507 6.1507 6.1512 6.1512 7.3220 7.3220 7.3223 7.3223 13.1539 13.1539 13.1591 13.1591 13.4016 13.4016 13.4018 13.4018 14.8408 14.8408 k = 0.1666 0.2887 0.5552 ( 13854 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7733 -8.7733 -8.7724 -8.7724 -7.7041 -7.7041 -7.7029 -7.7029 -5.9096 -5.9096 -5.9095 -5.9095 -0.9021 -0.9021 -0.9020 -0.9020 1.1810 1.1810 1.1836 1.1836 2.6310 2.6310 2.6314 2.6314 2.6813 2.6813 2.6875 2.6875 3.9254 3.9254 3.9302 3.9302 4.6313 4.6313 4.6318 4.6318 5.7256 5.7256 5.7258 5.7258 6.1288 6.1288 6.1291 6.1291 7.3390 7.3390 7.3393 7.3393 13.1520 13.1520 13.1570 13.1570 13.4480 13.4480 13.4482 13.4482 14.9016 14.9016 k = 0.1583 0.2743 0.5552 ( 13854 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8024 -8.8024 -8.8016 -8.8016 -7.6644 -7.6644 -7.6632 -7.6632 -5.9006 -5.9006 -5.9006 -5.9006 -0.9574 -0.9574 -0.9574 -0.9574 1.2262 1.2262 1.2289 1.2289 2.5833 2.5833 2.5836 2.5836 2.6649 2.6649 2.6713 2.6713 3.9433 3.9433 3.9478 3.9478 4.6605 4.6605 4.6612 4.6612 5.7404 5.7404 5.7406 5.7406 6.1095 6.1095 6.1098 6.1098 7.3546 7.3546 7.3549 7.3549 13.1479 13.1479 13.1528 13.1528 13.4958 13.4958 13.4961 13.4961 14.9562 14.9562 k = 0.1500 0.2598 0.5552 ( 13862 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8303 -8.8303 -8.8295 -8.8295 -7.6254 -7.6254 -7.6243 -7.6243 -5.8920 -5.8920 -5.8920 -5.8920 -1.0113 -1.0113 -1.0112 -1.0112 1.2699 1.2699 1.2727 1.2727 2.5362 2.5362 2.5365 2.5365 2.6483 2.6483 2.6547 2.6547 3.9611 3.9611 3.9654 3.9654 4.6879 4.6879 4.6887 4.6887 5.7556 5.7556 5.7557 5.7557 6.0935 6.0935 6.0936 6.0936 7.3688 7.3688 7.3692 7.3692 13.1420 13.1420 13.1467 13.1467 13.5444 13.5444 13.5448 13.5448 14.9994 14.9994 k = 0.1416 0.2454 0.5552 ( 13856 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8568 -8.8568 -8.8561 -8.8561 -7.5873 -7.5873 -7.5861 -7.5861 -5.8837 -5.8837 -5.8837 -5.8837 -1.0635 -1.0635 -1.0634 -1.0634 1.3123 1.3123 1.3152 1.3152 2.4902 2.4902 2.4905 2.4905 2.6314 2.6314 2.6379 2.6379 3.9788 3.9788 3.9829 3.9829 4.7127 4.7127 4.7136 4.7136 5.7709 5.7709 5.7710 5.7710 6.0811 6.0811 6.0811 6.0811 7.3816 7.3816 7.3820 7.3820 13.1345 13.1345 13.1390 13.1390 13.5934 13.5934 13.5937 13.5937 15.0243 15.0243 k = 0.1333 0.2310 0.5552 ( 13858 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8821 -8.8821 -8.8813 -8.8813 -7.5501 -7.5501 -7.5490 -7.5490 -5.8759 -5.8759 -5.8758 -5.8758 -1.1139 -1.1139 -1.1137 -1.1137 1.3532 1.3532 1.3562 1.3562 2.4454 2.4454 2.4457 2.4457 2.6144 2.6144 2.6208 2.6208 3.9962 3.9962 4.0000 4.0000 4.7345 4.7345 4.7356 4.7356 5.7861 5.7861 5.7862 5.7862 6.0727 6.0727 6.0729 6.0729 7.3929 7.3929 7.3933 7.3933 13.1257 13.1257 13.1299 13.1299 13.6418 13.6418 13.6421 13.6421 15.0275 15.0275 k = 0.1250 0.2165 0.5552 ( 13866 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9059 -8.9059 -8.9052 -8.9052 -7.5141 -7.5141 -7.5130 -7.5130 -5.8683 -5.8683 -5.8683 -5.8683 -1.1624 -1.1624 -1.1622 -1.1622 1.3927 1.3927 1.3958 1.3958 2.4023 2.4023 2.4026 2.4026 2.5973 2.5973 2.6037 2.6037 4.0132 4.0132 4.0167 4.0167 4.7529 4.7529 4.7541 4.7541 5.8012 5.8012 5.8012 5.8012 6.0686 6.0686 6.0689 6.0689 7.4026 7.4026 7.4031 7.4031 13.1158 13.1158 13.1198 13.1198 13.6890 13.6890 13.6893 13.6893 15.0128 15.0128 k = 0.1166 0.2021 0.5552 ( 13874 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9283 -8.9283 -8.9277 -8.9277 -7.4794 -7.4794 -7.4784 -7.4784 -5.8612 -5.8612 -5.8612 -5.8612 -1.2087 -1.2087 -1.2085 -1.2085 1.4307 1.4307 1.4339 1.4339 2.3610 2.3610 2.3613 2.3613 2.5802 2.5802 2.5866 2.5866 4.0296 4.0296 4.0329 4.0329 4.7677 4.7677 4.7690 4.7690 5.8160 5.8160 5.8160 5.8160 6.0688 6.0688 6.0693 6.0693 7.4109 7.4109 7.4114 7.4114 13.1052 13.1052 13.1089 13.1089 13.7341 13.7341 13.7343 13.7343 14.9884 14.9884 k = 0.1083 0.1877 0.5552 ( 13870 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9493 -8.9493 -8.9487 -8.9487 -7.4461 -7.4461 -7.4452 -7.4452 -5.8546 -5.8546 -5.8545 -5.8545 -1.2528 -1.2528 -1.2526 -1.2526 1.4672 1.4672 1.4704 1.4704 2.3218 2.3218 2.3221 2.3221 2.5633 2.5633 2.5696 2.5696 4.0454 4.0454 4.0485 4.0485 4.7788 4.7788 4.7801 4.7801 5.8303 5.8303 5.8303 5.8303 6.0734 6.0734 6.0739 6.0739 7.4178 7.4178 7.4183 7.4183 13.0940 13.0940 13.0975 13.0975 13.7761 13.7761 13.7762 13.7762 14.9611 14.9611 k = 0.1000 0.1732 0.5552 ( 13858 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9688 -8.9688 -8.9682 -8.9682 -7.4145 -7.4145 -7.4136 -7.4136 -5.8483 -5.8483 -5.8483 -5.8483 -1.2945 -1.2945 -1.2943 -1.2943 1.5020 1.5020 1.5053 1.5053 2.2848 2.2848 2.2851 2.2851 2.5466 2.5466 2.5528 2.5528 4.0604 4.0604 4.0632 4.0632 4.7863 4.7863 4.7877 4.7877 5.8441 5.8441 5.8441 5.8441 6.0818 6.0818 6.0824 6.0824 7.4233 7.4233 7.4238 7.4238 13.0825 13.0825 13.0857 13.0857 13.8142 13.8142 13.8143 13.8143 14.9352 14.9352 k = 0.0917 0.1588 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9868 -8.9868 -8.9863 -8.9863 -7.3847 -7.3847 -7.3839 -7.3839 -5.8425 -5.8425 -5.8425 -5.8425 -1.3335 -1.3335 -1.3333 -1.3333 1.5352 1.5352 1.5384 1.5384 2.2501 2.2501 2.2504 2.2504 2.5303 2.5303 2.5363 2.5363 4.0746 4.0746 4.0772 4.0772 4.7906 4.7906 4.7920 4.7920 5.8572 5.8572 5.8573 5.8573 6.0937 6.0937 6.0944 6.0944 7.4274 7.4274 7.4279 7.4279 13.0710 13.0710 13.0740 13.0740 13.8476 13.8476 13.8477 13.8477 14.9136 14.9136 k = 0.0833 0.1444 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0034 -9.0034 -9.0029 -9.0029 -7.3569 -7.3569 -7.3561 -7.3561 -5.8372 -5.8372 -5.8371 -5.8371 -1.3698 -1.3698 -1.3697 -1.3697 1.5665 1.5665 1.5697 1.5697 2.2181 2.2181 2.2184 2.2184 2.5144 2.5144 2.5202 2.5202 4.0878 4.0878 4.0902 4.0902 4.7920 4.7920 4.7934 4.7934 5.8696 5.8696 5.8696 5.8696 6.1083 6.1083 6.1090 6.1090 7.4303 7.4303 7.4308 7.4308 13.0597 13.0597 13.0625 13.0625 13.8757 13.8757 13.8759 13.8759 14.8975 14.8975 k = 0.0750 0.1299 0.5552 ( 13824 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0184 -9.0184 -9.0180 -9.0180 -7.3311 -7.3311 -7.3304 -7.3304 -5.8323 -5.8323 -5.8323 -5.8323 -1.4033 -1.4033 -1.4031 -1.4031 1.5959 1.5959 1.5991 1.5991 2.1887 2.1887 2.1890 2.1890 2.4992 2.4992 2.5047 2.5047 4.1000 4.1000 4.1022 4.1022 4.7911 4.7911 4.7925 4.7925 5.8811 5.8811 5.8811 5.8811 6.1250 6.1250 6.1257 6.1257 7.4322 7.4322 7.4326 7.4326 13.0489 13.0489 13.0513 13.0513 13.8982 13.8982 13.8985 13.8985 14.8876 14.8876 k = 0.0667 0.1155 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0319 -9.0319 -9.0315 -9.0315 -7.3076 -7.3076 -7.3070 -7.3070 -5.8279 -5.8279 -5.8279 -5.8279 -1.4336 -1.4336 -1.4334 -1.4334 1.6232 1.6232 1.6262 1.6262 2.1621 2.1621 2.1624 2.1624 2.4848 2.4848 2.4900 2.4900 4.1112 4.1112 4.1131 4.1131 4.7884 4.7884 4.7897 4.7897 5.8916 5.8916 5.8917 5.8917 6.1428 6.1428 6.1435 6.1435 7.4331 7.4331 7.4335 7.4335 13.0386 13.0386 13.0408 13.0408 13.9152 13.9152 13.9156 13.9156 14.8836 14.8836 k = 0.0583 0.1011 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0438 -9.0438 -9.0434 -9.0434 -7.2865 -7.2865 -7.2859 -7.2859 -5.8240 -5.8240 -5.8240 -5.8240 -1.4608 -1.4608 -1.4606 -1.4606 1.6481 1.6481 1.6509 1.6509 2.1384 2.1384 2.1387 2.1387 2.4714 2.4714 2.4762 2.4762 4.1212 4.1212 4.1229 4.1229 4.7846 4.7846 4.7858 4.7858 5.9011 5.9011 5.9012 5.9012 6.1610 6.1610 6.1616 6.1616 7.4332 7.4332 7.4336 7.4336 13.0292 13.0292 13.0311 13.0311 13.9272 13.9272 13.9276 13.9276 14.8849 14.8849 k = 0.0500 0.0866 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0541 -9.0541 -9.0538 -9.0538 -7.2679 -7.2679 -7.2674 -7.2674 -5.8206 -5.8206 -5.8206 -5.8206 -1.4846 -1.4846 -1.4845 -1.4845 1.6705 1.6705 1.6731 1.6731 2.1178 2.1178 2.1180 2.1180 2.4592 2.4592 2.4635 2.4635 4.1300 4.1300 4.1315 4.1315 4.7800 4.7800 4.7811 4.7811 5.9095 5.9095 5.9095 5.9095 6.1786 6.1786 6.1792 6.1792 7.4328 7.4328 7.4332 7.4332 13.0207 13.0207 13.0223 13.0223 13.9349 13.9349 13.9353 13.9353 14.8902 14.8902 k = 0.0417 0.0722 0.5552 ( 13854 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0629 -9.0629 -9.0627 -9.0627 -7.2520 -7.2520 -7.2515 -7.2515 -5.8177 -5.8177 -5.8177 -5.8177 -1.5050 -1.5050 -1.5049 -1.5049 1.6901 1.6901 1.6924 1.6924 2.1001 2.1001 2.1003 2.1003 2.4484 2.4484 2.4521 2.4521 4.1376 4.1376 4.1388 4.1388 4.7754 4.7754 4.7763 4.7763 5.9167 5.9167 5.9167 5.9167 6.1951 6.1951 6.1956 6.1956 7.4320 7.4320 7.4323 7.4323 13.0133 13.0133 13.0147 13.0147 13.9393 13.9393 13.9397 13.9397 14.8982 14.8982 k = 0.0333 0.0577 0.5552 ( 13850 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0701 -9.0701 -9.0699 -9.0699 -7.2388 -7.2388 -7.2384 -7.2384 -5.8153 -5.8153 -5.8153 -5.8153 -1.5218 -1.5218 -1.5217 -1.5217 1.7066 1.7066 1.7086 1.7086 2.0856 2.0856 2.0858 2.0858 2.4392 2.4392 2.4423 2.4423 4.1439 4.1439 4.1448 4.1448 4.7709 4.7709 4.7717 4.7717 5.9227 5.9227 5.9227 5.9227 6.2096 6.2096 6.2100 6.2100 7.4310 7.4310 7.4312 7.4312 13.0071 13.0071 13.0082 13.0082 13.9413 13.9413 13.9417 13.9417 14.9073 14.9073 k = 0.0250 0.0433 0.5552 ( 13862 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0757 -9.0757 -9.0755 -9.0755 -7.2284 -7.2284 -7.2281 -7.2281 -5.8135 -5.8135 -5.8135 -5.8135 -1.5350 -1.5350 -1.5349 -1.5349 1.7199 1.7199 1.7214 1.7214 2.0743 2.0743 2.0744 2.0744 2.4319 2.4319 2.4343 2.4343 4.1488 4.1488 4.1495 4.1495 4.7671 4.7671 4.7677 4.7677 5.9274 5.9274 5.9274 5.9274 6.2215 6.2215 6.2219 6.2219 7.4300 7.4300 7.4302 7.4302 13.0022 13.0022 13.0030 13.0030 13.9419 13.9419 13.9421 13.9421 14.9161 14.9161 k = 0.0167 0.0289 0.5552 ( 13858 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0797 -9.0797 -9.0796 -9.0796 -7.2209 -7.2209 -7.2207 -7.2207 -5.8122 -5.8122 -5.8122 -5.8122 -1.5445 -1.5445 -1.5444 -1.5444 1.7296 1.7296 1.7307 1.7307 2.0662 2.0662 2.0663 2.0663 2.4266 2.4266 2.4282 2.4282 4.1524 4.1524 4.1529 4.1529 4.7642 4.7642 4.7646 4.7646 5.9308 5.9308 5.9308 5.9308 6.2304 6.2304 6.2307 6.2307 7.4291 7.4291 7.4293 7.4293 12.9987 12.9987 12.9992 12.9992 13.9417 13.9417 13.9419 13.9419 14.9233 14.9234 k = 0.0083 0.0144 0.5552 ( 13870 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0820 -9.0820 -9.0820 -9.0820 -7.2164 -7.2164 -7.2163 -7.2163 -5.8114 -5.8114 -5.8114 -5.8114 -1.5502 -1.5502 -1.5502 -1.5502 1.7357 1.7357 1.7362 1.7362 2.0614 2.0614 2.0614 2.0614 2.4236 2.4236 2.4244 2.4244 4.1546 4.1546 4.1548 4.1548 4.7625 4.7625 4.7627 4.7627 5.9328 5.9328 5.9328 5.9328 6.2360 6.2360 6.2361 6.2361 7.4286 7.4286 7.4287 7.4287 12.9966 12.9966 12.9969 12.9969 13.9414 13.9414 13.9415 13.9415 14.9281 14.9281 k = 0.0000 0.0000 0.5552 ( 13878 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0828 -9.0828 -9.0828 -9.0828 -7.2148 -7.2148 -7.2148 -7.2148 -5.8111 -5.8111 -5.8111 -5.8111 -1.5521 -1.5521 -1.5521 -1.5521 1.7379 1.7379 1.7379 1.7379 2.0597 2.0597 2.0597 2.0597 2.4228 2.4228 2.4228 2.4228 4.1554 4.1554 4.1554 4.1554 4.7619 4.7619 4.7619 4.7619 5.9335 5.9335 5.9335 5.9335 6.2379 6.2379 6.2379 6.2379 7.4284 7.4284 7.4284 7.4284 12.9960 12.9960 12.9960 12.9960 13.9413 13.9413 13.9413 13.9413 14.9298 14.9298 k = 0.0000 0.0000 0.5552 ( 13878 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0828 -9.0828 -9.0828 -9.0828 -7.2148 -7.2148 -7.2148 -7.2148 -5.8111 -5.8111 -5.8111 -5.8111 -1.5521 -1.5521 -1.5521 -1.5521 1.7379 1.7379 1.7379 1.7379 2.0597 2.0597 2.0597 2.0597 2.4228 2.4228 2.4228 2.4228 4.1554 4.1554 4.1554 4.1554 4.7619 4.7619 4.7619 4.7619 5.9335 5.9335 5.9335 5.9335 6.2379 6.2379 6.2379 6.2379 7.4284 7.4284 7.4284 7.4284 12.9960 12.9960 12.9960 12.9960 13.9413 13.9413 13.9413 13.9413 14.9298 14.9298 k = 0.0000 0.0000 0.5384 ( 13878 PWs) bands (ev): -35.7671 -35.7671 -35.7666 -35.7666 -9.1421 -9.1421 -9.0223 -9.0223 -7.2192 -7.2192 -7.2111 -7.2111 -5.8159 -5.8159 -5.8066 -5.8066 -1.5533 -1.5533 -1.5473 -1.5473 1.6584 1.6584 1.7988 1.7988 2.0049 2.0049 2.1152 2.1152 2.4303 2.4303 2.4332 2.4332 4.1273 4.1273 4.1765 4.1765 4.7426 4.7426 4.7849 4.7849 5.9319 5.9319 5.9349 5.9349 6.2196 6.2196 6.2561 6.2561 7.4093 7.4093 7.4440 7.4440 12.9962 12.9962 13.0061 13.0061 13.9356 13.9356 13.9429 13.9429 14.8916 14.8916 k = 0.0000 0.0000 0.5215 ( 13878 PWs) bands (ev): -35.7673 -35.7673 -35.7663 -35.7663 -9.2001 -9.2001 -8.9607 -8.9607 -7.2240 -7.2240 -7.2078 -7.2078 -5.8210 -5.8210 -5.8023 -5.8023 -1.5509 -1.5509 -1.5389 -1.5389 1.5653 1.5653 1.8376 1.8376 1.9508 1.9508 2.1713 2.1713 2.4515 2.4515 2.4645 2.4645 4.0924 4.0924 4.1904 4.1904 4.7267 4.7267 4.8115 4.8115 5.9298 5.9298 5.9363 5.9363 6.2015 6.2015 6.2742 6.2742 7.3866 7.3866 7.4559 7.4559 13.0067 13.0067 13.0263 13.0263 13.9261 13.9261 13.9398 13.9398 14.8500 14.8500 k = 0.0000 0.0000 0.5047 ( 13862 PWs) bands (ev): -35.7676 -35.7676 -35.7661 -35.7661 -9.2567 -9.2567 -8.8979 -8.8979 -7.2294 -7.2294 -7.2052 -7.2052 -5.8264 -5.8264 -5.7982 -5.7982 -1.5450 -1.5450 -1.5271 -1.5271 1.4630 1.4630 1.8545 1.8545 1.8975 1.8975 2.2277 2.2277 2.4819 2.4819 2.5164 2.5164 4.0511 4.0511 4.1967 4.1967 4.7142 4.7142 4.8419 4.8419 5.9273 5.9273 5.9380 5.9380 6.1836 6.1836 6.2921 6.2921 7.3605 7.3605 7.4641 7.4641 13.0274 13.0274 13.0565 13.0565 13.9132 13.9132 13.9315 13.9315 14.8049 14.8049 k = 0.0000 0.0000 0.4879 ( 13846 PWs) bands (ev): -35.7678 -35.7678 -35.7658 -35.7658 -9.3118 -9.3118 -8.8342 -8.8342 -7.2352 -7.2352 -7.2031 -7.2031 -5.8322 -5.8322 -5.7944 -5.7944 -1.5355 -1.5355 -1.5118 -1.5118 1.3545 1.3545 1.8445 1.8445 1.8542 1.8542 2.2845 2.2845 2.5186 2.5186 2.5847 2.5847 4.0039 4.0039 4.1956 4.1956 4.7049 4.7049 4.8762 4.8762 5.9240 5.9240 5.9401 5.9401 6.1661 6.1661 6.3097 6.3097 7.3312 7.3312 7.4687 7.4687 13.0582 13.0582 13.0963 13.0963 13.8971 13.8971 13.9175 13.9175 14.7569 14.7569 k = 0.0000 0.0000 0.4711 ( 13848 PWs) bands (ev): -35.7681 -35.7681 -35.7656 -35.7656 -9.3656 -9.3656 -8.7695 -8.7695 -7.2415 -7.2415 -7.2015 -7.2015 -5.8382 -5.8382 -5.7908 -5.7908 -1.5224 -1.5224 -1.4932 -1.4932 1.2421 1.2421 1.7933 1.7933 1.8405 1.8405 2.3414 2.3414 2.5598 2.5598 2.6636 2.6636 3.9510 3.9510 4.1869 4.1869 4.6988 4.6988 4.9145 4.9145 5.9201 5.9201 5.9428 5.9428 6.1490 6.1490 6.3267 6.3267 7.2988 7.2988 7.4698 7.4698 13.0987 13.0987 13.1454 13.1454 13.8779 13.8779 13.8974 13.8974 14.7066 14.7066 k = 0.0000 0.0000 0.4542 ( 13847 PWs) bands (ev): -35.7683 -35.7683 -35.7653 -35.7653 -9.4178 -9.4178 -8.7040 -8.7040 -7.2482 -7.2482 -7.2005 -7.2005 -5.8447 -5.8447 -5.7874 -5.7874 -1.5059 -1.5059 -1.4712 -1.4712 1.1273 1.1273 1.7429 1.7429 1.8192 1.8192 2.3984 2.3984 2.6042 2.6042 2.7484 2.7484 3.8930 3.8930 4.1707 4.1707 4.6956 4.6956 4.9566 4.9566 5.9154 5.9154 5.9464 5.9464 6.1324 6.1324 6.3431 6.3431 7.2637 7.2637 7.4674 7.4674 13.1488 13.1488 13.2030 13.2030 13.8555 13.8555 13.8708 13.8708 14.6544 14.6544 k = 0.0000 0.0000 0.4374 ( 13847 PWs) bands (ev): -35.7686 -35.7686 -35.7651 -35.7651 -9.4684 -9.4684 -8.6378 -8.6378 -7.2552 -7.2552 -7.2001 -7.2001 -5.8515 -5.8515 -5.7842 -5.7842 -1.4860 -1.4860 -1.4460 -1.4460 1.0111 1.0111 1.6934 1.6934 1.7929 1.7929 2.4553 2.4553 2.6508 2.6508 2.8357 2.8357 3.8302 3.8302 4.1473 4.1473 4.6952 4.6952 5.0026 5.0026 5.9100 5.9100 5.9508 5.9508 6.1165 6.1165 6.3586 6.3586 7.2260 7.2260 7.4616 7.4616 13.2080 13.2080 13.2686 13.2686 13.8299 13.8299 13.8376 13.8376 14.5633 14.5633 k = 0.0000 0.0000 0.4206 ( 13821 PWs) bands (ev): -35.7688 -35.7688 -35.7649 -35.7649 -9.5174 -9.5174 -8.5709 -8.5709 -7.2626 -7.2626 -7.2001 -7.2001 -5.8587 -5.8587 -5.7811 -5.7811 -1.4627 -1.4627 -1.4178 -1.4178 0.8944 0.8944 1.6451 1.6451 1.7638 1.7638 2.5119 2.5119 2.6992 2.6992 2.9233 2.9233 3.7631 3.7631 4.1170 4.1170 4.6976 4.6976 5.0523 5.0523 5.9039 5.9039 5.9563 5.9563 6.1014 6.1014 6.3731 6.3731 7.1861 7.1861 7.4528 7.4528 13.2759 13.2759 13.3409 13.3409 13.7974 13.7974 13.8015 13.8015 14.4604 14.4604 k = 0.0000 0.0000 0.4038 ( 13823 PWs) bands (ev): -35.7690 -35.7690 -35.7646 -35.7646 -9.5648 -9.5648 -8.5036 -8.5036 -7.2703 -7.2703 -7.2006 -7.2006 -5.8663 -5.8663 -5.7783 -5.7783 -1.4362 -1.4362 -1.3866 -1.3866 0.7779 0.7779 1.5979 1.5979 1.7332 1.7332 2.5680 2.5680 2.7488 2.7488 3.0097 3.0097 3.6922 3.6922 4.0801 4.0801 4.7027 4.7027 5.1056 5.1056 5.8972 5.8972 5.9627 5.9627 6.0872 6.0872 6.3863 6.3863 7.1445 7.1445 7.4410 7.4410 13.3519 13.3519 13.4184 13.4184 13.7518 13.7518 13.7688 13.7688 14.3594 14.3594 k = 0.0000 0.0000 0.3869 ( 13823 PWs) bands (ev): -35.7693 -35.7693 -35.7644 -35.7644 -9.6105 -9.6105 -8.4359 -8.4359 -7.2781 -7.2781 -7.2015 -7.2015 -5.8744 -5.8744 -5.7756 -5.7756 -1.4066 -1.4066 -1.3526 -1.3526 0.6621 0.6621 1.5518 1.5518 1.7019 1.7019 2.6234 2.6234 2.7992 2.7992 3.0938 3.0938 3.6181 3.6181 4.0372 4.0372 4.7102 4.7102 5.1622 5.1622 5.8900 5.8900 5.9700 5.9700 6.0741 6.0741 6.3979 6.3979 7.1015 7.1015 7.4266 7.4266 13.4356 13.4356 13.4981 13.4981 13.7001 13.7001 13.7326 13.7326 14.2633 14.2633 k = 0.0000 0.0000 0.3701 ( 13823 PWs) bands (ev): -35.7695 -35.7695 -35.7642 -35.7642 -9.6544 -9.6544 -8.3680 -8.3680 -7.2862 -7.2862 -7.2029 -7.2029 -5.8829 -5.8829 -5.7731 -5.7731 -1.3740 -1.3740 -1.3160 -1.3160 0.5476 0.5476 1.5070 1.5070 1.6705 1.6705 2.6777 2.6777 2.8502 2.8502 3.1750 3.1750 3.5413 3.5413 3.9888 3.9888 4.7201 4.7201 5.2215 5.2215 5.8824 5.8824 5.9782 5.9782 6.0623 6.0623 6.4075 6.4075 7.0577 7.0577 7.4097 7.4097 13.5264 13.5264 13.5744 13.5744 13.6433 13.6433 13.6927 13.6927 14.1779 14.1779 k = 0.0000 0.0000 0.3533 ( 13797 PWs) bands (ev): -35.7697 -35.7697 -35.7640 -35.7640 -9.6966 -9.6966 -8.3000 -8.3000 -7.2944 -7.2944 -7.2046 -7.2046 -5.8919 -5.8919 -5.7707 -5.7707 -1.3385 -1.3385 -1.2768 -1.2768 0.4347 0.4347 1.4634 1.4634 1.6394 1.6394 2.7305 2.7305 2.9014 2.9014 3.2527 3.2527 3.4625 3.4625 3.9356 3.9356 4.7322 4.7322 5.2832 5.2832 5.8745 5.8745 5.9871 5.9871 6.0520 6.0520 6.4147 6.4147 7.0138 7.0138 7.3908 7.3908 13.5819 13.5819 13.6232 13.6232 13.6350 13.6350 13.6495 13.6495 14.1156 14.1156 k = 0.0000 0.0000 0.3365 ( 13807 PWs) bands (ev): -35.7699 -35.7699 -35.7638 -35.7638 -9.7370 -9.7370 -8.2321 -8.2321 -7.3026 -7.3026 -7.2066 -7.2066 -5.9014 -5.9014 -5.7685 -5.7685 -1.3004 -1.3004 -1.2354 -1.2354 0.3239 0.3239 1.4211 1.4211 1.6090 1.6090 2.7811 2.7811 2.9527 2.9527 3.3268 3.3268 3.3828 3.3828 3.8781 3.8781 4.7465 4.7465 5.3465 5.3465 5.8665 5.8665 5.9967 5.9967 6.0433 6.0433 6.4189 6.4189 6.9706 6.9706 7.3701 7.3701 13.5170 13.5170 13.6018 13.6018 13.6582 13.6582 13.7268 13.7268 14.0978 14.0978 k = 0.0000 0.0000 0.3197 ( 13811 PWs) bands (ev): -35.7701 -35.7701 -35.7636 -35.7636 -9.7757 -9.7757 -8.1644 -8.1644 -7.3109 -7.3109 -7.2090 -7.2090 -5.9114 -5.9114 -5.7665 -5.7665 -1.2598 -1.2598 -1.1919 -1.1919 0.2155 0.2155 1.3801 1.3801 1.5794 1.5794 2.8283 2.8283 3.0038 3.0038 3.3036 3.3036 3.3972 3.3972 3.8171 3.8171 4.7628 4.7628 5.4105 5.4105 5.8584 5.8584 6.0067 6.0067 6.0368 6.0368 6.4193 6.4193 6.9290 6.9290 7.3481 7.3481 13.4489 13.4489 13.5515 13.5515 13.6309 13.6309 13.8348 13.8348 14.1378 14.1378 k = 0.0000 0.0000 0.3028 ( 13847 PWs) bands (ev): -35.7703 -35.7703 -35.7634 -35.7634 -9.8124 -9.8124 -8.0972 -8.0972 -7.3191 -7.3191 -7.2115 -7.2115 -5.9219 -5.9219 -5.7645 -5.7645 -1.2169 -1.2169 -1.1466 -1.1466 0.1099 0.1099 1.3403 1.3403 1.5508 1.5508 2.8692 2.8692 3.0545 3.0545 3.2280 3.2280 3.4635 3.4635 3.7533 3.7533 4.7809 4.7809 5.4743 5.4743 5.8504 5.8504 6.0171 6.0171 6.0329 6.0329 6.4152 6.4152 6.8901 6.8901 7.3250 7.3250 13.3786 13.3786 13.4986 13.4986 13.5679 13.5679 13.9472 13.9472 14.2204 14.2204 k = 0.0000 0.0000 0.2860 ( 13847 PWs) bands (ev): -35.7705 -35.7705 -35.7632 -35.7632 -9.8473 -9.8473 -8.0306 -8.0306 -7.3273 -7.3273 -7.2143 -7.2143 -5.9329 -5.9329 -5.7627 -5.7627 -1.1720 -1.1720 -1.0997 -1.0997 0.0075 0.0075 1.3019 1.3019 1.5233 1.5233 2.8973 2.8973 3.1045 3.1045 3.1631 3.1631 3.5260 3.5260 3.6873 3.6873 4.8008 4.8008 5.5364 5.5364 5.8426 5.8426 6.0273 6.0273 6.0325 6.0325 6.4056 6.4056 6.8549 6.8549 7.3015 7.3015 13.3068 13.3068 13.4437 13.4437 13.4885 13.4885 14.0630 14.0630 14.1986 14.1986 k = 0.0000 0.0000 0.2692 ( 13867 PWs) bands (ev): -35.7707 -35.7707 -35.7630 -35.7630 -9.8804 -9.8804 -7.9649 -7.9649 -7.3352 -7.3352 -7.2172 -7.2172 -5.9444 -5.9444 -5.7610 -5.7610 -1.1254 -1.1254 -1.0515 -1.0515 -0.0914 -0.0914 1.2647 1.2647 1.4971 1.4971 2.8977 2.8977 3.1235 3.1235 3.1541 3.1541 3.5846 3.5846 3.6199 3.6199 4.8223 4.8223 5.5954 5.5954 5.8350 5.8350 6.0343 6.0343 6.0392 6.0392 6.3897 6.3897 6.8246 6.8246 7.2778 7.2778 13.2342 13.2342 13.3875 13.3875 13.4032 13.4032 14.1685 14.1685 14.1817 14.1817 k = 0.0000 0.0000 0.2524 ( 13871 PWs) bands (ev): -35.7709 -35.7709 -35.7629 -35.7629 -9.9115 -9.9115 -7.9003 -7.9003 -7.3430 -7.3430 -7.2202 -7.2202 -5.9564 -5.9564 -5.7595 -5.7595 -1.0774 -1.0774 -1.0023 -1.0023 -0.1865 -0.1865 1.2289 1.2289 1.4722 1.4722 2.8590 2.8590 3.1218 3.1218 3.2021 3.2021 3.5515 3.5515 3.6396 3.6396 4.8452 4.8452 5.6496 5.6496 5.8277 5.8277 6.0424 6.0424 6.0497 6.0497 6.3674 6.3674 6.7996 6.7996 7.2546 7.2546 13.1615 13.1615 13.3166 13.3166 13.3309 13.3309 14.1414 14.1414 14.3017 14.3017 k = 0.0000 0.0000 0.2355 ( 13859 PWs) bands (ev): -35.7710 -35.7710 -35.7627 -35.7627 -9.9407 -9.9407 -7.8370 -7.8370 -7.3505 -7.3505 -7.2233 -7.2233 -5.9689 -5.9689 -5.7580 -5.7580 -1.0283 -1.0283 -0.9524 -0.9524 -0.2773 -0.2773 1.1944 1.1944 1.4487 1.4487 2.7945 2.7945 3.1446 3.1446 3.2489 3.2489 3.4833 3.4833 3.6907 3.6907 4.8695 4.8695 5.6971 5.6971 5.8209 5.8209 6.0553 6.0553 6.0609 6.0609 6.3386 6.3386 6.7802 6.7802 7.2324 7.2324 13.0894 13.0894 13.2314 13.2314 13.2744 13.2744 14.1168 14.1168 14.4224 14.4224 k = 0.0000 0.0000 0.2187 ( 13863 PWs) bands (ev): -35.7712 -35.7712 -35.7625 -35.7625 -9.9679 -9.9679 -7.7755 -7.7755 -7.3578 -7.3578 -7.2263 -7.2263 -5.9817 -5.9817 -5.7567 -5.7567 -0.9785 -0.9785 -0.9023 -0.9023 -0.3637 -0.3637 1.1613 1.1613 1.4266 1.4266 2.7196 2.7196 3.1766 3.1766 3.2942 3.2942 3.4157 3.4157 3.7381 3.7381 4.8948 4.8948 5.7366 5.7366 5.8145 5.8145 6.0686 6.0686 6.0776 6.0776 6.3042 6.3042 6.7658 6.7658 7.2117 7.2117 13.0185 13.0185 13.1488 13.1488 13.2189 13.2189 14.0946 14.0946 14.5421 14.5421 k = 0.0000 0.0000 0.2019 ( 13853 PWs) bands (ev): -35.7713 -35.7713 -35.7624 -35.7624 -9.9932 -9.9932 -7.7159 -7.7159 -7.3647 -7.3647 -7.2294 -7.2294 -5.9949 -5.9949 -5.7555 -5.7555 -0.9285 -0.9285 -0.8523 -0.8523 -0.4453 -0.4453 1.1295 1.1295 1.4060 1.4060 2.6417 2.6417 3.2112 3.2112 3.3375 3.3375 3.3496 3.3496 3.7821 3.7821 4.9211 4.9211 5.7676 5.7676 5.8088 5.8088 6.0788 6.0788 6.1027 6.1027 6.2654 6.2654 6.7557 6.7557 7.1929 7.1929 12.9494 12.9494 13.0699 13.0699 13.1650 13.1650 14.0745 14.0745 14.6594 14.6594 k = 0.0000 0.0000 0.1851 ( 13853 PWs) bands (ev): -35.7715 -35.7715 -35.7623 -35.7623 -10.0166 -10.0166 -7.6586 -7.6586 -7.3712 -7.3712 -7.2323 -7.2323 -6.0084 -6.0084 -5.7544 -5.7544 -0.8787 -0.8787 -0.8029 -0.8029 -0.5217 -0.5217 1.0993 1.0993 1.3870 1.3870 2.5638 2.5638 3.2455 3.2455 3.2854 3.2854 3.3791 3.3791 3.8225 3.8225 4.9481 4.9481 5.7901 5.7901 5.8045 5.8045 6.0882 6.0882 6.1322 6.1322 6.2235 6.2235 6.7489 6.7489 7.1767 7.1767 12.8829 12.8829 12.9954 12.9954 13.1133 13.1133 14.0565 14.0565 14.7722 14.7722 k = 0.0000 0.0000 0.1682 ( 13837 PWs) bands (ev): -35.7716 -35.7716 -35.7622 -35.7622 -10.0379 -10.0379 -7.6041 -7.6041 -7.3772 -7.3772 -7.2352 -7.2352 -6.0219 -6.0219 -5.7534 -5.7534 -0.8296 -0.8296 -0.7546 -0.7546 -0.5928 -0.5928 1.0706 1.0706 1.3695 1.3695 2.4877 2.4877 3.2232 3.2232 3.2793 3.2793 3.4182 3.4182 3.8594 3.8594 4.9756 4.9756 5.7963 5.7963 5.8108 5.8108 6.0969 6.0969 6.1633 6.1633 6.1799 6.1799 6.7445 6.7445 7.1634 7.1634 12.8194 12.8194 12.9257 12.9257 13.0643 13.0643 14.0403 14.0403 14.8780 14.8780 k = 0.0000 0.0000 0.1514 ( 13817 PWs) bands (ev): -35.7717 -35.7717 -35.7620 -35.7620 -10.0572 -10.0572 -7.5526 -7.5526 -7.3828 -7.3828 -7.2379 -7.2379 -6.0354 -6.0354 -5.7525 -5.7525 -0.7820 -0.7820 -0.7080 -0.7080 -0.6580 -0.6580 1.0435 1.0435 1.3536 1.3536 2.4147 2.4147 3.1652 3.1652 3.3103 3.3103 3.4547 3.4547 3.8929 3.8929 5.0033 5.0033 5.7927 5.7927 5.8228 5.8228 6.1048 6.1048 6.1350 6.1350 6.1947 6.1947 6.7418 6.7418 7.1534 7.1534 12.7598 12.7598 12.8614 12.8614 13.0185 13.0185 14.0258 14.0258 14.9739 14.9739 k = 0.0000 0.0000 0.1346 ( 13835 PWs) bands (ev): -35.7718 -35.7718 -35.7619 -35.7619 -10.0746 -10.0746 -7.5046 -7.5046 -7.3880 -7.3880 -7.2404 -7.2404 -6.0486 -6.0486 -5.7517 -5.7517 -0.7364 -0.7364 -0.7173 -0.7173 -0.6635 -0.6635 1.0182 1.0182 1.3393 1.3393 2.3457 2.3457 3.1110 3.1110 3.3388 3.3388 3.4883 3.4883 3.9229 3.9229 5.0309 5.0309 5.7891 5.7891 5.8323 5.8323 6.0903 6.0903 6.1127 6.1127 6.2232 6.2232 6.7403 6.7403 7.1466 7.1466 12.7044 12.7044 12.8029 12.8029 12.9765 12.9765 14.0130 14.0130 15.0570 15.0570 k = 0.0000 0.0000 0.1178 ( 13815 PWs) bands (ev): -35.7719 -35.7719 -35.7619 -35.7619 -10.0899 -10.0899 -7.4606 -7.4606 -7.3925 -7.3925 -7.2427 -7.2427 -6.0613 -6.0613 -5.7510 -5.7510 -0.7703 -0.7703 -0.6934 -0.6934 -0.6220 -0.6220 0.9949 0.9949 1.3267 1.3267 2.2819 2.2819 3.0614 3.0614 3.3646 3.3646 3.5188 3.5188 3.9495 3.9495 5.0579 5.0579 5.7858 5.7858 5.8398 5.8398 6.0476 6.0476 6.1191 6.1191 6.2481 6.2481 6.7397 6.7397 7.1430 7.1430 12.6540 12.6540 12.7504 12.7504 12.9385 12.9385 14.0019 14.0019 15.1249 15.1249 k = 0.0000 0.0000 0.1009 ( 13831 PWs) bands (ev): -35.7719 -35.7719 -35.7618 -35.7618 -10.1032 -10.1032 -7.4211 -7.4211 -7.3966 -7.3966 -7.2447 -7.2447 -6.0733 -6.0733 -5.7504 -5.7504 -0.8167 -0.8167 -0.6540 -0.6540 -0.5840 -0.5840 0.9738 0.9738 1.3157 1.3157 2.2240 2.2240 3.0171 3.0171 3.3873 3.3873 3.5458 3.5458 3.9726 3.9726 5.0838 5.0838 5.7830 5.7830 5.8458 5.8458 6.0070 6.0070 6.1249 6.1249 6.2689 6.2689 6.7395 6.7395 7.1422 7.1422 12.6090 12.6090 12.7043 12.7043 12.9049 12.9049 13.9922 13.9922 15.1771 15.1771 k = 0.0000 0.0000 0.0841 ( 13847 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -10.1145 -10.1145 -7.4000 -7.4000 -7.3866 -7.3866 -7.2465 -7.2465 -6.0842 -6.0842 -5.7499 -5.7499 -0.8565 -0.8565 -0.6189 -0.6189 -0.5502 -0.5502 0.9551 0.9551 1.3064 1.3064 2.1731 2.1731 2.9785 2.9785 3.4069 3.4069 3.5692 3.5692 3.9923 3.9923 5.1081 5.1081 5.7806 5.7806 5.8506 5.8506 5.9698 5.9698 6.1298 6.1298 6.2854 6.2854 6.7396 6.7396 7.1435 7.1435 12.5699 12.5699 12.6649 12.6649 12.8760 12.8760 13.9841 13.9841 15.2150 15.2150 k = 0.0000 0.0000 0.0673 ( 13843 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -10.1237 -10.1237 -7.4029 -7.4029 -7.3574 -7.3574 -7.2480 -7.2480 -6.0937 -6.0937 -5.7495 -5.7495 -0.8892 -0.8892 -0.5888 -0.5888 -0.5214 -0.5214 0.9393 0.9393 1.2988 1.2988 2.1300 2.1300 2.9462 2.9462 3.4230 3.4230 3.5887 3.5887 4.0084 4.0084 5.1298 5.1298 5.7788 5.7788 5.8545 5.8545 5.9370 5.9370 6.1339 6.1339 6.2978 6.2978 6.7398 6.7398 7.1462 7.1462 12.5373 12.5373 12.6324 12.6324 12.8520 12.8520 13.9775 13.9775 15.2412 15.2412 k = 0.0000 0.0000 0.0505 ( 13859 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -10.1308 -10.1308 -7.4051 -7.4051 -7.3342 -7.3342 -7.2491 -7.2491 -6.1015 -6.1015 -5.7491 -5.7491 -0.9149 -0.9149 -0.5645 -0.5645 -0.4982 -0.4982 0.9266 0.9266 1.2928 1.2928 2.0955 2.0955 2.9206 2.9206 3.4357 3.4357 3.6041 3.6041 4.0210 4.0210 5.1482 5.1482 5.7773 5.7773 5.8576 5.8576 5.9098 5.9098 6.1372 6.1372 6.3067 6.3067 6.7400 6.7400 7.1493 7.1493 12.5115 12.5115 12.6069 12.6069 12.8332 12.8332 13.9724 13.9724 15.2587 15.2587 k = 0.0000 0.0000 0.0336 ( 13869 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1360 -10.1360 -7.4067 -7.4067 -7.3173 -7.3173 -7.2500 -7.2500 -6.1073 -6.1073 -5.7489 -5.7489 -0.9333 -0.9333 -0.5466 -0.5466 -0.4811 -0.4811 0.9172 0.9172 1.2886 1.2886 2.0703 2.0703 2.9021 2.9021 3.4448 3.4448 3.6152 3.6152 4.0300 4.0300 5.1622 5.1622 5.7763 5.7763 5.8597 5.8597 5.8893 5.8893 6.1395 6.1395 6.3126 6.3126 6.7403 6.7403 7.1522 7.1522 12.4928 12.4928 12.5885 12.5885 12.8196 12.8196 13.9688 13.9688 15.2696 15.2696 k = 0.0000 0.0000 0.0168 ( 13885 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1391 -10.1391 -7.4077 -7.4077 -7.3071 -7.3071 -7.2505 -7.2505 -6.1109 -6.1109 -5.7488 -5.7488 -0.9444 -0.9444 -0.5357 -0.5357 -0.4707 -0.4707 0.9115 0.9115 1.2860 1.2860 2.0549 2.0549 2.8908 2.8908 3.4503 3.4503 3.6219 3.6219 4.0354 4.0354 5.1711 5.1711 5.7757 5.7757 5.8610 5.8610 5.8766 5.8766 6.1409 6.1409 6.3159 6.3159 6.7404 6.7404 7.1542 7.1542 12.4815 12.4815 12.5775 12.5775 12.8114 12.8114 13.9666 13.9666 15.2756 15.2756 k = 0.0000 0.0000 0.0000 ( 13901 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1401 -10.1401 -7.4080 -7.4080 -7.3036 -7.3036 -7.2506 -7.2506 -6.1121 -6.1121 -5.7487 -5.7487 -0.9481 -0.9481 -0.5320 -0.5320 -0.4672 -0.4672 0.9096 0.9096 1.2851 1.2851 2.0498 2.0498 2.8871 2.8871 3.4521 3.4521 3.6241 3.6241 4.0372 4.0372 5.1741 5.1741 5.7755 5.7755 5.8615 5.8615 5.8722 5.8722 6.1413 6.1413 6.3170 6.3170 6.7405 6.7405 7.1549 7.1549 12.4777 12.4777 12.5738 12.5738 12.8087 12.8087 13.9659 13.9659 15.2775 15.2775 k = 0.0000 0.0000 0.0000 ( 13901 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1401 -10.1401 -7.4080 -7.4080 -7.3036 -7.3036 -7.2506 -7.2506 -6.1121 -6.1121 -5.7487 -5.7487 -0.9481 -0.9481 -0.5320 -0.5320 -0.4672 -0.4672 0.9096 0.9096 1.2851 1.2851 2.0498 2.0498 2.8871 2.8871 3.4521 3.4521 3.6241 3.6241 4.0372 4.0372 5.1741 5.1741 5.7755 5.7755 5.8615 5.8615 5.8722 5.8722 6.1413 6.1413 6.3170 6.3170 6.7405 6.7405 7.1549 7.1549 12.4777 12.4777 12.5738 12.5738 12.8087 12.8087 13.9659 13.9659 15.2775 15.2775 k =-0.0143 0.0082 0.0000 ( 13895 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1396 -10.1396 -7.4088 -7.4087 -7.3040 -7.3036 -7.2511 -7.2505 -6.1117 -6.1113 -5.7500 -5.7498 -0.9506 -0.9506 -0.5291 -0.5287 -0.4649 -0.4647 0.9095 0.9098 1.2869 1.2870 2.0486 2.0487 2.8866 2.8868 3.4462 3.4470 3.6281 3.6284 4.0383 4.0384 5.1763 5.1767 5.7539 5.7543 5.8595 5.8595 5.8928 5.8931 6.1376 6.1385 6.3174 6.3182 6.7405 6.7406 7.1547 7.1547 12.4810 12.4810 12.5731 12.5731 12.8107 12.8111 13.9680 13.9682 15.2705 15.2713 k =-0.0286 0.0165 0.0000 ( 13886 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1380 -10.1380 -7.4111 -7.4109 -7.3048 -7.3041 -7.2519 -7.2508 -6.1100 -6.1093 -5.7535 -5.7532 -0.9579 -0.9579 -0.5201 -0.5195 -0.4580 -0.4576 0.9095 0.9102 1.2924 1.2926 2.0453 2.0455 2.8854 2.8858 3.4305 3.4321 3.6391 3.6398 4.0418 4.0418 5.1831 5.1840 5.7118 5.7124 5.8536 5.8539 5.9326 5.9328 6.1275 6.1293 6.3191 6.3206 6.7407 6.7409 7.1540 7.1541 12.4907 12.4907 12.5711 12.5712 12.8171 12.8179 13.9746 13.9748 15.2506 15.2523 k =-0.0429 0.0247 0.0000 ( 13872 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1354 -10.1354 -7.4148 -7.4145 -7.3061 -7.3051 -7.2530 -7.2513 -6.1070 -6.1060 -5.7593 -5.7588 -0.9693 -0.9692 -0.5058 -0.5049 -0.4466 -0.4460 0.9099 0.9109 1.3014 1.3018 2.0399 2.0401 2.8834 2.8840 3.4076 3.4097 3.6550 3.6558 4.0474 4.0474 5.1943 5.1956 5.6646 5.6654 5.8435 5.8441 5.9760 5.9761 6.1121 6.1146 6.3221 6.3241 6.7411 6.7413 7.1528 7.1529 12.5067 12.5068 12.5683 12.5685 12.8277 12.8287 13.9852 13.9856 15.2188 15.2212 k =-0.0571 0.0330 0.0000 ( 13864 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1318 -10.1317 -7.4200 -7.4196 -7.3081 -7.3068 -7.2540 -7.2518 -6.1029 -6.1016 -5.7672 -5.7666 -0.9840 -0.9839 -0.4870 -0.4858 -0.4307 -0.4299 0.9107 0.9121 1.3140 1.3144 2.0323 2.0326 2.8808 2.8816 3.3793 3.3819 3.6739 3.6746 4.0552 4.0553 5.2095 5.2112 5.6163 5.6173 5.8285 5.8295 6.0194 6.0195 6.0924 6.0954 6.3259 6.3282 6.7417 6.7419 7.1512 7.1513 12.5289 12.5290 12.5653 12.5656 12.8419 12.8432 13.9996 14.0001 15.1764 15.1795 k =-0.0714 0.0412 0.0000 ( 13868 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1271 -10.1271 -7.4266 -7.4261 -7.3109 -7.3094 -7.2547 -7.2521 -6.0976 -6.0960 -5.7772 -5.7764 -1.0011 -1.0011 -0.4645 -0.4630 -0.4107 -0.4097 0.9121 0.9138 1.3300 1.3305 2.0227 2.0231 2.8775 2.8785 3.3470 3.3500 3.6946 3.6953 4.0651 4.0652 5.2278 5.2299 5.5685 5.5696 5.8079 5.8091 6.0614 6.0617 6.0698 6.0732 6.3302 6.3327 6.7423 6.7427 7.1491 7.1493 12.5569 12.5570 12.5627 12.5632 12.8595 12.8611 14.0172 14.0178 15.1251 15.1287 k =-0.0857 0.0495 0.0000 ( 13872 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1215 -10.1215 -7.4347 -7.4341 -7.3148 -7.3132 -7.2549 -7.2520 -6.0914 -6.0895 -5.7891 -5.7882 -1.0199 -1.0198 -0.4390 -0.4373 -0.3868 -0.3856 0.9144 0.9164 1.3492 1.3497 2.0112 2.0116 2.8736 2.8747 3.3114 3.3147 3.7166 3.7172 4.0769 4.0770 5.2478 5.2504 5.5228 5.5242 5.7805 5.7820 6.0457 6.0493 6.1019 6.1024 6.3348 6.3374 6.7431 6.7435 7.1466 7.1467 12.5611 12.5618 12.5905 12.5907 12.8802 12.8819 14.0374 14.0381 15.0666 15.0707 k =-0.1000 0.0577 0.0000 ( 13876 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1149 -10.1149 -7.4441 -7.4435 -7.3197 -7.3181 -7.2544 -7.2513 -6.0842 -6.0820 -5.8027 -5.8017 -1.0398 -1.0396 -0.4112 -0.4093 -0.3593 -0.3580 0.9179 0.9202 1.3715 1.3721 1.9978 1.9982 2.8691 2.8705 3.2731 3.2767 3.7396 3.7402 4.0906 4.0907 5.2669 5.2699 5.4821 5.4837 5.7456 5.7472 6.0214 6.0251 6.1403 6.1409 6.3397 6.3423 6.7440 6.7444 7.1435 7.1436 12.5612 12.5621 12.6293 12.6294 12.9037 12.9055 14.0597 14.0605 15.0026 15.0071 k =-0.1143 0.0660 0.0000 ( 13864 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.1074 -10.1074 -7.4549 -7.4542 -7.3258 -7.3243 -7.2531 -7.2500 -6.0762 -6.0737 -5.8179 -5.8167 -1.0601 -1.0599 -0.3817 -0.3796 -0.3287 -0.3272 0.9228 0.9254 1.3967 1.3974 1.9826 1.9831 2.8642 2.8657 3.2324 3.2363 3.7635 3.7641 4.1060 4.1061 5.2792 5.2823 5.4523 5.4538 5.7027 5.7044 5.9978 6.0016 6.1764 6.1771 6.3449 6.3474 6.7449 6.7454 7.1400 7.1401 12.5634 12.5644 12.6728 12.6729 12.9297 12.9316 14.0834 14.0842 14.9347 14.9396 k =-0.1286 0.0742 0.0000 ( 13876 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0990 -10.0989 -7.4671 -7.4663 -7.3329 -7.3315 -7.2511 -7.2480 -6.0675 -6.0648 -5.8344 -5.8332 -1.0806 -1.0804 -0.3507 -0.3485 -0.2954 -0.2938 0.9295 0.9324 1.4248 1.4255 1.9657 1.9663 2.8588 2.8605 3.1896 3.1937 3.7883 3.7888 4.1229 4.1230 5.2755 5.2781 5.4428 5.4436 5.6517 5.6534 5.9753 5.9790 6.2100 6.2109 6.3502 6.3526 6.7458 6.7463 7.1360 7.1360 12.5680 12.5693 12.7205 12.7206 12.9582 12.9602 14.1078 14.1086 14.8644 14.8695 k =-0.1429 0.0825 0.0000 ( 13862 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0897 -10.0896 -7.4805 -7.4796 -7.3409 -7.3397 -7.2484 -7.2454 -6.0582 -6.0553 -5.8521 -5.8508 -1.1010 -1.1006 -0.3187 -0.3163 -0.2600 -0.2582 0.9384 0.9415 1.4555 1.4563 1.9474 1.9480 2.8531 2.8549 3.1450 3.1493 3.8139 3.8144 4.1411 4.1413 5.2527 5.2544 5.4559 5.4562 5.5931 5.5949 5.9537 5.9573 6.2411 6.2422 6.3556 6.3579 6.7467 6.7472 7.1316 7.1316 12.5755 12.5770 12.7721 12.7722 12.9890 12.9910 14.1324 14.1333 14.7929 14.7982 k =-0.1571 0.0907 0.0000 ( 13858 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0796 -10.0796 -7.4951 -7.4942 -7.3497 -7.3487 -7.2451 -7.2422 -6.0484 -6.0454 -5.8707 -5.8693 -1.1208 -1.1204 -0.2859 -0.2833 -0.2231 -0.2211 0.9499 0.9532 1.4887 1.4895 1.9277 1.9283 2.8471 2.8491 3.0988 3.1034 3.8404 3.8408 4.1605 4.1607 5.2183 5.2192 5.4831 5.4843 5.5278 5.5295 5.9327 5.9362 6.2697 6.2709 6.3613 6.3635 6.7474 6.7480 7.1267 7.1268 12.5860 12.5878 12.8269 12.8269 13.0219 13.0239 14.1567 14.1576 14.7214 14.7268 k =-0.1714 0.0989 0.0000 ( 13854 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0688 -10.0687 -7.5109 -7.5099 -7.3591 -7.3583 -7.2413 -7.2385 -6.0383 -6.0352 -5.8900 -5.8886 -1.1400 -1.1395 -0.2526 -0.2498 -0.1852 -0.1830 0.9643 0.9679 1.5242 1.5250 1.9067 1.9074 2.8408 2.8429 3.0514 3.0561 3.8675 3.8679 4.1808 4.1811 5.1790 5.1795 5.4563 5.4582 5.5184 5.5201 5.9119 5.9153 6.2956 6.2969 6.3671 6.3691 6.7480 6.7486 7.1215 7.1217 12.5996 12.6017 12.8844 12.8845 13.0569 13.0589 14.1804 14.1813 14.6508 14.6562 k =-0.1857 0.1072 0.0000 ( 13850 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0572 -10.0571 -7.5277 -7.5267 -7.3690 -7.3684 -7.2371 -7.2344 -6.0280 -6.0247 -5.9099 -5.9083 -1.1584 -1.1578 -0.2188 -0.2159 -0.1470 -0.1447 0.9822 0.9860 1.5618 1.5626 1.8848 1.8854 2.8343 2.8366 3.0028 3.0077 3.8953 3.8957 4.2019 4.2023 5.1382 5.1385 5.3799 5.3818 5.5578 5.5599 5.8909 5.8942 6.3190 6.3204 6.3731 6.3749 6.7483 6.7489 7.1159 7.1162 12.6165 12.6188 12.9442 12.9443 13.0938 13.0958 14.2030 14.2039 14.5819 14.5873 k =-0.2000 0.1154 0.0000 ( 13832 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0450 -10.0450 -7.5455 -7.5444 -7.3793 -7.3788 -7.2325 -7.2299 -6.0176 -6.0142 -5.9300 -5.9284 -1.1758 -1.1752 -0.1848 -0.1818 -0.1091 -0.1068 1.0040 1.0080 1.6013 1.6022 1.8620 1.8626 2.8277 2.8301 2.9535 2.9585 3.9236 3.9241 4.2235 4.2239 5.0975 5.0975 5.2991 5.3011 5.5998 5.6022 5.8693 5.8725 6.3398 6.3414 6.3793 6.3809 6.7483 6.7489 7.1102 7.1105 12.6366 12.6390 13.0057 13.0058 13.1325 13.1344 14.2244 14.2252 14.5156 14.5209 k =-0.2143 0.1237 0.0000 ( 13840 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0323 -10.0322 -7.5642 -7.5631 -7.3897 -7.3894 -7.2276 -7.2251 -6.0071 -6.0037 -5.9503 -5.9487 -1.1923 -1.1916 -0.1507 -0.1476 -0.0723 -0.0698 1.0300 1.0342 1.6426 1.6434 1.8385 1.8391 2.8210 2.8234 2.9036 2.9088 3.9525 3.9529 4.2453 4.2458 5.0573 5.0574 5.2148 5.2168 5.6434 5.6461 5.8470 5.8501 6.3583 6.3598 6.3856 6.3869 6.7479 6.7486 7.1042 7.1047 12.6597 12.6624 13.0685 13.0686 13.1727 13.1747 14.2444 14.2451 14.4523 14.4575 k =-0.2286 0.1319 0.0000 ( 13852 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0191 -10.0190 -7.5836 -7.5825 -7.4003 -7.4001 -7.2225 -7.2201 -5.9968 -5.9933 -5.9704 -5.9688 -1.2076 -1.2069 -0.1167 -0.1134 -0.0370 -0.0345 1.0606 1.0650 1.6854 1.6862 1.8146 1.8151 2.8142 2.8166 2.8533 2.8588 3.9816 3.9820 4.2670 4.2676 5.0183 5.0186 5.1278 5.1298 5.6878 5.6908 5.8237 5.8268 6.3744 6.3758 6.3921 6.3931 6.7471 6.7477 7.0982 7.0987 12.6858 12.6887 13.1319 13.1321 13.2144 13.2163 14.2629 14.2635 14.3928 14.3978 k =-0.2429 0.1402 0.0000 ( 13866 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -10.0054 -10.0054 -7.6037 -7.6026 -7.4108 -7.4107 -7.2172 -7.2150 -5.9904 -5.9888 -5.9866 -5.9831 -1.2218 -1.2211 -0.0828 -0.0795 -0.0039 -0.0014 1.0962 1.1006 1.7294 1.7302 1.7903 1.7908 2.8028 2.8048 2.8077 2.8136 4.0109 4.0114 4.2883 4.2891 4.9808 4.9811 5.0387 5.0409 5.7327 5.7358 5.7995 5.8024 6.3884 6.3892 6.3992 6.3994 6.7458 6.7464 7.0922 7.0928 12.7146 12.7177 13.1955 13.1958 13.2573 13.2591 14.2798 14.2802 14.3375 14.3420 k =-0.2571 0.1484 0.0000 ( 13862 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9915 -9.9914 -7.6243 -7.6231 -7.4213 -7.4213 -7.2119 -7.2097 -6.0098 -6.0082 -5.9767 -5.9732 -1.2349 -1.2341 -0.0493 -0.0459 0.0267 0.0292 1.1368 1.1412 1.7659 1.7665 1.7744 1.7752 2.7528 2.7575 2.8006 2.8040 4.0403 4.0408 4.3086 4.3095 4.9448 4.9449 4.9490 4.9509 5.7729 5.7760 5.7785 5.7820 6.3996 6.4000 6.4060 6.4074 6.7439 6.7445 7.0862 7.0869 12.7459 12.7492 13.2587 13.2593 13.3011 13.3029 14.2838 14.2907 14.2954 14.2982 k =-0.2714 0.1567 0.0000 ( 13874 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9773 -9.9773 -7.6452 -7.6440 -7.4316 -7.4316 -7.2064 -7.2043 -6.0288 -6.0272 -5.9671 -5.9637 -1.2468 -1.2460 -0.0163 -0.0128 0.0545 0.0569 1.1824 1.1869 1.7419 1.7422 1.8200 1.8207 2.7031 2.7079 2.7938 2.7971 4.0695 4.0700 4.3271 4.3283 4.8584 4.8611 4.9106 4.9111 5.7474 5.7503 5.8222 5.8259 6.4073 6.4089 6.4135 6.4164 6.7415 6.7420 7.0804 7.0811 12.7793 12.7827 13.3212 13.3219 13.3457 13.3473 14.2395 14.2443 14.3094 14.3104 k =-0.2857 0.1649 0.0000 ( 13876 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9631 -9.9630 -7.6662 -7.6651 -7.4417 -7.4416 -7.2009 -7.1989 -6.0470 -6.0455 -5.9580 -5.9546 -1.2575 -1.2567 0.0162 0.0197 0.0794 0.0817 1.2329 1.2374 1.7181 1.7184 1.8660 1.8667 2.6540 2.6589 2.7870 2.7904 4.0983 4.0989 4.3424 4.3439 4.7702 4.7732 4.8782 4.8787 5.7200 5.7229 5.8661 5.8698 6.4139 6.4157 6.4216 6.4249 6.7384 6.7389 7.0747 7.0755 12.8144 12.8180 13.3819 13.3831 13.3909 13.3922 14.1987 14.2030 14.3220 14.3228 k =-0.3000 0.1732 0.0000 ( 13878 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9489 -9.9488 -7.6872 -7.6862 -7.4514 -7.4513 -7.1955 -7.1936 -6.0645 -6.0630 -5.9492 -5.9459 -1.2671 -1.2663 0.0478 0.0514 0.1012 0.1035 1.2879 1.2924 1.6948 1.6951 1.9119 1.9126 2.6059 2.6107 2.7802 2.7836 4.1267 4.1273 4.3516 4.3536 4.6870 4.6905 4.8475 4.8482 5.6918 5.6945 5.9090 5.9128 6.4200 6.4217 6.4288 6.4324 6.7347 6.7352 7.0693 7.0701 12.8510 12.8547 13.4344 13.4365 13.4425 13.4431 14.1632 14.1671 14.3335 14.3341 k =-0.3143 0.1814 0.0000 ( 13878 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9348 -9.9347 -7.7080 -7.7070 -7.4607 -7.4605 -7.1902 -7.1884 -6.0810 -6.0796 -5.9410 -5.9378 -1.2756 -1.2748 0.0786 0.0822 0.1203 0.1224 1.3471 1.3516 1.6724 1.6725 1.9575 1.9580 2.5590 2.5637 2.7734 2.7769 4.1545 4.1551 4.3490 4.3515 4.6151 4.6191 4.8188 4.8195 5.6629 5.6655 5.9506 5.9545 6.4257 6.4274 6.4352 6.4388 6.7303 6.7308 7.0643 7.0651 12.8886 12.8923 13.4791 13.4808 13.4991 13.5001 14.1334 14.1368 14.3438 14.3443 k =-0.3286 0.1896 0.0000 ( 13874 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9210 -9.9209 -7.7284 -7.7275 -7.4695 -7.4693 -7.1850 -7.1833 -6.0966 -6.0952 -5.9333 -5.9303 -1.2830 -1.2823 0.1083 0.1118 0.1366 0.1385 1.4099 1.4143 1.6509 1.6509 2.0021 2.0026 2.5137 2.5182 2.7665 2.7702 4.1813 4.1820 4.3252 4.3277 4.5648 4.5689 4.7919 4.7926 5.6336 5.6361 5.9906 5.9947 6.4312 6.4327 6.4406 6.4444 6.7254 6.7259 7.0595 7.0603 12.9268 12.9306 13.5225 13.5240 13.5530 13.5545 14.1093 14.1122 14.3533 14.3536 k =-0.3429 0.1979 0.0000 ( 13882 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.9076 -9.9075 -7.7482 -7.7473 -7.4778 -7.4776 -7.1800 -7.1785 -6.1111 -6.1098 -5.9262 -5.9233 -1.2895 -1.2887 0.1366 0.1401 0.1504 0.1522 1.4755 1.4799 1.6305 1.6306 2.0454 2.0458 2.4701 2.4745 2.7596 2.7634 4.2071 4.2077 4.2752 4.2771 4.5419 4.5454 4.7670 4.7677 5.6042 5.6066 6.0287 6.0329 6.4363 6.4377 6.4453 6.4492 6.7199 6.7203 7.0552 7.0560 12.9652 12.9689 13.5641 13.5655 13.6037 13.6054 14.0912 14.0934 14.3622 14.3625 k =-0.3571 0.2061 0.0000 ( 13880 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.8947 -9.8946 -7.7672 -7.7664 -7.4855 -7.4853 -7.1753 -7.1739 -6.1245 -6.1233 -5.9196 -5.9169 -1.2950 -1.2943 0.1620 0.1633 0.1639 0.1669 1.5432 1.5476 1.6114 1.6118 2.0868 2.0872 2.4288 2.4328 2.7526 2.7565 4.2062 4.2080 4.2317 4.2328 4.5384 4.5413 4.7439 4.7447 5.5750 5.5773 6.0648 6.0690 6.4411 6.4424 6.4495 6.4535 6.7139 6.7143 7.0513 7.0520 13.0033 13.0070 13.6034 13.6047 13.6505 13.6526 14.0788 14.0803 14.3710 14.3711 k =-0.3714 0.2144 0.0000 ( 13876 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8825 -9.8824 -7.7852 -7.7844 -7.4926 -7.4924 -7.1708 -7.1695 -6.1367 -6.1356 -5.9136 -5.9111 -1.2997 -1.2990 0.1717 0.1732 0.1888 0.1920 1.5926 1.5937 1.6140 1.6168 2.1259 2.1262 2.3899 2.3937 2.7454 2.7494 4.1303 4.1311 4.2549 4.2557 4.5444 4.5467 4.7228 4.7236 5.5465 5.5487 6.0984 6.1026 6.4456 6.4467 6.4534 6.4574 6.7074 6.7078 7.0477 7.0485 13.0408 13.0444 13.6395 13.6407 13.6932 13.6957 14.0719 14.0728 14.3801 14.3801 k =-0.3857 0.2226 0.0000 ( 13884 PWs) bands (ev): -35.7722 -35.7722 -35.7616 -35.7616 -9.8711 -9.8710 -7.8020 -7.8012 -7.4991 -7.4989 -7.1667 -7.1655 -6.1477 -6.1467 -5.9083 -5.9060 -1.3036 -1.3030 0.1797 0.1810 0.2121 0.2151 1.5778 1.5778 1.6826 1.6862 2.1619 2.1621 2.3538 2.3572 2.7381 2.7421 4.0525 4.0529 4.2764 4.2773 4.5542 4.5561 4.7036 4.7044 5.5191 5.5211 6.1294 6.1335 6.4497 6.4507 6.4571 6.4611 6.7006 6.7010 7.0447 7.0453 13.0770 13.0805 13.6718 13.6728 13.7317 13.7346 14.0698 14.0700 14.3900 14.3902 k =-0.4000 0.2309 0.0000 ( 13876 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8606 -9.8606 -7.8173 -7.8166 -7.5048 -7.5047 -7.1629 -7.1619 -6.1575 -6.1566 -5.9035 -5.9015 -1.3068 -1.3062 0.1862 0.1873 0.2334 0.2362 1.5636 1.5637 1.7513 1.7549 2.1943 2.1944 2.3208 2.3240 2.7307 2.7346 3.9768 3.9770 4.2962 4.2970 4.5653 4.5668 4.6864 4.6872 5.4932 5.4950 6.1574 6.1614 6.4534 6.4543 6.4606 6.4646 6.6936 6.6940 7.0420 7.0426 13.1116 13.1148 13.6995 13.7004 13.7663 13.7695 14.0711 14.0715 14.4012 14.4017 k =-0.4143 0.2391 0.0000 ( 13874 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8513 -9.8512 -7.8310 -7.8304 -7.5099 -7.5097 -7.1596 -7.1587 -6.1660 -6.1652 -5.8994 -5.8976 -1.3094 -1.3089 0.1914 0.1924 0.2524 0.2548 1.5513 1.5514 1.8182 1.8216 2.2224 2.2225 2.2914 2.2941 2.7231 2.7270 3.9056 3.9056 4.3140 4.3148 4.5762 4.5775 4.6712 4.6719 5.4694 5.4710 6.1822 6.1860 6.4567 6.4574 6.4642 6.4680 6.6866 6.6870 7.0397 7.0402 13.1439 13.1468 13.7222 13.7230 13.7974 13.8007 14.0745 14.0755 14.4012 14.4033 k =-0.4286 0.2474 0.0000 ( 13876 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8431 -9.8431 -7.8429 -7.8424 -7.5142 -7.5140 -7.1567 -7.1559 -6.1732 -6.1726 -5.8959 -5.8944 -1.3114 -1.3110 0.1956 0.1963 0.2688 0.2710 1.5408 1.5409 1.8816 1.8848 2.2455 2.2458 2.2661 2.2681 2.7155 2.7192 3.8407 3.8409 4.3296 4.3303 4.5864 4.5874 4.6580 4.6587 5.4482 5.4496 6.2035 6.2070 6.4596 6.4602 6.4679 6.4714 6.6798 6.6802 7.0378 7.0383 13.1733 13.1759 13.7398 13.7403 13.8255 13.8289 14.0783 14.0798 14.3578 14.3586 k =-0.4429 0.2556 0.0000 ( 13872 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8363 -9.8362 -7.8529 -7.8525 -7.5177 -7.5176 -7.1543 -7.1536 -6.1791 -6.1786 -5.8930 -5.8918 -1.3129 -1.3126 0.1988 0.1994 0.2827 0.2844 1.5322 1.5324 1.9398 1.9426 2.2439 2.2462 2.2638 2.2641 2.7082 2.7115 3.7843 3.7845 4.3429 4.3435 4.5953 4.5961 4.6471 4.6476 5.4300 5.4312 6.2212 6.2242 6.4620 6.4625 6.4715 6.4746 6.6735 6.6738 7.0363 7.0367 13.1989 13.2011 13.7524 13.7528 13.8512 13.8545 14.0805 14.0823 14.3202 14.3209 k =-0.4571 0.2639 0.0000 ( 13868 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8308 -9.8308 -7.8608 -7.8605 -7.5205 -7.5204 -7.1523 -7.1519 -6.1837 -6.1833 -5.8907 -5.8898 -1.3141 -1.3138 0.2012 0.2016 0.2936 0.2950 1.5256 1.5257 1.9904 1.9927 2.2272 2.2288 2.2762 2.2763 2.7017 2.7045 3.7381 3.7383 4.3535 4.3540 4.6025 4.6031 4.6383 4.6388 5.4154 5.4162 6.2352 6.2376 6.4640 6.4644 6.4749 6.4774 6.6680 6.6683 7.0352 7.0355 13.2202 13.2219 13.7608 13.7611 13.8745 13.8775 14.0795 14.0814 14.2909 14.2915 k =-0.4714 0.2721 0.0000 ( 13872 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8269 -9.8269 -7.8665 -7.8663 -7.5225 -7.5224 -7.1509 -7.1506 -6.1870 -6.1867 -5.8890 -5.8884 -1.3148 -1.3147 0.2028 0.2031 0.3017 0.3026 1.5209 1.5210 2.0306 2.0323 2.2150 2.2161 2.2835 2.2836 2.6965 2.6985 3.7037 3.7039 4.3613 4.3617 4.6079 4.6083 4.6320 4.6323 5.4047 5.4052 6.2454 6.2470 6.4654 6.4656 6.4779 6.4797 6.6637 6.6640 7.0344 7.0346 13.2362 13.2374 13.7659 13.7660 13.8944 13.8967 14.0752 14.0769 14.2708 14.2713 k =-0.4857 0.2803 0.0000 ( 13886 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8245 -9.8245 -7.8699 -7.8698 -7.5237 -7.5237 -7.1500 -7.1499 -6.1889 -6.1888 -5.8880 -5.8877 -1.3153 -1.3152 0.2038 0.2040 0.3066 0.3071 1.5181 1.5182 2.0570 2.0580 2.2077 2.2083 2.2869 2.2869 2.6933 2.6943 3.6825 3.6826 4.3662 4.3663 4.6112 4.6114 4.6282 4.6284 5.3981 5.3984 6.2516 6.2525 6.4663 6.4664 6.4801 6.4810 6.6610 6.6611 7.0340 7.0341 13.2462 13.2468 13.7685 13.7685 13.9088 13.9102 14.0700 14.0710 14.2596 14.2599 k =-0.5000 0.2886 0.0000 ( 13880 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8237 -9.8237 -7.8710 -7.8710 -7.5241 -7.5241 -7.1497 -7.1497 -6.1895 -6.1895 -5.8875 -5.8875 -1.3154 -1.3154 0.2042 0.2042 0.3084 0.3084 1.5172 1.5172 2.0666 2.0666 2.2055 2.2055 2.2877 2.2877 2.6925 2.6925 3.6753 3.6753 4.3678 4.3678 4.6124 4.6124 4.6270 4.6270 5.3960 5.3960 6.2540 6.2540 6.4666 6.4666 6.4811 6.4811 6.6601 6.6601 7.0339 7.0339 13.2498 13.2498 13.7692 13.7692 13.9147 13.9147 14.0680 14.0680 14.2562 14.2562 k =-0.5000 0.2886 0.0000 ( 13880 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8237 -9.8237 -7.8710 -7.8710 -7.5241 -7.5241 -7.1497 -7.1497 -6.1895 -6.1895 -5.8875 -5.8875 -1.3154 -1.3154 0.2042 0.2042 0.3084 0.3084 1.5172 1.5172 2.0666 2.0666 2.2055 2.2055 2.2877 2.2877 2.6925 2.6925 3.6753 3.6753 4.3678 4.3678 4.6124 4.6124 4.6270 4.6270 5.3960 5.3960 6.2540 6.2540 6.4666 6.4666 6.4811 6.4811 6.6601 6.6601 7.0339 7.0339 13.2498 13.2498 13.7692 13.7692 13.9147 13.9147 14.0680 14.0680 14.2562 14.2562 k =-0.4917 0.3030-0.0000 ( 13876 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8228 -9.8227 -7.8788 -7.8781 -7.5182 -7.5175 -7.1493 -7.1491 -6.1908 -6.1904 -5.8869 -5.8866 -1.3148 -1.3147 0.1976 0.1976 0.3182 0.3188 1.5097 1.5115 2.0712 2.0732 2.1652 2.1676 2.3243 2.3263 2.6920 2.6920 3.6764 3.6764 4.3620 4.3649 4.6133 4.6167 4.6265 4.6268 5.3973 5.3977 6.2550 6.2552 6.4592 6.4633 6.4826 6.4870 6.6600 6.6604 7.0332 7.0334 13.2389 13.2405 13.7677 13.7687 13.9252 13.9270 14.0694 14.0706 14.2285 14.2335 k =-0.4833 0.3175-0.0000 ( 13872 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8200 -9.8200 -7.8999 -7.8988 -7.5014 -7.5000 -7.1480 -7.1475 -6.1942 -6.1934 -5.8847 -5.8842 -1.3130 -1.3128 0.1830 0.1830 0.3431 0.3442 1.4900 1.4935 2.0860 2.0899 2.1009 2.1037 2.3839 2.3860 2.6907 2.6908 3.6795 3.6796 4.3482 4.3535 4.6190 4.6245 4.6260 4.6261 5.4015 5.4023 6.2580 6.2584 6.4479 6.4527 6.4879 6.4931 6.6601 6.6608 7.0315 7.0320 13.2099 13.2128 13.7642 13.7660 13.9564 13.9596 14.0749 14.0773 14.1714 14.1787 k =-0.4750 0.3319-0.0000 ( 13880 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8154 -9.8153 -7.9313 -7.9299 -7.4765 -7.4746 -7.1458 -7.1451 -6.1996 -6.1984 -5.8811 -5.8804 -1.3101 -1.3097 0.1668 0.1670 0.3766 0.3780 1.4601 1.4648 2.0320 2.0350 2.1102 2.1155 2.4434 2.4453 2.6897 2.6898 3.6848 3.6848 4.3278 4.3348 4.6233 4.6241 4.6289 4.6372 5.4086 5.4098 6.2629 6.2636 6.4347 6.4395 6.4924 6.4977 6.6605 6.6615 7.0288 7.0295 13.1679 13.1718 13.7588 13.7614 14.0029 14.0066 14.0842 14.0876 14.1056 14.1143 k =-0.4667 0.3464-0.0000 ( 13872 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8089 -9.8088 -7.9699 -7.9683 -7.4466 -7.4445 -7.1426 -7.1417 -6.2069 -6.2054 -5.8762 -5.8753 -1.3059 -1.3054 0.1521 0.1526 0.4153 0.4171 1.4224 1.4280 1.9622 1.9654 2.1404 2.1468 2.4975 2.4990 2.6916 2.6916 3.6920 3.6921 4.3022 4.3104 4.6210 4.6222 4.6405 4.6506 5.4185 5.4200 6.2696 6.2705 6.4197 6.4245 6.4951 6.5006 6.6610 6.6624 7.0251 7.0261 13.1183 13.1227 13.7518 13.7550 14.0296 14.0339 14.0677 14.0770 14.0979 14.1022 k =-0.4583 0.3608-0.0000 ( 13870 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8005 -9.8005 -8.0136 -8.0119 -7.4140 -7.4116 -7.1385 -7.1374 -6.2159 -6.2141 -5.8703 -5.8692 -1.3005 -1.3000 0.1401 0.1409 0.4580 0.4602 1.3789 1.3851 1.8919 1.8953 2.1751 2.1823 2.5398 2.5408 2.7017 2.7018 3.7013 3.7014 4.2726 4.2815 4.6185 4.6199 4.6534 4.6646 5.4310 5.4329 6.2778 6.2788 6.4033 6.4079 6.4959 6.5014 6.6620 6.6638 7.0206 7.0219 13.0652 13.0698 13.7434 13.7470 13.9654 13.9727 14.1144 14.1196 14.1285 14.1355 k =-0.4500 0.3752-0.0000 ( 13862 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7904 -9.7903 -8.0608 -8.0591 -7.3800 -7.3774 -7.1335 -7.1322 -6.2265 -6.2244 -5.8634 -5.8622 -1.2941 -1.2934 0.1314 0.1324 0.5038 0.5063 1.3314 1.3379 1.8216 1.8251 2.2127 2.2206 2.5628 2.5632 2.7269 2.7274 3.7125 3.7126 4.2397 4.2490 4.6159 4.6175 4.6664 4.6784 5.4461 5.4482 6.2870 6.2883 6.3854 6.3898 6.4947 6.5002 6.6633 6.6655 7.0153 7.0169 13.0115 13.0163 13.7339 13.7377 13.8996 13.9074 14.1349 14.1405 14.1960 14.2030 k =-0.4416 0.3897-0.0000 ( 13866 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7784 -9.7783 -8.1106 -8.1089 -7.3455 -7.3427 -7.1276 -7.1261 -6.2384 -6.2361 -5.8558 -5.8545 -1.2865 -1.2857 0.1262 0.1274 0.5522 0.5550 1.2813 1.2879 1.7514 1.7552 2.2522 2.2605 2.5663 2.5664 2.7673 2.7680 3.7255 3.7257 4.2042 4.2136 4.6135 4.6153 4.6790 4.6916 5.4635 5.4658 6.2969 6.2984 6.3661 6.3704 6.4913 6.4969 6.6652 6.6679 7.0095 7.0115 12.9595 12.9642 13.7234 13.7274 13.8361 13.8440 14.1585 14.1646 14.2653 14.2724 k =-0.4333 0.4041-0.0000 ( 13860 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7645 -9.7644 -8.1625 -8.1608 -7.3110 -7.3081 -7.1209 -7.1191 -6.2515 -6.2491 -5.8477 -5.8463 -1.2778 -1.2770 0.1246 0.1261 0.6023 0.6057 1.2297 1.2363 1.6818 1.6857 2.2927 2.3013 2.5568 2.5572 2.8158 2.8165 3.7404 3.7405 4.1665 4.1758 4.6115 4.6135 4.6908 4.7038 5.4831 5.4856 6.3069 6.3087 6.3455 6.3497 6.4858 6.4914 6.6676 6.6709 7.0033 7.0057 12.9107 12.9153 13.7120 13.7161 13.7756 13.7836 14.1851 14.1916 14.3347 14.3419 k =-0.4250 0.4186-0.0000 ( 13870 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7489 -9.7488 -8.2159 -8.2142 -7.2769 -7.2740 -7.1133 -7.1113 -6.2657 -6.2631 -5.8393 -5.8379 -1.2682 -1.2673 0.1265 0.1282 0.6536 0.6574 1.1780 1.1845 1.6129 1.6170 2.3338 2.3426 2.5398 2.5404 2.8669 2.8676 3.7568 3.7570 4.1267 4.1359 4.6103 4.6124 4.7016 4.7149 5.5046 5.5072 6.3162 6.3185 6.3238 6.3281 6.4782 6.4837 6.6707 6.6746 6.9970 6.9999 12.8662 12.8707 13.7000 13.7039 13.7186 13.7264 14.2147 14.2214 14.4032 14.4104 k =-0.4166 0.4330-0.0000 ( 13862 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7314 -9.7313 -8.2705 -8.2689 -7.2435 -7.2405 -7.1050 -7.1027 -6.2808 -6.2782 -5.8306 -5.8292 -1.2576 -1.2566 0.1320 0.1339 0.7044 0.7089 1.1280 1.1341 1.5450 1.5492 2.3750 2.3841 2.5177 2.5185 2.9181 2.9186 3.7748 3.7750 4.0853 4.0943 4.6102 4.6123 4.7112 4.7247 5.5278 5.5305 6.3006 6.3038 6.3261 6.3277 6.4684 6.4738 6.6745 6.6790 6.9910 6.9944 12.8270 12.8313 13.6643 13.6724 13.6879 13.6919 14.2472 14.2541 14.4700 14.4772 k =-0.4083 0.4475-0.0000 ( 13864 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.7122 -9.7120 -8.3260 -8.3244 -7.2109 -7.2077 -7.0958 -7.0934 -6.2968 -6.2941 -5.8219 -5.8205 -1.2462 -1.2450 0.1407 0.1428 0.7519 0.7574 1.0828 1.0882 1.4782 1.4825 2.4162 2.4255 2.4916 2.4926 2.9677 2.9682 3.7943 3.7945 4.0425 4.0512 4.6114 4.6135 4.7195 4.7332 5.5524 5.5552 6.2765 6.2796 6.3335 6.3355 6.4564 6.4618 6.6787 6.6840 6.9857 6.9897 12.7937 12.7978 13.6143 13.6224 13.6750 13.6789 14.2824 14.2894 14.5349 14.5419 k =-0.4000 0.4619-0.0000 ( 13862 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.6911 -9.6910 -8.3823 -8.3808 -7.1792 -7.1759 -7.0859 -7.0833 -6.3134 -6.3106 -5.8133 -5.8119 -1.2340 -1.2327 0.1524 0.1548 0.7897 0.7966 1.0491 1.0533 1.4127 1.4173 2.4561 2.4612 2.4643 2.4674 3.0150 3.0154 3.8151 3.8152 3.9984 4.0069 4.6142 4.6163 4.7264 4.7402 5.5783 5.5811 6.2514 6.2543 6.3394 6.3415 6.4423 6.4476 6.6831 6.6891 6.9816 6.9862 12.7669 12.7708 13.5679 13.5759 13.6619 13.6657 14.3202 14.3272 14.5975 14.6044 k =-0.3916 0.4763-0.0000 ( 13856 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.6683 -9.6681 -8.4391 -8.4376 -7.1485 -7.1452 -7.0754 -7.0725 -6.3306 -6.3278 -5.8048 -5.8034 -1.2211 -1.2197 0.1669 0.1694 0.8062 0.8147 1.0389 1.0417 1.3489 1.3535 2.4290 2.4301 2.4986 2.5079 3.0593 3.0596 3.8371 3.8373 3.9536 3.9618 4.6189 4.6209 4.7318 4.7457 5.6051 5.6078 6.2254 6.2280 6.3434 6.3456 6.4263 6.4314 6.6873 6.6941 6.9793 6.9845 12.7471 12.7507 13.5252 13.5330 13.6488 13.6525 14.3603 14.3673 14.6252 14.6256 k =-0.3833 0.4908-0.0000 ( 13852 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.6438 -9.6436 -8.4962 -8.4948 -7.1189 -7.1154 -7.0642 -7.0611 -6.3482 -6.3454 -5.7965 -5.7951 -1.2075 -1.2061 0.1834 0.1862 0.7939 0.8033 1.0599 1.0621 1.2868 1.2916 2.3932 2.3945 2.5393 2.5487 3.0998 3.1000 3.8602 3.8604 3.9083 3.9163 4.6256 4.6276 4.7358 4.7497 5.6325 5.6352 6.1986 6.2009 6.3453 6.3476 6.4083 6.4134 6.6906 6.6981 6.9794 6.9852 12.7345 12.7378 13.4861 13.4938 13.6358 13.6392 14.4023 14.4094 14.5851 14.5857 k =-0.3750 0.5052-0.0000 ( 13860 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.6175 -9.6173 -8.5536 -8.5523 -7.0904 -7.0868 -7.0524 -7.0491 -6.3660 -6.3633 -5.7885 -5.7872 -1.1936 -1.1920 0.2013 0.2043 0.7618 0.7712 1.1039 1.1062 1.2268 1.2317 2.3545 2.3561 2.5799 2.5893 3.1357 3.1359 3.8630 3.8704 3.8848 3.8850 4.6347 4.6366 4.7381 4.7521 5.6602 5.6629 6.1712 6.1733 6.3451 6.3475 6.3887 6.3935 6.6924 6.7006 6.9824 6.9887 12.7294 12.7324 13.4505 13.4580 13.6229 13.6262 14.4452 14.4520 14.5453 14.5463 k =-0.3666 0.5197-0.0000 ( 13858 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -9.5895 -9.5892 -8.6111 -8.6099 -7.0632 -7.0595 -7.0400 -7.0365 -6.3840 -6.3814 -5.7809 -5.7797 -1.1792 -1.1776 0.2195 0.2226 0.7220 0.7311 1.1585 1.1623 1.1701 1.1741 2.3132 2.3149 2.6203 2.6298 3.1660 3.1663 3.8191 3.8265 3.9099 3.9100 4.6462 4.6480 4.7389 4.7529 5.6880 5.6905 6.1434 6.1452 6.3431 6.3454 6.3674 6.3721 6.6923 6.7010 6.9886 6.9954 12.7319 12.7346 13.4182 13.4256 13.6104 13.6135 14.4774 14.4814 14.5172 14.5211 k =-0.3583 0.5341-0.0000 ( 13864 PWs) bands (ev): -35.7721 -35.7721 -35.7617 -35.7617 -9.5598 -9.5595 -8.6686 -8.6674 -7.0373 -7.0334 -7.0272 -7.0235 -6.4020 -6.3995 -5.7737 -5.7725 -1.1646 -1.1630 0.2362 0.2394 0.6817 0.6906 1.1135 1.1189 1.2216 1.2244 2.2693 2.2712 2.6606 2.6701 3.1895 3.1897 3.7773 3.7847 3.9362 3.9363 4.6602 4.6620 4.7378 4.7518 5.7154 5.7177 6.1154 6.1168 6.3393 6.3416 6.3449 6.3495 6.6899 6.6989 6.9982 7.0052 12.7421 12.7446 13.3893 13.3964 13.5983 13.6012 14.4521 14.4534 14.5474 14.5540 k =-0.3500 0.5485-0.0000 ( 13846 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.5285 -9.5281 -8.7259 -8.7248 -7.0140 -7.0128 -7.0100 -7.0088 -6.4196 -6.4173 -5.7669 -5.7658 -1.1500 -1.1482 0.2489 0.2523 0.6457 0.6543 1.0609 1.0664 1.2866 1.2898 2.2229 2.2250 2.7009 2.7104 3.2043 3.2047 3.7395 3.7467 3.9636 3.9638 4.6769 4.6785 4.7348 4.7489 5.7420 5.7441 6.0873 6.0884 6.3211 6.3253 6.3345 6.3368 6.6852 6.6944 7.0108 7.0180 12.7600 12.7622 13.3633 13.3703 13.5869 13.5897 14.4119 14.4132 14.5928 14.5995 k =-0.3416 0.5630-0.0000 ( 13842 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4954 -9.4951 -8.7830 -8.7819 -7.0003 -6.9962 -6.9900 -6.9858 -6.4367 -6.4345 -5.7607 -5.7596 -1.1354 -1.1336 0.2541 0.2579 0.6184 0.6267 1.0112 1.0168 1.3538 1.3573 2.1742 2.1764 2.7412 2.7507 3.2086 3.2091 3.7074 3.7146 3.9922 3.9924 4.6962 4.6977 4.7298 4.7439 5.7673 5.7693 6.0594 6.0602 6.2966 6.3006 6.3288 6.3309 6.6782 6.6874 7.0259 7.0331 12.7856 12.7875 13.3402 13.3469 13.5763 13.5789 14.3707 14.3722 14.6384 14.6447 k =-0.3333 0.5774-0.0000 ( 13852 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4608 -9.4604 -8.8397 -8.8387 -6.9864 -6.9822 -6.9690 -6.9647 -6.4529 -6.4510 -5.7549 -5.7538 -1.1211 -1.1192 0.2485 0.2527 0.6036 0.6115 0.9647 0.9704 1.4224 1.4262 2.1233 2.1256 2.7815 2.7910 3.2007 3.2014 3.6829 3.6900 4.0220 4.0223 4.7180 4.7195 4.7226 4.7367 5.7909 5.7926 6.0319 6.0324 6.2715 6.2753 6.3228 6.3246 6.6694 6.6785 7.0429 7.0500 12.8187 12.8204 13.3196 13.3261 13.5667 13.5691 14.3299 14.3315 14.6809 14.6868 k =-0.3333 0.5774-0.0000 ( 13852 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4608 -9.4604 -8.8397 -8.8387 -6.9864 -6.9822 -6.9690 -6.9647 -6.4529 -6.4510 -5.7549 -5.7538 -1.1211 -1.1192 0.2485 0.2527 0.6036 0.6115 0.9647 0.9704 1.4224 1.4262 2.1233 2.1256 2.7815 2.7910 3.2007 3.2014 3.6829 3.6900 4.0220 4.0223 4.7180 4.7195 4.7226 4.7367 5.7909 5.7926 6.0319 6.0324 6.2715 6.2753 6.3228 6.3246 6.6694 6.6785 7.0429 7.0500 12.8187 12.8204 13.3196 13.3261 13.5667 13.5691 14.3299 14.3315 14.6809 14.6868 k =-0.3333 0.5774 0.0168 ( 13855 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4598 -9.4594 -8.8389 -8.8379 -6.9886 -6.9844 -6.9703 -6.9659 -6.4528 -6.4508 -5.7553 -5.7543 -1.1190 -1.1171 0.2391 0.2432 0.6162 0.6240 0.9671 0.9728 1.4190 1.4227 2.1204 2.1227 2.7833 2.7927 3.2014 3.2020 3.6838 3.6909 4.0221 4.0224 4.7177 4.7191 4.7216 4.7357 5.7917 5.7934 6.0315 6.0320 6.2706 6.2744 6.3240 6.3259 6.6697 6.6788 7.0431 7.0503 12.8159 12.8176 13.3185 13.3250 13.5624 13.5648 14.3227 14.3243 14.6795 14.6853 k =-0.3333 0.5774 0.0336 ( 13851 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4569 -9.4565 -8.8363 -8.8353 -6.9953 -6.9911 -6.9739 -6.9695 -6.4522 -6.4503 -5.7566 -5.7556 -1.1128 -1.1110 0.2141 0.2183 0.6503 0.6581 0.9743 0.9801 1.4088 1.4125 2.1119 2.1141 2.7887 2.7980 3.2033 3.2039 3.6864 3.6935 4.0222 4.0225 4.7168 4.7178 4.7191 4.7328 5.7942 5.7958 6.0301 6.0306 6.2678 6.2716 6.3278 6.3296 6.6704 6.6795 7.0439 7.0509 12.8077 12.8093 13.3156 13.3222 13.5497 13.5520 14.3017 14.3032 14.6759 14.6817 k =-0.3333 0.5774 0.0505 ( 13869 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.4519 -9.4516 -8.8321 -8.8311 -7.0064 -7.0022 -6.9800 -6.9756 -6.4513 -6.4494 -5.7588 -5.7578 -1.1026 -1.1008 0.1799 0.1842 0.6997 0.7073 0.9864 0.9922 1.3923 1.3957 2.0977 2.0999 2.7973 2.8063 3.2064 3.2070 3.6906 3.6977 4.0224 4.0226 4.7136 4.7154 4.7172 4.7279 5.7983 5.7998 6.0278 6.0283 6.2632 6.2670 6.3339 6.3357 6.6716 6.6805 7.0452 7.0522 12.7940 12.7955 13.3117 13.3183 13.5289 13.5311 14.2688 14.2703 14.6714 14.6771 k =-0.3333 0.5774 0.0673 ( 13875 PWs) bands (ev): -35.7719 -35.7719 -35.7618 -35.7618 -9.4450 -9.4447 -8.8261 -8.8251 -7.0218 -7.0177 -6.9886 -6.9842 -6.4499 -6.4480 -5.7619 -5.7609 -1.0883 -1.0866 0.1416 0.1459 0.7589 0.7666 1.0032 1.0090 1.3699 1.3731 2.0782 2.0803 2.8086 2.8174 3.2108 3.2113 3.6964 3.7034 4.0224 4.0227 4.7069 4.7137 4.7155 4.7212 5.8039 5.8053 6.0246 6.0250 6.2568 6.2606 6.3423 6.3440 6.6731 6.6819 7.0470 7.0540 12.7750 12.7765 13.3077 13.3144 13.5004 13.5024 14.2268 14.2282 14.6671 14.6726 k =-0.3333 0.5774 0.0841 ( 13870 PWs) bands (ev): -35.7719 -35.7719 -35.7618 -35.7618 -9.4362 -9.4358 -8.8185 -8.8175 -7.0414 -7.0373 -6.9996 -6.9953 -6.4480 -6.4462 -5.7658 -5.7648 -1.0702 -1.0686 0.1023 0.1065 0.8248 0.8325 1.0248 1.0306 1.3424 1.3454 2.0536 2.0556 2.8222 2.8305 3.2165 3.2169 3.7035 3.7104 4.0223 4.0226 4.6981 4.7099 4.7141 4.7145 5.8110 5.8123 6.0202 6.0207 6.2488 6.2525 6.3527 6.3543 6.6747 6.6833 7.0496 7.0564 12.7513 12.7526 13.3046 13.3114 13.4649 13.4666 14.1786 14.1800 14.6633 14.6684 k =-0.3333 0.5774 0.1009 ( 13901 PWs) bands (ev): -35.7718 -35.7718 -35.7619 -35.7619 -9.4253 -9.4250 -8.8092 -8.8082 -7.0650 -7.0610 -7.0131 -7.0088 -6.4456 -6.4438 -5.7706 -5.7696 -1.0484 -1.0469 0.0637 0.0677 0.8951 0.9028 1.0509 1.0568 1.3108 1.3135 2.0243 2.0262 2.8373 2.8453 3.2234 3.2237 3.7117 3.7186 4.0218 4.0222 4.6871 4.6998 4.7125 4.7131 5.8195 5.8207 6.0146 6.0151 6.2390 6.2427 6.3648 6.3663 6.6764 6.6847 7.0530 7.0596 12.7235 12.7245 13.3033 13.3101 13.4230 13.4246 14.1269 14.1282 14.6595 14.6643 k =-0.3333 0.5774 0.1178 ( 13903 PWs) bands (ev): -35.7718 -35.7718 -35.7620 -35.7620 -9.4125 -9.4122 -8.7982 -8.7973 -7.0925 -7.0886 -7.0290 -7.0247 -6.4425 -6.4409 -5.7762 -5.7752 -1.0231 -1.0217 0.0267 0.0306 0.9676 0.9754 1.0815 1.0875 1.2768 1.2792 1.9908 1.9925 2.8534 2.8609 3.2315 3.2317 3.7208 3.7276 4.0208 4.0212 4.6741 4.6866 4.7123 4.7129 5.8293 5.8303 6.0077 6.0082 6.2277 6.2313 6.3783 6.3797 6.6779 6.6859 7.0573 7.0637 12.6926 12.6933 13.3042 13.3111 13.3759 13.3772 14.0737 14.0751 14.6553 14.6597 k =-0.3333 0.5774 0.1346 ( 13877 PWs) bands (ev): -35.7717 -35.7717 -35.7621 -35.7621 -9.3978 -9.3975 -8.7855 -8.7846 -7.1237 -7.1198 -7.0474 -7.0432 -6.4389 -6.4373 -5.7826 -5.7817 -0.9944 -0.9932 -0.0081 -0.0043 1.0383 1.0460 1.1164 1.1224 1.2443 1.2466 1.9536 1.9551 2.8699 2.8769 3.2408 3.2409 3.7306 3.7373 4.0191 4.0196 4.6588 4.6709 4.7134 4.7139 5.8403 5.8412 5.9994 5.9999 6.2149 6.2185 6.3929 6.3942 6.6791 6.6867 7.0625 7.0686 12.6595 12.6599 13.3074 13.3144 13.3248 13.3259 14.0207 14.0221 14.6498 14.6538 k =-0.3333 0.5774 0.1514 ( 13875 PWs) bands (ev): -35.7716 -35.7716 -35.7621 -35.7621 -9.3812 -9.3809 -8.7713 -8.7704 -7.1583 -7.1546 -7.0682 -7.0640 -6.4345 -6.4330 -5.7898 -5.7889 -0.9626 -0.9615 -0.0403 -0.0367 1.0923 1.0986 1.1551 1.1612 1.2284 1.2317 1.9132 1.9146 2.8863 2.8928 3.2512 3.2512 3.7409 3.7474 4.0166 4.0171 4.6411 4.6529 4.7160 4.7164 5.8524 5.8532 5.9896 5.9901 6.2008 6.2042 6.4084 6.4095 6.6798 6.6869 7.0687 7.0745 12.6255 12.6256 13.2701 13.2707 13.3137 13.3205 13.9689 13.9703 14.6423 14.6458 k =-0.3333 0.5774 0.1682 ( 13863 PWs) bands (ev): -35.7714 -35.7714 -35.7622 -35.7622 -9.3626 -9.3623 -8.7553 -8.7545 -7.1962 -7.1926 -7.0913 -7.0872 -6.4294 -6.4280 -5.7979 -5.7970 -0.9278 -0.9270 -0.0697 -0.0663 1.0953 1.0989 1.1973 1.2035 1.2632 1.2691 1.8706 1.8718 2.9022 2.9082 3.2627 3.2628 3.7513 3.7578 4.0132 4.0137 4.6211 4.6324 4.7201 4.7204 5.8655 5.8662 5.9783 5.9787 6.1853 6.1887 6.4242 6.4251 6.6801 6.6866 7.0759 7.0814 12.5915 12.5918 13.2138 13.2142 13.3217 13.3285 13.9190 13.9203 14.6320 14.6349 k =-0.3333 0.5774 0.1851 ( 13854 PWs) bands (ev): -35.7713 -35.7713 -35.7624 -35.7624 -9.3421 -9.3419 -8.7378 -8.7370 -7.2371 -7.2336 -7.1168 -7.1127 -6.4235 -6.4222 -5.8067 -5.8058 -0.8904 -0.8897 -0.0962 -0.0930 1.0614 1.0637 1.2421 1.2483 1.3349 1.3418 1.8267 1.8278 2.9172 2.9227 3.2753 3.2755 3.7618 3.7680 4.0089 4.0095 4.5986 4.6094 4.7259 4.7260 5.8794 5.8801 5.9653 5.9657 6.1687 6.1719 6.4400 6.4408 6.6798 6.6858 7.0839 7.0891 12.5587 12.5593 13.1569 13.1570 13.3315 13.3383 13.8714 13.8727 14.6181 14.6205 k =-0.3333 0.5774 0.2019 ( 13864 PWs) bands (ev): -35.7712 -35.7712 -35.7625 -35.7625 -9.3197 -9.3195 -8.7186 -8.7179 -7.2808 -7.2775 -7.1444 -7.1404 -6.4169 -6.4156 -5.8162 -5.8153 -0.8504 -0.8499 -0.1198 -0.1168 1.0164 1.0181 1.2880 1.2941 1.4177 1.4250 1.7834 1.7844 2.9311 2.9362 3.2890 3.2893 3.7720 3.7781 4.0037 4.0043 4.5736 4.5838 4.7331 4.7332 5.8942 5.8948 5.9507 5.9510 6.1510 6.1540 6.4556 6.4561 6.6792 6.6845 7.0927 7.0974 12.5282 12.5291 13.1003 13.1004 13.3427 13.3495 13.8265 13.8278 14.5998 14.6017 k =-0.3333 0.5774 0.2187 ( 13860 PWs) bands (ev): -35.7711 -35.7711 -35.7626 -35.7626 -9.2955 -9.2953 -8.6979 -8.6972 -7.3271 -7.3238 -7.1741 -7.1702 -6.4094 -6.4083 -5.8264 -5.8256 -0.8081 -0.8077 -0.1403 -0.1375 0.9673 0.9686 1.3320 1.3380 1.5046 1.5121 1.7438 1.7448 2.9438 2.9484 3.3036 3.3041 3.7817 3.7877 3.9978 3.9985 4.5459 4.5555 4.7416 4.7416 5.9096 5.9103 5.9348 5.9349 6.1322 6.1350 6.4704 6.4707 6.6784 6.6829 7.1020 7.1063 12.5006 12.5018 13.0451 13.0455 13.3547 13.3616 13.7844 13.7857 14.5765 14.5778 k =-0.3333 0.5774 0.2355 ( 13842 PWs) bands (ev): -35.7709 -35.7709 -35.7628 -35.7628 -9.2694 -9.2692 -8.6757 -8.6750 -7.3756 -7.3725 -7.2058 -7.2020 -6.4012 -6.4001 -5.8374 -5.8366 -0.7637 -0.7635 -0.1578 -0.1552 0.9162 0.9172 1.3685 1.3740 1.5934 1.6010 1.7136 1.7150 2.9551 2.9592 3.3193 3.3199 3.7908 3.7966 3.9915 3.9923 4.5155 4.5244 4.7508 4.7508 5.9160 5.9172 5.9266 5.9270 6.1125 6.1151 6.4841 6.4842 6.6777 6.6814 7.1115 7.1155 12.4768 12.4783 12.9924 12.9931 13.3670 13.3738 13.7452 13.7466 14.5477 14.5484 k =-0.3333 0.5774 0.2524 ( 13836 PWs) bands (ev): -35.7707 -35.7707 -35.7629 -35.7629 -9.2415 -9.2413 -8.6519 -8.6513 -7.4262 -7.4232 -7.2394 -7.2357 -6.3922 -6.3912 -5.8490 -5.8482 -0.7174 -0.7173 -0.1723 -0.1698 0.8640 0.8648 1.3878 1.3924 1.6832 1.6908 1.7028 1.7050 2.9649 2.9686 3.3358 3.3366 3.7990 3.8046 3.9852 3.9860 4.4822 4.4905 4.7602 4.7603 5.8979 5.8985 5.9431 5.9433 6.0919 6.0943 6.4959 6.4964 6.6776 6.6805 7.1211 7.1247 12.4573 12.4590 12.9432 12.9440 13.3788 13.3856 13.7092 13.7105 14.5130 14.5132 k =-0.3333 0.5774 0.2692 ( 13845 PWs) bands (ev): -35.7706 -35.7706 -35.7631 -35.7631 -9.2117 -9.2116 -8.6266 -8.6261 -7.4786 -7.4758 -7.2747 -7.2711 -6.3824 -6.3815 -5.8612 -5.8605 -0.6694 -0.6692 -0.1837 -0.1815 0.8112 0.8119 1.3816 1.3849 1.7195 1.7227 1.7736 1.7812 2.9734 2.9767 3.3533 3.3541 3.8062 3.8115 3.9792 3.9800 4.4460 4.4535 4.7692 4.7693 5.8783 5.8787 5.9604 5.9607 6.0705 6.0727 6.5056 6.5066 6.6787 6.6806 7.1302 7.1335 12.4424 12.4445 12.8981 12.8991 13.3895 13.3962 13.6762 13.6776 14.4721 14.4723 k =-0.3333 0.5774 0.2860 ( 13839 PWs) bands (ev): -35.7704 -35.7704 -35.7633 -35.7633 -9.1802 -9.1801 -8.5998 -8.5994 -7.5327 -7.5299 -7.3116 -7.3081 -6.3719 -6.3710 -5.8741 -5.8734 -0.6197 -0.6195 -0.1922 -0.1901 0.7583 0.7588 1.3515 1.3538 1.7624 1.7664 1.8635 1.8711 2.9804 2.9833 3.3715 3.3725 3.8121 3.8171 3.9740 3.9749 4.4069 4.4136 4.7770 4.7771 5.8579 5.8583 5.9781 5.9785 6.0484 6.0503 6.5128 6.5143 6.6815 6.6825 7.1387 7.1416 12.4326 12.4349 12.8578 12.8591 13.3981 13.4048 13.6463 13.6478 14.4255 14.4261 k =-0.3333 0.5774 0.3028 ( 13831 PWs) bands (ev): -35.7702 -35.7702 -35.7634 -35.7634 -9.1468 -9.1468 -8.5716 -8.5712 -7.5881 -7.5854 -7.3499 -7.3467 -6.3607 -6.3599 -5.8875 -5.8868 -0.5686 -0.5682 -0.1977 -0.1959 0.7055 0.7058 1.3061 1.3077 1.8228 1.8274 1.9525 1.9601 2.9861 2.9885 3.3904 3.3915 3.8165 3.8212 3.9702 3.9712 4.3648 4.3706 4.7827 4.7829 5.8372 5.8376 5.9963 5.9969 6.0256 6.0274 6.5171 6.5190 6.6865 6.6867 7.1462 7.1488 12.4280 12.4305 12.8230 12.8244 13.4040 13.4106 13.6194 13.6210 14.3738 14.3747 k =-0.3333 0.5774 0.3197 ( 13846 PWs) bands (ev): -35.7700 -35.7700 -35.7636 -35.7636 -9.1118 -9.1118 -8.5420 -8.5417 -7.6446 -7.6421 -7.3896 -7.3865 -6.3488 -6.3481 -5.9014 -5.9008 -0.5161 -0.5155 -0.2004 -0.1987 0.6530 0.6532 1.2521 1.2531 1.8941 1.8990 2.0401 2.0476 2.9903 2.9924 3.4099 3.4112 3.8192 3.8236 3.9684 3.9694 4.3197 4.3246 4.7858 4.7861 5.8165 5.8169 6.0022 6.0033 6.0157 6.0158 6.5184 6.5206 6.6936 6.6941 7.1523 7.1546 12.4287 12.4314 12.7940 12.7956 13.4061 13.4127 13.5953 13.5969 14.3179 14.3191 k =-0.3333 0.5774 0.3365 ( 13854 PWs) bands (ev): -35.7698 -35.7698 -35.7638 -35.7638 -9.0751 -9.0750 -8.5111 -8.5108 -7.7021 -7.6998 -7.4305 -7.4275 -6.3363 -6.3356 -5.9159 -5.9153 -0.4623 -0.4616 -0.2001 -0.1987 0.6010 0.6011 1.1929 1.1936 1.9726 1.9777 2.1258 2.1331 2.9932 2.9948 3.4298 3.4314 3.8200 3.8239 3.9692 3.9702 4.2717 4.2756 4.7853 4.7858 5.7963 5.7968 5.9785 5.9797 6.0346 6.0351 6.5165 6.5190 6.7036 6.7045 7.1567 7.1588 12.4349 12.4378 12.7713 12.7730 13.4037 13.4102 13.5735 13.5753 14.2592 14.2605 k =-0.3333 0.5774 0.3533 ( 13825 PWs) bands (ev): -35.7696 -35.7696 -35.7640 -35.7640 -9.0368 -9.0366 -8.4788 -8.4786 -7.7604 -7.7582 -7.4724 -7.4695 -6.3231 -6.3225 -5.9308 -5.9302 -0.4072 -0.4064 -0.1971 -0.1958 0.5498 0.5498 1.1306 1.1310 2.0563 2.0614 2.2089 2.2161 2.9946 2.9959 3.4501 3.4518 3.8185 3.8219 3.9732 3.9741 4.2210 4.2239 4.7808 4.7814 5.7769 5.7775 5.9545 5.9555 6.0543 6.0549 6.5119 6.5145 6.7164 6.7177 7.1593 7.1611 12.4464 12.4494 12.7552 12.7570 13.3961 13.4025 13.5536 13.5555 14.1990 14.2005 k =-0.3333 0.5774 0.3701 ( 13811 PWs) bands (ev): -35.7694 -35.7694 -35.7642 -35.7642 -8.9967 -8.9966 -8.4452 -8.4451 -7.8193 -7.8172 -7.5152 -7.5125 -6.3093 -6.3088 -5.9461 -5.9456 -0.3510 -0.3501 -0.1914 -0.1902 0.4993 0.4995 1.0662 1.0664 2.1439 2.1490 2.2888 2.2958 2.9946 2.9955 3.4705 3.4724 3.8143 3.8171 3.9809 3.9818 4.1680 4.1697 4.7716 4.7724 5.7588 5.7594 5.9305 5.9312 6.0745 6.0753 6.5048 6.5073 6.7320 6.7335 7.1597 7.1613 12.4631 12.4663 12.7458 12.7477 13.3827 13.3889 13.5345 13.5366 14.1392 14.1408 k =-0.3333 0.5774 0.3869 ( 13818 PWs) bands (ev): -35.7692 -35.7692 -35.7644 -35.7644 -8.9551 -8.9549 -8.4104 -8.4104 -7.8786 -7.8766 -7.5587 -7.5562 -6.2951 -6.2946 -5.9619 -5.9614 -0.2938 -0.2928 -0.1830 -0.1820 0.4499 0.4501 1.0005 1.0005 2.2346 2.2396 2.3650 2.3717 2.9931 2.9936 3.4906 3.4927 3.8069 3.8090 3.9930 3.9937 4.1134 4.1138 4.7574 4.7584 5.7423 5.7430 5.9064 5.9069 6.0953 6.0961 6.4954 6.4978 6.7501 6.7517 7.1578 7.1592 12.4850 12.4883 12.7433 12.7453 13.3632 13.3692 13.5149 13.5171 14.0822 14.0838 k =-0.3333 0.5774 0.4038 ( 13820 PWs) bands (ev): -35.7690 -35.7690 -35.7647 -35.7647 -8.9120 -8.9117 -8.3745 -8.3744 -7.9381 -7.9362 -7.6029 -7.6005 -6.2803 -6.2798 -5.9780 -5.9775 -0.2355 -0.2344 -0.1720 -0.1711 0.4017 0.4019 0.9337 0.9339 2.3277 2.3326 2.4370 2.4434 2.9899 2.9901 3.5099 3.5123 3.7956 3.7967 4.0098 4.0103 4.0575 4.0584 4.7380 4.7391 5.7278 5.7286 5.8827 5.8830 6.1165 6.1174 6.4840 6.4863 6.7705 6.7721 7.1534 7.1547 12.5117 12.5151 12.7476 12.7497 13.3376 13.3434 13.4929 13.4953 14.0307 14.0323 k =-0.3333 0.5774 0.4206 ( 13822 PWs) bands (ev): -35.7687 -35.7687 -35.7649 -35.7649 -8.8673 -8.8669 -8.3375 -8.3373 -7.9977 -7.9959 -7.6475 -7.6453 -6.2651 -6.2647 -5.9944 -5.9940 -0.1764 -0.1751 -0.1584 -0.1575 0.3547 0.3549 0.8663 0.8667 2.4227 2.4274 2.5043 2.5104 2.9848 2.9850 3.5275 3.5301 3.7792 3.7792 4.0022 4.0049 4.0318 4.0323 4.7132 4.7145 5.7155 5.7164 5.8594 5.8595 6.1383 6.1393 6.4709 6.4730 6.7928 6.7944 7.1464 7.1476 12.5430 12.5466 12.7589 12.7610 13.3059 13.3115 13.4665 13.4690 13.9876 13.9891 k =-0.3333 0.5774 0.4374 ( 13835 PWs) bands (ev): -35.7685 -35.7685 -35.7651 -35.7651 -8.8211 -8.8207 -8.2994 -8.2991 -8.0572 -8.0556 -7.6925 -7.6904 -6.2494 -6.2491 -6.0110 -6.0107 -0.1423 -0.1419 -0.1158 -0.1148 0.3090 0.3093 0.7986 0.7991 2.5191 2.5236 2.5666 2.5723 2.9777 2.9782 3.5412 3.5441 3.7560 3.7571 3.9516 3.9557 4.0589 4.0592 4.6832 4.6846 5.7058 5.7068 5.8367 5.8368 6.1604 6.1615 6.4561 6.4581 6.8168 6.8184 7.1368 7.1379 12.5787 12.5823 12.7768 12.7790 13.2687 13.2741 13.4338 13.4362 13.9556 13.9569 k =-0.3333 0.5774 0.4542 ( 13818 PWs) bands (ev): -35.7683 -35.7683 -35.7653 -35.7653 -8.7736 -8.7731 -8.2602 -8.2598 -8.1166 -8.1150 -7.7378 -7.7358 -6.2334 -6.2331 -6.0279 -6.0276 -0.1238 -0.1234 -0.0548 -0.0537 0.2648 0.2651 0.7308 0.7314 2.6164 2.6207 2.6237 2.6290 2.9686 2.9695 3.5466 3.5494 3.7294 3.7309 3.9081 3.9133 4.0912 4.0913 4.6483 4.6497 5.6987 5.6998 5.8148 5.8151 6.1830 6.1841 6.4400 6.4418 6.8422 6.8437 7.1246 7.1256 12.6183 12.6220 12.8012 12.8034 13.2266 13.2318 13.3936 13.3960 13.9366 13.9376 k =-0.3333 0.5774 0.4711 ( 13824 PWs) bands (ev): -35.7680 -35.7680 -35.7656 -35.7656 -8.7247 -8.7241 -8.2201 -8.2196 -8.1756 -8.1742 -7.7831 -7.7813 -6.2170 -6.2168 -6.0450 -6.0448 -0.1029 -0.1026 0.0071 0.0082 0.2222 0.2224 0.6630 0.6637 2.6754 2.6803 2.7142 2.7183 2.9574 2.9585 3.5345 3.5367 3.7080 3.7089 3.8727 3.8785 4.1284 4.1286 4.6087 4.6103 5.6944 5.6955 5.7941 5.7945 6.2058 6.2070 6.4225 6.4242 6.8687 6.8700 7.1098 7.1108 12.6615 12.6653 12.8319 12.8341 13.1804 13.1853 13.3463 13.3486 13.9307 13.9314 k =-0.3333 0.5774 0.4879 ( 13821 PWs) bands (ev): -35.7678 -35.7678 -35.7658 -35.7658 -8.6744 -8.6738 -8.2342 -8.2328 -8.1791 -8.1785 -7.8285 -7.8268 -6.2004 -6.2002 -6.0623 -6.0621 -0.0797 -0.0795 0.0698 0.0710 0.1812 0.1814 0.5953 0.5961 2.7221 2.7265 2.8119 2.8157 2.9438 2.9453 3.4965 3.4980 3.7013 3.7018 3.8440 3.8497 4.1699 4.1704 4.5652 4.5668 5.6930 5.6941 5.7747 5.7753 6.2289 6.2301 6.4038 6.4055 6.8958 6.8971 7.0927 7.0936 12.7079 12.7118 12.8684 12.8706 13.1308 13.1356 13.2933 13.2955 13.9371 13.9374 k =-0.3333 0.5774 0.5047 ( 13831 PWs) bands (ev): -35.7675 -35.7675 -35.7661 -35.7661 -8.6230 -8.6223 -8.2922 -8.2910 -8.1373 -8.1366 -7.8737 -7.8722 -6.1835 -6.1834 -6.0796 -6.0794 -0.0542 -0.0541 0.1330 0.1343 0.1421 0.1423 0.5279 0.5288 2.7637 2.7678 2.9089 2.9124 2.9279 2.9296 3.4362 3.4374 3.7073 3.7090 3.8195 3.8249 4.2153 4.2160 4.5184 4.5200 5.6944 5.6955 5.7569 5.7576 6.2519 6.2532 6.3841 6.3857 6.9232 6.9244 7.0732 7.0741 12.7570 12.7610 12.9103 12.9125 13.0788 13.0834 13.2366 13.2387 13.9541 13.9542 k =-0.3333 0.5774 0.5215 ( 13835 PWs) bands (ev): -35.7673 -35.7673 -35.7663 -35.7663 -8.5703 -8.5696 -8.3495 -8.3484 -8.0948 -8.0939 -7.9187 -7.9174 -6.1664 -6.1663 -6.0970 -6.0969 -0.0266 -0.0265 0.1043 0.1045 0.1976 0.1987 0.4608 0.4618 2.8007 2.8043 2.9089 2.9110 3.0052 3.0082 3.3619 3.3633 3.7208 3.7234 3.7974 3.8023 4.2637 4.2647 4.4690 4.4705 5.6986 5.6997 5.7408 5.7416 6.2749 6.2762 6.3636 6.3651 6.9506 6.9517 7.0517 7.0526 12.8083 12.8124 12.9570 12.9592 13.0251 13.0295 13.1782 13.1803 13.9800 13.9804 k =-0.3333 0.5774 0.5384 ( 13836 PWs) bands (ev): -35.7671 -35.7671 -35.7666 -35.7666 -8.5166 -8.5157 -8.4061 -8.4051 -8.0516 -8.0506 -7.9635 -7.9622 -6.1492 -6.1491 -6.1144 -6.1144 0.0031 0.0032 0.0686 0.0688 0.2625 0.2636 0.3942 0.3952 2.8333 2.8366 2.8871 2.8896 3.0995 3.1021 3.2793 3.2810 3.7379 3.7412 3.7766 3.7810 4.3143 4.3154 4.4179 4.4193 5.7055 5.7066 5.7268 5.7277 6.2978 6.2991 6.3422 6.3436 6.9774 6.9785 7.0283 7.0293 12.8614 12.8656 12.9702 12.9748 13.0084 13.0103 13.1197 13.1218 14.0136 14.0143 k =-0.3333 0.5774 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4618 -8.4618 -8.4609 -8.4609 -8.0078 -8.0078 -8.0066 -8.0066 -6.1318 -6.1318 -6.1318 -6.1318 0.0349 0.0349 0.0350 0.0350 0.3280 0.3280 0.3291 0.3291 2.8620 2.8620 2.8649 2.8649 3.1912 3.1912 3.1934 3.1934 3.7568 3.7568 3.7606 3.7606 4.3660 4.3660 4.3673 4.3673 5.7149 5.7149 5.7159 5.7159 6.3202 6.3202 6.3216 6.3216 7.0035 7.0035 7.0045 7.0045 12.9156 12.9156 12.9199 12.9199 13.0627 13.0627 13.0648 13.0648 14.0539 14.0539 k =-0.3333 0.5774 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4618 -8.4618 -8.4609 -8.4609 -8.0078 -8.0078 -8.0066 -8.0066 -6.1318 -6.1318 -6.1318 -6.1318 0.0349 0.0349 0.0350 0.0350 0.3280 0.3280 0.3291 0.3291 2.8620 2.8620 2.8649 2.8649 3.1912 3.1912 3.1934 3.1934 3.7568 3.7568 3.7606 3.7606 4.3660 4.3660 4.3673 4.3673 5.7149 5.7149 5.7159 5.7159 6.3202 6.3202 6.3216 6.3216 7.0035 7.0035 7.0045 7.0045 12.9156 12.9156 12.9199 12.9199 13.0627 13.0627 13.0648 13.0648 14.0539 14.0539 k =-0.3416 0.5630 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.4912 -8.4912 -8.4903 -8.4903 -7.9665 -7.9665 -7.9654 -7.9654 -6.1436 -6.1436 -6.1436 -6.1436 -0.0261 -0.0261 -0.0260 -0.0260 0.3865 0.3865 0.3876 0.3876 2.8660 2.8660 2.8686 2.8686 3.1910 3.1910 3.1934 3.1934 3.7521 3.7521 3.7556 3.7556 4.3804 4.3804 4.3817 4.3817 5.7324 5.7324 5.7334 5.7334 6.2934 6.2934 6.2947 6.2947 7.0001 7.0001 7.0010 7.0010 12.9152 12.9152 12.9194 12.9194 13.0625 13.0625 13.0646 13.0646 14.0595 14.0595 k =-0.3500 0.5485 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5192 -8.5192 -8.5184 -8.5184 -7.9259 -7.9259 -7.9248 -7.9248 -6.1554 -6.1554 -6.1554 -6.1554 -0.0859 -0.0859 -0.0859 -0.0859 0.4437 0.4437 0.4449 0.4449 2.8699 2.8699 2.8724 2.8724 3.1900 3.1900 3.1928 3.1928 3.7459 3.7459 3.7489 3.7489 4.3964 4.3964 4.3978 4.3978 5.7506 5.7506 5.7516 5.7516 6.2641 6.2641 6.2653 6.2653 6.9975 6.9975 6.9984 6.9984 12.9192 12.9192 12.9231 12.9231 13.0613 13.0613 13.0633 13.0633 14.0715 14.0715 k =-0.3583 0.5341 0.5552 ( 13822 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5460 -8.5460 -8.5452 -8.5452 -7.8859 -7.8859 -7.8848 -7.8848 -6.1670 -6.1670 -6.1670 -6.1670 -0.1445 -0.1445 -0.1444 -0.1444 0.4994 0.4994 0.5006 0.5006 2.8740 2.8740 2.8763 2.8763 3.1888 3.1888 3.1918 3.1918 3.7381 3.7381 3.7407 3.7407 4.4140 4.4140 4.4153 4.4153 5.7691 5.7691 5.7701 5.7701 6.2329 6.2329 6.2340 6.2340 6.9955 6.9955 6.9963 6.9963 12.9277 12.9277 12.9313 12.9313 13.0589 13.0589 13.0609 13.0609 14.0895 14.0895 k =-0.3666 0.5197 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5714 -8.5714 -8.5706 -8.5706 -7.8467 -7.8467 -7.8457 -7.8457 -6.1785 -6.1785 -6.1785 -6.1785 -0.2014 -0.2014 -0.2013 -0.2013 0.5534 0.5534 0.5547 0.5547 2.8781 2.8781 2.8803 2.8803 3.1875 3.1875 3.1907 3.1907 3.7286 3.7286 3.7308 3.7308 4.4328 4.4328 4.4341 4.4341 5.7877 5.7877 5.7887 5.7887 6.2003 6.2003 6.2013 6.2013 6.9938 6.9938 6.9945 6.9945 12.9407 12.9407 12.9442 12.9442 13.0553 13.0553 13.0573 13.0573 14.1132 14.1132 k =-0.3750 0.5052 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.5955 -8.5955 -8.5947 -8.5947 -7.8085 -7.8085 -7.8076 -7.8076 -6.1898 -6.1898 -6.1898 -6.1898 -0.2564 -0.2564 -0.2563 -0.2563 0.6057 0.6057 0.6069 0.6069 2.8824 2.8824 2.8844 2.8844 3.1865 3.1865 3.1899 3.1899 3.7174 3.7174 3.7193 3.7193 4.4526 4.4526 4.4539 4.4539 5.8061 5.8061 5.8071 5.8071 6.1668 6.1668 6.1677 6.1677 6.9923 6.9923 6.9929 6.9929 12.9585 12.9585 12.9617 12.9617 13.0505 13.0505 13.0524 13.0524 14.1419 14.1419 k =-0.3833 0.4908 0.5552 ( 13850 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6181 -8.6181 -8.6174 -8.6174 -7.7715 -7.7715 -7.7706 -7.7706 -6.2009 -6.2009 -6.2009 -6.2009 -0.3093 -0.3093 -0.3092 -0.3092 0.6558 0.6558 0.6571 0.6571 2.8867 2.8867 2.8885 2.8885 3.1859 3.1859 3.1895 3.1895 3.7048 3.7048 3.7063 3.7063 4.4731 4.4731 4.4743 4.4743 5.8241 5.8241 5.8251 5.8251 6.1327 6.1327 6.1335 6.1335 6.9908 6.9908 6.9914 6.9914 12.9807 12.9807 12.9838 12.9838 13.0448 13.0448 13.0465 13.0465 14.1751 14.1751 k =-0.3916 0.4763 0.5552 ( 13856 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6393 -8.6393 -8.6386 -8.6386 -7.7359 -7.7359 -7.7350 -7.7350 -6.2117 -6.2117 -6.2117 -6.2117 -0.3599 -0.3599 -0.3597 -0.3597 0.7038 0.7038 0.7051 0.7051 2.8910 2.8910 2.8927 2.8927 3.1859 3.1859 3.1896 3.1896 3.6908 3.6908 3.6920 3.6920 4.4940 4.4940 4.4952 4.4952 5.8413 5.8413 5.8423 5.8423 6.0986 6.0986 6.0993 6.0993 6.9894 6.9894 6.9899 6.9899 13.0072 13.0072 13.0103 13.0103 13.0384 13.0384 13.0398 13.0398 14.2119 14.2119 k =-0.4000 0.4619 0.5552 ( 13856 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6590 -8.6590 -8.6584 -8.6584 -7.7018 -7.7018 -7.7009 -7.7009 -6.2222 -6.2222 -6.2221 -6.2221 -0.4077 -0.4077 -0.4075 -0.4075 0.7493 0.7493 0.7506 0.7506 2.8953 2.8953 2.8969 2.8969 3.1866 3.1866 3.1904 3.1904 3.6756 3.6756 3.6764 3.6764 4.5152 4.5152 4.5163 4.5163 5.8577 5.8577 5.8587 5.8587 6.0648 6.0648 6.0654 6.0654 6.9878 6.9878 6.9883 6.9883 13.0290 13.0290 13.0323 13.0323 13.0404 13.0404 13.0412 13.0412 14.2515 14.2515 k =-0.4083 0.4475 0.5552 ( 13840 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6773 -8.6773 -8.6767 -8.6767 -7.6694 -7.6694 -7.6686 -7.6686 -6.2322 -6.2322 -6.2322 -6.2322 -0.4528 -0.4528 -0.4526 -0.4526 0.7922 0.7922 0.7934 0.7934 2.8997 2.8997 2.9011 2.9011 3.1882 3.1882 3.1921 3.1921 3.6595 3.6595 3.6600 3.6600 4.5362 4.5362 4.5373 4.5373 5.8730 5.8730 5.8740 5.8740 6.0317 6.0317 6.0323 6.0323 6.9862 6.9862 6.9866 6.9866 13.0227 13.0227 13.0247 13.0247 13.0736 13.0736 13.0755 13.0755 14.2929 14.2929 k =-0.4166 0.4330 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.6940 -8.6940 -8.6935 -8.6935 -7.6389 -7.6389 -7.6382 -7.6382 -6.2418 -6.2418 -6.2418 -6.2418 -0.4947 -0.4947 -0.4945 -0.4945 0.8322 0.8322 0.8334 0.8334 2.9039 2.9039 2.9051 2.9051 3.1907 3.1907 3.1945 3.1945 3.6427 3.6427 3.6429 3.6429 4.5569 4.5569 4.5579 4.5579 5.8872 5.8872 5.8881 5.8881 5.9997 5.9997 6.0002 6.0002 6.9846 6.9846 6.9849 6.9849 13.0152 13.0152 13.0168 13.0168 13.1112 13.1112 13.1130 13.1130 14.3353 14.3353 k =-0.4250 0.4186 0.5552 ( 13840 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7091 -8.7091 -8.7087 -8.7087 -7.6106 -7.6106 -7.6099 -7.6099 -6.2508 -6.2508 -6.2508 -6.2508 -0.5334 -0.5334 -0.5332 -0.5332 0.8691 0.8691 0.8703 0.8703 2.9080 2.9080 2.9091 2.9091 3.1940 3.1940 3.1978 3.1978 3.6253 3.6253 3.6254 3.6254 4.5770 4.5770 4.5779 4.5779 5.9001 5.9001 5.9010 5.9010 5.9692 5.9692 5.9696 5.9696 6.9829 6.9829 6.9832 6.9832 13.0076 13.0076 13.0091 13.0091 13.1513 13.1513 13.1529 13.1529 14.3776 14.3776 k =-0.4333 0.4041 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7228 -8.7228 -8.7224 -8.7224 -7.5845 -7.5845 -7.5839 -7.5839 -6.2593 -6.2593 -6.2592 -6.2592 -0.5685 -0.5685 -0.5683 -0.5683 0.9029 0.9029 0.9039 0.9039 2.9118 2.9118 2.9128 2.9128 3.1982 3.1982 3.2019 3.2019 3.6077 3.6077 3.6080 3.6080 4.5961 4.5961 4.5970 4.5970 5.9116 5.9116 5.9125 5.9125 5.9407 5.9407 5.9409 5.9409 6.9813 6.9813 6.9815 6.9815 13.0003 13.0003 13.0016 13.0016 13.1930 13.1930 13.1944 13.1944 14.4189 14.4189 k =-0.4416 0.3897 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7348 -8.7348 -8.7345 -8.7345 -7.5609 -7.5609 -7.5604 -7.5604 -6.2670 -6.2670 -6.2669 -6.2669 -0.6000 -0.6000 -0.5998 -0.5998 0.9331 0.9331 0.9341 0.9341 2.9154 2.9154 2.9163 2.9163 3.2031 3.2031 3.2066 3.2066 3.5904 3.5904 3.5909 3.5909 4.6140 4.6140 4.6148 4.6148 5.9133 5.9133 5.9143 5.9143 5.9228 5.9228 5.9229 5.9229 6.9796 6.9796 6.9798 6.9798 12.9935 12.9935 12.9947 12.9947 13.2351 13.2351 13.2363 13.2363 14.4583 14.4583 k =-0.4500 0.3752 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7453 -8.7453 -8.7450 -8.7450 -7.5400 -7.5400 -7.5395 -7.5395 -6.2739 -6.2739 -6.2738 -6.2738 -0.6276 -0.6276 -0.6275 -0.6275 0.9598 0.9598 0.9607 0.9607 2.9187 2.9187 2.9194 2.9194 3.2085 3.2085 3.2117 3.2117 3.5737 3.5737 3.5744 3.5744 4.6304 4.6304 4.6310 4.6310 5.8900 5.8900 5.8904 5.8904 5.9311 5.9311 5.9316 5.9316 6.9781 6.9781 6.9783 6.9783 12.9874 12.9874 12.9883 12.9883 13.2764 13.2764 13.2774 13.2774 14.4948 14.4948 k =-0.4583 0.3608 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7542 -8.7542 -8.7539 -8.7539 -7.5220 -7.5220 -7.5216 -7.5216 -6.2799 -6.2799 -6.2799 -6.2799 -0.6513 -0.6513 -0.6511 -0.6511 0.9826 0.9826 0.9834 0.9834 2.9216 2.9216 2.9222 2.9222 3.2141 3.2141 3.2171 3.2171 3.5583 3.5583 3.5590 3.5590 4.6449 4.6449 4.6454 4.6454 5.8691 5.8691 5.8694 5.8694 5.9386 5.9386 5.9390 5.9390 6.9767 6.9767 6.9769 6.9769 12.9819 12.9819 12.9827 12.9827 13.3154 13.3154 13.3163 13.3163 14.5276 14.5276 k =-0.4667 0.3464 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7615 -8.7615 -8.7612 -8.7612 -7.5070 -7.5070 -7.5067 -7.5067 -6.2850 -6.2850 -6.2849 -6.2849 -0.6708 -0.6708 -0.6707 -0.6707 1.0016 1.0016 1.0022 1.0022 2.9241 2.9241 2.9245 2.9245 3.2198 3.2198 3.2223 3.2223 3.5445 3.5445 3.5453 3.5453 4.6572 4.6572 4.6577 4.6577 5.8515 5.8515 5.8517 5.8517 5.9447 5.9447 5.9451 5.9451 6.9755 6.9755 6.9756 6.9756 12.9774 12.9774 12.9780 12.9780 13.3506 13.3506 13.3513 13.3513 14.5558 14.5558 k =-0.4750 0.3319 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7671 -8.7671 -8.7670 -8.7670 -7.4951 -7.4951 -7.4949 -7.4949 -6.2890 -6.2890 -6.2890 -6.2890 -0.6861 -0.6861 -0.6860 -0.6860 1.0164 1.0164 1.0169 1.0169 2.9260 2.9260 2.9264 2.9264 3.2249 3.2249 3.2269 3.2269 3.5330 3.5330 3.5337 3.5337 4.6672 4.6672 4.6675 4.6675 5.8374 5.8374 5.8376 5.8376 5.9494 5.9494 5.9497 5.9497 6.9746 6.9746 6.9746 6.9746 12.9738 12.9738 12.9743 12.9743 13.3803 13.3803 13.3808 13.3808 14.5787 14.5787 k =-0.4833 0.3175 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7712 -8.7712 -8.7710 -8.7710 -7.4866 -7.4866 -7.4864 -7.4864 -6.2919 -6.2919 -6.2919 -6.2919 -0.6971 -0.6971 -0.6970 -0.6970 1.0272 1.0272 1.0275 1.0275 2.9275 2.9275 2.9277 2.9277 3.2292 3.2292 3.2306 3.2306 3.5244 3.5244 3.5248 3.5248 4.6745 4.6745 4.6747 4.6747 5.8271 5.8271 5.8273 5.8273 5.9528 5.9528 5.9530 5.9530 6.9738 6.9738 6.9739 6.9739 12.9712 12.9712 12.9715 12.9715 13.4029 13.4029 13.4032 13.4032 14.5955 14.5955 k =-0.4917 0.3030 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7736 -8.7736 -8.7735 -8.7735 -7.4814 -7.4814 -7.4813 -7.4813 -6.2937 -6.2937 -6.2937 -6.2937 -0.7037 -0.7037 -0.7036 -0.7036 1.0337 1.0337 1.0338 1.0338 2.9284 2.9284 2.9285 2.9285 3.2321 3.2321 3.2328 3.2328 3.5190 3.5190 3.5192 3.5192 4.6790 4.6790 4.6791 4.6791 5.8209 5.8209 5.8210 5.8210 5.9549 5.9549 5.9550 5.9550 6.9734 6.9734 6.9734 6.9734 12.9696 12.9696 12.9698 12.9698 13.4171 13.4171 13.4173 13.4173 14.6058 14.6058 k =-0.5000 0.2886 0.5552 ( 13824 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7744 -8.7744 -8.7744 -8.7744 -7.4796 -7.4796 -7.4796 -7.4796 -6.2943 -6.2943 -6.2943 -6.2943 -0.7059 -0.7059 -0.7059 -0.7059 1.0359 1.0359 1.0359 1.0359 2.9287 2.9287 2.9287 2.9287 3.2333 3.2333 3.2333 3.2333 3.5172 3.5172 3.5172 3.5172 4.6805 4.6805 4.6805 4.6805 5.8188 5.8188 5.8188 5.8188 5.9556 5.9556 5.9556 5.9556 6.9733 6.9733 6.9733 6.9733 12.9692 12.9692 12.9692 12.9692 13.4220 13.4220 13.4220 13.4220 14.6093 14.6093 k =-0.5000 0.2886 0.5552 ( 13824 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7744 -8.7744 -8.7744 -8.7744 -7.4796 -7.4796 -7.4796 -7.4796 -6.2943 -6.2943 -6.2943 -6.2943 -0.7059 -0.7059 -0.7059 -0.7059 1.0359 1.0359 1.0359 1.0359 2.9287 2.9287 2.9287 2.9287 3.2333 3.2333 3.2333 3.2333 3.5172 3.5172 3.5172 3.5172 4.6805 4.6805 4.6805 4.6805 5.8188 5.8188 5.8188 5.8188 5.9556 5.9556 5.9556 5.9556 6.9733 6.9733 6.9733 6.9733 12.9692 12.9692 12.9692 12.9692 13.4220 13.4220 13.4220 13.4220 14.6093 14.6093 k =-0.5000 0.2886 0.5384 ( 13846 PWs) bands (ev): -35.7671 -35.7671 -35.7666 -35.7666 -8.8326 -8.8326 -8.7150 -8.7150 -7.4903 -7.4903 -7.4701 -7.4701 -6.2982 -6.2982 -6.2890 -6.2890 -0.7049 -0.7049 -0.7040 -0.7040 0.9481 0.9481 1.1219 1.1219 2.9221 2.9221 2.9331 2.9331 3.1924 3.1924 3.2708 3.2708 3.4581 3.4581 3.5802 3.5802 4.6653 4.6653 4.6902 4.6902 5.7916 5.7916 5.8470 5.8470 5.9485 5.9485 5.9650 5.9650 6.9654 6.9654 6.9815 6.9815 12.9249 12.9249 13.0183 13.0183 13.4069 13.4069 13.4366 13.4366 14.5992 14.5992 k =-0.5000 0.2886 0.5215 ( 13848 PWs) bands (ev): -35.7673 -35.7673 -35.7663 -35.7663 -8.8896 -8.8896 -8.6547 -8.6547 -7.5022 -7.5022 -7.4618 -7.4618 -6.3009 -6.3009 -6.2823 -6.2823 -0.7012 -0.7012 -0.6994 -0.6994 0.8588 0.8588 1.2061 1.2061 2.9131 2.9131 2.9353 2.9353 3.1507 3.1507 3.2938 3.2938 3.4142 3.4142 3.6440 3.6440 4.6444 4.6444 4.6947 4.6947 5.7653 5.7653 5.8760 5.8760 5.9439 5.9439 5.9765 5.9765 6.9578 6.9578 6.9900 6.9900 12.8858 12.8858 13.0721 13.0721 13.3915 13.3915 13.4501 13.4501 14.5922 14.5922 k =-0.5000 0.2886 0.5047 ( 13852 PWs) bands (ev): -35.7676 -35.7676 -35.7661 -35.7661 -8.9454 -8.9454 -8.5934 -8.5934 -7.5150 -7.5150 -7.4548 -7.4548 -6.3022 -6.3022 -6.2743 -6.2743 -0.6946 -0.6946 -0.6920 -0.6920 0.7681 0.7681 1.2882 1.2882 2.9015 2.9015 2.9354 2.9354 3.1092 3.1092 3.2747 3.2747 3.4131 3.4131 3.7076 3.7076 4.6181 4.6181 4.6942 4.6942 5.7400 5.7400 5.9057 5.9057 5.9419 5.9419 5.9899 5.9899 6.9502 6.9502 6.9990 6.9990 12.8521 12.8521 13.1301 13.1301 13.3763 13.3763 13.4624 13.4624 14.5882 14.5882 k =-0.5000 0.2886 0.4879 ( 13854 PWs) bands (ev): -35.7678 -35.7678 -35.7658 -35.7658 -8.9998 -8.9998 -8.5313 -8.5313 -7.5288 -7.5288 -7.4491 -7.4491 -6.3024 -6.3024 -6.2648 -6.2648 -0.6853 -0.6853 -0.6818 -0.6818 0.6761 0.6761 1.3683 1.3683 2.8871 2.8871 2.9335 2.9335 3.0682 3.0682 3.2237 3.2237 3.4450 3.4450 3.7703 3.7703 4.5864 4.5864 4.6893 4.6893 5.7157 5.7157 5.9360 5.9360 5.9428 5.9428 6.0051 6.0051 6.9424 6.9424 7.0083 7.0083 12.8242 12.8242 13.1919 13.1919 13.3615 13.3615 13.4731 13.4731 14.5871 14.5871 k =-0.5000 0.2886 0.4711 ( 13852 PWs) bands (ev): -35.7681 -35.7681 -35.7656 -35.7656 -9.0529 -9.0529 -8.4685 -8.4685 -7.5434 -7.5434 -7.4447 -7.4447 -6.3016 -6.3016 -6.2540 -6.2540 -0.6731 -0.6731 -0.6688 -0.6688 0.5830 0.5830 1.4461 1.4461 2.8697 2.8697 2.9295 2.9295 3.0281 3.0281 3.1645 3.1645 3.4863 3.4863 3.8317 3.8317 4.5498 4.5498 4.6807 4.6807 5.6924 5.6924 5.9463 5.9463 5.9670 5.9670 6.0219 6.0219 6.9342 6.9342 7.0177 7.0177 12.8021 12.8021 13.2572 13.2572 13.3476 13.3476 13.4819 13.4819 14.5887 14.5887 k =-0.5000 0.2886 0.4542 ( 13842 PWs) bands (ev): -35.7683 -35.7683 -35.7653 -35.7653 -9.1045 -9.1045 -8.4050 -8.4050 -7.5587 -7.5587 -7.4415 -7.4415 -6.2997 -6.2997 -6.2419 -6.2419 -0.6583 -0.6583 -0.6532 -0.6532 0.4890 0.4890 1.5215 1.5215 2.8491 2.8491 2.9234 2.9234 2.9890 2.9890 3.1036 3.1036 3.5305 3.5305 3.8912 3.8912 4.5088 4.5088 4.6692 4.6692 5.6700 5.6700 5.9528 5.9528 5.9981 5.9981 6.0400 6.0400 6.9251 6.9251 7.0271 7.0271 12.7862 12.7862 13.3253 13.3253 13.3352 13.3352 13.4886 13.4886 14.5930 14.5930 k =-0.5000 0.2886 0.4374 ( 13850 PWs) bands (ev): -35.7685 -35.7685 -35.7651 -35.7651 -9.1546 -9.1546 -8.3411 -8.3411 -7.5745 -7.5745 -7.4395 -7.4395 -6.2970 -6.2970 -6.2286 -6.2286 -0.6407 -0.6407 -0.6349 -0.6349 0.3944 0.3944 1.5945 1.5945 2.8251 2.8251 2.9151 2.9151 2.9511 2.9511 3.0429 3.0429 3.5759 3.5759 3.9487 3.9487 4.4640 4.4640 4.6554 4.6554 5.6486 5.6486 5.9623 5.9623 6.0295 6.0295 6.0594 6.0594 6.9150 6.9150 7.0363 7.0363 12.7765 12.7765 13.3238 13.3238 13.3964 13.3964 13.4931 13.4931 14.5997 14.5997 k =-0.5000 0.2886 0.4206 ( 13862 PWs) bands (ev): -35.7688 -35.7688 -35.7649 -35.7649 -9.2032 -9.2032 -8.2768 -8.2768 -7.5909 -7.5909 -7.4386 -7.4386 -6.2936 -6.2936 -6.2142 -6.2142 -0.6205 -0.6205 -0.6139 -0.6139 0.2993 0.2993 1.6650 1.6650 2.7974 2.7974 2.9041 2.9041 2.9149 2.9149 2.9832 2.9832 3.6217 3.6217 4.0039 4.0039 4.4161 4.4161 4.6401 4.6401 5.6281 5.6281 5.9748 5.9748 6.0608 6.0608 6.0798 6.0798 6.9036 6.9036 7.0451 7.0451 12.7730 12.7730 13.3145 13.3145 13.4689 13.4689 13.4952 13.4952 14.6089 14.6089 k =-0.5000 0.2886 0.4038 ( 13858 PWs) bands (ev): -35.7690 -35.7690 -35.7646 -35.7646 -9.2502 -9.2502 -8.2122 -8.2122 -7.6075 -7.6075 -7.4389 -7.4389 -6.2894 -6.2894 -6.1989 -6.1989 -0.5976 -0.5976 -0.5903 -0.5903 0.2041 0.2041 1.7327 1.7327 2.7659 2.7659 2.8781 2.8781 2.8925 2.8925 2.9250 2.9250 3.6677 3.6677 4.0565 4.0565 4.3657 4.3657 4.6242 4.6242 5.6085 5.6085 5.9901 5.9901 6.0918 6.0918 6.1011 6.1011 6.8906 6.8906 7.0533 7.0533 12.7759 12.7759 13.3074 13.3074 13.4948 13.4948 13.5427 13.5427 14.6206 14.6206 k =-0.5000 0.2886 0.3869 ( 13866 PWs) bands (ev): -35.7692 -35.7692 -35.7644 -35.7644 -9.2956 -9.2956 -8.1476 -8.1476 -7.6244 -7.6244 -7.4400 -7.4400 -6.2848 -6.2848 -6.1826 -6.1826 -0.5722 -0.5722 -0.5642 -0.5642 0.1089 0.1089 1.7976 1.7976 2.7304 2.7304 2.8446 2.8446 2.8677 2.8677 2.8774 2.8774 3.7136 3.7136 4.1064 4.1064 4.3136 4.3136 4.6083 4.6083 5.5898 5.5898 6.0081 6.0081 6.1211 6.1211 6.1246 6.1246 6.8760 6.8760 7.0607 7.0607 12.7852 12.7852 13.3028 13.3028 13.4921 13.4921 13.6164 13.6164 14.6352 14.6352 k =-0.5000 0.2886 0.3701 ( 13868 PWs) bands (ev): -35.7695 -35.7695 -35.7642 -35.7642 -9.3393 -9.3393 -8.0831 -8.0831 -7.6414 -7.6414 -7.4421 -7.4421 -6.2796 -6.2796 -6.1657 -6.1657 -0.5443 -0.5443 -0.5355 -0.5355 0.0141 0.0141 1.8595 1.8595 2.6908 2.6908 2.8114 2.8114 2.8144 2.8144 2.8586 2.8586 3.7591 3.7591 4.1534 4.1534 4.2606 4.2606 4.5930 4.5930 5.5720 5.5720 6.0286 6.0286 6.1446 6.1446 6.1538 6.1538 6.8596 6.8596 7.0671 7.0671 12.8006 12.8006 13.3008 13.3008 13.4871 13.4871 13.6891 13.6891 14.6533 14.6533 k =-0.5000 0.2886 0.3533 ( 13874 PWs) bands (ev): -35.7697 -35.7697 -35.7640 -35.7640 -9.3812 -9.3812 -8.0188 -8.0188 -7.6583 -7.6583 -7.4449 -7.4449 -6.2742 -6.2742 -6.1482 -6.1482 -0.5141 -0.5141 -0.5045 -0.5045 -0.0801 -0.0801 1.9183 1.9183 2.6472 2.6472 2.7604 2.7604 2.7822 2.7822 2.8373 2.8373 3.8041 3.8041 4.1971 4.1971 4.2080 4.2080 4.5790 4.5790 5.5551 5.5551 6.0514 6.0514 6.1673 6.1673 6.1833 6.1833 6.8414 6.8414 7.0725 7.0725 12.8221 12.8221 13.3018 13.3018 13.4800 13.4800 13.7592 13.7592 14.6758 14.6758 k =-0.5000 0.2886 0.3365 ( 13860 PWs) bands (ev): -35.7699 -35.7699 -35.7638 -35.7638 -9.4215 -9.4215 -7.9549 -7.9549 -7.6751 -7.6751 -7.4484 -7.4484 -6.2684 -6.2684 -6.1302 -6.1302 -0.4815 -0.4815 -0.4710 -0.4710 -0.1734 -0.1734 1.9738 1.9738 2.5996 2.5996 2.7098 2.7098 2.7537 2.7537 2.8129 2.8129 3.8485 3.8485 4.1547 4.1547 4.2392 4.2392 4.5667 4.5667 5.5391 5.5391 6.0761 6.0761 6.1902 6.1902 6.2121 6.2121 6.8216 6.8216 7.0768 7.0768 12.8495 12.8495 13.3059 13.3059 13.4709 13.4709 13.8251 13.8251 14.7039 14.7039 k =-0.5000 0.2886 0.3197 ( 13848 PWs) bands (ev): -35.7701 -35.7701 -35.7636 -35.7636 -9.4599 -9.4599 -7.8917 -7.8917 -7.6917 -7.6917 -7.4525 -7.4525 -6.2625 -6.2625 -6.1120 -6.1120 -0.4468 -0.4468 -0.4353 -0.4353 -0.2655 -0.2655 2.0257 2.0257 2.5481 2.5481 2.6613 2.6613 2.7273 2.7273 2.7852 2.7852 3.8920 3.8920 4.1035 4.1035 4.2778 4.2778 4.5564 4.5564 5.5240 5.5240 6.1025 6.1025 6.2131 6.2131 6.2397 6.2397 6.8002 6.8002 7.0799 7.0799 12.8825 12.8825 13.3134 13.3134 13.4602 13.4602 13.8852 13.8852 14.7389 14.7389 k =-0.5000 0.2886 0.3028 ( 13850 PWs) bands (ev): -35.7703 -35.7703 -35.7634 -35.7634 -9.4965 -9.4965 -7.8294 -7.8294 -7.7080 -7.7080 -7.4570 -7.4570 -6.2565 -6.2565 -6.0937 -6.0937 -0.4101 -0.4101 -0.3974 -0.3974 -0.3560 -0.3560 2.0739 2.0739 2.4929 2.4929 2.6150 2.6150 2.7034 2.7034 2.7539 2.7539 3.9346 3.9346 4.0541 4.0541 4.3137 4.3137 4.5483 4.5483 5.5098 5.5098 6.1300 6.1300 6.2357 6.2357 6.2659 6.2659 6.7776 6.7776 7.0818 7.0818 12.9208 12.9208 13.3243 13.3243 13.4479 13.4479 13.9379 13.9379 14.7819 14.7819 k =-0.5000 0.2886 0.2860 ( 13846 PWs) bands (ev): -35.7705 -35.7705 -35.7632 -35.7632 -9.5313 -9.5313 -7.7681 -7.7681 -7.7238 -7.7238 -7.4619 -7.4619 -6.2505 -6.2505 -6.0754 -6.0754 -0.4446 -0.4446 -0.3716 -0.3716 -0.3574 -0.3574 2.1180 2.1180 2.4344 2.4344 2.5712 2.5712 2.6821 2.6821 2.7192 2.7192 3.9760 3.9760 4.0072 4.0072 4.3471 4.3471 4.5426 4.5426 5.4965 5.4965 6.1584 6.1584 6.2582 6.2582 6.2904 6.2904 6.7542 6.7542 7.0826 7.0826 12.9639 12.9639 13.3387 13.3387 13.4345 13.4345 13.9821 13.9821 14.8338 14.8338 k =-0.5000 0.2886 0.2692 ( 13854 PWs) bands (ev): -35.7707 -35.7707 -35.7630 -35.7630 -9.5642 -9.5642 -7.7392 -7.7392 -7.7081 -7.7081 -7.4670 -7.4670 -6.2445 -6.2445 -6.0573 -6.0573 -0.5310 -0.5310 -0.3314 -0.3314 -0.3154 -0.3154 2.1576 2.1576 2.3729 2.3729 2.5296 2.5296 2.6635 2.6635 2.6813 2.6813 3.9631 3.9631 4.0162 4.0162 4.3780 4.3780 4.5393 4.5393 5.4841 5.4841 6.1872 6.1872 6.2801 6.2801 6.3126 6.3126 6.7305 6.7305 7.0823 7.0823 13.0116 13.0116 13.3568 13.3568 13.4201 13.4201 14.0174 14.0174 14.8843 14.8843 k =-0.5000 0.2886 0.2524 ( 13862 PWs) bands (ev): -35.7708 -35.7708 -35.7629 -35.7629 -9.5953 -9.5953 -7.7539 -7.7539 -7.6497 -7.6497 -7.4723 -7.4723 -6.2386 -6.2386 -6.0395 -6.0395 -0.6147 -0.6147 -0.2898 -0.2898 -0.2717 -0.2717 2.1925 2.1925 2.3088 2.3088 2.4906 2.4906 2.6383 2.6383 2.6501 2.6501 3.9224 3.9224 4.0549 4.0549 4.4067 4.4067 4.5384 4.5384 5.4727 5.4727 6.2161 6.2161 6.3015 6.3015 6.3321 6.3321 6.7073 6.7073 7.0810 7.0810 13.0632 13.0632 13.3781 13.3781 13.4055 13.4055 14.0442 14.0442 14.8503 14.8503 k =-0.5000 0.2886 0.2355 ( 13862 PWs) bands (ev): -35.7710 -35.7710 -35.7627 -35.7627 -9.6244 -9.6244 -7.7681 -7.7681 -7.5931 -7.5931 -7.4777 -7.4777 -6.2329 -6.2329 -6.0222 -6.0222 -0.6955 -0.6955 -0.2470 -0.2470 -0.2263 -0.2263 2.2221 2.2221 2.2428 2.2428 2.4539 2.4539 2.5944 2.5944 2.6382 2.6382 3.8852 3.8852 4.0919 4.0919 4.4332 4.4332 4.5397 4.5397 5.4621 5.4621 6.2445 6.2445 6.3222 6.3222 6.3482 6.3482 6.6855 6.6855 7.0788 7.0788 13.1183 13.1183 13.3882 13.3882 13.4054 13.4054 14.0634 14.0634 14.8150 14.8150 k =-0.5000 0.2886 0.2187 ( 13850 PWs) bands (ev): -35.7711 -35.7711 -35.7625 -35.7625 -9.6516 -9.6516 -7.7815 -7.7815 -7.5386 -7.5386 -7.4830 -7.4830 -6.2275 -6.2275 -6.0055 -6.0055 -0.7730 -0.7730 -0.2034 -0.2034 -0.1796 -0.1796 2.1746 2.1746 2.2469 2.2469 2.4198 2.4198 2.5474 2.5474 2.6308 2.6308 3.8515 3.8515 4.1273 4.1273 4.4577 4.4577 4.5429 4.5429 5.4523 5.4523 6.2722 6.2722 6.3420 6.3420 6.3601 6.3601 6.6662 6.6662 7.0759 7.0759 13.1761 13.1761 13.3734 13.3734 13.4335 13.4335 14.0763 14.0763 14.7788 14.7788 k =-0.5000 0.2886 0.2019 ( 13852 PWs) bands (ev): -35.7713 -35.7713 -35.7624 -35.7624 -9.6769 -9.6769 -7.7941 -7.7941 -7.4884 -7.4884 -7.4864 -7.4864 -6.2222 -6.2222 -5.9895 -5.9895 -0.8467 -0.8467 -0.1592 -0.1592 -0.1317 -0.1317 2.1058 2.1058 2.2659 2.2659 2.3881 2.3881 2.4983 2.4983 2.6275 2.6275 3.8214 3.8214 4.1607 4.1607 4.4803 4.4803 4.5480 4.5480 5.4435 5.4435 6.2989 6.2989 6.3604 6.3604 6.3673 6.3673 6.6505 6.6505 7.0723 7.0723 13.2362 13.2362 13.3582 13.3582 13.4658 13.4658 14.0841 14.0841 14.7366 14.7366 k =-0.5000 0.2886 0.1851 ( 13864 PWs) bands (ev): -35.7714 -35.7714 -35.7623 -35.7623 -9.7002 -9.7002 -7.8060 -7.8060 -7.4933 -7.4933 -7.4371 -7.4371 -6.2173 -6.2173 -5.9743 -5.9743 -0.9164 -0.9164 -0.1150 -0.1150 -0.0830 -0.0830 2.0366 2.0366 2.2797 2.2797 2.3589 2.3589 2.4479 2.4479 2.6281 2.6281 3.7948 3.7948 4.1921 4.1921 4.5011 4.5011 4.5545 4.5545 5.4355 5.4355 6.3242 6.3242 6.3671 6.3671 6.3796 6.3796 6.6392 6.6392 7.0683 7.0683 13.2976 13.2976 13.3432 13.3432 13.5013 13.5013 14.0880 14.0880 14.6883 14.6883 k =-0.5000 0.2886 0.1682 ( 13856 PWs) bands (ev): -35.7715 -35.7715 -35.7622 -35.7622 -9.7215 -9.7215 -7.8169 -7.8169 -7.4982 -7.4982 -7.3907 -7.3907 -6.2127 -6.2127 -5.9601 -5.9601 -0.9816 -0.9816 -0.0712 -0.0712 -0.0338 -0.0338 1.9676 1.9676 2.2888 2.2888 2.3323 2.3323 2.3969 2.3969 2.6319 2.6319 3.7715 3.7715 4.2213 4.2213 4.5200 4.5200 4.5622 4.5622 5.4283 5.4283 6.3479 6.3479 6.3627 6.3627 6.3960 6.3960 6.6327 6.6327 7.0640 7.0640 13.3285 13.3285 13.3599 13.3599 13.5398 13.5398 14.0892 14.0892 14.6398 14.6398 k =-0.5000 0.2886 0.1514 ( 13866 PWs) bands (ev): -35.7717 -35.7717 -35.7620 -35.7620 -9.7409 -9.7409 -7.8269 -7.8269 -7.5028 -7.5028 -7.3475 -7.3475 -6.2084 -6.2084 -5.9470 -5.9470 -1.0419 -1.0419 -0.0282 -0.0282 0.0153 0.0153 1.8998 1.8998 2.2940 2.2940 2.3082 2.3082 2.3463 2.3463 2.6382 2.6382 3.7513 3.7513 4.2481 4.2481 4.5372 4.5372 4.5707 4.5707 5.4219 5.4219 6.3532 6.3532 6.3699 6.3699 6.4114 6.4114 6.6306 6.6306 7.0595 7.0595 13.3148 13.3148 13.4215 13.4215 13.5809 13.5809 14.0883 14.0883 14.5915 14.5915 k =-0.5000 0.2886 0.1346 ( 13868 PWs) bands (ev): -35.7718 -35.7718 -35.7620 -35.7620 -9.7582 -9.7582 -7.8360 -7.8360 -7.5070 -7.5070 -7.3079 -7.3079 -6.2046 -6.2046 -5.9349 -5.9349 -1.0971 -1.0971 0.0133 0.0133 0.0638 0.0638 1.8338 1.8338 2.2858 2.2858 2.2965 2.2965 2.2976 2.2976 2.6461 2.6461 3.7339 3.7339 4.2726 4.2726 4.5527 4.5527 4.5797 4.5797 5.4163 5.4163 6.3401 6.3401 6.3898 6.3898 6.4255 6.4255 6.6319 6.6319 7.0550 7.0550 13.3021 13.3021 13.4818 13.4818 13.6242 13.6242 14.0861 14.0861 14.5436 14.5436 k =-0.5000 0.2886 0.1178 ( 13872 PWs) bands (ev): -35.7718 -35.7718 -35.7619 -35.7619 -9.7735 -9.7735 -7.8441 -7.8441 -7.5108 -7.5108 -7.2721 -7.2721 -6.2011 -6.2011 -5.9241 -5.9241 -1.1467 -1.1467 0.0526 0.0526 0.1109 0.1109 1.7706 1.7706 2.2490 2.2490 2.2680 2.2680 2.2969 2.2969 2.6547 2.6547 3.7192 3.7192 4.2944 4.2944 4.5665 4.5665 4.5888 4.5888 5.4114 5.4114 6.3250 6.3250 6.4076 6.4076 6.4382 6.4382 6.6355 6.6355 7.0507 7.0507 13.2905 13.2905 13.5398 13.5398 13.6691 13.6691 14.0832 14.0832 14.4963 14.4963 k =-0.5000 0.2886 0.1009 ( 13880 PWs) bands (ev): -35.7719 -35.7719 -35.7618 -35.7618 -9.7868 -9.7868 -7.8512 -7.8512 -7.5142 -7.5142 -7.2405 -7.2405 -6.1981 -6.1981 -5.9146 -5.9146 -1.1904 -1.1904 0.0891 0.0891 0.1557 0.1557 1.7115 1.7115 2.2054 2.2054 2.2513 2.2513 2.2959 2.2959 2.6635 2.6635 3.7070 3.7070 4.3136 4.3136 4.5785 4.5785 4.5976 4.5976 5.4072 5.4072 6.3093 6.3093 6.4231 6.4231 6.4493 6.4493 6.6403 6.6403 7.0466 7.0466 13.2801 13.2801 13.5940 13.5940 13.7149 13.7149 14.0800 14.0800 14.4498 14.4498 k =-0.5000 0.2886 0.0841 ( 13886 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.7980 -9.7980 -7.8572 -7.8572 -7.5172 -7.5172 -7.2133 -7.2133 -6.1955 -6.1955 -5.9064 -5.9064 -1.2280 -1.2280 0.1218 0.1218 0.1973 0.1973 1.6575 1.6575 2.1659 2.1659 2.2373 2.2373 2.2942 2.2942 2.6716 2.6716 3.6969 3.6969 4.3300 4.3300 4.5888 4.5888 4.6057 4.6057 5.4037 5.4037 6.2942 6.2942 6.4364 6.4364 6.4589 6.4589 6.6454 6.6454 7.0429 7.0429 13.2711 13.2711 13.6433 13.6433 13.7607 13.7607 14.0768 14.0768 14.4045 14.4045 k =-0.5000 0.2886 0.0673 ( 13884 PWs) bands (ev): -35.7720 -35.7720 -35.7617 -35.7617 -9.8073 -9.8073 -7.8621 -7.8621 -7.5196 -7.5196 -7.1907 -7.1907 -6.1933 -6.1933 -5.8997 -5.8997 -1.2591 -1.2591 0.1501 0.1501 0.2342 0.2342 1.6102 1.6102 2.1318 2.1318 2.2258 2.2258 2.2922 2.2922 2.6788 2.6788 3.6890 3.6890 4.3435 4.3435 4.5972 4.5972 4.6129 4.6129 5.4009 5.4009 6.2806 6.2806 6.4472 6.4472 6.4668 6.4668 6.6502 6.6502 7.0398 7.0398 13.2635 13.2635 13.6862 13.6862 13.8052 13.8052 14.0738 14.0738 14.3614 14.3614 k =-0.5000 0.2886 0.0505 ( 13868 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8144 -9.8144 -7.8660 -7.8660 -7.5216 -7.5216 -7.1728 -7.1728 -6.1917 -6.1917 -5.8944 -5.8944 -1.2836 -1.2836 0.1732 0.1732 0.2652 0.2652 1.5711 1.5711 2.1040 2.1040 2.2169 2.2169 2.2904 2.2904 2.6846 2.6846 3.6829 3.6829 4.3541 4.3541 4.6038 4.6038 4.6189 4.6189 5.3988 5.3988 6.2694 6.2694 6.4557 6.4557 6.4730 6.4730 6.6544 6.6544 7.0373 7.0373 13.2576 13.2576 13.7214 13.7214 13.8464 13.8464 14.0714 14.0714 14.3217 14.3217 k =-0.5000 0.2886 0.0336 ( 13888 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8196 -9.8196 -7.8688 -7.8688 -7.5229 -7.5229 -7.1600 -7.1600 -6.1905 -6.1905 -5.8906 -5.8906 -1.3012 -1.3012 0.1902 0.1902 0.2887 0.2887 1.5417 1.5417 2.0835 2.0835 2.2106 2.2106 2.2889 2.2889 2.6890 2.6890 3.6787 3.6787 4.3617 4.3617 4.6086 4.6086 4.6233 4.6233 5.3973 5.3973 6.2610 6.2610 6.4618 6.4618 6.4775 6.4775 6.6575 6.6575 7.0354 7.0354 13.2533 13.2533 13.7476 13.7476 13.8813 13.8813 14.0695 14.0695 14.2882 14.2882 k =-0.5000 0.2886 0.0168 ( 13884 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8227 -9.8227 -7.8705 -7.8705 -7.5238 -7.5238 -7.1523 -7.1523 -6.1898 -6.1898 -5.8883 -5.8883 -1.3118 -1.3118 0.2007 0.2007 0.3034 0.3034 1.5234 1.5234 2.0709 2.0709 2.2068 2.2068 2.2880 2.2880 2.6916 2.6916 3.6762 3.6762 4.3663 4.3663 4.6114 4.6114 4.6261 4.6261 5.3963 5.3963 6.2558 6.2558 6.4654 6.4654 6.4802 6.4802 6.6595 6.6595 7.0342 7.0342 13.2507 13.2507 13.7638 13.7638 13.9057 13.9057 14.0683 14.0683 14.2648 14.2648 k =-0.5000 0.2886 0.0000 ( 13880 PWs) bands (ev): -35.7721 -35.7721 -35.7616 -35.7616 -9.8237 -9.8237 -7.8710 -7.8710 -7.5241 -7.5241 -7.1497 -7.1497 -6.1895 -6.1895 -5.8875 -5.8875 -1.3154 -1.3154 0.2042 0.2042 0.3084 0.3084 1.5172 1.5172 2.0666 2.0666 2.2055 2.2055 2.2877 2.2877 2.6925 2.6925 3.6753 3.6753 4.3678 4.3678 4.6124 4.6124 4.6270 4.6270 5.3960 5.3960 6.2540 6.2540 6.4666 6.4666 6.4811 6.4811 6.6601 6.6601 7.0339 7.0339 13.2498 13.2498 13.7692 13.7692 13.9147 13.9147 14.0680 14.0680 14.2562 14.2562 k = 0.0000 0.0000 0.5552 ( 13878 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0828 -9.0828 -9.0828 -9.0828 -7.2148 -7.2148 -7.2148 -7.2148 -5.8111 -5.8111 -5.8111 -5.8111 -1.5521 -1.5521 -1.5521 -1.5521 1.7379 1.7379 1.7379 1.7379 2.0597 2.0597 2.0597 2.0597 2.4228 2.4228 2.4228 2.4228 4.1554 4.1554 4.1554 4.1554 4.7619 4.7619 4.7619 4.7619 5.9335 5.9335 5.9335 5.9335 6.2379 6.2379 6.2379 6.2379 7.4284 7.4284 7.4284 7.4284 12.9960 12.9960 12.9960 12.9960 13.9413 13.9413 13.9413 13.9413 14.9298 14.9298 k =-0.0143 0.0082 0.5552 ( 13868 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0823 -9.0823 -9.0823 -9.0823 -7.2153 -7.2153 -7.2152 -7.2152 -5.8123 -5.8123 -5.8121 -5.8121 -1.5507 -1.5507 -1.5504 -1.5504 1.7337 1.7337 1.7349 1.7349 2.0623 2.0623 2.0640 2.0640 2.4243 2.4243 2.4248 2.4248 4.1546 4.1546 4.1548 4.1548 4.7635 4.7635 4.7637 4.7637 5.9295 5.9295 5.9298 5.9298 6.2374 6.2374 6.2375 6.2375 7.4290 7.4290 7.4292 7.4292 12.9954 12.9954 12.9958 12.9958 13.9427 13.9427 13.9432 13.9432 14.9232 14.9232 k =-0.0286 0.0165 0.5552 ( 13868 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0808 -9.0808 -9.0808 -9.0808 -7.2166 -7.2166 -7.2163 -7.2163 -5.8157 -5.8157 -5.8152 -5.8152 -1.5462 -1.5462 -1.5457 -1.5457 1.7229 1.7229 1.7252 1.7252 2.0714 2.0714 2.0745 2.0745 2.4294 2.4294 2.4303 2.4303 4.1525 4.1525 4.1529 4.1529 4.7684 4.7684 4.7688 4.7688 5.9180 5.9180 5.9186 5.9186 6.2360 6.2360 6.2361 6.2361 7.4306 7.4306 7.4310 7.4310 12.9939 12.9939 12.9948 12.9948 13.9472 13.9472 13.9484 13.9484 14.9059 14.9059 k =-0.0429 0.0247 0.5552 ( 13852 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0784 -9.0784 -9.0783 -9.0783 -7.2186 -7.2186 -7.2181 -7.2181 -5.8213 -5.8213 -5.8204 -5.8204 -1.5387 -1.5387 -1.5380 -1.5380 1.7067 1.7067 1.7098 1.7098 2.0861 2.0861 2.0903 2.0903 2.4378 2.4378 2.4392 2.4392 4.1490 4.1490 4.1496 4.1496 4.7766 4.7766 4.7772 4.7772 5.8993 5.8993 5.9002 5.9002 6.2337 6.2337 6.2339 6.2339 7.4333 7.4333 7.4339 7.4339 12.9918 12.9918 12.9931 12.9931 13.9548 13.9548 13.9564 13.9564 14.8804 14.8804 k =-0.0571 0.0330 0.5552 ( 13854 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0749 -9.0749 -9.0749 -9.0749 -7.2214 -7.2214 -7.2208 -7.2208 -5.8289 -5.8289 -5.8277 -5.8277 -1.5282 -1.5282 -1.5273 -1.5273 1.6861 1.6861 1.6898 1.6898 2.1053 2.1053 2.1104 2.1104 2.4494 2.4494 2.4512 2.4512 4.1442 4.1442 4.1450 4.1450 4.7879 4.7879 4.7888 4.7888 5.8737 5.8737 5.8749 5.8749 6.2305 6.2305 6.2307 6.2307 7.4366 7.4366 7.4373 7.4373 12.9890 12.9890 12.9908 12.9908 13.9647 13.9647 13.9669 13.9669 14.8492 14.8492 k =-0.0714 0.0412 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0705 -9.0705 -9.0704 -9.0704 -7.2250 -7.2250 -7.2242 -7.2242 -5.8384 -5.8384 -5.8371 -5.8371 -1.5148 -1.5148 -1.5137 -1.5137 1.6625 1.6625 1.6664 1.6664 2.1281 2.1281 2.1338 2.1338 2.4640 2.4640 2.4661 2.4661 4.1381 4.1381 4.1391 4.1391 4.8024 4.8024 4.8035 4.8035 5.8420 5.8420 5.8435 5.8435 6.2263 6.2263 6.2266 6.2266 7.4403 7.4403 7.4411 7.4411 12.9859 12.9859 12.9880 12.9880 13.9765 13.9765 13.9791 13.9791 14.8144 14.8144 k =-0.0857 0.0495 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0651 -9.0651 -9.0650 -9.0650 -7.2293 -7.2293 -7.2284 -7.2284 -5.8499 -5.8499 -5.8483 -5.8483 -1.4986 -1.4986 -1.4973 -1.4973 1.6365 1.6365 1.6406 1.6406 2.1537 2.1537 2.1598 2.1598 2.4812 2.4812 2.4837 2.4837 4.1306 4.1306 4.1318 4.1318 4.8199 4.8199 4.8212 4.8212 5.8047 5.8047 5.8064 5.8064 6.2212 6.2212 6.2216 6.2216 7.4438 7.4438 7.4447 7.4447 12.9825 12.9825 12.9850 12.9850 13.9891 13.9891 13.9921 13.9921 14.7778 14.7778 k =-0.1000 0.0577 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0589 -9.0589 -9.0587 -9.0587 -7.2344 -7.2344 -7.2334 -7.2334 -5.8632 -5.8632 -5.8613 -5.8613 -1.4797 -1.4797 -1.4782 -1.4782 1.6089 1.6089 1.6131 1.6131 2.1816 2.1816 2.1879 2.1879 2.5008 2.5008 2.5035 2.5035 4.1219 4.1219 4.1233 4.1233 4.8402 4.8402 4.8417 4.8417 5.7626 5.7626 5.7646 5.7646 6.2151 6.2151 6.2157 6.2157 7.4467 7.4467 7.4477 7.4477 12.9790 12.9790 12.9818 12.9818 14.0014 14.0014 14.0048 14.0048 14.7409 14.7409 k =-0.1143 0.0660 0.5552 ( 13826 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0517 -9.0517 -9.0516 -9.0516 -7.2402 -7.2402 -7.2390 -7.2390 -5.8780 -5.8780 -5.8760 -5.8760 -1.4582 -1.4582 -1.4566 -1.4566 1.5803 1.5803 1.5845 1.5845 2.2114 2.2114 2.2179 2.2179 2.5225 2.5225 2.5253 2.5253 4.1119 4.1119 4.1135 4.1135 4.8631 4.8631 4.8648 4.8648 5.7166 5.7166 5.7187 5.7187 6.2081 6.2081 6.2088 6.2088 7.4487 7.4487 7.4498 7.4498 12.9756 12.9756 12.9787 12.9787 14.0122 14.0122 14.0159 14.0159 14.7053 14.7053 k =-0.1286 0.0742 0.5552 ( 13846 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0436 -9.0436 -9.0435 -9.0435 -7.2467 -7.2467 -7.2454 -7.2454 -5.8944 -5.8944 -5.8921 -5.8921 -1.4343 -1.4343 -1.4325 -1.4325 1.5510 1.5510 1.5551 1.5551 2.2429 2.2429 2.2495 2.2495 2.5459 2.5459 2.5489 2.5489 4.1005 4.1005 4.1023 4.1023 4.8885 4.8885 4.8903 4.8903 5.6673 5.6673 5.6696 5.6696 6.2002 6.2002 6.2009 6.2009 7.4493 7.4493 7.4504 7.4504 12.9725 12.9725 12.9758 12.9758 14.0199 14.0199 14.0238 14.0238 14.6727 14.6727 k =-0.1429 0.0825 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0347 -9.0347 -9.0346 -9.0346 -7.2539 -7.2539 -7.2525 -7.2525 -5.9121 -5.9121 -5.9096 -5.9096 -1.4081 -1.4081 -1.4062 -1.4062 1.5213 1.5213 1.5253 1.5253 2.2759 2.2759 2.2824 2.2824 2.5708 2.5708 2.5740 2.5740 4.0878 4.0878 4.0898 4.0898 4.9160 4.9160 4.9180 4.9180 5.6158 5.6158 5.6183 5.6183 6.1913 6.1913 6.1922 6.1922 7.4483 7.4483 7.4494 7.4494 12.9697 12.9697 12.9732 12.9732 14.0229 14.0229 14.0268 14.0268 14.6446 14.6446 k =-0.1571 0.0907 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0251 -9.0251 -9.0249 -9.0249 -7.2618 -7.2618 -7.2603 -7.2603 -5.9309 -5.9309 -5.9283 -5.9283 -1.3798 -1.3798 -1.3778 -1.3778 1.4914 1.4914 1.4954 1.4954 2.3101 2.3101 2.3166 2.3166 2.5971 2.5971 2.6003 2.6003 4.0736 4.0736 4.0759 4.0759 4.9452 4.9452 4.9474 4.9474 5.5629 5.5629 5.5656 5.5656 6.1815 6.1815 6.1826 6.1826 7.4453 7.4453 7.4464 7.4464 12.9673 12.9673 12.9709 12.9709 14.0195 14.0195 14.0236 14.0236 14.6227 14.6227 k =-0.1714 0.0989 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0147 -9.0147 -9.0145 -9.0145 -7.2703 -7.2703 -7.2687 -7.2687 -5.9507 -5.9507 -5.9479 -5.9479 -1.3496 -1.3496 -1.3474 -1.3474 1.4616 1.4616 1.4655 1.4655 2.3454 2.3454 2.3517 2.3517 2.6245 2.6245 2.6278 2.6278 4.0581 4.0581 4.0606 4.0606 4.9756 4.9756 4.9780 4.9780 5.5097 5.5097 5.5126 5.5126 6.1709 6.1709 6.1720 6.1720 7.4401 7.4401 7.4413 7.4413 12.9653 12.9653 12.9691 12.9691 14.0089 14.0089 14.0129 14.0129 14.6078 14.6078 k =-0.1857 0.1072 0.5552 ( 13846 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -9.0036 -9.0036 -9.0034 -9.0034 -7.2794 -7.2794 -7.2777 -7.2777 -5.9713 -5.9713 -5.9684 -5.9684 -1.3177 -1.3177 -1.3154 -1.3154 1.4321 1.4321 1.4358 1.4358 2.3814 2.3814 2.3877 2.3877 2.6530 2.6530 2.6563 2.6563 4.0410 4.0410 4.0437 4.0437 5.0062 5.0062 5.0089 5.0089 5.4577 5.4577 5.4608 5.4608 6.1594 6.1594 6.1607 6.1607 7.4326 7.4326 7.4338 7.4338 12.9639 12.9639 12.9678 12.9678 13.9907 13.9907 13.9946 13.9946 14.6001 14.6001 k =-0.2000 0.1154 0.5552 ( 13856 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9919 -8.9919 -8.9917 -8.9917 -7.2891 -7.2891 -7.2874 -7.2874 -5.9924 -5.9924 -5.9895 -5.9895 -1.2842 -1.2842 -1.2819 -1.2819 1.4029 1.4029 1.4065 1.4065 2.4180 2.4180 2.4241 2.4241 2.6824 2.6824 2.6857 2.6857 4.0224 4.0224 4.0253 4.0253 5.0355 5.0355 5.0385 5.0385 5.4088 5.4088 5.4122 5.4122 6.1470 6.1470 6.1485 6.1485 7.4227 7.4227 7.4239 7.4239 12.9629 12.9629 12.9669 12.9669 13.9655 13.9655 13.9692 13.9692 14.5992 14.5992 k =-0.2143 0.1237 0.5552 ( 13842 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9796 -8.9796 -8.9794 -8.9794 -7.2993 -7.2993 -7.2975 -7.2975 -6.0140 -6.0140 -6.0110 -6.0110 -1.2495 -1.2495 -1.2471 -1.2471 1.3741 1.3741 1.3776 1.3776 2.4548 2.4548 2.4609 2.4609 2.7127 2.7127 2.7160 2.7160 4.0021 4.0021 4.0053 4.0053 5.0607 5.0607 5.0640 5.0640 5.3662 5.3662 5.3700 5.3700 6.1340 6.1340 6.1355 6.1355 7.4103 7.4103 7.4115 7.4115 12.9624 12.9624 12.9664 12.9664 13.9344 13.9344 13.9380 13.9380 14.6036 14.6036 k =-0.2286 0.1319 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9668 -8.9668 -8.9666 -8.9666 -7.3100 -7.3100 -7.3082 -7.3082 -6.0358 -6.0358 -6.0327 -6.0327 -1.2137 -1.2137 -1.2112 -1.2112 1.3460 1.3460 1.3494 1.3494 2.4915 2.4915 2.4975 2.4975 2.7438 2.7438 2.7472 2.7472 3.9801 3.9801 3.9836 3.9836 5.0768 5.0768 5.0804 5.0804 5.3354 5.3354 5.3395 5.3395 6.1202 6.1202 6.1219 6.1219 7.3954 7.3954 7.3967 7.3967 12.9623 12.9623 12.9663 12.9663 13.8990 13.8990 13.9023 13.9023 14.6118 14.6118 k =-0.2429 0.1402 0.5552 ( 13822 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9536 -8.9536 -8.9534 -8.9534 -7.3211 -7.3211 -7.3192 -7.3192 -6.0576 -6.0576 -6.0545 -6.0545 -1.1770 -1.1770 -1.1746 -1.1746 1.3186 1.3186 1.3218 1.3218 2.5279 2.5279 2.5338 2.5338 2.7759 2.7759 2.7793 2.7793 3.9565 3.9565 3.9602 3.9602 5.0775 5.0775 5.0811 5.0811 5.3232 5.3232 5.3273 5.3273 6.1058 6.1058 6.1076 6.1076 7.3782 7.3782 7.3795 7.3795 12.9625 12.9625 12.9665 12.9665 13.8606 13.8606 13.8637 13.8637 14.6222 14.6222 k =-0.2571 0.1484 0.5552 ( 13826 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9401 -8.9401 -8.9399 -8.9399 -7.3326 -7.3326 -7.3307 -7.3307 -6.0793 -6.0793 -6.0762 -6.0762 -1.1398 -1.1398 -1.1374 -1.1374 1.2919 1.2919 1.2950 1.2950 2.5636 2.5636 2.5694 2.5694 2.8088 2.8088 2.8122 2.8122 3.9312 3.9312 3.9351 3.9351 5.0608 5.0608 5.0638 5.0638 5.3321 5.3321 5.3357 5.3357 6.0909 6.0909 6.0927 6.0927 7.3586 7.3586 7.3601 7.3601 12.9629 12.9629 12.9669 12.9669 13.8206 13.8206 13.8234 13.8234 14.6334 14.6334 k =-0.2714 0.1567 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9264 -8.9264 -8.9262 -8.9262 -7.3443 -7.3443 -7.3424 -7.3424 -6.1006 -6.1006 -6.0976 -6.0976 -1.1023 -1.1023 -1.0999 -1.0999 1.2660 1.2660 1.2690 1.2690 2.5983 2.5983 2.6040 2.6040 2.8425 2.8425 2.8459 2.8459 3.9042 3.9042 3.9083 3.9083 5.0315 5.0315 5.0339 5.0339 5.3570 5.3570 5.3601 5.3601 6.0756 6.0756 6.0775 6.0775 7.3369 7.3369 7.3385 7.3385 12.9636 12.9636 12.9675 12.9675 13.7801 13.7801 13.7827 13.7827 14.6443 14.6443 k =-0.2857 0.1649 0.5552 ( 13832 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.9125 -8.9125 -8.9123 -8.9123 -7.3563 -7.3563 -7.3544 -7.3544 -6.1215 -6.1215 -6.1185 -6.1185 -1.0648 -1.0648 -1.0624 -1.0624 1.2412 1.2412 1.2440 1.2440 2.6319 2.6319 2.6375 2.6375 2.8769 2.8769 2.8803 2.8803 3.8757 3.8757 3.8800 3.8800 4.9961 4.9961 4.9980 4.9980 5.3912 5.3912 5.3938 5.3938 6.0599 6.0599 6.0619 6.0619 7.3132 7.3132 7.3149 7.3149 12.9644 12.9644 12.9682 12.9682 13.7399 13.7399 13.7423 13.7423 14.6540 14.6540 k =-0.3000 0.1732 0.5552 ( 13838 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8986 -8.8986 -8.8984 -8.8984 -7.3683 -7.3683 -7.3665 -7.3665 -6.1417 -6.1417 -6.1388 -6.1388 -1.0275 -1.0275 -1.0252 -1.0252 1.2173 1.2173 1.2200 1.2200 2.6640 2.6640 2.6695 2.6695 2.9118 2.9118 2.9151 2.9151 3.8458 3.8458 3.8502 3.8502 4.9587 4.9587 4.9603 4.9603 5.4306 5.4306 5.4329 5.4329 6.0442 6.0442 6.0462 6.0462 7.2878 7.2878 7.2895 7.2895 12.9652 12.9652 12.9689 12.9689 13.7009 13.7009 13.7031 13.7031 14.6617 14.6617 k =-0.3143 0.1814 0.5552 ( 13834 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8849 -8.8849 -8.8846 -8.8846 -7.3804 -7.3804 -7.3786 -7.3786 -6.1611 -6.1611 -6.1583 -6.1583 -0.9908 -0.9908 -0.9886 -0.9886 1.1945 1.1945 1.1971 1.1971 2.6947 2.6947 2.7001 2.7001 2.9469 2.9469 2.9502 2.9502 3.8148 3.8148 3.8193 3.8193 4.9218 4.9218 4.9231 4.9231 5.4727 5.4727 5.4747 5.4747 6.0284 6.0284 6.0305 6.0305 7.2608 7.2608 7.2626 7.2626 12.9661 12.9661 12.9696 12.9696 13.6635 13.6635 13.6655 13.6655 14.6671 14.6671 k =-0.3286 0.1896 0.5552 ( 13830 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8713 -8.8713 -8.8711 -8.8711 -7.3923 -7.3923 -7.3906 -7.3906 -6.1796 -6.1796 -6.1769 -6.1769 -0.9550 -0.9550 -0.9528 -0.9528 1.1729 1.1729 1.1753 1.1753 2.7238 2.7238 2.7291 2.7291 2.9819 2.9819 2.9851 2.9851 3.7829 3.7829 3.7875 3.7875 4.8865 4.8865 4.8876 4.8876 5.5161 5.5161 5.5178 5.5178 6.0129 6.0129 6.0151 6.0151 7.2326 7.2326 7.2345 7.2345 12.9668 12.9668 12.9701 12.9701 13.6282 13.6282 13.6300 13.6300 14.6699 14.6699 k =-0.3429 0.1979 0.5552 ( 13836 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8581 -8.8581 -8.8579 -8.8579 -7.4040 -7.4040 -7.4024 -7.4024 -6.1970 -6.1970 -6.1945 -6.1945 -0.9204 -0.9204 -0.9183 -0.9183 1.1525 1.1525 1.1548 1.1548 2.7514 2.7514 2.7565 2.7565 3.0164 3.0164 3.0195 3.0195 3.7505 3.7505 3.7551 3.7551 4.8535 4.8535 4.8544 4.8544 5.5597 5.5597 5.5611 5.5611 5.9978 5.9978 6.0001 6.0001 7.2035 7.2035 7.2055 7.2055 12.9675 12.9675 12.9706 12.9706 13.5953 13.5953 13.5969 13.5969 14.6701 14.6701 k =-0.3571 0.2061 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8453 -8.8453 -8.8451 -8.8451 -7.4154 -7.4154 -7.4138 -7.4138 -6.2133 -6.2133 -6.2109 -6.2109 -0.8872 -0.8872 -0.8853 -0.8853 1.1334 1.1334 1.1356 1.1356 2.7774 2.7774 2.7824 2.7824 3.0498 3.0498 3.0529 3.0529 3.7181 3.7181 3.7227 3.7227 4.8232 4.8232 4.8240 4.8240 5.6026 5.6026 5.6038 5.6038 5.9835 5.9835 5.9860 5.9860 7.1740 7.1740 7.1760 7.1760 12.9680 12.9680 12.9709 12.9709 13.5650 13.5650 13.5665 13.5665 14.6678 14.6678 k =-0.3714 0.2144 0.5552 ( 13850 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8332 -8.8332 -8.8331 -8.8331 -7.4263 -7.4263 -7.4248 -7.4248 -6.2282 -6.2282 -6.2260 -6.2260 -0.8559 -0.8559 -0.8541 -0.8541 1.1158 1.1158 1.1178 1.1178 2.8019 2.8019 2.8067 2.8067 3.0817 3.0817 3.0847 3.0847 3.6862 3.6862 3.6906 3.6906 4.7957 4.7957 4.7965 4.7965 5.6441 5.6441 5.6451 5.6451 5.9704 5.9704 5.9730 5.9730 7.1443 7.1443 7.1463 7.1463 12.9684 12.9684 12.9711 12.9711 13.5376 13.5376 13.5388 13.5388 14.6632 14.6632 k =-0.3857 0.2226 0.5552 ( 13856 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8219 -8.8219 -8.8217 -8.8217 -7.4365 -7.4365 -7.4352 -7.4352 -6.2419 -6.2419 -6.2398 -6.2398 -0.8268 -0.8268 -0.8252 -0.8252 1.0997 1.0997 1.1015 1.1015 2.8248 2.8248 2.8294 2.8294 3.1117 3.1117 3.1146 3.1146 3.6553 3.6553 3.6595 3.6595 4.7713 4.7713 4.7719 4.7719 5.6830 5.6830 5.6842 5.6842 5.9588 5.9588 5.9617 5.9617 7.1151 7.1151 7.1171 7.1171 12.9687 12.9687 12.9711 12.9711 13.5130 13.5130 13.5141 13.5141 14.6569 14.6569 k =-0.4000 0.2309 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8115 -8.8115 -8.8113 -8.8113 -7.4459 -7.4459 -7.4448 -7.4448 -6.2540 -6.2540 -6.2522 -6.2522 -0.8001 -0.8001 -0.7987 -0.7987 1.0852 1.0852 1.0868 1.0868 2.8460 2.8460 2.8504 2.8504 3.1391 3.1391 3.1419 3.1419 3.6261 3.6261 3.6300 3.6300 4.7498 4.7498 4.7503 4.7503 5.7185 5.7185 5.7200 5.7200 5.9493 5.9493 5.9525 5.9525 7.0868 7.0868 7.0887 7.0887 12.9689 12.9689 12.9710 12.9710 13.4914 13.4914 13.4923 13.4923 14.6492 14.6492 k =-0.4143 0.2391 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.8021 -8.8021 -8.8020 -8.8020 -7.4545 -7.4545 -7.4534 -7.4534 -6.2647 -6.2647 -6.2631 -6.2631 -0.7763 -0.7763 -0.7750 -0.7750 1.0724 1.0724 1.0737 1.0737 2.8655 2.8655 2.8695 2.8695 3.1636 3.1636 3.1662 3.1662 3.5991 3.5991 3.6027 3.6027 4.7312 4.7312 4.7317 4.7317 5.7494 5.7494 5.7513 5.7513 5.9426 5.9426 5.9462 5.9462 7.0602 7.0602 7.0620 7.0620 12.9690 12.9690 12.9708 12.9708 13.4728 13.4728 13.4735 13.4735 14.6409 14.6409 k =-0.4286 0.2474 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7939 -8.7939 -8.7938 -8.7938 -7.4619 -7.4619 -7.4610 -7.4610 -6.2737 -6.2737 -6.2724 -6.2724 -0.7555 -0.7555 -0.7544 -0.7544 1.0613 1.0613 1.0625 1.0625 2.8830 2.8830 2.8866 2.8866 3.1846 3.1846 3.1871 3.1871 3.5751 3.5751 3.5782 3.5782 4.7156 4.7156 4.7160 4.7160 5.7746 5.7746 5.7769 5.7769 5.9394 5.9394 5.9432 5.9432 7.0358 7.0358 7.0375 7.0375 12.9690 12.9690 12.9705 12.9705 13.4571 13.4571 13.4577 13.4577 14.6325 14.6325 k =-0.4429 0.2556 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7871 -8.7871 -8.7870 -8.7870 -7.4682 -7.4682 -7.4675 -7.4675 -6.2812 -6.2812 -6.2801 -6.2801 -0.7381 -0.7381 -0.7372 -0.7372 1.0522 1.0522 1.0532 1.0532 2.8982 2.8982 2.9013 2.9013 3.2021 3.2021 3.2042 3.2042 3.5546 3.5546 3.5572 3.5572 4.7029 4.7029 4.7032 4.7032 5.7934 5.7934 5.7959 5.7959 5.9401 5.9401 5.9438 5.9438 7.0145 7.0145 7.0159 7.0159 12.9690 12.9690 12.9702 12.9702 13.4443 13.4443 13.4448 13.4448 14.6247 14.6247 k =-0.4571 0.2639 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7816 -8.7816 -8.7815 -8.7815 -7.4732 -7.4732 -7.4727 -7.4727 -6.2870 -6.2870 -6.2862 -6.2862 -0.7242 -0.7242 -0.7235 -0.7235 1.0450 1.0450 1.0458 1.0458 2.9108 2.9108 2.9132 2.9132 3.2156 3.2156 3.2174 3.2174 3.5382 3.5382 3.5402 3.5402 4.6931 4.6931 4.6933 4.6933 5.8060 5.8060 5.8082 5.8082 5.9439 5.9439 5.9471 5.9471 6.9970 6.9970 6.9981 6.9981 12.9690 12.9690 12.9699 12.9699 13.4345 13.4345 13.4349 13.4349 14.6180 14.6180 k =-0.4714 0.2721 0.5552 ( 13848 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7776 -8.7776 -8.7775 -8.7775 -7.4768 -7.4768 -7.4764 -7.4764 -6.2911 -6.2911 -6.2906 -6.2906 -0.7141 -0.7141 -0.7137 -0.7137 1.0399 1.0399 1.0404 1.0404 2.9203 2.9203 2.9220 2.9220 3.2253 3.2253 3.2266 3.2266 3.5264 3.5264 3.5278 3.5278 4.6861 4.6861 4.6862 4.6862 5.8135 5.8135 5.8151 5.8151 5.9491 5.9491 5.9514 5.9514 6.9839 6.9839 6.9847 6.9847 12.9690 12.9690 12.9696 12.9696 13.4275 13.4275 13.4278 13.4278 14.6130 14.6130 k =-0.4857 0.2803 0.5552 ( 13844 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7752 -8.7752 -8.7751 -8.7751 -7.4790 -7.4790 -7.4788 -7.4788 -6.2936 -6.2936 -6.2933 -6.2933 -0.7080 -0.7080 -0.7078 -0.7078 1.0368 1.0368 1.0371 1.0371 2.9264 2.9264 2.9272 2.9272 3.2311 3.2311 3.2318 3.2318 3.5194 3.5194 3.5200 3.5200 4.6819 4.6819 4.6820 4.6820 5.8174 5.8174 5.8182 5.8182 5.9535 5.9535 5.9547 5.9547 6.9759 6.9759 6.9763 6.9763 12.9690 12.9690 12.9693 12.9693 13.4234 13.4234 13.4235 13.4235 14.6100 14.6100 k =-0.5000 0.2886 0.5552 ( 13824 PWs) bands (ev): -35.7668 -35.7668 -35.7668 -35.7668 -8.7744 -8.7744 -8.7744 -8.7744 -7.4796 -7.4796 -7.4796 -7.4796 -6.2943 -6.2943 -6.2943 -6.2943 -0.7059 -0.7059 -0.7059 -0.7059 1.0359 1.0359 1.0359 1.0359 2.9287 2.9287 2.9287 2.9287 3.2333 3.2333 3.2333 3.2333 3.5172 3.5172 3.5172 3.5172 4.6805 4.6805 4.6805 4.6805 5.8188 5.8188 5.8188 5.8188 5.9556 5.9556 5.9556 5.9556 6.9733 6.9733 6.9733 6.9733 12.9692 12.9692 12.9692 12.9692 13.4220 13.4220 13.4220 13.4220 14.6093 14.6093 Writing output data file LiSi2N3.save init_run : 4.43s CPU 13.42s WALL ( 1 calls) electrons : 1790.78s CPU 1808.88s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.33s CPU 1.57s WALL ( 1 calls) Called by electrons: c_bands : 1790.72s CPU 1808.59s WALL ( 1 calls) v_of_rho : 0.14s CPU 0.98s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.13s CPU 0.59s WALL ( 1 calls) newd : 0.46s CPU 0.73s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.35s CPU 0.53s WALL ( 374 calls) cegterg : 1634.99s CPU 1649.09s WALL ( 821 calls) Called by sum_band: Called by *egterg: h_psi : 926.79s CPU 937.43s WALL ( 14141 calls) s_psi : 108.36s CPU 108.70s WALL ( 14141 calls) g_psi : 2.72s CPU 2.70s WALL ( 12946 calls) cdiaghg : 392.32s CPU 389.12s WALL ( 13320 calls) cegterg:over : 144.45s CPU 142.20s WALL ( 12946 calls) cegterg:upda : 62.76s CPU 67.00s WALL ( 12946 calls) cegterg:last : 42.34s CPU 43.09s WALL ( 1946 calls) Called by h_psi: h_psi:vloc : 694.96s CPU 702.50s WALL ( 14141 calls) h_psi:vnl : 229.93s CPU 232.12s WALL ( 14141 calls) add_vuspsi : 92.34s CPU 97.22s WALL ( 14141 calls) General routines calbec : 137.50s CPU 134.74s WALL ( 14141 calls) fft : 0.14s CPU 1.47s WALL ( 15 calls) fftw : 649.20s CPU 654.22s WALL ( 1586084 calls) davcio : 0.04s CPU 3.66s WALL ( 748 calls) Parallel routines fft_scatter : 289.82s CPU 289.64s WALL ( 1586099 calls) PWSCF : 31m55.73s CPU 35m38.62s WALL This run was terminated on: 8:31:47 14Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=