Program PWSCF v.5.1.1 starts on 26Oct2016 at 11:57:43 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 64 processors R & G space division: proc/nbgrp/npool/nimage = 64 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: ./Cs3LiCl4.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: scalapack distributed-memory algorithm (size of sub-group: 5* 5 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 54 54 15 4806 4806 677 Max 55 55 16 4821 4821 687 Sum 3499 3499 961 308113 308113 43693 bravais-lattice index = 14 lattice parameter (alat) = 13.1951 a.u. unit-cell volume = 2180.6767 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.195139 celldm(2)= 1.000000 celldm(3)= 1.546709 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.789556 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.789556 0.613678 0.000000 ) a(3) = ( 0.000000 0.000000 1.546709 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.286596 -0.000000 ) b(2) = ( 0.000000 1.629518 -0.000000 ) b(3) = ( 0.000000 0.000000 0.646534 ) PseudoPot. # 1 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Li read from file: /users/gautes/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. # 3 for Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 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 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential Cl 7.00 35.45300 Cl( 1.00) Li 3.00 6.94100 Li( 1.00) Cs 9.00 132.90550 Cs( 1.00) 2 Sym. Ops. (no inversion) found 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s 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 s 2 -E -1 -s -2 Cartesian axes number of k points= 286 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 2) = ( 0.0071641 0.0208913 -0.0000000), wk = 0.0034965 k( 3) = ( 0.0143281 0.0417825 -0.0000000), wk = 0.0034965 k( 4) = ( 0.0214922 0.0626738 -0.0000000), wk = 0.0034965 k( 5) = ( 0.0286563 0.0835651 -0.0000000), wk = 0.0034965 k( 6) = ( 0.0358204 0.1044563 -0.0000000), wk = 0.0034965 k( 7) = ( 0.0429844 0.1253476 -0.0000000), wk = 0.0034965 k( 8) = ( 0.0501485 0.1462388 -0.0000000), wk = 0.0034965 k( 9) = ( 0.0573126 0.1671301 -0.0000000), wk = 0.0034965 k( 10) = ( 0.0644767 0.1880213 -0.0000000), wk = 0.0034965 k( 11) = ( 0.0716407 0.2089126 -0.0000000), wk = 0.0034965 k( 12) = ( 0.0788048 0.2298039 -0.0000000), wk = 0.0034965 k( 13) = ( 0.0859689 0.2506952 -0.0000000), wk = 0.0034965 k( 14) = ( 0.0931330 0.2715864 -0.0000000), wk = 0.0034965 k( 15) = ( 0.1002970 0.2924777 -0.0000000), wk = 0.0034965 k( 16) = ( 0.1074611 0.3133689 -0.0000000), wk = 0.0034965 k( 17) = ( 0.1146252 0.3342602 -0.0000000), wk = 0.0034965 k( 18) = ( 0.1217893 0.3551515 -0.0000000), wk = 0.0034965 k( 19) = ( 0.1289533 0.3760427 -0.0000000), wk = 0.0034965 k( 20) = ( 0.1361174 0.3969340 -0.0000000), wk = 0.0034965 k( 21) = ( 0.1432815 0.4178252 -0.0000000), wk = 0.0034965 k( 22) = ( 0.1504456 0.4387165 -0.0000000), wk = 0.0034965 k( 23) = ( 0.1576096 0.4596077 -0.0000000), wk = 0.0034965 k( 24) = ( 0.1647737 0.4804990 -0.0000000), wk = 0.0034965 k( 25) = ( 0.1719378 0.5013903 -0.0000000), wk = 0.0034965 k( 26) = ( 0.1791019 0.5222816 -0.0000000), wk = 0.0034965 k( 27) = ( 0.1862659 0.5431728 -0.0000000), wk = 0.0034965 k( 28) = ( 0.1934300 0.5640641 -0.0000000), wk = 0.0034965 k( 29) = ( 0.2005941 0.5849553 -0.0000000), wk = 0.0034965 k( 30) = ( 0.2077581 0.6058466 -0.0000000), wk = 0.0034965 k( 31) = ( 0.2149222 0.6267378 -0.0000000), wk = 0.0034965 k( 32) = ( 0.2220863 0.6476291 -0.0000000), wk = 0.0034965 k( 33) = ( 0.2292504 0.6685204 -0.0000000), wk = 0.0034965 k( 34) = ( 0.2364144 0.6894116 -0.0000000), wk = 0.0034965 k( 35) = ( 0.2435785 0.7103029 -0.0000000), wk = 0.0034965 k( 36) = ( 0.2507426 0.7311941 -0.0000000), wk = 0.0034965 k( 37) = ( 0.2579067 0.7520854 -0.0000000), wk = 0.0034965 k( 38) = ( 0.2650707 0.7729767 -0.0000000), wk = 0.0034965 k( 39) = ( 0.2722348 0.7938680 -0.0000000), wk = 0.0034965 k( 40) = ( 0.2793989 0.8147592 -0.0000000), wk = 0.0034965 k( 41) = ( 0.2793989 0.8147592 -0.0000000), wk = 0.0034965 k( 42) = ( 0.2579067 0.8147592 -0.0000000), wk = 0.0034965 k( 43) = ( 0.2364144 0.8147592 -0.0000000), wk = 0.0034965 k( 44) = ( 0.2149222 0.8147592 -0.0000000), wk = 0.0034965 k( 45) = ( 0.1934300 0.8147592 -0.0000000), wk = 0.0034965 k( 46) = ( 0.1719378 0.8147592 -0.0000000), wk = 0.0034965 k( 47) = ( 0.1504456 0.8147592 -0.0000000), wk = 0.0034965 k( 48) = ( 0.1289533 0.8147592 -0.0000000), wk = 0.0034965 k( 49) = ( 0.1074611 0.8147592 -0.0000000), wk = 0.0034965 k( 50) = ( 0.0859689 0.8147592 -0.0000000), wk = 0.0034965 k( 51) = ( 0.0644767 0.8147592 -0.0000000), wk = 0.0034965 k( 52) = ( 0.0429844 0.8147592 -0.0000000), wk = 0.0034965 k( 53) = ( 0.0214922 0.8147592 -0.0000000), wk = 0.0034965 k( 54) = ( 0.0000000 0.8147592 -0.0000000), wk = 0.0034965 k( 55) = ( 0.0000000 0.8147592 -0.0000000), wk = 0.0034965 k( 56) = ( 0.0000000 0.8147592 0.0215511), wk = 0.0034965 k( 57) = ( 0.0000000 0.8147592 0.0431023), wk = 0.0034965 k( 58) = ( 0.0000000 0.8147592 0.0646534), wk = 0.0034965 k( 59) = ( 0.0000000 0.8147592 0.0862045), wk = 0.0034965 k( 60) = ( 0.0000000 0.8147592 0.1077557), wk = 0.0034965 k( 61) = ( 0.0000000 0.8147592 0.1293068), wk = 0.0034965 k( 62) = ( 0.0000000 0.8147592 0.1508579), wk = 0.0034965 k( 63) = ( 0.0000000 0.8147592 0.1724091), wk = 0.0034965 k( 64) = ( 0.0000000 0.8147592 0.1939602), wk = 0.0034965 k( 65) = ( 0.0000000 0.8147592 0.2155113), wk = 0.0034965 k( 66) = ( 0.0000000 0.8147592 0.2370625), wk = 0.0034965 k( 67) = ( 0.0000000 0.8147592 0.2586136), wk = 0.0034965 k( 68) = ( 0.0000000 0.8147592 0.2801647), wk = 0.0034965 k( 69) = ( 0.0000000 0.8147592 0.3017159), wk = 0.0034965 k( 70) = ( 0.0000000 0.8147592 0.3232670), wk = 0.0034965 k( 71) = ( 0.0000000 0.8147592 0.3232670), wk = 0.0034965 k( 72) = ( 0.0214922 0.8147592 0.3232670), wk = 0.0034965 k( 73) = ( 0.0429844 0.8147592 0.3232670), wk = 0.0034965 k( 74) = ( 0.0644767 0.8147592 0.3232670), wk = 0.0034965 k( 75) = ( 0.0859689 0.8147592 0.3232670), wk = 0.0034965 k( 76) = ( 0.1074611 0.8147592 0.3232670), wk = 0.0034965 k( 77) = ( 0.1289533 0.8147592 0.3232670), wk = 0.0034965 k( 78) = ( 0.1504456 0.8147592 0.3232670), wk = 0.0034965 k( 79) = ( 0.1719378 0.8147592 0.3232670), wk = 0.0034965 k( 80) = ( 0.1934300 0.8147592 0.3232670), wk = 0.0034965 k( 81) = ( 0.2149222 0.8147592 0.3232670), wk = 0.0034965 k( 82) = ( 0.2364144 0.8147592 0.3232670), wk = 0.0034965 k( 83) = ( 0.2579067 0.8147592 0.3232670), wk = 0.0034965 k( 84) = ( 0.2793989 0.8147592 0.3232670), wk = 0.0034965 k( 85) = ( 0.2793989 0.8147592 0.3232670), wk = 0.0034965 k( 86) = ( 0.2722348 0.7938680 0.3232670), wk = 0.0034965 k( 87) = ( 0.2650707 0.7729767 0.3232670), wk = 0.0034965 k( 88) = ( 0.2579067 0.7520854 0.3232670), wk = 0.0034965 k( 89) = ( 0.2507426 0.7311941 0.3232670), wk = 0.0034965 k( 90) = ( 0.2435785 0.7103029 0.3232670), wk = 0.0034965 k( 91) = ( 0.2364144 0.6894116 0.3232670), wk = 0.0034965 k( 92) = ( 0.2292504 0.6685204 0.3232670), wk = 0.0034965 k( 93) = ( 0.2220863 0.6476291 0.3232670), wk = 0.0034965 k( 94) = ( 0.2149222 0.6267378 0.3232670), wk = 0.0034965 k( 95) = ( 0.2077581 0.6058466 0.3232670), wk = 0.0034965 k( 96) = ( 0.2005941 0.5849553 0.3232670), wk = 0.0034965 k( 97) = ( 0.1934300 0.5640641 0.3232670), wk = 0.0034965 k( 98) = ( 0.1862659 0.5431728 0.3232670), wk = 0.0034965 k( 99) = ( 0.1791019 0.5222816 0.3232670), wk = 0.0034965 k( 100) = ( 0.1719378 0.5013903 0.3232670), wk = 0.0034965 k( 101) = ( 0.1647737 0.4804990 0.3232670), wk = 0.0034965 k( 102) = ( 0.1576096 0.4596077 0.3232670), wk = 0.0034965 k( 103) = ( 0.1504456 0.4387165 0.3232670), wk = 0.0034965 k( 104) = ( 0.1432815 0.4178252 0.3232670), wk = 0.0034965 k( 105) = ( 0.1361174 0.3969340 0.3232670), wk = 0.0034965 k( 106) = ( 0.1289533 0.3760427 0.3232670), wk = 0.0034965 k( 107) = ( 0.1217893 0.3551515 0.3232670), wk = 0.0034965 k( 108) = ( 0.1146252 0.3342602 0.3232670), wk = 0.0034965 k( 109) = ( 0.1074611 0.3133689 0.3232670), wk = 0.0034965 k( 110) = ( 0.1002970 0.2924777 0.3232670), wk = 0.0034965 k( 111) = ( 0.0931330 0.2715864 0.3232670), wk = 0.0034965 k( 112) = ( 0.0859689 0.2506952 0.3232670), wk = 0.0034965 k( 113) = ( 0.0788048 0.2298039 0.3232670), wk = 0.0034965 k( 114) = ( 0.0716407 0.2089126 0.3232670), wk = 0.0034965 k( 115) = ( 0.0644767 0.1880213 0.3232670), wk = 0.0034965 k( 116) = ( 0.0573126 0.1671301 0.3232670), wk = 0.0034965 k( 117) = ( 0.0501485 0.1462388 0.3232670), wk = 0.0034965 k( 118) = ( 0.0429844 0.1253476 0.3232670), wk = 0.0034965 k( 119) = ( 0.0358204 0.1044563 0.3232670), wk = 0.0034965 k( 120) = ( 0.0286563 0.0835651 0.3232670), wk = 0.0034965 k( 121) = ( 0.0214922 0.0626738 0.3232670), wk = 0.0034965 k( 122) = ( 0.0143281 0.0417825 0.3232670), wk = 0.0034965 k( 123) = ( 0.0071641 0.0208913 0.3232670), wk = 0.0034965 k( 124) = ( 0.0000000 0.0000000 0.3232670), wk = 0.0034965 k( 125) = ( 0.0000000 0.0000000 0.3232670), wk = 0.0034965 k( 126) = ( 0.0000000 0.0000000 0.3017159), wk = 0.0034965 k( 127) = ( 0.0000000 0.0000000 0.2801647), wk = 0.0034965 k( 128) = ( 0.0000000 0.0000000 0.2586136), wk = 0.0034965 k( 129) = ( 0.0000000 0.0000000 0.2370625), wk = 0.0034965 k( 130) = ( 0.0000000 0.0000000 0.2155113), wk = 0.0034965 k( 131) = ( 0.0000000 0.0000000 0.1939602), wk = 0.0034965 k( 132) = ( 0.0000000 0.0000000 0.1724091), wk = 0.0034965 k( 133) = ( 0.0000000 0.0000000 0.1508579), wk = 0.0034965 k( 134) = ( 0.0000000 0.0000000 0.1293068), wk = 0.0034965 k( 135) = ( 0.0000000 0.0000000 0.1077557), wk = 0.0034965 k( 136) = ( 0.0000000 0.0000000 0.0862045), wk = 0.0034965 k( 137) = ( 0.0000000 0.0000000 0.0646534), wk = 0.0034965 k( 138) = ( 0.0000000 0.0000000 0.0431023), wk = 0.0034965 k( 139) = ( 0.0000000 0.0000000 0.0215511), wk = 0.0034965 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 142) = ( -0.0208333 0.0071442 0.0000000), wk = 0.0034965 k( 143) = ( -0.0416667 0.0142884 0.0000000), wk = 0.0034965 k( 144) = ( -0.0625000 0.0214326 0.0000000), wk = 0.0034965 k( 145) = ( -0.0833333 0.0285768 0.0000000), wk = 0.0034965 k( 146) = ( -0.1041667 0.0357210 0.0000000), wk = 0.0034965 k( 147) = ( -0.1250000 0.0428653 0.0000000), wk = 0.0034965 k( 148) = ( -0.1458333 0.0500095 0.0000000), wk = 0.0034965 k( 149) = ( -0.1666667 0.0571537 0.0000000), wk = 0.0034965 k( 150) = ( -0.1875000 0.0642979 0.0000000), wk = 0.0034965 k( 151) = ( -0.2083333 0.0714421 0.0000000), wk = 0.0034965 k( 152) = ( -0.2291667 0.0785863 0.0000000), wk = 0.0034965 k( 153) = ( -0.2500000 0.0857305 0.0000000), wk = 0.0034965 k( 154) = ( -0.2708333 0.0928747 0.0000000), wk = 0.0034965 k( 155) = ( -0.2916667 0.1000189 0.0000000), wk = 0.0034965 k( 156) = ( -0.3125000 0.1071631 0.0000000), wk = 0.0034965 k( 157) = ( -0.3333333 0.1143073 0.0000000), wk = 0.0034965 k( 158) = ( -0.3541667 0.1214516 0.0000000), wk = 0.0034965 k( 159) = ( -0.3750000 0.1285958 0.0000000), wk = 0.0034965 k( 160) = ( -0.3958333 0.1357400 0.0000000), wk = 0.0034965 k( 161) = ( -0.4166667 0.1428842 0.0000000), wk = 0.0034965 k( 162) = ( -0.4375000 0.1500284 0.0000000), wk = 0.0034965 k( 163) = ( -0.4583333 0.1571726 0.0000000), wk = 0.0034965 k( 164) = ( -0.4791667 0.1643168 0.0000000), wk = 0.0034965 k( 165) = ( -0.5000000 0.1714610 0.0000000), wk = 0.0034965 k( 166) = ( -0.5000000 0.1714610 0.0000000), wk = 0.0034965 k( 167) = ( -0.4928838 0.1922126 -0.0000000), wk = 0.0034965 k( 168) = ( -0.4857677 0.2129641 -0.0000000), wk = 0.0034965 k( 169) = ( -0.4786515 0.2337157 -0.0000000), wk = 0.0034965 k( 170) = ( -0.4715353 0.2544672 -0.0000000), wk = 0.0034965 k( 171) = ( -0.4644192 0.2752188 -0.0000000), wk = 0.0034965 k( 172) = ( -0.4573030 0.2959703 -0.0000000), wk = 0.0034965 k( 173) = ( -0.4501868 0.3167219 -0.0000000), wk = 0.0034965 k( 174) = ( -0.4430707 0.3374734 -0.0000000), wk = 0.0034965 k( 175) = ( -0.4359545 0.3582250 -0.0000000), wk = 0.0034965 k( 176) = ( -0.4288383 0.3789766 -0.0000000), wk = 0.0034965 k( 177) = ( -0.4217222 0.3997281 -0.0000000), wk = 0.0034965 k( 178) = ( -0.4146060 0.4204797 -0.0000000), wk = 0.0034965 k( 179) = ( -0.4074898 0.4412312 -0.0000000), wk = 0.0034965 k( 180) = ( -0.4003737 0.4619828 -0.0000000), wk = 0.0034965 k( 181) = ( -0.3932575 0.4827343 -0.0000000), wk = 0.0034965 k( 182) = ( -0.3861414 0.5034859 -0.0000000), wk = 0.0034965 k( 183) = ( -0.3790252 0.5242374 -0.0000000), wk = 0.0034965 k( 184) = ( -0.3719090 0.5449890 -0.0000000), wk = 0.0034965 k( 185) = ( -0.3647929 0.5657406 -0.0000000), wk = 0.0034965 k( 186) = ( -0.3576767 0.5864921 -0.0000000), wk = 0.0034965 k( 187) = ( -0.3505605 0.6072437 -0.0000000), wk = 0.0034965 k( 188) = ( -0.3434444 0.6279952 -0.0000000), wk = 0.0034965 k( 189) = ( -0.3363282 0.6487468 -0.0000000), wk = 0.0034965 k( 190) = ( -0.3292120 0.6694983 -0.0000000), wk = 0.0034965 k( 191) = ( -0.3220959 0.6902499 -0.0000000), wk = 0.0034965 k( 192) = ( -0.3149797 0.7110014 -0.0000000), wk = 0.0034965 k( 193) = ( -0.3078635 0.7317530 -0.0000000), wk = 0.0034965 k( 194) = ( -0.3007474 0.7525046 -0.0000000), wk = 0.0034965 k( 195) = ( -0.2936312 0.7732561 -0.0000000), wk = 0.0034965 k( 196) = ( -0.2865150 0.7940077 -0.0000000), wk = 0.0034965 k( 197) = ( -0.2793989 0.8147592 -0.0000000), wk = 0.0034965 k( 198) = ( -0.2793989 0.8147592 -0.0000000), wk = 0.0034965 k( 199) = ( -0.2793989 0.8147592 0.0215511), wk = 0.0034965 k( 200) = ( -0.2793989 0.8147592 0.0431023), wk = 0.0034965 k( 201) = ( -0.2793989 0.8147592 0.0646534), wk = 0.0034965 k( 202) = ( -0.2793989 0.8147592 0.0862045), wk = 0.0034965 k( 203) = ( -0.2793989 0.8147592 0.1077557), wk = 0.0034965 k( 204) = ( -0.2793989 0.8147592 0.1293068), wk = 0.0034965 k( 205) = ( -0.2793989 0.8147592 0.1508579), wk = 0.0034965 k( 206) = ( -0.2793989 0.8147592 0.1724091), wk = 0.0034965 k( 207) = ( -0.2793989 0.8147592 0.1939602), wk = 0.0034965 k( 208) = ( -0.2793989 0.8147592 0.2155113), wk = 0.0034965 k( 209) = ( -0.2793989 0.8147592 0.2370625), wk = 0.0034965 k( 210) = ( -0.2793989 0.8147592 0.2586136), wk = 0.0034965 k( 211) = ( -0.2793989 0.8147592 0.2801647), wk = 0.0034965 k( 212) = ( -0.2793989 0.8147592 0.3017159), wk = 0.0034965 k( 213) = ( -0.2793989 0.8147592 0.3232670), wk = 0.0034965 k( 214) = ( -0.2793989 0.8147592 0.3232670), wk = 0.0034965 k( 215) = ( -0.2865150 0.7940077 0.3232670), wk = 0.0034965 k( 216) = ( -0.2936312 0.7732561 0.3232670), wk = 0.0034965 k( 217) = ( -0.3007474 0.7525046 0.3232670), wk = 0.0034965 k( 218) = ( -0.3078635 0.7317530 0.3232670), wk = 0.0034965 k( 219) = ( -0.3149797 0.7110014 0.3232670), wk = 0.0034965 k( 220) = ( -0.3220959 0.6902499 0.3232670), wk = 0.0034965 k( 221) = ( -0.3292120 0.6694983 0.3232670), wk = 0.0034965 k( 222) = ( -0.3363282 0.6487468 0.3232670), wk = 0.0034965 k( 223) = ( -0.3434444 0.6279952 0.3232670), wk = 0.0034965 k( 224) = ( -0.3505605 0.6072437 0.3232670), wk = 0.0034965 k( 225) = ( -0.3576767 0.5864921 0.3232670), wk = 0.0034965 k( 226) = ( -0.3647929 0.5657406 0.3232670), wk = 0.0034965 k( 227) = ( -0.3719090 0.5449890 0.3232670), wk = 0.0034965 k( 228) = ( -0.3790252 0.5242374 0.3232670), wk = 0.0034965 k( 229) = ( -0.3861414 0.5034859 0.3232670), wk = 0.0034965 k( 230) = ( -0.3932575 0.4827343 0.3232670), wk = 0.0034965 k( 231) = ( -0.4003737 0.4619828 0.3232670), wk = 0.0034965 k( 232) = ( -0.4074898 0.4412312 0.3232670), wk = 0.0034965 k( 233) = ( -0.4146060 0.4204797 0.3232670), wk = 0.0034965 k( 234) = ( -0.4217222 0.3997281 0.3232670), wk = 0.0034965 k( 235) = ( -0.4288383 0.3789766 0.3232670), wk = 0.0034965 k( 236) = ( -0.4359545 0.3582250 0.3232670), wk = 0.0034965 k( 237) = ( -0.4430707 0.3374734 0.3232670), wk = 0.0034965 k( 238) = ( -0.4501868 0.3167219 0.3232670), wk = 0.0034965 k( 239) = ( -0.4573030 0.2959703 0.3232670), wk = 0.0034965 k( 240) = ( -0.4644192 0.2752188 0.3232670), wk = 0.0034965 k( 241) = ( -0.4715353 0.2544672 0.3232670), wk = 0.0034965 k( 242) = ( -0.4786515 0.2337157 0.3232670), wk = 0.0034965 k( 243) = ( -0.4857677 0.2129641 0.3232670), wk = 0.0034965 k( 244) = ( -0.4928838 0.1922126 0.3232670), wk = 0.0034965 k( 245) = ( -0.5000000 0.1714610 0.3232670), wk = 0.0034965 k( 246) = ( -0.5000000 0.1714610 0.3232670), wk = 0.0034965 k( 247) = ( -0.5000000 0.1714610 0.3017159), wk = 0.0034965 k( 248) = ( -0.5000000 0.1714610 0.2801647), wk = 0.0034965 k( 249) = ( -0.5000000 0.1714610 0.2586136), wk = 0.0034965 k( 250) = ( -0.5000000 0.1714610 0.2370625), wk = 0.0034965 k( 251) = ( -0.5000000 0.1714610 0.2155113), wk = 0.0034965 k( 252) = ( -0.5000000 0.1714610 0.1939602), wk = 0.0034965 k( 253) = ( -0.5000000 0.1714610 0.1724091), wk = 0.0034965 k( 254) = ( -0.5000000 0.1714610 0.1508579), wk = 0.0034965 k( 255) = ( -0.5000000 0.1714610 0.1293068), wk = 0.0034965 k( 256) = ( -0.5000000 0.1714610 0.1077557), wk = 0.0034965 k( 257) = ( -0.5000000 0.1714610 0.0862045), wk = 0.0034965 k( 258) = ( -0.5000000 0.1714610 0.0646534), wk = 0.0034965 k( 259) = ( -0.5000000 0.1714610 0.0431023), wk = 0.0034965 k( 260) = ( -0.5000000 0.1714610 0.0215511), wk = 0.0034965 k( 261) = ( -0.5000000 0.1714610 0.0000000), wk = 0.0034965 k( 262) = ( 0.0000000 0.0000000 0.3232670), wk = 0.0034965 k( 263) = ( -0.0208333 0.0071442 0.3232670), wk = 0.0034965 k( 264) = ( -0.0416667 0.0142884 0.3232670), wk = 0.0034965 k( 265) = ( -0.0625000 0.0214326 0.3232670), wk = 0.0034965 k( 266) = ( -0.0833333 0.0285768 0.3232670), wk = 0.0034965 k( 267) = ( -0.1041667 0.0357210 0.3232670), wk = 0.0034965 k( 268) = ( -0.1250000 0.0428653 0.3232670), wk = 0.0034965 k( 269) = ( -0.1458333 0.0500095 0.3232670), wk = 0.0034965 k( 270) = ( -0.1666667 0.0571537 0.3232670), wk = 0.0034965 k( 271) = ( -0.1875000 0.0642979 0.3232670), wk = 0.0034965 k( 272) = ( -0.2083333 0.0714421 0.3232670), wk = 0.0034965 k( 273) = ( -0.2291667 0.0785863 0.3232670), wk = 0.0034965 k( 274) = ( -0.2500000 0.0857305 0.3232670), wk = 0.0034965 k( 275) = ( -0.2708333 0.0928747 0.3232670), wk = 0.0034965 k( 276) = ( -0.2916667 0.1000189 0.3232670), wk = 0.0034965 k( 277) = ( -0.3125000 0.1071631 0.3232670), wk = 0.0034965 k( 278) = ( -0.3333333 0.1143073 0.3232670), wk = 0.0034965 k( 279) = ( -0.3541667 0.1214516 0.3232670), wk = 0.0034965 k( 280) = ( -0.3750000 0.1285958 0.3232670), wk = 0.0034965 k( 281) = ( -0.3958333 0.1357400 0.3232670), wk = 0.0034965 k( 282) = ( -0.4166667 0.1428842 0.3232670), wk = 0.0034965 k( 283) = ( -0.4375000 0.1500284 0.3232670), wk = 0.0034965 k( 284) = ( -0.4583333 0.1571726 0.3232670), wk = 0.0034965 k( 285) = ( -0.4791667 0.1643168 0.3232670), wk = 0.0034965 k( 286) = ( -0.5000000 0.1714610 0.3232670), wk = 0.0034965 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 2) = ( 0.0071641 0.0071641 -0.0000000), wk = 0.0034965 k( 3) = ( 0.0143281 0.0143282 -0.0000000), wk = 0.0034965 k( 4) = ( 0.0214922 0.0214922 0.0000000), wk = 0.0034965 k( 5) = ( 0.0286563 0.0286563 -0.0000000), wk = 0.0034965 k( 6) = ( 0.0358204 0.0358204 -0.0000000), wk = 0.0034965 k( 7) = ( 0.0429844 0.0429844 0.0000000), wk = 0.0034965 k( 8) = ( 0.0501485 0.0501485 -0.0000000), wk = 0.0034965 k( 9) = ( 0.0573126 0.0573126 -0.0000000), wk = 0.0034965 k( 10) = ( 0.0644767 0.0644767 -0.0000000), wk = 0.0034965 k( 11) = ( 0.0716407 0.0716407 -0.0000000), wk = 0.0034965 k( 12) = ( 0.0788048 0.0788048 -0.0000000), wk = 0.0034965 k( 13) = ( 0.0859689 0.0859689 -0.0000000), wk = 0.0034965 k( 14) = ( 0.0931330 0.0931330 -0.0000000), wk = 0.0034965 k( 15) = ( 0.1002970 0.1002970 -0.0000000), wk = 0.0034965 k( 16) = ( 0.1074611 0.1074611 -0.0000000), wk = 0.0034965 k( 17) = ( 0.1146252 0.1146252 -0.0000000), wk = 0.0034965 k( 18) = ( 0.1217893 0.1217893 -0.0000000), wk = 0.0034965 k( 19) = ( 0.1289533 0.1289533 -0.0000000), wk = 0.0034965 k( 20) = ( 0.1361174 0.1361174 -0.0000000), wk = 0.0034965 k( 21) = ( 0.1432815 0.1432815 -0.0000000), wk = 0.0034965 k( 22) = ( 0.1504456 0.1504456 0.0000000), wk = 0.0034965 k( 23) = ( 0.1576096 0.1576096 -0.0000000), wk = 0.0034965 k( 24) = ( 0.1647737 0.1647737 -0.0000000), wk = 0.0034965 k( 25) = ( 0.1719378 0.1719378 -0.0000000), wk = 0.0034965 k( 26) = ( 0.1791019 0.1791019 -0.0000000), wk = 0.0034965 k( 27) = ( 0.1862659 0.1862659 -0.0000000), wk = 0.0034965 k( 28) = ( 0.1934300 0.1934300 -0.0000000), wk = 0.0034965 k( 29) = ( 0.2005941 0.2005941 -0.0000000), wk = 0.0034965 k( 30) = ( 0.2077581 0.2077581 -0.0000000), wk = 0.0034965 k( 31) = ( 0.2149222 0.2149222 -0.0000000), wk = 0.0034965 k( 32) = ( 0.2220863 0.2220863 -0.0000000), wk = 0.0034965 k( 33) = ( 0.2292504 0.2292504 -0.0000000), wk = 0.0034965 k( 34) = ( 0.2364144 0.2364144 -0.0000000), wk = 0.0034965 k( 35) = ( 0.2435785 0.2435785 0.0000000), wk = 0.0034965 k( 36) = ( 0.2507426 0.2507426 -0.0000000), wk = 0.0034965 k( 37) = ( 0.2579067 0.2579067 -0.0000000), wk = 0.0034965 k( 38) = ( 0.2650707 0.2650707 0.0000000), wk = 0.0034965 k( 39) = ( 0.2722348 0.2722348 -0.0000000), wk = 0.0034965 k( 40) = ( 0.2793989 0.2793989 -0.0000000), wk = 0.0034965 k( 41) = ( 0.2793989 0.2793989 -0.0000000), wk = 0.0034965 k( 42) = ( 0.2579067 0.2963682 -0.0000000), wk = 0.0034965 k( 43) = ( 0.2364144 0.3133375 -0.0000000), wk = 0.0034965 k( 44) = ( 0.2149222 0.3303068 -0.0000000), wk = 0.0034965 k( 45) = ( 0.1934300 0.3472761 -0.0000000), wk = 0.0034965 k( 46) = ( 0.1719378 0.3642455 -0.0000000), wk = 0.0034965 k( 47) = ( 0.1504456 0.3812148 0.0000000), wk = 0.0034965 k( 48) = ( 0.1289533 0.3981841 -0.0000000), wk = 0.0034965 k( 49) = ( 0.1074611 0.4151534 0.0000000), wk = 0.0034965 k( 50) = ( 0.0859689 0.4321227 -0.0000000), wk = 0.0034965 k( 51) = ( 0.0644767 0.4490921 -0.0000000), wk = 0.0034965 k( 52) = ( 0.0429844 0.4660614 -0.0000000), wk = 0.0034965 k( 53) = ( 0.0214922 0.4830307 -0.0000000), wk = 0.0034965 k( 54) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034965 k( 55) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034965 k( 56) = ( 0.0000000 0.5000000 0.0333333), wk = 0.0034965 k( 57) = ( 0.0000000 0.5000000 0.0666667), wk = 0.0034965 k( 58) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0034965 k( 59) = ( 0.0000000 0.5000000 0.1333333), wk = 0.0034965 k( 60) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0034965 k( 61) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0034965 k( 62) = ( 0.0000000 0.5000000 0.2333333), wk = 0.0034965 k( 63) = ( 0.0000000 0.5000000 0.2666667), wk = 0.0034965 k( 64) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0034965 k( 65) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0034965 k( 66) = ( 0.0000000 0.5000000 0.3666667), wk = 0.0034965 k( 67) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0034965 k( 68) = ( 0.0000000 0.5000000 0.4333333), wk = 0.0034965 k( 69) = ( 0.0000000 0.5000000 0.4666667), wk = 0.0034965 k( 70) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034965 k( 71) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034965 k( 72) = ( 0.0214922 0.4830307 0.5000000), wk = 0.0034965 k( 73) = ( 0.0429844 0.4660614 0.5000000), wk = 0.0034965 k( 74) = ( 0.0644767 0.4490921 0.5000000), wk = 0.0034965 k( 75) = ( 0.0859689 0.4321227 0.5000000), wk = 0.0034965 k( 76) = ( 0.1074611 0.4151534 0.5000000), wk = 0.0034965 k( 77) = ( 0.1289533 0.3981841 0.5000000), wk = 0.0034965 k( 78) = ( 0.1504456 0.3812148 0.5000000), wk = 0.0034965 k( 79) = ( 0.1719378 0.3642455 0.5000000), wk = 0.0034965 k( 80) = ( 0.1934300 0.3472761 0.5000000), wk = 0.0034965 k( 81) = ( 0.2149222 0.3303068 0.5000000), wk = 0.0034965 k( 82) = ( 0.2364144 0.3133375 0.5000000), wk = 0.0034965 k( 83) = ( 0.2579067 0.2963682 0.5000000), wk = 0.0034965 k( 84) = ( 0.2793989 0.2793989 0.5000000), wk = 0.0034965 k( 85) = ( 0.2793989 0.2793989 0.5000000), wk = 0.0034965 k( 86) = ( 0.2722348 0.2722348 0.5000000), wk = 0.0034965 k( 87) = ( 0.2650707 0.2650707 0.5000000), wk = 0.0034965 k( 88) = ( 0.2579067 0.2579067 0.5000000), wk = 0.0034965 k( 89) = ( 0.2507426 0.2507426 0.5000000), wk = 0.0034965 k( 90) = ( 0.2435785 0.2435785 0.5000000), wk = 0.0034965 k( 91) = ( 0.2364144 0.2364144 0.5000000), wk = 0.0034965 k( 92) = ( 0.2292504 0.2292504 0.5000000), wk = 0.0034965 k( 93) = ( 0.2220863 0.2220863 0.5000000), wk = 0.0034965 k( 94) = ( 0.2149222 0.2149222 0.5000000), wk = 0.0034965 k( 95) = ( 0.2077581 0.2077581 0.5000000), wk = 0.0034965 k( 96) = ( 0.2005941 0.2005941 0.5000000), wk = 0.0034965 k( 97) = ( 0.1934300 0.1934300 0.5000000), wk = 0.0034965 k( 98) = ( 0.1862659 0.1862659 0.5000000), wk = 0.0034965 k( 99) = ( 0.1791019 0.1791019 0.5000000), wk = 0.0034965 k( 100) = ( 0.1719378 0.1719378 0.5000000), wk = 0.0034965 k( 101) = ( 0.1647737 0.1647737 0.5000000), wk = 0.0034965 k( 102) = ( 0.1576096 0.1576096 0.5000000), wk = 0.0034965 k( 103) = ( 0.1504456 0.1504456 0.5000000), wk = 0.0034965 k( 104) = ( 0.1432815 0.1432815 0.5000000), wk = 0.0034965 k( 105) = ( 0.1361174 0.1361174 0.5000000), wk = 0.0034965 k( 106) = ( 0.1289533 0.1289533 0.5000000), wk = 0.0034965 k( 107) = ( 0.1217893 0.1217893 0.5000000), wk = 0.0034965 k( 108) = ( 0.1146252 0.1146252 0.5000000), wk = 0.0034965 k( 109) = ( 0.1074611 0.1074611 0.5000000), wk = 0.0034965 k( 110) = ( 0.1002970 0.1002970 0.5000000), wk = 0.0034965 k( 111) = ( 0.0931330 0.0931330 0.5000000), wk = 0.0034965 k( 112) = ( 0.0859689 0.0859689 0.5000000), wk = 0.0034965 k( 113) = ( 0.0788048 0.0788048 0.5000000), wk = 0.0034965 k( 114) = ( 0.0716407 0.0716407 0.5000000), wk = 0.0034965 k( 115) = ( 0.0644767 0.0644767 0.5000000), wk = 0.0034965 k( 116) = ( 0.0573126 0.0573126 0.5000000), wk = 0.0034965 k( 117) = ( 0.0501485 0.0501485 0.5000000), wk = 0.0034965 k( 118) = ( 0.0429844 0.0429844 0.5000000), wk = 0.0034965 k( 119) = ( 0.0358204 0.0358204 0.5000000), wk = 0.0034965 k( 120) = ( 0.0286563 0.0286563 0.5000000), wk = 0.0034965 k( 121) = ( 0.0214922 0.0214922 0.5000000), wk = 0.0034965 k( 122) = ( 0.0143281 0.0143282 0.5000000), wk = 0.0034965 k( 123) = ( 0.0071641 0.0071641 0.5000000), wk = 0.0034965 k( 124) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034965 k( 125) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034965 k( 126) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0034965 k( 127) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0034965 k( 128) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0034965 k( 129) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0034965 k( 130) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0034965 k( 131) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0034965 k( 132) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0034965 k( 133) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0034965 k( 134) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0034965 k( 135) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0034965 k( 136) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0034965 k( 137) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0034965 k( 138) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0034965 k( 139) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0034965 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 142) = ( -0.0208333 0.0208333 0.0000000), wk = 0.0034965 k( 143) = ( -0.0416667 0.0416667 -0.0000000), wk = 0.0034965 k( 144) = ( -0.0625000 0.0625000 -0.0000000), wk = 0.0034965 k( 145) = ( -0.0833333 0.0833333 -0.0000000), wk = 0.0034965 k( 146) = ( -0.1041667 0.1041667 0.0000000), wk = 0.0034965 k( 147) = ( -0.1250000 0.1250000 -0.0000000), wk = 0.0034965 k( 148) = ( -0.1458333 0.1458333 -0.0000000), wk = 0.0034965 k( 149) = ( -0.1666667 0.1666667 -0.0000000), wk = 0.0034965 k( 150) = ( -0.1875000 0.1875000 -0.0000000), wk = 0.0034965 k( 151) = ( -0.2083333 0.2083333 0.0000000), wk = 0.0034965 k( 152) = ( -0.2291667 0.2291667 -0.0000000), wk = 0.0034965 k( 153) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0034965 k( 154) = ( -0.2708333 0.2708333 0.0000000), wk = 0.0034965 k( 155) = ( -0.2916667 0.2916667 0.0000000), wk = 0.0034965 k( 156) = ( -0.3125000 0.3125000 -0.0000000), wk = 0.0034965 k( 157) = ( -0.3333333 0.3333333 -0.0000000), wk = 0.0034965 k( 158) = ( -0.3541667 0.3541667 -0.0000000), wk = 0.0034965 k( 159) = ( -0.3750000 0.3750000 -0.0000000), wk = 0.0034965 k( 160) = ( -0.3958333 0.3958333 0.0000000), wk = 0.0034965 k( 161) = ( -0.4166667 0.4166667 0.0000000), wk = 0.0034965 k( 162) = ( -0.4375000 0.4375000 0.0000000), wk = 0.0034965 k( 163) = ( -0.4583333 0.4583333 -0.0000000), wk = 0.0034965 k( 164) = ( -0.4791667 0.4791667 -0.0000000), wk = 0.0034965 k( 165) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0034965 k( 166) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0034965 k( 167) = ( -0.4928838 0.5071162 -0.0000000), wk = 0.0034965 k( 168) = ( -0.4857677 0.5142323 0.0000000), wk = 0.0034965 k( 169) = ( -0.4786515 0.5213485 -0.0000000), wk = 0.0034965 k( 170) = ( -0.4715353 0.5284647 0.0000000), wk = 0.0034965 k( 171) = ( -0.4644192 0.5355808 -0.0000000), wk = 0.0034965 k( 172) = ( -0.4573030 0.5426970 0.0000000), wk = 0.0034965 k( 173) = ( -0.4501868 0.5498132 -0.0000000), wk = 0.0034965 k( 174) = ( -0.4430707 0.5569293 -0.0000000), wk = 0.0034965 k( 175) = ( -0.4359545 0.5640455 -0.0000000), wk = 0.0034965 k( 176) = ( -0.4288383 0.5711616 0.0000000), wk = 0.0034965 k( 177) = ( -0.4217222 0.5782778 0.0000000), wk = 0.0034965 k( 178) = ( -0.4146060 0.5853940 0.0000000), wk = 0.0034965 k( 179) = ( -0.4074898 0.5925101 0.0000000), wk = 0.0034965 k( 180) = ( -0.4003737 0.5996263 -0.0000000), wk = 0.0034965 k( 181) = ( -0.3932575 0.6067425 -0.0000000), wk = 0.0034965 k( 182) = ( -0.3861414 0.6138586 -0.0000000), wk = 0.0034965 k( 183) = ( -0.3790252 0.6209748 -0.0000000), wk = 0.0034965 k( 184) = ( -0.3719090 0.6280910 -0.0000000), wk = 0.0034965 k( 185) = ( -0.3647929 0.6352071 -0.0000000), wk = 0.0034965 k( 186) = ( -0.3576767 0.6423233 -0.0000000), wk = 0.0034965 k( 187) = ( -0.3505605 0.6494395 -0.0000000), wk = 0.0034965 k( 188) = ( -0.3434444 0.6565556 -0.0000000), wk = 0.0034965 k( 189) = ( -0.3363282 0.6636718 -0.0000000), wk = 0.0034965 k( 190) = ( -0.3292120 0.6707880 0.0000000), wk = 0.0034965 k( 191) = ( -0.3220959 0.6779041 -0.0000000), wk = 0.0034965 k( 192) = ( -0.3149797 0.6850203 -0.0000000), wk = 0.0034965 k( 193) = ( -0.3078635 0.6921365 -0.0000000), wk = 0.0034965 k( 194) = ( -0.3007474 0.6992526 -0.0000000), wk = 0.0034965 k( 195) = ( -0.2936312 0.7063688 -0.0000000), wk = 0.0034965 k( 196) = ( -0.2865150 0.7134850 -0.0000000), wk = 0.0034965 k( 197) = ( -0.2793989 0.7206011 -0.0000000), wk = 0.0034965 k( 198) = ( -0.2793989 0.7206011 -0.0000000), wk = 0.0034965 k( 199) = ( -0.2793989 0.7206011 0.0333333), wk = 0.0034965 k( 200) = ( -0.2793989 0.7206011 0.0666667), wk = 0.0034965 k( 201) = ( -0.2793989 0.7206011 0.1000000), wk = 0.0034965 k( 202) = ( -0.2793989 0.7206011 0.1333333), wk = 0.0034965 k( 203) = ( -0.2793989 0.7206011 0.1666667), wk = 0.0034965 k( 204) = ( -0.2793989 0.7206011 0.2000000), wk = 0.0034965 k( 205) = ( -0.2793989 0.7206011 0.2333333), wk = 0.0034965 k( 206) = ( -0.2793989 0.7206011 0.2666667), wk = 0.0034965 k( 207) = ( -0.2793989 0.7206011 0.3000000), wk = 0.0034965 k( 208) = ( -0.2793989 0.7206011 0.3333333), wk = 0.0034965 k( 209) = ( -0.2793989 0.7206011 0.3666667), wk = 0.0034965 k( 210) = ( -0.2793989 0.7206011 0.4000000), wk = 0.0034965 k( 211) = ( -0.2793989 0.7206011 0.4333333), wk = 0.0034965 k( 212) = ( -0.2793989 0.7206011 0.4666667), wk = 0.0034965 k( 213) = ( -0.2793989 0.7206011 0.5000000), wk = 0.0034965 k( 214) = ( -0.2793989 0.7206011 0.5000000), wk = 0.0034965 k( 215) = ( -0.2865150 0.7134850 0.5000000), wk = 0.0034965 k( 216) = ( -0.2936312 0.7063688 0.5000000), wk = 0.0034965 k( 217) = ( -0.3007474 0.6992526 0.5000000), wk = 0.0034965 k( 218) = ( -0.3078635 0.6921365 0.5000000), wk = 0.0034965 k( 219) = ( -0.3149797 0.6850203 0.5000000), wk = 0.0034965 k( 220) = ( -0.3220959 0.6779041 0.5000000), wk = 0.0034965 k( 221) = ( -0.3292120 0.6707880 0.5000000), wk = 0.0034965 k( 222) = ( -0.3363282 0.6636718 0.5000000), wk = 0.0034965 k( 223) = ( -0.3434444 0.6565556 0.5000000), wk = 0.0034965 k( 224) = ( -0.3505605 0.6494395 0.5000000), wk = 0.0034965 k( 225) = ( -0.3576767 0.6423233 0.5000000), wk = 0.0034965 k( 226) = ( -0.3647929 0.6352071 0.5000000), wk = 0.0034965 k( 227) = ( -0.3719090 0.6280910 0.5000000), wk = 0.0034965 k( 228) = ( -0.3790252 0.6209748 0.5000000), wk = 0.0034965 k( 229) = ( -0.3861414 0.6138586 0.5000000), wk = 0.0034965 k( 230) = ( -0.3932575 0.6067425 0.5000000), wk = 0.0034965 k( 231) = ( -0.4003737 0.5996263 0.5000000), wk = 0.0034965 k( 232) = ( -0.4074898 0.5925101 0.5000000), wk = 0.0034965 k( 233) = ( -0.4146060 0.5853940 0.5000000), wk = 0.0034965 k( 234) = ( -0.4217222 0.5782778 0.5000000), wk = 0.0034965 k( 235) = ( -0.4288383 0.5711616 0.5000000), wk = 0.0034965 k( 236) = ( -0.4359545 0.5640455 0.5000000), wk = 0.0034965 k( 237) = ( -0.4430707 0.5569293 0.5000000), wk = 0.0034965 k( 238) = ( -0.4501868 0.5498132 0.5000000), wk = 0.0034965 k( 239) = ( -0.4573030 0.5426970 0.5000000), wk = 0.0034965 k( 240) = ( -0.4644192 0.5355808 0.5000000), wk = 0.0034965 k( 241) = ( -0.4715353 0.5284647 0.5000000), wk = 0.0034965 k( 242) = ( -0.4786515 0.5213485 0.5000000), wk = 0.0034965 k( 243) = ( -0.4857677 0.5142323 0.5000000), wk = 0.0034965 k( 244) = ( -0.4928838 0.5071162 0.5000000), wk = 0.0034965 k( 245) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034965 k( 246) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034965 k( 247) = ( -0.5000000 0.5000000 0.4666667), wk = 0.0034965 k( 248) = ( -0.5000000 0.5000000 0.4333333), wk = 0.0034965 k( 249) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0034965 k( 250) = ( -0.5000000 0.5000000 0.3666667), wk = 0.0034965 k( 251) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0034965 k( 252) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0034965 k( 253) = ( -0.5000000 0.5000000 0.2666667), wk = 0.0034965 k( 254) = ( -0.5000000 0.5000000 0.2333333), wk = 0.0034965 k( 255) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0034965 k( 256) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0034965 k( 257) = ( -0.5000000 0.5000000 0.1333333), wk = 0.0034965 k( 258) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0034965 k( 259) = ( -0.5000000 0.5000000 0.0666667), wk = 0.0034965 k( 260) = ( -0.5000000 0.5000000 0.0333333), wk = 0.0034965 k( 261) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0034965 k( 262) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034965 k( 263) = ( -0.0208333 0.0208333 0.5000000), wk = 0.0034965 k( 264) = ( -0.0416667 0.0416667 0.5000000), wk = 0.0034965 k( 265) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0034965 k( 266) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0034965 k( 267) = ( -0.1041667 0.1041667 0.5000000), wk = 0.0034965 k( 268) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0034965 k( 269) = ( -0.1458333 0.1458333 0.5000000), wk = 0.0034965 k( 270) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0034965 k( 271) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0034965 k( 272) = ( -0.2083333 0.2083333 0.5000000), wk = 0.0034965 k( 273) = ( -0.2291667 0.2291667 0.5000000), wk = 0.0034965 k( 274) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0034965 k( 275) = ( -0.2708333 0.2708333 0.5000000), wk = 0.0034965 k( 276) = ( -0.2916667 0.2916667 0.5000000), wk = 0.0034965 k( 277) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0034965 k( 278) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0034965 k( 279) = ( -0.3541667 0.3541667 0.5000000), wk = 0.0034965 k( 280) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0034965 k( 281) = ( -0.3958333 0.3958333 0.5000000), wk = 0.0034965 k( 282) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0034965 k( 283) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0034965 k( 284) = ( -0.4583333 0.4583333 0.5000000), wk = 0.0034965 k( 285) = ( -0.4791667 0.4791667 0.5000000), wk = 0.0034965 k( 286) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034965 Dense grid: 308113 G-vectors FFT dimensions: ( 90, 90, 135) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.30 Mb ( 1214, 70) NL pseudopotentials 3.11 Mb ( 607, 336) Each V/rho on FFT grid 0.37 Mb ( 24300) Each G-vector array 0.04 Mb ( 4808) G-vector shells 0.02 Mb ( 2367) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 5.19 Mb ( 1214, 280) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.72 Mb ( 336, 2, 70) The potential is recalculated from file : ./Cs3LiCl4.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 20.5 secs Computing kpt #: 2 total cpu time spent up to now is 37.4 secs Computing kpt #: 3 total cpu time spent up to now is 54.2 secs Computing kpt #: 4 total cpu time spent up to now is 72.7 secs Computing kpt #: 5 total cpu time spent up to now is 89.8 secs Computing kpt #: 6 total cpu time spent up to now is 105.0 secs Computing kpt #: 7 total cpu time spent up to now is 118.9 secs Computing kpt #: 8 total cpu time spent up to now is 137.6 secs Computing kpt #: 9 total cpu time spent up to now is 151.2 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 170.7 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 190.0 secs Computing kpt #: 12 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 209.4 secs Computing kpt #: 13 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 228.6 secs Computing kpt #: 14 total cpu time spent up to now is 245.4 secs Computing kpt #: 15 total cpu time spent up to now is 260.7 secs Computing kpt #: 16 total cpu time spent up to now is 274.7 secs Computing kpt #: 17 total cpu time spent up to now is 290.1 secs Computing kpt #: 18 total cpu time spent up to now is 303.8 secs Computing kpt #: 19 total cpu time spent up to now is 317.4 secs Computing kpt #: 20 total cpu time spent up to now is 330.7 secs Computing kpt #: 21 total cpu time spent up to now is 344.0 secs Computing kpt #: 22 total cpu time spent up to now is 357.4 secs Computing kpt #: 23 total cpu time spent up to now is 370.7 secs Computing kpt #: 24 total cpu time spent up to now is 384.4 secs Computing kpt #: 25 total cpu time spent up to now is 398.3 secs Computing kpt #: 26 total cpu time spent up to now is 412.1 secs Computing kpt #: 27 total cpu time spent up to now is 426.2 secs Computing kpt #: 28 total cpu time spent up to now is 441.4 secs Computing kpt #: 29 total cpu time spent up to now is 456.9 secs Computing kpt #: 30 total cpu time spent up to now is 473.9 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 493.5 secs Computing kpt #: 32 total cpu time spent up to now is 510.6 secs Computing kpt #: 33 total cpu time spent up to now is 524.2 secs Computing kpt #: 34 total cpu time spent up to now is 537.6 secs Computing kpt #: 35 total cpu time spent up to now is 550.9 secs Computing kpt #: 36 total cpu time spent up to now is 564.3 secs Computing kpt #: 37 total cpu time spent up to now is 577.7 secs Computing kpt #: 38 total cpu time spent up to now is 591.1 secs Computing kpt #: 39 total cpu time spent up to now is 604.5 secs Computing kpt #: 40 total cpu time spent up to now is 617.8 secs Computing kpt #: 41 total cpu time spent up to now is 631.4 secs Computing kpt #: 42 total cpu time spent up to now is 644.9 secs Computing kpt #: 43 total cpu time spent up to now is 658.7 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 678.2 secs Computing kpt #: 45 total cpu time spent up to now is 697.5 secs Computing kpt #: 46 total cpu time spent up to now is 712.8 secs Computing kpt #: 47 total cpu time spent up to now is 726.9 secs Computing kpt #: 48 total cpu time spent up to now is 741.0 secs Computing kpt #: 49 total cpu time spent up to now is 754.8 secs Computing kpt #: 50 total cpu time spent up to now is 768.5 secs Computing kpt #: 51 total cpu time spent up to now is 782.0 secs Computing kpt #: 52 total cpu time spent up to now is 795.4 secs Computing kpt #: 53 total cpu time spent up to now is 808.7 secs Computing kpt #: 54 total cpu time spent up to now is 822.2 secs Computing kpt #: 55 total cpu time spent up to now is 835.6 secs Computing kpt #: 56 total cpu time spent up to now is 849.1 secs Computing kpt #: 57 total cpu time spent up to now is 862.6 secs Computing kpt #: 58 total cpu time spent up to now is 876.2 secs Computing kpt #: 59 total cpu time spent up to now is 890.1 secs Computing kpt #: 60 total cpu time spent up to now is 907.3 secs Computing kpt #: 61 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 926.9 secs Computing kpt #: 62 total cpu time spent up to now is 943.9 secs Computing kpt #: 63 total cpu time spent up to now is 959.3 secs Computing kpt #: 64 total cpu time spent up to now is 974.7 secs Computing kpt #: 65 total cpu time spent up to now is 988.9 secs Computing kpt #: 66 total cpu time spent up to now is 1003.0 secs Computing kpt #: 67 total cpu time spent up to now is 1016.8 secs Computing kpt #: 68 total cpu time spent up to now is 1030.4 secs Computing kpt #: 69 total cpu time spent up to now is 1042.8 secs Computing kpt #: 70 total cpu time spent up to now is 1056.3 secs Computing kpt #: 71 total cpu time spent up to now is 1069.7 secs Computing kpt #: 72 total cpu time spent up to now is 1083.0 secs Computing kpt #: 73 total cpu time spent up to now is 1096.4 secs Computing kpt #: 74 total cpu time spent up to now is 1109.9 secs Computing kpt #: 75 total cpu time spent up to now is 1123.4 secs Computing kpt #: 76 total cpu time spent up to now is 1137.5 secs Computing kpt #: 77 total cpu time spent up to now is 1151.5 secs Computing kpt #: 78 total cpu time spent up to now is 1168.5 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1188.2 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1208.0 secs Computing kpt #: 81 total cpu time spent up to now is 1223.2 secs Computing kpt #: 82 total cpu time spent up to now is 1236.9 secs Computing kpt #: 83 total cpu time spent up to now is 1250.6 secs Computing kpt #: 84 total cpu time spent up to now is 1264.4 secs Computing kpt #: 85 total cpu time spent up to now is 1278.0 secs Computing kpt #: 86 total cpu time spent up to now is 1291.7 secs Computing kpt #: 87 total cpu time spent up to now is 1305.2 secs Computing kpt #: 88 total cpu time spent up to now is 1318.7 secs Computing kpt #: 89 total cpu time spent up to now is 1332.1 secs Computing kpt #: 90 total cpu time spent up to now is 1345.7 secs Computing kpt #: 91 total cpu time spent up to now is 1359.1 secs Computing kpt #: 92 total cpu time spent up to now is 1372.4 secs Computing kpt #: 93 total cpu time spent up to now is 1385.8 secs Computing kpt #: 94 total cpu time spent up to now is 1399.3 secs Computing kpt #: 95 total cpu time spent up to now is 1412.9 secs Computing kpt #: 96 total cpu time spent up to now is 1426.6 secs Computing kpt #: 97 total cpu time spent up to now is 1441.7 secs Computing kpt #: 98 total cpu time spent up to now is 1457.2 secs Computing kpt #: 99 total cpu time spent up to now is 1472.5 secs Computing kpt #: 100 total cpu time spent up to now is 1488.1 secs Computing kpt #: 101 total cpu time spent up to now is 1503.5 secs Computing kpt #: 102 total cpu time spent up to now is 1519.0 secs Computing kpt #: 103 total cpu time spent up to now is 1535.1 secs Computing kpt #: 104 total cpu time spent up to now is 1551.1 secs Computing kpt #: 105 total cpu time spent up to now is 1566.6 secs Computing kpt #: 106 total cpu time spent up to now is 1581.9 secs Computing kpt #: 107 total cpu time spent up to now is 1595.7 secs Computing kpt #: 108 total cpu time spent up to now is 1609.7 secs Computing kpt #: 109 total cpu time spent up to now is 1623.4 secs Computing kpt #: 110 total cpu time spent up to now is 1637.4 secs Computing kpt #: 111 total cpu time spent up to now is 1650.5 secs Computing kpt #: 112 total cpu time spent up to now is 1663.7 secs Computing kpt #: 113 total cpu time spent up to now is 1676.7 secs Computing kpt #: 114 total cpu time spent up to now is 1688.6 secs Computing kpt #: 115 total cpu time spent up to now is 1701.5 secs Computing kpt #: 116 total cpu time spent up to now is 1714.4 secs Computing kpt #: 117 total cpu time spent up to now is 1727.1 secs Computing kpt #: 118 total cpu time spent up to now is 1740.1 secs Computing kpt #: 119 total cpu time spent up to now is 1752.8 secs Computing kpt #: 120 total cpu time spent up to now is 1765.5 secs Computing kpt #: 121 total cpu time spent up to now is 1778.4 secs Computing kpt #: 122 total cpu time spent up to now is 1791.1 secs Computing kpt #: 123 total cpu time spent up to now is 1804.0 secs Computing kpt #: 124 total cpu time spent up to now is 1815.6 secs Computing kpt #: 125 total cpu time spent up to now is 1827.2 secs Computing kpt #: 126 total cpu time spent up to now is 1839.9 secs Computing kpt #: 127 total cpu time spent up to now is 1851.7 secs Computing kpt #: 128 total cpu time spent up to now is 1864.7 secs Computing kpt #: 129 total cpu time spent up to now is 1877.6 secs Computing kpt #: 130 total cpu time spent up to now is 1890.5 secs Computing kpt #: 131 total cpu time spent up to now is 1903.4 secs Computing kpt #: 132 total cpu time spent up to now is 1916.3 secs Computing kpt #: 133 total cpu time spent up to now is 1929.5 secs Computing kpt #: 134 total cpu time spent up to now is 1942.7 secs Computing kpt #: 135 total cpu time spent up to now is 1955.9 secs Computing kpt #: 136 total cpu time spent up to now is 1969.2 secs Computing kpt #: 137 total cpu time spent up to now is 1982.7 secs Computing kpt #: 138 total cpu time spent up to now is 1996.1 secs Computing kpt #: 139 total cpu time spent up to now is 2011.5 secs Computing kpt #: 140 total cpu time spent up to now is 2026.4 secs Computing kpt #: 141 total cpu time spent up to now is 2042.9 secs Computing kpt #: 142 total cpu time spent up to now is 2059.6 secs Computing kpt #: 143 total cpu time spent up to now is 2074.7 secs Computing kpt #: 144 total cpu time spent up to now is 2088.2 secs Computing kpt #: 145 total cpu time spent up to now is 2101.8 secs Computing kpt #: 146 total cpu time spent up to now is 2116.6 secs Computing kpt #: 147 total cpu time spent up to now is 2130.2 secs Computing kpt #: 148 total cpu time spent up to now is 2143.6 secs Computing kpt #: 149 total cpu time spent up to now is 2157.0 secs Computing kpt #: 150 total cpu time spent up to now is 2170.4 secs Computing kpt #: 151 total cpu time spent up to now is 2183.7 secs Computing kpt #: 152 total cpu time spent up to now is 2197.0 secs Computing kpt #: 153 total cpu time spent up to now is 2210.3 secs Computing kpt #: 154 total cpu time spent up to now is 2223.7 secs Computing kpt #: 155 total cpu time spent up to now is 2237.1 secs Computing kpt #: 156 total cpu time spent up to now is 2251.9 secs Computing kpt #: 157 total cpu time spent up to now is 2265.7 secs Computing kpt #: 158 total cpu time spent up to now is 2280.5 secs Computing kpt #: 159 total cpu time spent up to now is 2295.4 secs Computing kpt #: 160 total cpu time spent up to now is 2310.2 secs Computing kpt #: 161 total cpu time spent up to now is 2323.9 secs Computing kpt #: 162 total cpu time spent up to now is 2337.5 secs Computing kpt #: 163 total cpu time spent up to now is 2351.1 secs Computing kpt #: 164 total cpu time spent up to now is 2364.8 secs Computing kpt #: 165 total cpu time spent up to now is 2378.4 secs Computing kpt #: 166 total cpu time spent up to now is 2391.9 secs Computing kpt #: 167 total cpu time spent up to now is 2405.3 secs Computing kpt #: 168 total cpu time spent up to now is 2419.1 secs Computing kpt #: 169 total cpu time spent up to now is 2433.0 secs Computing kpt #: 170 total cpu time spent up to now is 2446.8 secs Computing kpt #: 171 total cpu time spent up to now is 2461.7 secs Computing kpt #: 172 total cpu time spent up to now is 2476.7 secs Computing kpt #: 173 total cpu time spent up to now is 2491.7 secs Computing kpt #: 174 total cpu time spent up to now is 2507.0 secs Computing kpt #: 175 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2526.3 secs Computing kpt #: 176 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2545.5 secs Computing kpt #: 177 total cpu time spent up to now is 2564.1 secs Computing kpt #: 178 total cpu time spent up to now is 2579.3 secs Computing kpt #: 179 total cpu time spent up to now is 2596.0 secs Computing kpt #: 180 total cpu time spent up to now is 2620.1 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2639.6 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2659.1 secs Computing kpt #: 183 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2678.6 secs Computing kpt #: 184 total cpu time spent up to now is 2697.8 secs Computing kpt #: 185 total cpu time spent up to now is 2716.7 secs Computing kpt #: 186 total cpu time spent up to now is 2735.4 secs Computing kpt #: 187 total cpu time spent up to now is 2753.0 secs Computing kpt #: 188 total cpu time spent up to now is 2770.0 secs Computing kpt #: 189 total cpu time spent up to now is 2785.2 secs Computing kpt #: 190 total cpu time spent up to now is 2799.3 secs Computing kpt #: 191 total cpu time spent up to now is 2812.9 secs Computing kpt #: 192 total cpu time spent up to now is 2825.2 secs Computing kpt #: 193 total cpu time spent up to now is 2837.5 secs Computing kpt #: 194 total cpu time spent up to now is 2850.7 secs Computing kpt #: 195 total cpu time spent up to now is 2864.0 secs Computing kpt #: 196 total cpu time spent up to now is 2877.4 secs Computing kpt #: 197 total cpu time spent up to now is 2891.0 secs Computing kpt #: 198 total cpu time spent up to now is 2904.3 secs Computing kpt #: 199 total cpu time spent up to now is 2917.8 secs Computing kpt #: 200 total cpu time spent up to now is 2931.5 secs Computing kpt #: 201 total cpu time spent up to now is 2945.0 secs Computing kpt #: 202 total cpu time spent up to now is 2958.7 secs Computing kpt #: 203 total cpu time spent up to now is 2974.1 secs Computing kpt #: 204 total cpu time spent up to now is 2989.6 secs Computing kpt #: 205 total cpu time spent up to now is 3005.2 secs Computing kpt #: 206 total cpu time spent up to now is 3022.2 secs Computing kpt #: 207 total cpu time spent up to now is 3037.5 secs Computing kpt #: 208 total cpu time spent up to now is 3052.5 secs Computing kpt #: 209 total cpu time spent up to now is 3066.2 secs Computing kpt #: 210 total cpu time spent up to now is 3080.0 secs Computing kpt #: 211 total cpu time spent up to now is 3093.6 secs Computing kpt #: 212 total cpu time spent up to now is 3107.3 secs Computing kpt #: 213 total cpu time spent up to now is 3120.9 secs Computing kpt #: 214 total cpu time spent up to now is 3134.5 secs Computing kpt #: 215 total cpu time spent up to now is 3148.1 secs Computing kpt #: 216 total cpu time spent up to now is 3161.8 secs Computing kpt #: 217 total cpu time spent up to now is 3175.6 secs Computing kpt #: 218 total cpu time spent up to now is 3189.3 secs Computing kpt #: 219 total cpu time spent up to now is 3203.0 secs Computing kpt #: 220 total cpu time spent up to now is 3216.8 secs Computing kpt #: 221 total cpu time spent up to now is 3230.4 secs Computing kpt #: 222 total cpu time spent up to now is 3245.7 secs Computing kpt #: 223 total cpu time spent up to now is 3259.5 secs Computing kpt #: 224 total cpu time spent up to now is 3277.1 secs Computing kpt #: 225 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3296.9 secs Computing kpt #: 226 total cpu time spent up to now is 3316.1 secs Computing kpt #: 227 total cpu time spent up to now is 3331.7 secs Computing kpt #: 228 total cpu time spent up to now is 3347.0 secs Computing kpt #: 229 total cpu time spent up to now is 3361.3 secs Computing kpt #: 230 total cpu time spent up to now is 3375.4 secs Computing kpt #: 231 total cpu time spent up to now is 3390.6 secs Computing kpt #: 232 total cpu time spent up to now is 3406.2 secs Computing kpt #: 233 total cpu time spent up to now is 3424.9 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3444.3 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3463.6 secs Computing kpt #: 236 total cpu time spent up to now is 3481.0 secs Computing kpt #: 237 total cpu time spent up to now is 3496.4 secs Computing kpt #: 238 total cpu time spent up to now is 3511.7 secs Computing kpt #: 239 total cpu time spent up to now is 3525.3 secs Computing kpt #: 240 total cpu time spent up to now is 3538.7 secs Computing kpt #: 241 total cpu time spent up to now is 3551.9 secs Computing kpt #: 242 total cpu time spent up to now is 3564.9 secs Computing kpt #: 243 total cpu time spent up to now is 3578.1 secs Computing kpt #: 244 total cpu time spent up to now is 3591.3 secs Computing kpt #: 245 total cpu time spent up to now is 3604.4 secs Computing kpt #: 246 total cpu time spent up to now is 3617.6 secs Computing kpt #: 247 total cpu time spent up to now is 3631.0 secs Computing kpt #: 248 total cpu time spent up to now is 3644.1 secs Computing kpt #: 249 total cpu time spent up to now is 3657.2 secs Computing kpt #: 250 total cpu time spent up to now is 3670.3 secs Computing kpt #: 251 total cpu time spent up to now is 3683.3 secs Computing kpt #: 252 total cpu time spent up to now is 3696.3 secs Computing kpt #: 253 total cpu time spent up to now is 3709.5 secs Computing kpt #: 254 total cpu time spent up to now is 3722.8 secs Computing kpt #: 255 total cpu time spent up to now is 3736.0 secs Computing kpt #: 256 total cpu time spent up to now is 3749.3 secs Computing kpt #: 257 total cpu time spent up to now is 3762.5 secs Computing kpt #: 258 total cpu time spent up to now is 3775.8 secs Computing kpt #: 259 total cpu time spent up to now is 3789.2 secs Computing kpt #: 260 total cpu time spent up to now is 3802.4 secs Computing kpt #: 261 total cpu time spent up to now is 3816.0 secs Computing kpt #: 262 total cpu time spent up to now is 3828.9 secs Computing kpt #: 263 total cpu time spent up to now is 3841.6 secs Computing kpt #: 264 total cpu time spent up to now is 3854.4 secs Computing kpt #: 265 total cpu time spent up to now is 3867.3 secs Computing kpt #: 266 total cpu time spent up to now is 3880.0 secs Computing kpt #: 267 total cpu time spent up to now is 3893.0 secs Computing kpt #: 268 total cpu time spent up to now is 3906.1 secs Computing kpt #: 269 total cpu time spent up to now is 3919.2 secs Computing kpt #: 270 total cpu time spent up to now is 3932.3 secs Computing kpt #: 271 total cpu time spent up to now is 3945.4 secs Computing kpt #: 272 total cpu time spent up to now is 3958.7 secs Computing kpt #: 273 total cpu time spent up to now is 3971.9 secs Computing kpt #: 274 total cpu time spent up to now is 3985.0 secs Computing kpt #: 275 total cpu time spent up to now is 3998.3 secs Computing kpt #: 276 total cpu time spent up to now is 4011.5 secs Computing kpt #: 277 total cpu time spent up to now is 4024.7 secs Computing kpt #: 278 total cpu time spent up to now is 4038.0 secs Computing kpt #: 279 total cpu time spent up to now is 4051.3 secs Computing kpt #: 280 total cpu time spent up to now is 4064.6 secs Computing kpt #: 281 total cpu time spent up to now is 4078.0 secs Computing kpt #: 282 total cpu time spent up to now is 4091.4 secs Computing kpt #: 283 total cpu time spent up to now is 4104.8 secs Computing kpt #: 284 total cpu time spent up to now is 4118.2 secs Computing kpt #: 285 total cpu time spent up to now is 4131.6 secs Computing kpt #: 286 total cpu time spent up to now is 4144.8 secs ethr = 1.72E-11, avg # of iterations = 59.4 total cpu time spent up to now is 4144.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 38409 PWs) bands (ev): -43.4454 -43.4454 -17.4761 -17.4761 -17.3488 -17.3488 -17.3384 -17.3384 -11.3375 -11.3375 -11.1939 -11.1939 -11.1915 -11.1915 -11.1509 -11.1509 -6.2665 -6.2665 -6.0821 -6.0821 -6.0062 -6.0062 -4.9841 -4.9841 -4.7580 -4.7580 -4.5624 -4.5624 -4.5591 -4.5591 -4.5030 -4.5030 -4.4464 -4.4464 -0.0950 -0.0950 0.1250 0.1250 0.2310 0.2310 0.3285 0.3285 0.3757 0.3757 0.5464 0.5464 0.5553 0.5553 0.6307 0.6307 0.7312 0.7312 0.7584 0.7584 0.8335 0.8335 0.8778 0.8778 5.4087 5.4087 6.5364 6.5364 6.6799 6.6799 6.7233 6.7233 6.9326 6.9326 7.3883 7.3883 k = 0.0072 0.0209-0.0000 ( 38427 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3487 -17.3487 -17.3383 -17.3383 -11.3375 -11.3374 -11.1938 -11.1938 -11.1915 -11.1915 -11.1509 -11.1509 -6.2667 -6.2666 -6.0824 -6.0823 -6.0069 -6.0059 -4.9842 -4.9838 -4.7590 -4.7575 -4.5633 -4.5628 -4.5604 -4.5579 -4.5043 -4.5026 -4.4469 -4.4468 -0.0954 -0.0937 0.1245 0.1246 0.2282 0.2325 0.3282 0.3294 0.3750 0.3762 0.5413 0.5505 0.5531 0.5565 0.6261 0.6349 0.7280 0.7343 0.7575 0.7591 0.8325 0.8338 0.8760 0.8774 5.4115 5.4121 6.5398 6.5403 6.6818 6.6834 6.7243 6.7258 6.9338 6.9348 7.3902 7.3906 k = 0.0143 0.0418-0.0000 ( 38423 PWs) bands (ev): -43.4454 -43.4454 -17.4758 -17.4758 -17.3485 -17.3485 -17.3381 -17.3381 -11.3372 -11.3372 -11.1936 -11.1936 -11.1915 -11.1914 -11.1508 -11.1508 -6.2669 -6.2668 -6.0830 -6.0830 -6.0080 -6.0059 -4.9841 -4.9831 -4.7607 -4.7577 -4.5655 -4.5650 -4.5611 -4.5576 -4.5065 -4.5033 -4.4481 -4.4481 -0.0951 -0.0917 0.1230 0.1234 0.2240 0.2325 0.3286 0.3311 0.3741 0.3766 0.5353 0.5500 0.5533 0.5565 0.6213 0.6385 0.7247 0.7369 0.7567 0.7596 0.8308 0.8335 0.8720 0.8747 5.4206 5.4217 6.5503 6.5513 6.6894 6.6925 6.7288 6.7317 6.9384 6.9404 7.3963 7.3971 k = 0.0215 0.0627-0.0000 ( 38419 PWs) bands (ev): -43.4454 -43.4454 -17.4754 -17.4754 -17.3482 -17.3482 -17.3378 -17.3378 -11.3369 -11.3368 -11.1933 -11.1933 -11.1914 -11.1914 -11.1507 -11.1507 -6.2673 -6.2671 -6.0841 -6.0841 -6.0094 -6.0062 -4.9837 -4.9822 -4.7630 -4.7585 -4.5695 -4.5674 -4.5621 -4.5582 -4.5096 -4.5048 -4.4502 -4.4501 -0.0940 -0.0888 0.1207 0.1212 0.2185 0.2311 0.3295 0.3336 0.3730 0.3770 0.5284 0.5462 0.5539 0.5559 0.6169 0.6412 0.7213 0.7387 0.7563 0.7599 0.8284 0.8325 0.8661 0.8700 5.4358 5.4375 6.5679 6.5695 6.7023 6.7069 6.7366 6.7410 6.9465 6.9494 7.4066 7.4078 k = 0.0287 0.0836-0.0000 ( 38449 PWs) bands (ev): -43.4454 -43.4454 -17.4749 -17.4749 -17.3477 -17.3477 -17.3374 -17.3374 -11.3363 -11.3362 -11.1929 -11.1929 -11.1913 -11.1913 -11.1505 -11.1505 -6.2679 -6.2676 -6.0856 -6.0855 -6.0111 -6.0069 -4.9830 -4.9811 -4.7661 -4.7600 -4.5745 -4.5703 -4.5637 -4.5597 -4.5136 -4.5073 -4.4528 -4.4527 -0.0922 -0.0853 0.1175 0.1181 0.2118 0.2284 0.3308 0.3368 0.3716 0.3775 0.5207 0.5417 0.5505 0.5561 0.6131 0.6430 0.7179 0.7395 0.7566 0.7597 0.8251 0.8308 0.8584 0.8633 5.4569 5.4592 6.5924 6.5946 6.7204 6.7263 6.7476 6.7534 6.9580 6.9617 7.4209 7.4224 k = 0.0358 0.1045-0.0000 ( 38451 PWs) bands (ev): -43.4454 -43.4454 -17.4743 -17.4743 -17.3472 -17.3472 -17.3369 -17.3369 -11.3357 -11.3355 -11.1924 -11.1923 -11.1912 -11.1912 -11.1503 -11.1503 -6.2686 -6.2683 -6.0875 -6.0874 -6.0132 -6.0080 -4.9822 -4.9797 -4.7698 -4.7621 -4.5804 -4.5736 -4.5661 -4.5622 -4.5184 -4.5108 -4.4559 -4.4558 -0.0898 -0.0811 0.1135 0.1140 0.2040 0.2244 0.3323 0.3408 0.3699 0.3782 0.5124 0.5367 0.5446 0.5555 0.6102 0.6437 0.7146 0.7390 0.7577 0.7592 0.8207 0.8283 0.8495 0.8551 5.4837 5.4867 6.6238 6.6265 6.7433 6.7505 6.7615 6.7685 6.9733 6.9774 7.4392 7.4409 k = 0.0430 0.1253-0.0000 ( 38443 PWs) bands (ev): -43.4454 -43.4454 -17.4735 -17.4735 -17.3465 -17.3465 -17.3362 -17.3362 -11.3349 -11.3346 -11.1917 -11.1917 -11.1910 -11.1910 -11.1501 -11.1500 -6.2694 -6.2691 -6.0899 -6.0897 -6.0156 -6.0093 -4.9811 -4.9780 -4.7744 -4.7648 -4.5871 -4.5774 -4.5692 -4.5659 -4.5239 -4.5150 -4.4593 -4.4591 -0.0871 -0.0764 0.1087 0.1091 0.1952 0.2193 0.3336 0.3454 0.3678 0.3792 0.5033 0.5313 0.5366 0.5538 0.6080 0.6433 0.7114 0.7375 0.7581 0.7595 0.8149 0.8249 0.8401 0.8459 5.5160 5.5196 6.6618 6.6650 6.7705 6.7779 6.7787 6.7860 6.9924 6.9967 7.4612 7.4630 k = 0.0501 0.1462-0.0000 ( 38441 PWs) bands (ev): -43.4454 -43.4454 -17.4726 -17.4726 -17.3457 -17.3457 -17.3354 -17.3354 -11.3339 -11.3336 -11.1910 -11.1910 -11.1909 -11.1908 -11.1497 -11.1497 -6.2704 -6.2701 -6.0927 -6.0923 -6.0183 -6.0110 -4.9799 -4.9762 -4.7797 -4.7683 -4.5947 -4.5816 -4.5732 -4.5705 -4.5301 -4.5201 -4.4628 -4.4625 -0.0840 -0.0713 0.1032 0.1033 0.1858 0.2131 0.3345 0.3504 0.3656 0.3809 0.4937 0.5254 0.5267 0.5511 0.6064 0.6416 0.7081 0.7351 0.7564 0.7616 0.8071 0.8202 0.8311 0.8366 5.5534 5.5577 6.7059 6.7097 6.7957 6.8020 6.8054 6.8102 7.0159 7.0197 7.4867 7.4885 k = 0.0573 0.1671-0.0000 ( 38445 PWs) bands (ev): -43.4454 -43.4454 -17.4716 -17.4716 -17.3448 -17.3448 -17.3346 -17.3346 -11.3328 -11.3325 -11.1907 -11.1907 -11.1901 -11.1900 -11.1494 -11.1494 -6.2715 -6.2713 -6.0959 -6.0953 -6.0213 -6.0130 -4.9785 -4.9742 -4.7859 -4.7725 -4.6029 -4.5861 -4.5780 -4.5763 -4.5368 -4.5259 -4.4662 -4.4658 -0.0808 -0.0660 0.0967 0.0971 0.1758 0.2061 0.3346 0.3552 0.3635 0.3832 0.4834 0.5153 0.5193 0.5476 0.6049 0.6387 0.7048 0.7321 0.7539 0.7637 0.7971 0.8134 0.8233 0.8284 5.5954 5.6004 6.7559 6.7601 6.8158 6.8261 6.8357 6.8439 7.0442 7.0468 7.5154 7.5166 k = 0.0645 0.1880-0.0000 ( 38481 PWs) bands (ev): -43.4454 -43.4454 -17.4705 -17.4705 -17.3439 -17.3439 -17.3336 -17.3336 -11.3316 -11.3313 -11.1906 -11.1906 -11.1892 -11.1891 -11.1490 -11.1490 -6.2728 -6.2727 -6.0995 -6.0987 -6.0245 -6.0153 -4.9771 -4.9720 -4.7929 -4.7774 -4.6117 -4.5911 -4.5836 -4.5829 -4.5440 -4.5323 -4.4693 -4.4688 -0.0778 -0.0608 0.0894 0.0906 0.1656 0.1985 0.3337 0.3568 0.3646 0.3864 0.4725 0.5026 0.5129 0.5432 0.6032 0.6345 0.7015 0.7287 0.7503 0.7656 0.7856 0.8046 0.8166 0.8220 5.6417 5.6474 6.8110 6.8153 6.8369 6.8476 6.8718 6.8790 7.0780 7.0787 7.5467 7.5469 k = 0.0716 0.2089-0.0000 ( 38491 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3428 -17.3428 -17.3326 -17.3326 -11.3303 -11.3299 -11.1904 -11.1904 -11.1882 -11.1881 -11.1485 -11.1485 -6.2743 -6.2742 -6.1035 -6.1023 -6.0280 -6.0179 -4.9756 -4.9697 -4.8007 -4.7832 -4.6211 -4.5970 -4.5901 -4.5898 -4.5514 -4.5392 -4.4720 -4.4714 -0.0753 -0.0561 0.0815 0.0836 0.1555 0.1904 0.3318 0.3540 0.3697 0.3900 0.4611 0.4891 0.5064 0.5382 0.6011 0.6291 0.6980 0.7249 0.7453 0.7655 0.7749 0.7953 0.8105 0.8167 5.6918 5.6983 6.8571 6.8688 6.8702 6.8746 6.9104 6.9152 7.1159 7.1180 7.5768 7.5796 k = 0.0788 0.2298-0.0000 ( 38523 PWs) bands (ev): -43.4454 -43.4454 -17.4680 -17.4680 -17.3416 -17.3416 -17.3315 -17.3315 -11.3289 -11.3285 -11.1902 -11.1902 -11.1871 -11.1870 -11.1481 -11.1480 -6.2760 -6.2757 -6.1078 -6.1063 -6.0318 -6.0207 -4.9741 -4.9674 -4.8094 -4.7897 -4.6310 -4.6046 -4.5974 -4.5959 -4.5587 -4.5465 -4.4743 -4.4737 -0.0735 -0.0523 0.0732 0.0765 0.1457 0.1822 0.3291 0.3501 0.3755 0.3938 0.4492 0.4749 0.5000 0.5327 0.5984 0.6225 0.6943 0.7207 0.7386 0.7569 0.7724 0.7870 0.8049 0.8117 5.7452 5.7524 6.8787 6.8908 6.9253 6.9267 6.9572 6.9583 7.1588 7.1644 7.6051 7.6060 k = 0.0860 0.2507-0.0000 ( 38515 PWs) bands (ev): -43.4454 -43.4454 -17.4666 -17.4666 -17.3404 -17.3404 -17.3303 -17.3303 -11.3274 -11.3269 -11.1901 -11.1900 -11.1859 -11.1858 -11.1476 -11.1475 -6.2779 -6.2774 -6.1125 -6.1105 -6.0357 -6.0238 -4.9727 -4.9650 -4.8188 -4.7970 -4.6413 -4.6139 -4.6055 -4.6012 -4.5657 -4.5539 -4.4761 -4.4755 -0.0728 -0.0500 0.0649 0.0693 0.1366 0.1741 0.3257 0.3455 0.3812 0.3968 0.4372 0.4604 0.4939 0.5268 0.5950 0.6150 0.6905 0.7159 0.7301 0.7446 0.7737 0.7804 0.7994 0.8069 5.8013 5.8093 6.8993 6.9115 6.9652 6.9653 7.0166 7.0220 7.2075 7.2168 7.6304 7.6313 k = 0.0931 0.2716-0.0000 ( 38542 PWs) bands (ev): -43.4454 -43.4454 -17.4651 -17.4651 -17.3391 -17.3391 -17.3291 -17.3291 -11.3258 -11.3253 -11.1899 -11.1899 -11.1847 -11.1846 -11.1470 -11.1470 -6.2800 -6.2791 -6.1175 -6.1150 -6.0399 -6.0271 -4.9715 -4.9627 -4.8288 -4.8050 -4.6519 -4.6242 -4.6142 -4.6061 -4.5723 -4.5615 -4.4776 -4.4769 -0.0735 -0.0499 0.0570 0.0622 0.1286 0.1665 0.3220 0.3405 0.3863 0.3973 0.4264 0.4459 0.4882 0.5206 0.5907 0.6067 0.6863 0.7105 0.7203 0.7325 0.7754 0.7754 0.7941 0.8020 5.8596 5.8684 6.9189 6.9310 6.9959 6.9971 7.0860 7.0926 7.2613 7.2743 7.6534 7.6555 k = 0.1003 0.2925-0.0000 ( 38562 PWs) bands (ev): -43.4454 -43.4454 -17.4636 -17.4636 -17.3378 -17.3378 -17.3278 -17.3278 -11.3241 -11.3236 -11.1898 -11.1897 -11.1835 -11.1834 -11.1465 -11.1464 -6.2822 -6.2810 -6.1228 -6.1197 -6.0442 -6.0306 -4.9705 -4.9604 -4.8395 -4.8137 -4.6626 -4.6352 -4.6234 -4.6109 -4.5783 -4.5688 -4.4786 -4.4779 -0.0760 -0.0527 0.0500 0.0552 0.1219 0.1596 0.3181 0.3349 0.3905 0.3923 0.4192 0.4318 0.4835 0.5145 0.5855 0.5978 0.6818 0.7042 0.7098 0.7213 0.7717 0.7772 0.7891 0.7973 5.9194 5.9290 6.9371 6.9489 7.0229 7.0258 7.1586 7.1657 7.3194 7.3354 7.6747 7.6780 k = 0.1075 0.3134-0.0000 ( 38538 PWs) bands (ev): -43.4454 -43.4454 -17.4620 -17.4620 -17.3364 -17.3364 -17.3264 -17.3264 -11.3224 -11.3219 -11.1897 -11.1896 -11.1822 -11.1821 -11.1459 -11.1458 -6.2846 -6.2829 -6.1283 -6.1246 -6.0486 -6.0343 -4.9697 -4.9583 -4.8505 -4.8230 -4.6735 -4.6464 -4.6330 -4.6159 -4.5836 -4.5757 -4.4792 -4.4786 -0.0805 -0.0587 0.0440 0.0484 0.1167 0.1535 0.3143 0.3289 0.3815 0.3934 0.4155 0.4183 0.4801 0.5085 0.5794 0.5887 0.6770 0.6964 0.6993 0.7114 0.7689 0.7789 0.7843 0.7927 5.9802 5.9905 6.9537 6.9649 7.0477 7.0521 7.2318 7.2391 7.3800 7.3985 7.6943 7.6985 k = 0.1146 0.3343-0.0000 ( 38548 PWs) bands (ev): -43.4454 -43.4454 -17.4604 -17.4604 -17.3350 -17.3350 -17.3251 -17.3251 -11.3206 -11.3201 -11.1897 -11.1896 -11.1809 -11.1808 -11.1453 -11.1452 -6.2872 -6.2850 -6.1341 -6.1296 -6.0530 -6.0381 -4.9694 -4.9565 -4.8619 -4.8327 -4.6843 -4.6575 -4.6427 -4.6214 -4.5882 -4.5819 -4.4796 -4.4790 -0.0871 -0.0679 0.0390 0.0420 0.1131 0.1483 0.3109 0.3224 0.3677 0.3945 0.4062 0.4123 0.4783 0.5030 0.5726 0.5796 0.6719 0.6874 0.6890 0.7028 0.7666 0.7796 0.7808 0.7882 6.0412 6.0522 6.9684 6.9790 7.0708 7.0763 7.3033 7.3106 7.4415 7.4618 7.7123 7.7172 k = 0.1218 0.3552-0.0000 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4588 -17.4587 -17.3336 -17.3336 -17.3237 -17.3237 -11.3188 -11.3182 -11.1897 -11.1895 -11.1796 -11.1795 -11.1447 -11.1446 -6.2898 -6.2871 -6.1400 -6.1347 -6.0576 -6.0420 -4.9695 -4.9549 -4.8735 -4.8427 -4.6949 -4.6683 -4.6525 -4.6274 -4.5922 -4.5872 -4.4797 -4.4792 -0.0958 -0.0799 0.0347 0.0359 0.1111 0.1441 0.3079 0.3154 0.3529 0.3915 0.3979 0.4076 0.4780 0.4981 0.5651 0.5705 0.6664 0.6776 0.6793 0.6949 0.7647 0.7754 0.7824 0.7842 6.1018 6.1136 6.9812 6.9910 7.0925 7.0989 7.3709 7.3780 7.5020 7.5235 7.7286 7.7343 k = 0.1290 0.3760-0.0000 ( 38534 PWs) bands (ev): -43.4454 -43.4454 -17.4571 -17.4571 -17.3322 -17.3322 -17.3224 -17.3224 -11.3170 -11.3164 -11.1897 -11.1896 -11.1782 -11.1782 -11.1441 -11.1440 -6.2926 -6.2892 -6.1461 -6.1399 -6.0621 -6.0460 -4.9702 -4.9537 -4.8851 -4.8529 -4.7052 -4.6787 -4.6620 -4.6340 -4.5954 -4.5915 -4.4795 -4.4792 -0.1064 -0.0941 0.0303 0.0307 0.1102 0.1405 0.3055 0.3082 0.3381 0.3836 0.3944 0.4014 0.4789 0.4938 0.5571 0.5615 0.6604 0.6675 0.6703 0.6873 0.7627 0.7713 0.7806 0.7842 6.1613 6.1737 6.9918 7.0007 7.1131 7.1201 7.4318 7.4387 7.5598 7.5817 7.7436 7.7498 k = 0.1361 0.3969-0.0000 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4555 -17.4554 -17.3307 -17.3307 -17.3210 -17.3210 -11.3151 -11.3145 -11.1898 -11.1896 -11.1769 -11.1769 -11.1435 -11.1434 -6.2955 -6.2913 -6.1522 -6.1451 -6.0667 -6.0500 -4.9715 -4.9530 -4.8965 -4.8631 -4.7150 -4.6884 -4.6713 -4.6412 -4.5981 -4.5948 -4.4792 -4.4790 -0.1186 -0.1099 0.0251 0.0270 0.1101 0.1372 0.3009 0.3032 0.3243 0.3761 0.3902 0.3939 0.4805 0.4902 0.5489 0.5528 0.6538 0.6575 0.6621 0.6796 0.7605 0.7674 0.7777 0.7859 6.2189 6.2318 7.0004 7.0084 7.1328 7.1403 7.4835 7.4903 7.6130 7.6348 7.7573 7.7639 k = 0.1433 0.4178-0.0000 ( 38526 PWs) bands (ev): -43.4454 -43.4454 -17.4538 -17.4538 -17.3293 -17.3293 -17.3197 -17.3197 -11.3133 -11.3127 -11.1899 -11.1898 -11.1757 -11.1757 -11.1428 -11.1428 -6.2984 -6.2935 -6.1584 -6.1502 -6.0711 -6.0540 -4.9736 -4.9527 -4.9077 -4.8732 -4.7242 -4.6972 -4.6801 -4.6487 -4.6002 -4.5972 -4.4788 -4.4788 -0.1322 -0.1267 0.0206 0.0235 0.1101 0.1341 0.2939 0.2992 0.3139 0.3704 0.3845 0.3855 0.4823 0.4870 0.5406 0.5443 0.6466 0.6477 0.6548 0.6718 0.7578 0.7637 0.7756 0.7877 6.2739 6.2873 7.0070 7.0140 7.1518 7.1596 7.5246 7.5312 7.6596 7.6806 7.7700 7.7769 k = 0.1504 0.4387-0.0000 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4522 -17.4522 -17.3280 -17.3279 -17.3183 -17.3183 -11.3114 -11.3108 -11.1902 -11.1900 -11.1745 -11.1744 -11.1422 -11.1422 -6.3013 -6.2956 -6.1645 -6.1553 -6.0755 -6.0580 -4.9763 -4.9530 -4.9184 -4.8830 -4.7326 -4.7051 -4.6884 -4.6564 -4.6018 -4.5989 -4.4784 -4.4782 -0.1468 -0.1441 0.0168 0.0203 0.1098 0.1306 0.2875 0.2905 0.3100 0.3663 0.3766 0.3775 0.4839 0.4839 0.5324 0.5361 0.6382 0.6390 0.6482 0.6639 0.7547 0.7601 0.7743 0.7894 6.3255 6.3392 7.0117 7.0177 7.1705 7.1785 7.5552 7.5617 7.6971 7.7166 7.7820 7.7889 k = 0.1576 0.4596-0.0000 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4506 -17.4506 -17.3266 -17.3266 -17.3171 -17.3171 -11.3096 -11.3090 -11.1904 -11.1903 -11.1734 -11.1733 -11.1417 -11.1416 -6.3043 -6.2977 -6.1705 -6.1602 -6.0797 -6.0620 -4.9798 -4.9539 -4.9285 -4.8924 -4.7402 -4.7119 -4.6960 -4.6641 -4.6030 -4.6000 -4.4780 -4.4776 -0.1621 -0.1617 0.0138 0.0175 0.1090 0.1267 0.2800 0.2821 0.3097 0.3638 0.3677 0.3694 0.4806 0.4850 0.5248 0.5281 0.6291 0.6314 0.6418 0.6560 0.7511 0.7566 0.7735 0.7910 6.3731 6.3869 7.0146 7.0197 7.1892 7.1972 7.5766 7.5828 7.7238 7.7410 7.7932 7.8003 k = 0.1648 0.4805-0.0000 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4491 -17.4491 -17.3253 -17.3253 -17.3159 -17.3159 -11.3078 -11.3072 -11.1908 -11.1906 -11.1723 -11.1722 -11.1411 -11.1411 -6.3071 -6.2996 -6.1765 -6.1650 -6.0838 -6.0658 -4.9840 -4.9554 -4.9379 -4.9013 -4.7469 -4.7177 -4.7030 -4.6717 -4.6037 -4.6006 -4.4776 -4.4769 -0.1794 -0.1778 0.0117 0.0152 0.1074 0.1222 0.2703 0.2777 0.3101 0.3594 0.3598 0.3635 0.4767 0.4856 0.5178 0.5205 0.6204 0.6240 0.6357 0.6480 0.7472 0.7531 0.7731 0.7926 6.4159 6.4297 7.0161 7.0202 7.2080 7.2160 7.5905 7.5962 7.7399 7.7541 7.8040 7.8112 k = 0.1719 0.5014-0.0000 ( 38560 PWs) bands (ev): -43.4454 -43.4454 -17.4477 -17.4477 -17.3241 -17.3241 -17.3147 -17.3147 -11.3060 -11.3055 -11.1912 -11.1910 -11.1713 -11.1711 -11.1406 -11.1406 -6.3099 -6.3015 -6.1822 -6.1695 -6.0877 -6.0696 -4.9889 -4.9574 -4.9465 -4.9095 -4.7528 -4.7224 -4.7092 -4.6790 -4.6041 -4.6009 -4.4772 -4.4761 -0.1968 -0.1937 0.0106 0.0135 0.1051 0.1171 0.2619 0.2745 0.3098 0.3505 0.3526 0.3637 0.4719 0.4854 0.5119 0.5134 0.6121 0.6169 0.6296 0.6401 0.7431 0.7496 0.7728 0.7940 6.4535 6.4670 7.0163 7.0195 7.2273 7.2352 7.5983 7.6033 7.7476 7.7587 7.8145 7.8219 k = 0.1791 0.5223-0.0000 ( 38574 PWs) bands (ev): -43.4454 -43.4454 -17.4463 -17.4463 -17.3229 -17.3229 -17.3136 -17.3136 -11.3043 -11.3038 -11.1917 -11.1915 -11.1704 -11.1702 -11.1401 -11.1401 -6.3126 -6.3032 -6.1877 -6.1737 -6.0913 -6.0731 -4.9941 -4.9598 -4.9543 -4.9170 -4.7577 -4.7261 -4.7145 -4.6860 -4.6041 -4.6008 -4.4767 -4.4754 -0.2136 -0.2094 0.0105 0.0125 0.1024 0.1115 0.2550 0.2724 0.3074 0.3406 0.3485 0.3652 0.4662 0.4841 0.5070 0.5072 0.6043 0.6102 0.6235 0.6325 0.7389 0.7460 0.7726 0.7952 6.4856 6.4986 7.0156 7.0179 7.2472 7.2547 7.6006 7.6048 7.7505 7.7586 7.8249 7.8323 k = 0.1863 0.5432-0.0000 ( 38554 PWs) bands (ev): -43.4454 -43.4454 -17.4450 -17.4450 -17.3218 -17.3218 -17.3126 -17.3126 -11.3027 -11.3022 -11.1923 -11.1921 -11.1696 -11.1693 -11.1397 -11.1397 -6.3151 -6.3047 -6.1928 -6.1776 -6.0946 -6.0765 -4.9996 -4.9627 -4.9614 -4.9237 -4.7619 -4.7289 -4.7190 -4.6925 -4.6039 -4.6004 -4.4764 -4.4747 -0.2299 -0.2247 0.0113 0.0122 0.0993 0.1055 0.2496 0.2710 0.3023 0.3307 0.3473 0.3676 0.4596 0.4815 0.5022 0.5031 0.5970 0.6041 0.6175 0.6251 0.7345 0.7424 0.7723 0.7962 6.5121 6.5244 7.0141 7.0156 7.2673 7.2745 7.5976 7.6008 7.7522 7.7579 7.8352 7.8425 k = 0.1934 0.5641-0.0000 ( 38540 PWs) bands (ev): -43.4454 -43.4454 -17.4438 -17.4438 -17.3208 -17.3208 -17.3117 -17.3117 -11.3011 -11.3007 -11.1929 -11.1927 -11.1689 -11.1686 -11.1393 -11.1393 -6.3174 -6.3060 -6.1977 -6.1811 -6.0977 -6.0796 -5.0051 -4.9677 -4.9657 -4.9296 -4.7653 -4.7308 -4.7227 -4.6985 -4.6034 -4.5997 -4.4760 -4.4739 -0.2452 -0.2395 0.0125 0.0133 0.0964 0.0995 0.2456 0.2703 0.2949 0.3211 0.3484 0.3706 0.4526 0.4774 0.4986 0.5001 0.5901 0.5985 0.6114 0.6181 0.7300 0.7386 0.7719 0.7968 6.5332 6.5448 7.0123 7.0129 7.2874 7.2941 7.5892 7.5916 7.7559 7.7598 7.8454 7.8526 k = 0.2006 0.5850-0.0000 ( 38544 PWs) bands (ev): -43.4454 -43.4454 -17.4427 -17.4427 -17.3199 -17.3199 -17.3109 -17.3109 -11.2997 -11.2992 -11.1936 -11.1934 -11.1683 -11.1679 -11.1390 -11.1390 -6.3194 -6.3070 -6.2021 -6.1842 -6.1004 -6.0825 -5.0104 -4.9733 -4.9687 -4.9346 -4.7680 -4.7319 -4.7254 -4.7040 -4.6027 -4.5989 -4.4758 -4.4733 -0.2596 -0.2534 0.0134 0.0163 0.0935 0.0937 0.2429 0.2698 0.2864 0.3119 0.3506 0.3738 0.4454 0.4723 0.4964 0.4978 0.5835 0.5935 0.6054 0.6117 0.7254 0.7348 0.7711 0.7971 6.5495 6.5602 7.0103 7.0104 7.3067 7.3130 7.5760 7.5778 7.7633 7.7659 7.8555 7.8626 k = 0.2078 0.6058-0.0000 ( 38526 PWs) bands (ev): -43.4454 -43.4454 -17.4417 -17.4417 -17.3191 -17.3191 -17.3102 -17.3102 -11.2983 -11.2979 -11.1943 -11.1941 -11.1678 -11.1674 -11.1388 -11.1388 -6.3212 -6.3078 -6.2060 -6.1868 -6.1027 -6.0851 -5.0152 -4.9782 -4.9716 -4.9388 -4.7701 -4.7324 -4.7274 -4.7090 -4.6018 -4.5979 -4.4756 -4.4726 -0.2729 -0.2664 0.0149 0.0203 0.0877 0.0917 0.2415 0.2691 0.2774 0.3039 0.3530 0.3768 0.4384 0.4667 0.4949 0.4961 0.5770 0.5891 0.5996 0.6061 0.7207 0.7309 0.7701 0.7971 6.5616 6.5712 7.0079 7.0087 7.3245 7.3304 7.5593 7.5606 7.7747 7.7766 7.8655 7.8722 k = 0.2149 0.6267-0.0000 ( 38520 PWs) bands (ev): -43.4454 -43.4454 -17.4408 -17.4408 -17.3184 -17.3184 -17.3097 -17.3097 -11.2970 -11.2967 -11.1950 -11.1949 -11.1675 -11.1670 -11.1387 -11.1386 -6.3227 -6.3082 -6.2095 -6.1890 -6.1047 -6.0874 -5.0194 -4.9825 -4.9741 -4.9423 -4.7715 -4.7323 -4.7286 -4.7133 -4.6007 -4.5967 -4.4755 -4.4721 -0.2850 -0.2783 0.0169 0.0254 0.0824 0.0905 0.2410 0.2676 0.2685 0.2977 0.3550 0.3791 0.4322 0.4613 0.4940 0.4949 0.5706 0.5849 0.5942 0.6014 0.7160 0.7269 0.7687 0.7967 6.5701 6.5788 7.0060 7.0075 7.3398 7.3451 7.5409 7.5420 7.7898 7.7911 7.8753 7.8802 k = 0.2221 0.6476-0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4401 -17.4401 -17.3178 -17.3178 -17.3092 -17.3092 -11.2959 -11.2956 -11.1958 -11.1957 -11.1672 -11.1667 -11.1386 -11.1386 -6.3237 -6.3083 -6.2124 -6.1906 -6.1063 -6.0894 -5.0229 -4.9860 -4.9761 -4.9449 -4.7723 -4.7318 -4.7290 -4.7170 -4.5994 -4.5953 -4.4755 -4.4716 -0.2957 -0.2889 0.0193 0.0313 0.0776 0.0902 0.2415 0.2598 0.2645 0.2940 0.3564 0.3803 0.4270 0.4561 0.4936 0.4942 0.5641 0.5803 0.5901 0.5978 0.7112 0.7228 0.7670 0.7959 6.5761 6.5838 7.0048 7.0069 7.3513 7.3562 7.5228 7.5237 7.8075 7.8082 7.8626 7.8713 k = 0.2293 0.6685-0.0000 ( 38470 PWs) bands (ev): -43.4454 -43.4454 -17.4395 -17.4395 -17.3174 -17.3174 -17.3089 -17.3089 -11.2949 -11.2947 -11.1966 -11.1965 -11.1672 -11.1666 -11.1387 -11.1386 -6.3245 -6.3081 -6.2147 -6.1916 -6.1074 -6.0911 -5.0256 -4.9887 -4.9774 -4.9468 -4.7725 -4.7308 -4.7289 -4.7200 -4.5980 -4.5938 -4.4756 -4.4713 -0.3051 -0.2982 0.0220 0.0382 0.0733 0.0909 0.2426 0.2519 0.2599 0.2929 0.3569 0.3799 0.4233 0.4513 0.4935 0.4940 0.5572 0.5747 0.5878 0.5956 0.7064 0.7187 0.7649 0.7947 6.5802 6.5869 7.0046 7.0073 7.3576 7.3620 7.5072 7.5081 7.8251 7.8260 7.8355 7.8440 k = 0.2364 0.6894-0.0000 ( 38468 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3171 -17.3171 -17.3086 -17.3086 -11.2941 -11.2939 -11.1974 -11.1973 -11.1672 -11.1666 -11.1388 -11.1388 -6.3248 -6.3075 -6.2165 -6.1921 -6.1082 -6.0924 -5.0274 -4.9907 -4.9781 -4.9479 -4.7721 -4.7296 -4.7282 -4.7223 -4.5964 -4.5922 -4.4759 -4.4710 -0.3129 -0.3060 0.0249 0.0457 0.0696 0.0927 0.2422 0.2470 0.2547 0.2939 0.3567 0.3780 0.4210 0.4470 0.4938 0.4943 0.5500 0.5681 0.5872 0.5946 0.7017 0.7147 0.7625 0.7932 6.5832 6.5890 7.0056 7.0088 7.3573 7.3612 7.4962 7.4971 7.8086 7.8136 7.8462 7.8474 k = 0.2436 0.7103-0.0000 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3169 -17.3169 -17.3086 -17.3086 -11.2934 -11.2933 -11.1982 -11.1982 -11.1674 -11.1668 -11.1391 -11.1390 -6.3247 -6.3065 -6.2176 -6.1920 -6.1085 -6.0933 -5.0282 -4.9919 -4.9779 -4.9482 -4.7710 -4.7282 -4.7270 -4.7238 -4.5947 -4.5905 -4.4762 -4.4708 -0.3193 -0.3123 0.0279 0.0537 0.0665 0.0953 0.2366 0.2489 0.2496 0.2961 0.3557 0.3749 0.4199 0.4432 0.4944 0.4950 0.5424 0.5608 0.5879 0.5948 0.6971 0.7107 0.7598 0.7914 6.5857 6.5907 7.0079 7.0115 7.3498 7.3532 7.4910 7.4918 7.7850 7.7902 7.8635 7.8636 k = 0.2507 0.7312-0.0000 ( 38468 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3168 -17.3168 -17.3086 -17.3086 -11.2929 -11.2929 -11.1990 -11.1989 -11.1678 -11.1671 -11.1394 -11.1394 -6.3241 -6.3052 -6.2181 -6.1913 -6.1084 -6.0938 -5.0281 -4.9923 -4.9769 -4.9478 -4.7693 -4.7269 -4.7255 -4.7243 -4.5930 -4.5887 -4.4767 -4.4708 -0.3240 -0.3171 0.0311 0.0606 0.0654 0.0986 0.2313 0.2453 0.2524 0.2992 0.3542 0.3712 0.4193 0.4396 0.4953 0.4964 0.5344 0.5531 0.5895 0.5961 0.6928 0.7068 0.7569 0.7894 6.5883 6.5926 7.0116 7.0157 7.3362 7.3393 7.4908 7.4916 7.7639 7.7691 7.8767 7.8779 k = 0.2579 0.7521-0.0000 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3168 -17.3168 -17.3088 -17.3088 -11.2927 -11.2927 -11.1997 -11.1997 -11.1683 -11.1675 -11.1399 -11.1399 -6.3231 -6.3034 -6.2179 -6.1900 -6.1079 -6.0940 -5.0270 -4.9918 -4.9751 -4.9466 -4.7669 -4.7261 -4.7235 -4.7234 -4.5911 -4.5868 -4.4773 -4.4708 -0.3273 -0.3203 0.0342 0.0604 0.0718 0.1022 0.2271 0.2422 0.2568 0.3031 0.3525 0.3674 0.4189 0.4364 0.4965 0.4982 0.5261 0.5449 0.5917 0.5982 0.6889 0.7032 0.7538 0.7871 6.5916 6.5951 7.0169 7.0214 7.3183 7.3214 7.4939 7.4945 7.7456 7.7509 7.8852 7.8876 k = 0.2651 0.7730-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3170 -17.3170 -17.3091 -17.3091 -11.2927 -11.2926 -11.2003 -11.2003 -11.1689 -11.1681 -11.1405 -11.1405 -6.3217 -6.3013 -6.2171 -6.1881 -6.1069 -6.0938 -5.0249 -4.9905 -4.9723 -4.9446 -4.7639 -4.7253 -4.7216 -4.7213 -4.5891 -4.5849 -4.4780 -4.4710 -0.3289 -0.3218 0.0374 0.0585 0.0800 0.1058 0.2247 0.2408 0.2618 0.3075 0.3508 0.3638 0.4185 0.4333 0.4979 0.5006 0.5178 0.5363 0.5944 0.6008 0.6856 0.7000 0.7506 0.7847 6.5958 6.5987 7.0238 7.0287 7.2979 7.3012 7.4987 7.4988 7.7305 7.7360 7.8882 7.8918 k = 0.2722 0.7939-0.0000 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3173 -17.3173 -17.3095 -17.3095 -11.2929 -11.2928 -11.2009 -11.2009 -11.1697 -11.1688 -11.1412 -11.1412 -6.3198 -6.2988 -6.2156 -6.1857 -6.1056 -6.0932 -5.0218 -4.9883 -4.9687 -4.9420 -4.7601 -4.7241 -4.7194 -4.7188 -4.5870 -4.5828 -4.4788 -4.4712 -0.3290 -0.3217 0.0406 0.0568 0.0875 0.1091 0.2242 0.2414 0.2675 0.3126 0.3493 0.3609 0.4178 0.4304 0.4983 0.5034 0.5103 0.5273 0.5970 0.6038 0.6831 0.6973 0.7474 0.7823 6.6014 6.6037 7.0325 7.0376 7.2760 7.2797 7.5030 7.5038 7.7191 7.7249 7.8851 7.8901 k = 0.2794 0.8148-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3177 -17.3177 -17.3101 -17.3101 -11.2934 -11.2932 -11.2014 -11.2013 -11.1706 -11.1697 -11.1420 -11.1420 -6.3175 -6.2960 -6.2136 -6.1827 -6.1038 -6.0923 -5.0177 -4.9853 -4.9642 -4.9387 -4.7557 -4.7223 -4.7170 -4.7159 -4.5849 -4.5807 -4.4797 -4.4716 -0.3276 -0.3200 0.0437 0.0551 0.0940 0.1116 0.2260 0.2440 0.2737 0.3182 0.3482 0.3587 0.4169 0.4276 0.4943 0.5064 0.5075 0.5182 0.5993 0.6067 0.6816 0.6952 0.7443 0.7799 6.6086 6.6103 7.0429 7.0483 7.2534 7.2576 7.5062 7.5080 7.7121 7.7181 7.8762 7.8826 k = 0.2794 0.8148-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3177 -17.3177 -17.3101 -17.3101 -11.2934 -11.2932 -11.2014 -11.2013 -11.1706 -11.1697 -11.1420 -11.1420 -6.3175 -6.2960 -6.2136 -6.1827 -6.1038 -6.0923 -5.0177 -4.9853 -4.9642 -4.9387 -4.7557 -4.7223 -4.7170 -4.7159 -4.5849 -4.5807 -4.4797 -4.4716 -0.3276 -0.3200 0.0437 0.0551 0.0940 0.1116 0.2260 0.2440 0.2737 0.3182 0.3482 0.3587 0.4169 0.4276 0.4943 0.5064 0.5075 0.5182 0.5993 0.6067 0.6816 0.6952 0.7443 0.7799 6.6086 6.6103 7.0429 7.0483 7.2534 7.2576 7.5062 7.5080 7.7121 7.7181 7.8762 7.8826 k = 0.2579 0.8148-0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4389 -17.4389 -17.3176 -17.3176 -17.3099 -17.3099 -11.2932 -11.2930 -11.2012 -11.2012 -11.1703 -11.1694 -11.1418 -11.1417 -6.3182 -6.2970 -6.2142 -6.1838 -6.1044 -6.0926 -5.0189 -4.9862 -4.9660 -4.9399 -4.7571 -4.7232 -4.7177 -4.7169 -4.5856 -4.5814 -4.4794 -4.4715 -0.3280 -0.3205 0.0430 0.0558 0.0922 0.1108 0.2255 0.2431 0.2715 0.3151 0.3489 0.3607 0.4168 0.4281 0.4950 0.5049 0.5085 0.5211 0.5986 0.6059 0.6820 0.6957 0.7457 0.7808 6.6082 6.6101 7.0414 7.0469 7.2560 7.2602 7.5058 7.5077 7.7182 7.7239 7.8789 7.8848 k = 0.2364 0.8148-0.0000 ( 38507 PWs) bands (ev): -43.4454 -43.4454 -17.4388 -17.4388 -17.3175 -17.3175 -17.3097 -17.3097 -11.2931 -11.2929 -11.2010 -11.2010 -11.1700 -11.1691 -11.1415 -11.1414 -6.3188 -6.2982 -6.2146 -6.1851 -6.1048 -6.0931 -5.0198 -4.9867 -4.9682 -4.9415 -4.7581 -4.7246 -4.7183 -4.7177 -4.5864 -4.5822 -4.4791 -4.4715 -0.3278 -0.3206 0.0429 0.0567 0.0905 0.1098 0.2258 0.2427 0.2692 0.3102 0.3505 0.3648 0.4157 0.4279 0.4932 0.5027 0.5113 0.5238 0.5978 0.6054 0.6828 0.6959 0.7479 0.7819 6.6123 6.6143 7.0443 7.0498 7.2495 7.2541 7.5070 7.5098 7.7317 7.7367 7.8803 7.8853 k = 0.2149 0.8148-0.0000 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3173 -17.3173 -17.3095 -17.3095 -11.2930 -11.2929 -11.2007 -11.2007 -11.1696 -11.1688 -11.1412 -11.1412 -6.3192 -6.2995 -6.2148 -6.1865 -6.1051 -6.0937 -5.0204 -4.9868 -4.9707 -4.9433 -4.7588 -4.7263 -4.7187 -4.7184 -4.5872 -4.5831 -4.4787 -4.4715 -0.3272 -0.3203 0.0433 0.0578 0.0891 0.1088 0.2268 0.2428 0.2667 0.3045 0.3527 0.3700 0.4138 0.4271 0.4902 0.4997 0.5145 0.5261 0.5968 0.6051 0.6837 0.6960 0.7507 0.7831 6.6206 6.6228 7.0515 7.0570 7.2347 7.2398 7.5109 7.5148 7.7489 7.7531 7.8811 7.8850 k = 0.1934 0.8148-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3172 -17.3172 -17.3094 -17.3094 -11.2930 -11.2928 -11.2005 -11.2005 -11.1693 -11.1686 -11.1409 -11.1409 -6.3195 -6.3009 -6.2147 -6.1880 -6.1052 -6.0943 -5.0205 -4.9866 -4.9736 -4.9453 -4.7592 -4.7283 -4.7191 -4.7190 -4.5880 -4.5840 -4.4783 -4.4716 -0.3261 -0.3196 0.0441 0.0589 0.0882 0.1077 0.2283 0.2431 0.2644 0.2987 0.3554 0.3753 0.4115 0.4256 0.4865 0.4962 0.5177 0.5282 0.5957 0.6048 0.6848 0.6959 0.7542 0.7845 6.6330 6.6353 7.0628 7.0685 7.2136 7.2191 7.5176 7.5226 7.7647 7.7684 7.8625 7.8655 k = 0.1719 0.8148-0.0000 ( 38482 PWs) bands (ev): -43.4454 -43.4454 -17.4386 -17.4386 -17.3171 -17.3171 -17.3092 -17.3092 -11.2929 -11.2928 -11.2002 -11.2002 -11.1690 -11.1683 -11.1407 -11.1406 -6.3196 -6.3023 -6.2144 -6.1897 -6.1052 -6.0951 -5.0202 -4.9860 -4.9767 -4.9476 -4.7592 -4.7305 -4.7197 -4.7193 -4.5887 -4.5850 -4.4780 -4.4718 -0.3248 -0.3188 0.0453 0.0599 0.0880 0.1069 0.2301 0.2435 0.2625 0.2931 0.3582 0.3800 0.4091 0.4237 0.4826 0.4921 0.5208 0.5302 0.5943 0.6044 0.6861 0.6957 0.7581 0.7859 6.6494 6.6518 7.0780 7.0840 7.1878 7.1934 7.5264 7.5321 7.7745 7.7780 7.8264 7.8283 k = 0.1504 0.8148-0.0000 ( 38491 PWs) bands (ev): -43.4454 -43.4454 -17.4386 -17.4386 -17.3170 -17.3170 -17.3091 -17.3091 -11.2929 -11.2928 -11.1999 -11.1999 -11.1687 -11.1681 -11.1404 -11.1404 -6.3195 -6.3039 -6.2139 -6.1914 -6.1052 -6.0958 -5.0195 -4.9851 -4.9801 -4.9501 -4.7589 -4.7328 -4.7202 -4.7196 -4.5894 -4.5859 -4.4776 -4.4720 -0.3232 -0.3178 0.0468 0.0605 0.0885 0.1062 0.2320 0.2438 0.2611 0.2882 0.3609 0.3830 0.4077 0.4217 0.4786 0.4875 0.5236 0.5322 0.5927 0.6037 0.6875 0.6955 0.7623 0.7872 6.6694 6.6720 7.0963 7.1030 7.1592 7.1643 7.5363 7.5422 7.7752 7.7773 7.7888 7.7896 k = 0.1290 0.8148-0.0000 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3170 -17.3170 -17.3090 -17.3090 -11.2929 -11.2928 -11.1996 -11.1996 -11.1684 -11.1679 -11.1402 -11.1401 -6.3193 -6.3054 -6.2131 -6.1933 -6.1049 -6.0966 -5.0185 -4.9838 -4.9836 -4.9527 -4.7583 -4.7352 -4.7206 -4.7200 -4.5900 -4.5869 -4.4771 -4.4723 -0.3215 -0.3167 0.0484 0.0608 0.0898 0.1057 0.2337 0.2438 0.2606 0.2839 0.3631 0.3834 0.4082 0.4200 0.4748 0.4827 0.5262 0.5342 0.5910 0.6027 0.6889 0.6953 0.7666 0.7883 6.6927 6.6954 7.1114 7.1225 7.1346 7.1354 7.5461 7.5520 7.7422 7.7424 7.7759 7.7804 k = 0.1075 0.8148-0.0000 ( 38497 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3169 -17.3169 -17.3089 -17.3089 -11.2929 -11.2928 -11.1994 -11.1994 -11.1682 -11.1677 -11.1400 -11.1400 -6.3188 -6.3070 -6.2121 -6.1952 -6.1046 -6.0975 -5.0171 -4.9872 -4.9822 -4.9555 -4.7575 -4.7377 -4.7209 -4.7203 -4.5905 -4.5877 -4.4767 -4.4726 -0.3199 -0.3158 0.0501 0.0607 0.0917 0.1054 0.2350 0.2435 0.2610 0.2805 0.3647 0.3816 0.4102 0.4187 0.4713 0.4779 0.5288 0.5362 0.5893 0.6011 0.6902 0.6952 0.7708 0.7891 6.7188 6.7217 7.0895 7.0978 7.1482 7.1516 7.5549 7.5604 7.6992 7.6997 7.7714 7.7761 k = 0.0860 0.8148-0.0000 ( 38513 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3169 -17.3169 -17.3088 -17.3088 -11.2929 -11.2929 -11.1992 -11.1992 -11.1679 -11.1675 -11.1398 -11.1398 -6.3182 -6.3086 -6.2110 -6.1971 -6.1042 -6.0984 -5.0153 -4.9909 -4.9803 -4.9584 -4.7563 -4.7401 -4.7211 -4.7205 -4.5908 -4.5885 -4.4763 -4.4729 -0.3183 -0.3149 0.0517 0.0603 0.0941 0.1052 0.2359 0.2428 0.2622 0.2778 0.3656 0.3785 0.4129 0.4182 0.4682 0.4734 0.5312 0.5379 0.5879 0.5991 0.6914 0.6951 0.7748 0.7896 6.7471 6.7502 7.0565 7.0636 7.1736 7.1776 7.5618 7.5667 7.6570 7.6579 7.7677 7.7723 k = 0.0645 0.8148-0.0000 ( 38529 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3087 -17.3087 -11.2930 -11.2929 -11.1990 -11.1990 -11.1677 -11.1674 -11.1397 -11.1397 -6.3175 -6.3101 -6.2096 -6.1991 -6.1037 -6.0992 -5.0131 -4.9945 -4.9781 -4.9614 -4.7549 -4.7425 -4.7213 -4.7208 -4.5910 -4.5893 -4.4759 -4.4733 -0.3169 -0.3143 0.0532 0.0596 0.0965 0.1049 0.2365 0.2417 0.2641 0.2757 0.3660 0.3751 0.4154 0.4182 0.4657 0.4695 0.5336 0.5392 0.5871 0.5967 0.6925 0.6950 0.7785 0.7896 6.7768 6.7801 7.0229 7.0292 7.1998 7.2035 7.5663 7.5709 7.6185 7.6191 7.7657 7.7697 k = 0.0430 0.8148-0.0000 ( 38530 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3086 -17.3086 -11.2930 -11.2929 -11.1989 -11.1988 -11.1676 -11.1674 -11.1396 -11.1396 -6.3165 -6.3116 -6.2081 -6.2010 -6.1031 -6.1001 -5.0106 -4.9981 -4.9757 -4.9644 -4.7532 -4.7449 -4.7213 -4.7210 -4.5911 -4.5899 -4.4754 -4.4737 -0.3157 -0.3139 0.0546 0.0588 0.0989 0.1045 0.2370 0.2405 0.2662 0.2739 0.3662 0.3721 0.4173 0.4185 0.4639 0.4664 0.5357 0.5399 0.5870 0.5941 0.6933 0.6949 0.7817 0.7892 6.8062 6.8095 6.9910 6.9963 7.2236 7.2266 7.5676 7.5729 7.5864 7.5877 7.7652 7.7682 k = 0.0215 0.8148-0.0000 ( 38538 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3086 -17.3086 -11.2930 -11.2929 -11.1988 -11.1988 -11.1675 -11.1674 -11.1395 -11.1395 -6.3155 -6.3130 -6.2065 -6.2029 -6.1024 -6.1009 -5.0079 -5.0015 -4.9730 -4.9674 -4.7514 -4.7472 -4.7214 -4.7212 -4.5910 -4.5904 -4.4750 -4.4741 -0.3147 -0.3139 0.0558 0.0579 0.1009 0.1037 0.2376 0.2394 0.2683 0.2722 0.3667 0.3695 0.4185 0.4189 0.4630 0.4642 0.5376 0.5398 0.5877 0.5916 0.6940 0.6947 0.7844 0.7882 6.8317 6.8342 6.9650 6.9685 7.2412 7.2429 7.5591 7.5623 7.5748 7.5757 7.7657 7.7673 k = 0.0000 0.8148-0.0000 ( 38538 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3086 -17.3086 -11.2930 -11.2930 -11.1987 -11.1987 -11.1674 -11.1674 -11.1395 -11.1395 -6.3143 -6.3143 -6.2047 -6.2047 -6.1017 -6.1017 -5.0048 -5.0048 -4.9703 -4.9703 -4.7493 -4.7493 -4.7213 -4.7213 -4.5908 -4.5908 -4.4746 -4.4746 -0.3141 -0.3141 0.0569 0.0569 0.1026 0.1026 0.2384 0.2384 0.2703 0.2703 0.3678 0.3678 0.4190 0.4190 0.4631 0.4631 0.5390 0.5390 0.5893 0.5893 0.6944 0.6944 0.7866 0.7866 6.8441 6.8441 6.9549 6.9549 7.2483 7.2483 7.5532 7.5532 7.5749 7.5749 7.7665 7.7665 k = 0.0000 0.8148-0.0000 ( 38538 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3086 -17.3086 -11.2930 -11.2930 -11.1987 -11.1987 -11.1674 -11.1674 -11.1395 -11.1395 -6.3143 -6.3143 -6.2047 -6.2047 -6.1017 -6.1017 -5.0048 -5.0048 -4.9703 -4.9703 -4.7493 -4.7493 -4.7213 -4.7213 -4.5908 -4.5908 -4.4746 -4.4746 -0.3141 -0.3141 0.0569 0.0569 0.1026 0.1026 0.2384 0.2384 0.2703 0.2703 0.3678 0.3678 0.4190 0.4190 0.4631 0.4631 0.5390 0.5390 0.5893 0.5893 0.6944 0.6944 0.7866 0.7866 6.8441 6.8441 6.9549 6.9549 7.2483 7.2483 7.5532 7.5532 7.5749 7.5749 7.7665 7.7665 k = 0.0000 0.8148 0.0216 ( 38532 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3168 -17.3168 -17.3085 -17.3085 -11.2930 -11.2930 -11.1988 -11.1988 -11.1674 -11.1674 -11.1395 -11.1395 -6.3148 -6.3138 -6.2054 -6.2036 -6.1022 -6.1016 -5.0054 -5.0039 -4.9713 -4.9692 -4.7514 -4.7476 -4.7263 -4.7167 -4.5907 -4.5902 -4.4770 -4.4726 -0.3144 -0.3140 0.0529 0.0619 0.1000 0.1060 0.2341 0.2425 0.2664 0.2739 0.3667 0.3692 0.4128 0.4239 0.4604 0.4648 0.5331 0.5457 0.5880 0.5925 0.6937 0.6949 0.7846 0.7872 6.8449 6.8454 6.9549 6.9563 7.2444 7.2472 7.5502 7.5519 7.5717 7.5775 7.7712 7.7741 k = 0.0000 0.8148 0.0431 ( 38520 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3170 -17.3170 -17.3084 -17.3084 -11.2929 -11.2929 -11.1988 -11.1988 -11.1673 -11.1673 -11.1395 -11.1395 -6.3154 -6.3135 -6.2055 -6.2021 -6.1032 -6.1018 -5.0057 -5.0026 -4.9722 -4.9682 -4.7538 -4.7464 -4.7312 -4.7127 -4.5899 -4.5889 -4.4799 -4.4711 -0.3148 -0.3140 0.0500 0.0677 0.0985 0.1104 0.2297 0.2465 0.2620 0.2769 0.3660 0.3705 0.4062 0.4267 0.4570 0.4655 0.5288 0.5525 0.5882 0.5971 0.6925 0.6950 0.7814 0.7866 6.8476 6.8487 6.9564 6.9592 7.2356 7.2412 7.5450 7.5473 7.5680 7.5777 7.7877 7.7928 k = 0.0000 0.8148 0.0647 ( 38528 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3173 -17.3173 -17.3081 -17.3081 -11.2929 -11.2929 -11.1989 -11.1989 -11.1673 -11.1673 -11.1395 -11.1395 -6.3161 -6.3133 -6.2050 -6.2001 -6.1045 -6.1024 -5.0056 -5.0011 -4.9732 -4.9671 -4.7563 -4.7464 -4.7351 -4.7094 -4.5887 -4.5867 -4.4831 -4.4701 -0.3152 -0.3140 0.0482 0.0741 0.0982 0.1157 0.2251 0.2501 0.2571 0.2794 0.3658 0.3704 0.4008 0.4269 0.4535 0.4655 0.5265 0.5590 0.5900 0.6029 0.6910 0.6949 0.7771 0.7848 6.8524 6.8541 6.9589 6.9632 7.2231 7.2312 7.5394 7.5424 7.5620 7.5741 7.8135 7.8202 k = 0.0000 0.8148 0.0862 ( 38514 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3176 -17.3176 -17.3078 -17.3078 -11.2929 -11.2929 -11.1990 -11.1990 -11.1672 -11.1672 -11.1396 -11.1396 -6.3168 -6.3133 -6.2040 -6.1977 -6.1062 -6.1034 -5.0051 -4.9993 -4.9741 -4.9660 -4.7592 -4.7488 -4.7367 -4.7071 -4.5870 -4.5838 -4.4866 -4.4697 -0.3157 -0.3143 0.0475 0.0804 0.0994 0.1221 0.2202 0.2518 0.2533 0.2814 0.3659 0.3675 0.3983 0.4243 0.4505 0.4652 0.5263 0.5646 0.5926 0.6094 0.6893 0.6949 0.7715 0.7819 6.8593 6.8615 6.9622 6.9679 7.2082 7.2188 7.5343 7.5384 7.5530 7.5667 7.8460 7.8538 k = 0.0000 0.8148 0.1078 ( 38514 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3180 -17.3180 -17.3075 -17.3075 -11.2928 -11.2928 -11.1991 -11.1991 -11.1671 -11.1671 -11.1396 -11.1396 -6.3174 -6.3135 -6.2026 -6.1951 -6.1081 -6.1048 -5.0042 -4.9973 -4.9749 -4.9651 -4.7625 -4.7529 -4.7363 -4.7056 -4.5849 -4.5801 -4.4903 -4.4699 -0.3163 -0.3146 0.0480 0.0859 0.1028 0.1295 0.2150 0.2460 0.2558 0.2828 0.3607 0.3665 0.3994 0.4195 0.4486 0.4653 0.5279 0.5693 0.5957 0.6160 0.6876 0.6951 0.7651 0.7780 6.8684 6.8710 6.9656 6.9728 7.1927 7.2055 7.5292 7.5345 7.5420 7.5554 7.8823 7.8911 k = 0.0000 0.8148 0.1293 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3184 -17.3184 -17.3071 -17.3071 -11.2928 -11.2928 -11.1993 -11.1993 -11.1669 -11.1669 -11.1397 -11.1397 -6.3180 -6.3137 -6.2006 -6.1922 -6.1104 -6.1065 -5.0031 -4.9952 -4.9757 -4.9641 -4.7661 -4.7572 -4.7351 -4.7050 -4.5826 -4.5758 -4.4941 -4.4707 -0.3169 -0.3150 0.0495 0.0902 0.1084 0.1381 0.2093 0.2397 0.2577 0.2836 0.3522 0.3664 0.4025 0.4137 0.4479 0.4659 0.5307 0.5731 0.5986 0.6220 0.6863 0.6955 0.7578 0.7732 6.8795 6.8825 6.9685 6.9771 7.1782 7.1930 7.5186 7.5287 7.5344 7.5412 7.9052 7.9199 k = 0.0000 0.8148 0.1509 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3188 -17.3188 -17.3067 -17.3067 -11.2927 -11.2927 -11.1994 -11.1994 -11.1668 -11.1668 -11.1397 -11.1397 -6.3185 -6.3141 -6.1982 -6.1892 -6.1129 -6.1085 -5.0017 -4.9931 -4.9765 -4.9634 -4.7700 -4.7613 -4.7336 -4.7051 -4.5800 -4.5712 -4.4978 -4.4721 -0.3175 -0.3155 0.0521 0.0938 0.1157 0.1479 0.2033 0.2328 0.2587 0.2840 0.3426 0.3652 0.4043 0.4105 0.4485 0.4674 0.5345 0.5759 0.6010 0.6266 0.6859 0.6963 0.7500 0.7677 6.8928 6.8962 6.9702 6.9797 7.1664 7.1826 7.5002 7.5178 7.5265 7.5316 7.8787 7.8975 k = 0.0000 0.8148 0.1724 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3192 -17.3192 -17.3064 -17.3064 -11.2926 -11.2926 -11.1996 -11.1996 -11.1666 -11.1666 -11.1398 -11.1398 -6.3189 -6.3146 -6.1955 -6.1862 -6.1155 -6.1107 -5.0000 -4.9909 -4.9771 -4.9629 -4.7739 -4.7650 -4.7320 -4.7058 -4.5771 -4.5663 -4.5013 -4.4741 -0.3181 -0.3161 0.0557 0.0974 0.1236 0.1585 0.1972 0.2253 0.2588 0.2841 0.3328 0.3616 0.4018 0.4138 0.4504 0.4699 0.5387 0.5778 0.6025 0.6293 0.6866 0.6975 0.7420 0.7617 6.9082 6.9119 6.9703 6.9801 7.1580 7.1749 7.4786 7.4971 7.5195 7.5254 7.8570 7.8745 k = 0.0000 0.8148 0.1940 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3196 -17.3196 -17.3061 -17.3061 -11.2926 -11.2926 -11.1997 -11.1997 -11.1665 -11.1665 -11.1398 -11.1398 -6.3193 -6.3152 -6.1925 -6.1832 -6.1181 -6.1131 -4.9983 -4.9889 -4.9775 -4.9626 -4.7775 -4.7684 -4.7304 -4.7070 -4.5741 -4.5617 -4.5044 -4.4766 -0.3186 -0.3166 0.0602 0.1011 0.1312 0.1695 0.1920 0.2175 0.2577 0.2839 0.3234 0.3547 0.4008 0.4182 0.4536 0.4731 0.5431 0.5791 0.6030 0.6300 0.6886 0.6990 0.7342 0.7555 6.9253 6.9293 6.9688 6.9779 7.1532 7.1696 7.4560 7.4736 7.5111 7.5171 7.8422 7.8575 k = 0.0000 0.8148 0.2155 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3199 -17.3199 -17.3058 -17.3058 -11.2925 -11.2925 -11.1999 -11.1999 -11.1664 -11.1664 -11.1398 -11.1398 -6.3195 -6.3158 -6.1893 -6.1804 -6.1207 -6.1157 -4.9964 -4.9872 -4.9776 -4.9627 -4.7804 -4.7717 -4.7286 -4.7086 -4.5710 -4.5575 -4.5067 -4.4797 -0.3190 -0.3173 0.0655 0.1049 0.1379 0.1785 0.1898 0.2104 0.2552 0.2837 0.3147 0.3452 0.4022 0.4220 0.4579 0.4766 0.5477 0.5799 0.6024 0.6289 0.6912 0.7005 0.7273 0.7492 6.9433 6.9477 6.9670 6.9741 7.1506 7.1656 7.4346 7.4503 7.5003 7.5062 7.8338 7.8464 k = 0.0000 0.8148 0.2371 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3202 -17.3201 -17.3055 -17.3055 -11.2925 -11.2925 -11.2000 -11.2000 -11.1663 -11.1663 -11.1399 -11.1399 -6.3195 -6.3165 -6.1861 -6.1780 -6.1230 -6.1183 -4.9946 -4.9861 -4.9769 -4.9632 -4.7827 -4.7747 -4.7268 -4.7105 -4.5678 -4.5544 -4.5079 -4.4831 -0.3193 -0.3178 0.0715 0.1083 0.1425 0.1825 0.1907 0.2085 0.2514 0.2832 0.3073 0.3340 0.4052 0.4246 0.4629 0.4801 0.5522 0.5805 0.6010 0.6263 0.6940 0.7018 0.7220 0.7431 6.9549 6.9614 6.9728 6.9744 7.1483 7.1608 7.4169 7.4298 7.4876 7.4932 7.8305 7.8402 k = 0.0000 0.8148 0.2586 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3204 -17.3204 -17.3053 -17.3053 -11.2924 -11.2924 -11.2001 -11.2001 -11.1662 -11.1662 -11.1399 -11.1399 -6.3195 -6.3171 -6.1829 -6.1762 -6.1249 -6.1207 -4.9928 -4.9859 -4.9755 -4.9641 -4.7841 -4.7775 -4.7249 -4.7125 -4.5645 -4.5527 -4.5078 -4.4870 -0.3196 -0.3184 0.0782 0.1102 0.1452 0.1839 0.1879 0.2159 0.2468 0.2819 0.3018 0.3224 0.4091 0.4258 0.4684 0.4828 0.5568 0.5806 0.5997 0.6227 0.6962 0.7022 0.7191 0.7374 6.9539 6.9598 6.9898 6.9926 7.1442 7.1534 7.4049 7.4144 7.4738 7.4788 7.8305 7.8374 k = 0.0000 0.8148 0.2802 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3205 -17.3205 -17.3052 -17.3052 -11.2924 -11.2924 -11.2002 -11.2002 -11.1661 -11.1661 -11.1399 -11.1399 -6.3193 -6.3177 -6.1801 -6.1752 -6.1261 -6.1230 -4.9911 -4.9863 -4.9736 -4.9655 -4.7847 -4.7800 -4.7230 -4.7146 -4.5613 -4.5525 -4.5061 -4.4911 -0.3197 -0.3188 0.0852 0.1092 0.1481 0.1762 0.1943 0.2225 0.2452 0.2789 0.2984 0.3117 0.4133 0.4256 0.4737 0.4842 0.5614 0.5791 0.6001 0.6181 0.6978 0.7017 0.7190 0.7322 6.9514 6.9553 7.0094 7.0119 7.1376 7.1433 7.3995 7.4053 7.4607 7.4647 7.8323 7.8367 k = 0.0000 0.8148 0.3017 ( 38540 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3206 -17.3206 -17.3051 -17.3051 -11.2924 -11.2924 -11.2002 -11.2002 -11.1661 -11.1661 -11.1400 -11.1400 -6.3191 -6.3182 -6.1777 -6.1751 -6.1265 -6.1248 -4.9896 -4.9872 -4.9714 -4.9672 -4.7845 -4.7821 -4.7209 -4.7167 -4.5583 -4.5536 -4.5032 -4.4953 -0.3197 -0.3192 0.0924 0.1053 0.1530 0.1677 0.2029 0.2198 0.2522 0.2727 0.2975 0.3036 0.4175 0.4239 0.4784 0.4840 0.5662 0.5757 0.6029 0.6128 0.6988 0.7007 0.7209 0.7278 6.9499 6.9519 7.0256 7.0271 7.1302 7.1328 7.3991 7.4017 7.4508 7.4532 7.8343 7.8364 k = 0.0000 0.8148 0.3233 ( 38540 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3051 -17.3051 -11.2924 -11.2924 -11.2002 -11.2002 -11.1660 -11.1660 -11.1400 -11.1400 -6.3187 -6.3187 -6.1759 -6.1759 -6.1260 -6.1260 -4.9883 -4.9883 -4.9692 -4.9692 -4.7836 -4.7836 -4.7189 -4.7189 -4.5556 -4.5556 -4.4995 -4.4995 -0.3195 -0.3195 0.0994 0.0994 0.1597 0.1597 0.2120 0.2120 0.2630 0.2630 0.2991 0.2991 0.4211 0.4211 0.4820 0.4820 0.5711 0.5711 0.6075 0.6075 0.6998 0.6998 0.7240 0.7240 6.9500 6.9500 7.0327 7.0327 7.1273 7.1273 7.4004 7.4004 7.4477 7.4477 7.8358 7.8358 k = 0.0000 0.8148 0.3233 ( 38540 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3051 -17.3051 -11.2924 -11.2924 -11.2002 -11.2002 -11.1660 -11.1660 -11.1400 -11.1400 -6.3187 -6.3187 -6.1759 -6.1759 -6.1260 -6.1260 -4.9883 -4.9883 -4.9692 -4.9692 -4.7836 -4.7836 -4.7189 -4.7189 -4.5556 -4.5556 -4.4995 -4.4995 -0.3195 -0.3195 0.0994 0.0994 0.1597 0.1597 0.2120 0.2120 0.2630 0.2630 0.2991 0.2991 0.4211 0.4211 0.4820 0.4820 0.5711 0.5711 0.6075 0.6075 0.6998 0.6998 0.7240 0.7240 6.9500 6.9500 7.0327 7.0327 7.1273 7.1273 7.4004 7.4004 7.4477 7.4477 7.8358 7.8358 k = 0.0215 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3051 -17.3051 -11.2924 -11.2924 -11.2003 -11.2003 -11.1661 -11.1660 -11.1400 -11.1400 -6.3197 -6.3176 -6.1775 -6.1743 -6.1269 -6.1252 -4.9910 -4.9853 -4.9717 -4.9665 -4.7847 -4.7826 -4.7190 -4.7184 -4.5565 -4.5546 -4.5004 -4.4985 -0.3204 -0.3187 0.0953 0.1015 0.1579 0.1605 0.2090 0.2164 0.2633 0.2639 0.2976 0.3010 0.4197 0.4233 0.4805 0.4828 0.5701 0.5726 0.6074 0.6080 0.6991 0.6999 0.7230 0.7241 6.9479 6.9499 7.0274 7.0281 7.1265 7.1269 7.3999 7.4016 7.4528 7.4537 7.8384 7.8385 k = 0.0430 0.8148 0.3233 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3051 -17.3051 -11.2924 -11.2924 -11.2003 -11.2003 -11.1663 -11.1661 -11.1401 -11.1400 -6.3205 -6.3164 -6.1789 -6.1726 -6.1276 -6.1243 -4.9935 -4.9821 -4.9741 -4.9638 -4.7857 -4.7816 -4.7190 -4.7178 -4.5573 -4.5536 -4.5013 -4.4975 -0.3216 -0.3182 0.0899 0.1014 0.1550 0.1604 0.2076 0.2223 0.2650 0.2657 0.2965 0.3033 0.4190 0.4261 0.4785 0.4831 0.5695 0.5744 0.6074 0.6087 0.6978 0.6996 0.7213 0.7235 6.9434 6.9472 7.0132 7.0145 7.1246 7.1254 7.4000 7.4035 7.4680 7.4694 7.8460 7.8462 k = 0.0645 0.8148 0.3233 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3052 -17.3052 -11.2924 -11.2924 -11.2004 -11.2004 -11.1664 -11.1662 -11.1402 -11.1401 -6.3212 -6.3151 -6.1802 -6.1709 -6.1283 -6.1233 -4.9957 -4.9788 -4.9762 -4.9611 -4.7867 -4.7806 -4.7188 -4.7170 -4.5580 -4.5524 -4.5022 -4.4966 -0.3228 -0.3178 0.0837 0.0993 0.1511 0.1594 0.2079 0.2292 0.2679 0.2680 0.2959 0.3060 0.4192 0.4295 0.4762 0.4827 0.5694 0.5765 0.6077 0.6097 0.6957 0.6987 0.7191 0.7222 6.9367 6.9422 6.9925 6.9941 7.1224 7.1236 7.4006 7.4058 7.4907 7.4926 7.8577 7.8582 k = 0.0860 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3208 -17.3208 -17.3052 -17.3052 -11.2924 -11.2924 -11.2005 -11.2005 -11.1667 -11.1663 -11.1403 -11.1403 -6.3218 -6.3138 -6.1813 -6.1691 -6.1289 -6.1224 -4.9975 -4.9781 -4.9753 -4.9584 -4.7877 -4.7797 -4.7183 -4.7160 -4.5585 -4.5512 -4.5030 -4.4956 -0.3242 -0.3176 0.0770 0.0956 0.1466 0.1574 0.2097 0.2367 0.2705 0.2717 0.2959 0.3089 0.4201 0.4330 0.4740 0.4817 0.5697 0.5787 0.6081 0.6110 0.6926 0.6973 0.7167 0.7205 6.9279 6.9347 6.9680 6.9698 7.1206 7.1223 7.4016 7.4083 7.5182 7.5203 7.8726 7.8735 k = 0.1075 0.8148 0.3233 ( 38528 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3208 -17.3208 -17.3053 -17.3053 -11.2925 -11.2924 -11.2006 -11.2006 -11.1669 -11.1665 -11.1405 -11.1405 -6.3222 -6.3124 -6.1822 -6.1674 -6.1295 -6.1215 -4.9990 -4.9797 -4.9718 -4.9558 -4.7885 -4.7789 -4.7177 -4.7148 -4.5589 -4.5500 -4.5038 -4.4946 -0.3256 -0.3176 0.0704 0.0909 0.1419 0.1546 0.2126 0.2440 0.2735 0.2761 0.2965 0.3120 0.4215 0.4364 0.4722 0.4805 0.5703 0.5809 0.6085 0.6123 0.6884 0.6952 0.7145 0.7184 6.9173 6.9251 6.9419 6.9438 7.1200 7.1223 7.4027 7.4107 7.5478 7.5501 7.8892 7.8906 k = 0.1290 0.8148 0.3233 ( 38530 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3209 -17.3209 -17.3054 -17.3054 -11.2925 -11.2924 -11.2008 -11.2007 -11.1673 -11.1667 -11.1407 -11.1407 -6.3225 -6.3110 -6.1830 -6.1657 -6.1299 -6.1205 -5.0002 -4.9810 -4.9683 -4.9533 -4.7892 -4.7781 -4.7169 -4.7135 -4.5592 -4.5488 -4.5046 -4.4937 -0.3271 -0.3177 0.0640 0.0858 0.1373 0.1514 0.2160 0.2502 0.2774 0.2809 0.2978 0.3151 0.4234 0.4390 0.4715 0.4791 0.5709 0.5829 0.6088 0.6137 0.6829 0.6925 0.7126 0.7164 6.9055 6.9135 6.9162 6.9184 7.1209 7.1240 7.4035 7.4127 7.5776 7.5803 7.9062 7.9084 k = 0.1504 0.8148 0.3233 ( 38530 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3209 -17.3209 -17.3055 -17.3055 -11.2925 -11.2924 -11.2009 -11.2009 -11.1676 -11.1670 -11.1410 -11.1409 -6.3225 -6.3096 -6.1835 -6.1641 -6.1302 -6.1196 -5.0011 -4.9820 -4.9648 -4.9510 -4.7898 -4.7774 -4.7160 -4.7121 -4.5593 -4.5476 -4.5053 -4.4929 -0.3286 -0.3179 0.0581 0.0806 0.1331 0.1483 0.2194 0.2545 0.2828 0.2859 0.2997 0.3181 0.4253 0.4401 0.4724 0.4780 0.5715 0.5845 0.6088 0.6149 0.6765 0.6893 0.7112 0.7147 6.8899 6.8926 6.8951 6.9030 7.1237 7.1274 7.4041 7.4141 7.6062 7.6094 7.9223 7.9253 k = 0.1719 0.8148 0.3233 ( 38534 PWs) bands (ev): -43.4454 -43.4454 -17.4382 -17.4382 -17.3210 -17.3210 -17.3057 -17.3057 -11.2926 -11.2924 -11.2011 -11.2011 -11.1679 -11.1672 -11.1413 -11.1412 -6.3225 -6.3082 -6.1838 -6.1626 -6.1305 -6.1187 -5.0015 -4.9826 -4.9614 -4.9489 -4.7901 -4.7767 -4.7149 -4.7107 -4.5593 -4.5464 -4.5059 -4.4921 -0.3300 -0.3182 0.0528 0.0756 0.1297 0.1456 0.2222 0.2566 0.2898 0.2907 0.3024 0.3207 0.4270 0.4398 0.4749 0.4773 0.5719 0.5857 0.6083 0.6159 0.6696 0.6858 0.7101 0.7133 6.8685 6.8704 6.8826 6.8913 7.1281 7.1325 7.4041 7.4148 7.6323 7.6365 7.9363 7.9404 k = 0.1934 0.8148 0.3233 ( 38550 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3211 -17.3211 -17.3058 -17.3058 -11.2926 -11.2925 -11.2012 -11.2012 -11.1683 -11.1675 -11.1416 -11.1415 -6.3222 -6.3069 -6.1839 -6.1611 -6.1306 -6.1179 -5.0017 -4.9828 -4.9583 -4.9471 -4.7902 -4.7760 -4.7137 -4.7092 -4.5591 -4.5452 -4.5065 -4.4914 -0.3313 -0.3184 0.0482 0.0712 0.1271 0.1436 0.2246 0.2572 0.2949 0.2976 0.3060 0.3231 0.4280 0.4384 0.4773 0.4785 0.5718 0.5864 0.6074 0.6163 0.6628 0.6824 0.7094 0.7123 6.8495 6.8512 6.8718 6.8806 7.1338 7.1389 7.4037 7.4148 7.6552 7.6606 7.9445 7.9482 k = 0.2149 0.8148 0.3233 ( 38536 PWs) bands (ev): -43.4454 -43.4454 -17.4384 -17.4384 -17.3212 -17.3212 -17.3060 -17.3060 -11.2927 -11.2926 -11.2014 -11.2014 -11.1686 -11.1678 -11.1419 -11.1418 -6.3218 -6.3056 -6.1838 -6.1598 -6.1306 -6.1171 -5.0014 -4.9826 -4.9554 -4.9454 -4.7901 -4.7754 -4.7125 -4.7079 -4.5589 -4.5441 -4.5071 -4.4908 -0.3324 -0.3187 0.0443 0.0673 0.1257 0.1425 0.2263 0.2567 0.2978 0.3053 0.3108 0.3251 0.4284 0.4365 0.4778 0.4823 0.5712 0.5864 0.6060 0.6158 0.6569 0.6795 0.7090 0.7116 6.8339 6.8355 6.8627 6.8715 7.1404 7.1458 7.4030 7.4143 7.6739 7.6809 7.9289 7.9336 k = 0.2364 0.8148 0.3233 ( 38526 PWs) bands (ev): -43.4454 -43.4454 -17.4385 -17.4385 -17.3214 -17.3214 -17.3062 -17.3062 -11.2929 -11.2927 -11.2016 -11.2015 -11.1690 -11.1681 -11.1422 -11.1421 -6.3213 -6.3044 -6.1834 -6.1587 -6.1305 -6.1164 -5.0008 -4.9821 -4.9529 -4.9439 -4.7897 -4.7747 -4.7112 -4.7066 -4.5585 -4.5431 -4.5076 -4.4903 -0.3332 -0.3188 0.0412 0.0642 0.1254 0.1426 0.2275 0.2557 0.2997 0.3124 0.3160 0.3270 0.4281 0.4348 0.4786 0.4856 0.5700 0.5857 0.6041 0.6140 0.6528 0.6773 0.7089 0.7113 6.8221 6.8237 6.8558 6.8645 7.1470 7.1525 7.4027 7.4137 7.6878 7.6965 7.9142 7.9215 k = 0.2579 0.8148 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4386 -17.4386 -17.3215 -17.3215 -17.3063 -17.3063 -11.2930 -11.2928 -11.2017 -11.2017 -11.1693 -11.1684 -11.1425 -11.1424 -6.3206 -6.3033 -6.1828 -6.1577 -6.1303 -6.1157 -4.9999 -4.9812 -4.9508 -4.9426 -4.7891 -4.7741 -4.7098 -4.7054 -4.5581 -4.5422 -4.5081 -4.4898 -0.3337 -0.3188 0.0390 0.0619 0.1265 0.1438 0.2283 0.2542 0.3008 0.3181 0.3211 0.3289 0.4276 0.4337 0.4793 0.4877 0.5682 0.5844 0.6021 0.6112 0.6508 0.6760 0.7091 0.7113 6.8145 6.8160 6.8514 6.8601 7.1526 7.1576 7.4036 7.4138 7.6958 7.7060 7.9041 7.9137 k = 0.2794 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3217 -17.3217 -17.3065 -17.3065 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1686 -11.1429 -11.1428 -6.3198 -6.3023 -6.1820 -6.1569 -6.1299 -6.1151 -4.9986 -4.9799 -4.9494 -4.9414 -4.7882 -4.7734 -4.7085 -4.7043 -4.5576 -4.5414 -4.5085 -4.4895 -0.3339 -0.3186 0.0376 0.0605 0.1288 0.1463 0.2287 0.2524 0.3014 0.3219 0.3254 0.3312 0.4269 0.4334 0.4796 0.4880 0.5660 0.5824 0.6002 0.6081 0.6508 0.6757 0.7094 0.7116 6.8111 6.8126 6.8497 6.8584 7.1560 7.1600 7.4068 7.4156 7.6976 7.7084 7.9004 7.9112 k = 0.2794 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3217 -17.3217 -17.3065 -17.3065 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1686 -11.1429 -11.1428 -6.3198 -6.3023 -6.1820 -6.1569 -6.1299 -6.1151 -4.9986 -4.9799 -4.9494 -4.9414 -4.7882 -4.7734 -4.7085 -4.7043 -4.5576 -4.5414 -4.5085 -4.4895 -0.3339 -0.3186 0.0376 0.0605 0.1288 0.1463 0.2287 0.2524 0.3014 0.3219 0.3254 0.3312 0.4269 0.4334 0.4796 0.4880 0.5660 0.5824 0.6002 0.6081 0.6508 0.6757 0.7094 0.7116 6.8111 6.8126 6.8497 6.8584 7.1560 7.1600 7.4068 7.4156 7.6976 7.7084 7.9004 7.9112 k = 0.2722 0.7939 0.3233 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3212 -17.3212 -17.3060 -17.3060 -11.2927 -11.2925 -11.2015 -11.2015 -11.1688 -11.1679 -11.1419 -11.1418 -6.3223 -6.3050 -6.1847 -6.1589 -6.1311 -6.1168 -5.0027 -4.9841 -4.9527 -4.9447 -4.7911 -4.7752 -4.7126 -4.7071 -4.5592 -4.5436 -4.5073 -4.4903 -0.3334 -0.3191 0.0408 0.0640 0.1197 0.1361 0.2281 0.2585 0.3004 0.3116 0.3139 0.3254 0.4291 0.4330 0.4800 0.4905 0.5729 0.5893 0.6066 0.6177 0.6488 0.6756 0.7081 0.7102 6.8167 6.8179 6.8501 6.8588 7.1456 7.1535 7.3971 7.4108 7.7036 7.7141 7.8992 7.9080 k = 0.2651 0.7730 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3209 -17.3209 -17.3056 -17.3056 -11.2923 -11.2922 -11.2011 -11.2011 -11.1680 -11.1672 -11.1411 -11.1410 -6.3244 -6.3074 -6.1868 -6.1605 -6.1318 -6.1180 -5.0059 -4.9876 -4.9553 -4.9474 -4.7931 -4.7763 -4.7164 -4.7095 -4.5606 -4.5458 -4.5061 -4.4911 -0.3316 -0.3184 0.0438 0.0679 0.1121 0.1260 0.2270 0.2636 0.2981 0.2994 0.3052 0.3225 0.4316 0.4331 0.4808 0.4932 0.5793 0.5956 0.6143 0.6278 0.6482 0.6764 0.7069 0.7088 6.8254 6.8264 6.8489 6.8575 7.1279 7.1382 7.3983 7.4152 7.7121 7.7222 7.8938 7.9006 k = 0.2579 0.7521 0.3233 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4380 -17.4380 -17.3207 -17.3207 -17.3053 -17.3053 -11.2922 -11.2922 -11.2008 -11.2007 -11.1672 -11.1665 -11.1404 -11.1403 -6.3261 -6.3093 -6.1884 -6.1616 -6.1320 -6.1188 -5.0081 -4.9906 -4.9570 -4.9494 -4.7943 -4.7767 -4.7200 -4.7116 -4.5620 -4.5479 -4.5050 -4.4919 -0.3286 -0.3165 0.0464 0.0720 0.1066 0.1168 0.2246 0.2664 0.2884 0.2913 0.3029 0.3208 0.4337 0.4345 0.4820 0.4960 0.5853 0.6011 0.6230 0.6383 0.6491 0.6779 0.7060 0.7075 6.8368 6.8377 6.8447 6.8530 7.1070 7.1181 7.4083 7.4268 7.7231 7.7330 7.8834 7.8883 k = 0.2507 0.7312 0.3233 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4381 -17.4381 -17.3207 -17.3207 -17.3051 -17.3051 -11.2924 -11.2923 -11.2004 -11.2004 -11.1665 -11.1658 -11.1399 -11.1398 -6.3274 -6.3109 -6.1895 -6.1621 -6.1317 -6.1191 -5.0093 -4.9929 -4.9578 -4.9509 -4.7947 -4.7764 -4.7231 -4.7133 -4.5634 -4.5500 -4.5039 -4.4926 -0.3244 -0.3135 0.0479 0.0756 0.1041 0.1096 0.2204 0.2628 0.2831 0.2849 0.3027 0.3199 0.4346 0.4376 0.4835 0.4989 0.5910 0.6059 0.6324 0.6482 0.6520 0.6800 0.7056 0.7063 6.8334 6.8420 6.8526 6.8531 7.0879 7.0986 7.4242 7.4430 7.7366 7.7462 7.8677 7.8708 k = 0.2436 0.7103 0.3233 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4383 -17.4383 -17.3207 -17.3207 -17.3050 -17.3050 -11.2928 -11.2927 -11.2001 -11.2000 -11.1658 -11.1652 -11.1395 -11.1395 -6.3282 -6.3121 -6.1900 -6.1622 -6.1309 -6.1190 -5.0095 -4.9946 -4.9577 -4.9518 -4.7942 -4.7753 -4.7259 -4.7146 -4.5646 -4.5521 -4.5028 -4.4934 -0.3189 -0.3092 0.0482 0.0774 0.1047 0.1058 0.2144 0.2526 0.2809 0.2845 0.3027 0.3193 0.4360 0.4409 0.4854 0.5018 0.5967 0.6100 0.6423 0.6542 0.6598 0.6825 0.7054 0.7060 6.8160 6.8252 6.8701 6.8702 7.0740 7.0836 7.4436 7.4621 7.7524 7.7616 7.8468 7.8481 k = 0.2364 0.6894 0.3233 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4386 -17.4386 -17.3210 -17.3210 -17.3051 -17.3051 -11.2933 -11.2932 -11.1997 -11.1997 -11.1651 -11.1646 -11.1393 -11.1393 -6.3286 -6.3129 -6.1899 -6.1617 -6.1296 -6.1185 -5.0087 -4.9956 -4.9566 -4.9524 -4.7928 -4.7735 -4.7283 -4.7155 -4.5658 -4.5541 -4.5017 -4.4941 -0.3123 -0.3039 0.0473 0.0763 0.1066 0.1084 0.2070 0.2406 0.2794 0.2879 0.3025 0.3187 0.4377 0.4444 0.4877 0.5047 0.6024 0.6137 0.6524 0.6585 0.6692 0.6850 0.7051 0.7078 6.7907 6.8003 6.8903 6.8908 7.0671 7.0750 7.4652 7.4826 7.7701 7.7782 7.8207 7.8217 k = 0.2293 0.6685 0.3233 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4391 -17.4391 -17.3213 -17.3213 -17.3053 -17.3053 -11.2941 -11.2939 -11.1994 -11.1993 -11.1645 -11.1641 -11.1393 -11.1392 -6.3286 -6.3134 -6.1893 -6.1608 -6.1279 -6.1174 -5.0071 -4.9959 -4.9546 -4.9525 -4.7907 -4.7710 -4.7303 -4.7161 -4.5670 -4.5560 -4.5007 -4.4949 -0.3045 -0.2974 0.0461 0.0730 0.1108 0.1144 0.1990 0.2287 0.2802 0.2919 0.3019 0.3182 0.4398 0.4480 0.4903 0.5076 0.6083 0.6170 0.6622 0.6627 0.6778 0.6872 0.7059 0.7116 6.7588 6.7688 6.9132 6.9140 7.0663 7.0726 7.4880 7.5040 7.7808 7.7814 7.7976 7.8074 k = 0.2221 0.6476 0.3233 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4397 -17.4397 -17.3218 -17.3218 -17.3056 -17.3056 -11.2951 -11.2948 -11.1990 -11.1990 -11.1640 -11.1636 -11.1394 -11.1393 -6.3282 -6.3134 -6.1881 -6.1593 -6.1257 -6.1160 -5.0047 -4.9954 -4.9526 -4.9512 -4.7877 -4.7677 -4.7317 -4.7161 -4.5680 -4.5578 -4.4997 -4.4956 -0.2955 -0.2898 0.0449 0.0693 0.1164 0.1221 0.1916 0.2176 0.2828 0.2961 0.3010 0.3178 0.4421 0.4518 0.4933 0.5106 0.6142 0.6202 0.6661 0.6711 0.6857 0.6891 0.7083 0.7178 6.7222 6.7324 6.9385 6.9397 7.0699 7.0745 7.5116 7.5259 7.7489 7.7502 7.8147 7.8252 k = 0.2149 0.6267 0.3233 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4405 -17.4405 -17.3224 -17.3224 -17.3061 -17.3061 -11.2962 -11.2959 -11.1987 -11.1987 -11.1636 -11.1632 -11.1396 -11.1396 -6.3274 -6.3131 -6.1864 -6.1574 -6.1232 -6.1141 -5.0022 -4.9937 -4.9521 -4.9473 -4.7840 -4.7638 -4.7325 -4.7157 -4.5689 -4.5596 -4.4987 -4.4964 -0.2855 -0.2812 0.0442 0.0660 0.1215 0.1305 0.1861 0.2079 0.2869 0.2997 0.2999 0.3180 0.4446 0.4557 0.4966 0.5135 0.6203 0.6232 0.6682 0.6772 0.6923 0.6934 0.7125 0.7260 6.6828 6.6930 6.9660 6.9675 7.0758 7.0787 7.5359 7.5481 7.7088 7.7116 7.8376 7.8480 k = 0.2078 0.6058 0.3233 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4413 -17.4413 -17.3231 -17.3231 -17.3066 -17.3066 -11.2974 -11.2971 -11.1983 -11.1983 -11.1632 -11.1629 -11.1400 -11.1400 -6.3263 -6.3125 -6.1842 -6.1551 -6.1201 -6.1118 -4.9999 -4.9902 -4.9515 -4.9423 -4.7794 -4.7592 -4.7327 -4.7146 -4.5697 -4.5612 -4.4977 -4.4971 -0.2744 -0.2715 0.0442 0.0634 0.1244 0.1385 0.1842 0.2004 0.2922 0.2981 0.3022 0.3201 0.4473 0.4597 0.5000 0.5166 0.6260 0.6265 0.6692 0.6793 0.6979 0.7013 0.7184 0.7356 6.6418 6.6520 6.9954 6.9972 7.0822 7.0834 7.5609 7.5709 7.6651 7.6694 7.8617 7.8721 k = 0.2006 0.5850 0.3233 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4423 -17.4423 -17.3239 -17.3239 -17.3073 -17.3073 -11.2988 -11.2984 -11.1980 -11.1980 -11.1629 -11.1627 -11.1405 -11.1405 -6.3248 -6.3115 -6.1815 -6.1523 -6.1168 -6.1091 -4.9981 -4.9850 -4.9509 -4.9364 -4.7742 -4.7540 -4.7322 -4.7129 -4.5704 -4.5628 -4.4979 -4.4968 -0.2623 -0.2609 0.0450 0.0615 0.1240 0.1443 0.1870 0.1969 0.2954 0.2995 0.3021 0.3250 0.4500 0.4637 0.5035 0.5197 0.6286 0.6328 0.6694 0.6791 0.7046 0.7097 0.7257 0.7458 6.6003 6.6105 7.0263 7.0281 7.0870 7.0875 7.5870 7.5946 7.6186 7.6243 7.8859 7.8965 k = 0.1934 0.5641 0.3233 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4434 -17.4434 -17.3249 -17.3249 -17.3081 -17.3081 -11.3004 -11.2999 -11.1977 -11.1977 -11.1628 -11.1626 -11.1412 -11.1412 -6.3231 -6.3103 -6.1784 -6.1492 -6.1130 -6.1061 -4.9965 -4.9785 -4.9503 -4.9295 -4.7682 -4.7482 -4.7309 -4.7104 -4.5709 -4.5642 -4.4986 -4.4958 -0.2493 -0.2491 0.0467 0.0602 0.1207 0.1459 0.1943 0.1992 0.2937 0.3004 0.3068 0.3321 0.4527 0.4676 0.5069 0.5229 0.6309 0.6389 0.6694 0.6784 0.7109 0.7184 0.7342 0.7562 6.5589 6.5690 7.0579 7.0598 7.0883 7.0903 7.5694 7.5770 7.6145 7.6197 7.9092 7.9201 k = 0.1863 0.5432 0.3233 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4446 -17.4446 -17.3259 -17.3259 -17.3090 -17.3090 -11.3020 -11.3015 -11.1974 -11.1974 -11.1627 -11.1625 -11.1420 -11.1420 -6.3210 -6.3088 -6.1748 -6.1457 -6.1090 -6.1027 -4.9949 -4.9708 -4.9498 -4.9219 -4.7616 -4.7420 -4.7287 -4.7070 -4.5713 -4.5655 -4.4993 -4.4949 -0.2368 -0.2351 0.0491 0.0593 0.1160 0.1435 0.2046 0.2071 0.2917 0.2979 0.3154 0.3408 0.4553 0.4714 0.5101 0.5262 0.6328 0.6448 0.6696 0.6778 0.7167 0.7273 0.7433 0.7666 6.5182 6.5280 7.0848 7.0895 7.0910 7.0913 7.5188 7.5286 7.6434 7.6465 7.9301 7.9413 k = 0.1791 0.5223 0.3233 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4459 -17.4459 -17.3270 -17.3270 -17.3099 -17.3099 -11.3037 -11.3032 -11.1971 -11.1971 -11.1627 -11.1626 -11.1429 -11.1429 -6.3188 -6.3071 -6.1709 -6.1420 -6.1047 -6.0990 -4.9933 -4.9622 -4.9496 -4.9135 -4.7543 -4.7354 -4.7256 -4.7027 -4.5715 -4.5666 -4.4999 -4.4939 -0.2234 -0.2201 0.0520 0.0586 0.1110 0.1389 0.2170 0.2186 0.2898 0.2953 0.3249 0.3506 0.4577 0.4749 0.5131 0.5297 0.6342 0.6503 0.6701 0.6778 0.7221 0.7363 0.7526 0.7767 6.4782 6.4879 7.0796 7.0848 7.1199 7.1201 7.4680 7.4805 7.6740 7.6752 7.9468 7.9581 k = 0.1719 0.5014 0.3233 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4473 -17.4472 -17.3283 -17.3282 -17.3110 -17.3110 -11.3055 -11.3050 -11.1968 -11.1968 -11.1628 -11.1627 -11.1439 -11.1439 -6.3164 -6.3052 -6.1667 -6.1380 -6.1002 -6.0950 -4.9918 -4.9527 -4.9496 -4.9043 -4.7464 -4.7284 -4.7217 -4.6973 -4.5714 -4.5675 -4.5006 -4.4929 -0.2093 -0.2043 0.0555 0.0576 0.1065 0.1336 0.2307 0.2321 0.2884 0.2929 0.3352 0.3614 0.4597 0.4781 0.5156 0.5332 0.6353 0.6552 0.6711 0.6790 0.7273 0.7453 0.7618 0.7865 6.4394 6.4489 7.0691 7.0753 7.1434 7.1449 7.4197 7.4359 7.7057 7.7058 7.9566 7.9680 k = 0.1648 0.4805 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4487 -17.4487 -17.3295 -17.3295 -17.3121 -17.3121 -11.3074 -11.3068 -11.1965 -11.1965 -11.1629 -11.1629 -11.1450 -11.1450 -6.3138 -6.3031 -6.1621 -6.1338 -6.0954 -6.0908 -4.9904 -4.9499 -4.9425 -4.8946 -4.7380 -4.7212 -4.7168 -4.6909 -4.5712 -4.5682 -4.5011 -4.4918 -0.1946 -0.1878 0.0560 0.0590 0.1030 0.1284 0.2453 0.2465 0.2877 0.2914 0.3461 0.3730 0.4614 0.4807 0.5177 0.5368 0.6360 0.6594 0.6726 0.6815 0.7322 0.7543 0.7707 0.7958 6.4017 6.4110 7.0540 7.0610 7.1548 7.1587 7.3801 7.4008 7.7374 7.7380 7.9573 7.9682 k = 0.1576 0.4596 0.3233 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4502 -17.4502 -17.3309 -17.3309 -17.3132 -17.3132 -11.3093 -11.3087 -11.1962 -11.1962 -11.1632 -11.1632 -11.1462 -11.1462 -6.3111 -6.3010 -6.1574 -6.1294 -6.0905 -6.0864 -4.9892 -4.9506 -4.9316 -4.8843 -4.7291 -4.7138 -4.7110 -4.6834 -4.5706 -4.5687 -4.5016 -4.4907 -0.1792 -0.1707 0.0538 0.0625 0.1007 0.1238 0.2602 0.2606 0.2882 0.2915 0.3577 0.3855 0.4627 0.4826 0.5195 0.5405 0.6367 0.6630 0.6745 0.6853 0.7369 0.7631 0.7791 0.8046 6.3654 6.3745 7.0345 7.0421 7.1458 7.1512 7.3587 7.3830 7.7681 7.7685 7.9469 7.9566 k = 0.1504 0.4387 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4518 -17.4518 -17.3323 -17.3323 -17.3145 -17.3145 -11.3112 -11.3107 -11.1960 -11.1960 -11.1635 -11.1635 -11.1474 -11.1474 -6.3083 -6.2987 -6.1524 -6.1249 -6.0855 -6.0819 -4.9882 -4.9516 -4.9201 -4.8736 -4.7197 -4.7061 -4.7044 -4.6749 -4.5697 -4.5690 -4.5021 -4.4895 -0.1635 -0.1530 0.0508 0.0657 0.0992 0.1199 0.2725 0.2748 0.2905 0.2954 0.3697 0.3987 0.4634 0.4835 0.5210 0.5443 0.6374 0.6666 0.6768 0.6899 0.7414 0.7716 0.7870 0.8128 6.3304 6.3392 7.0108 7.0189 7.1137 7.1180 7.3591 7.3845 7.7913 7.7956 7.9253 7.9331 k = 0.1433 0.4178 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4534 -17.4534 -17.3337 -17.3337 -17.3157 -17.3157 -11.3132 -11.3126 -11.1958 -11.1957 -11.1640 -11.1639 -11.1487 -11.1487 -6.3055 -6.2964 -6.1472 -6.1203 -6.0804 -6.0772 -4.9874 -4.9530 -4.9081 -4.8626 -4.7100 -4.6981 -4.6971 -4.6656 -4.5689 -4.5685 -4.5024 -4.4882 -0.1475 -0.1350 0.0476 0.0682 0.0983 0.1169 0.2798 0.2863 0.2977 0.3054 0.3820 0.4124 0.4636 0.4835 0.5225 0.5481 0.6384 0.6704 0.6793 0.6950 0.7457 0.7799 0.7942 0.8203 6.2968 6.3053 6.9835 6.9918 7.0648 7.0669 7.3724 7.3979 7.7975 7.8107 7.8941 7.8989 k = 0.1361 0.3969 0.3233 ( 38514 PWs) bands (ev): -43.4454 -43.4454 -17.4550 -17.4550 -17.3352 -17.3352 -17.3170 -17.3170 -11.3151 -11.3146 -11.1955 -11.1955 -11.1645 -11.1644 -11.1501 -11.1501 -6.3027 -6.2941 -6.1420 -6.1158 -6.0753 -6.0724 -4.9868 -4.9547 -4.8958 -4.8514 -4.7000 -4.6899 -4.6891 -4.6557 -4.5685 -4.5669 -4.5026 -4.4868 -0.1314 -0.1168 0.0442 0.0699 0.0975 0.1146 0.2846 0.2932 0.3113 0.3197 0.3943 0.4265 0.4634 0.4824 0.5239 0.5521 0.6399 0.6747 0.6820 0.7004 0.7497 0.7878 0.8007 0.8271 6.2645 6.2728 6.9529 6.9615 7.0065 7.0067 7.3883 7.4141 7.7782 7.8020 7.8553 7.8565 k = 0.1290 0.3760 0.3233 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4566 -17.4566 -17.3367 -17.3367 -17.3183 -17.3183 -11.3171 -11.3166 -11.1953 -11.1953 -11.1650 -11.1649 -11.1514 -11.1514 -6.2998 -6.2918 -6.1367 -6.1112 -6.0702 -6.0676 -4.9865 -4.9567 -4.8833 -4.8401 -4.6898 -4.6814 -4.6806 -4.6451 -4.5677 -4.5649 -4.5027 -4.4853 -0.1154 -0.0988 0.0411 0.0709 0.0964 0.1130 0.2897 0.2999 0.3266 0.3354 0.4064 0.4406 0.4629 0.4804 0.5253 0.5562 0.6417 0.6795 0.6849 0.7058 0.7535 0.7953 0.8065 0.8331 6.2337 6.2416 6.9189 6.9283 6.9427 6.9431 7.4001 7.4266 7.7373 7.7671 7.8075 7.8104 k = 0.1218 0.3552 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4583 -17.4583 -17.3382 -17.3382 -17.3197 -17.3196 -11.3190 -11.3185 -11.1951 -11.1951 -11.1656 -11.1655 -11.1528 -11.1528 -6.2971 -6.2895 -6.1314 -6.1068 -6.0651 -6.0629 -4.9865 -4.9589 -4.8706 -4.8289 -4.6795 -4.6728 -4.6717 -4.6342 -4.5666 -4.5625 -4.5025 -4.4836 -0.0998 -0.0813 0.0387 0.0710 0.0950 0.1121 0.2961 0.3079 0.3422 0.3516 0.4178 0.4539 0.4625 0.4787 0.5269 0.5605 0.6442 0.6849 0.6878 0.7112 0.7570 0.8022 0.8114 0.8383 6.2042 6.2118 6.8710 6.8769 6.8881 6.8932 7.4028 7.4297 7.6842 7.7153 7.7526 7.7594 k = 0.1146 0.3343 0.3233 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4599 -17.4599 -17.3397 -17.3397 -17.3210 -17.3210 -11.3209 -11.3204 -11.1950 -11.1950 -11.1662 -11.1661 -11.1542 -11.1542 -6.2944 -6.2873 -6.1261 -6.1024 -6.0601 -6.0581 -4.9867 -4.9614 -4.8580 -4.8179 -4.6693 -4.6640 -4.6623 -4.6230 -4.5650 -4.5595 -4.5022 -4.4817 -0.0850 -0.0648 0.0372 0.0704 0.0932 0.1120 0.3040 0.3175 0.3576 0.3676 0.4275 0.4624 0.4631 0.4812 0.5284 0.5648 0.6471 0.6908 0.6909 0.7165 0.7602 0.8086 0.8155 0.8428 6.1760 6.1833 6.8046 6.8098 6.8498 6.8563 7.3928 7.4195 7.6245 7.6548 7.6914 7.7011 k = 0.1075 0.3134 0.3233 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4615 -17.4615 -17.3411 -17.3411 -17.3223 -17.3223 -11.3228 -11.3223 -11.1948 -11.1948 -11.1668 -11.1667 -11.1556 -11.1556 -6.2918 -6.2852 -6.1209 -6.0982 -6.0552 -6.0535 -4.9871 -4.9640 -4.8455 -4.8073 -4.6595 -4.6554 -4.6526 -4.6117 -4.5629 -4.5561 -4.5016 -4.4796 -0.0713 -0.0502 0.0373 0.0691 0.0915 0.1131 0.3133 0.3284 0.3726 0.3833 0.4341 0.4620 0.4660 0.4920 0.5300 0.5694 0.6506 0.6940 0.6970 0.7217 0.7630 0.8144 0.8187 0.8463 6.1492 6.1561 6.7369 6.7425 6.8119 6.8184 7.3689 7.3941 7.5615 7.5901 7.6251 7.6361 k = 0.1003 0.2925 0.3233 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4631 -17.4631 -17.3426 -17.3425 -17.3235 -17.3235 -11.3246 -11.3241 -11.1947 -11.1947 -11.1675 -11.1674 -11.1570 -11.1570 -6.2892 -6.2831 -6.1158 -6.0942 -6.0505 -6.0490 -4.9877 -4.9667 -4.8333 -4.7972 -4.6502 -4.6470 -4.6426 -4.6004 -4.5603 -4.5522 -4.5007 -4.4773 -0.0589 -0.0385 0.0391 0.0669 0.0904 0.1156 0.3239 0.3405 0.3869 0.3983 0.4370 0.4581 0.4720 0.5059 0.5316 0.5741 0.6546 0.6972 0.7035 0.7268 0.7654 0.8196 0.8211 0.8490 6.1238 6.1302 6.6701 6.6761 6.7737 6.7801 7.3323 7.3547 7.4973 7.5239 7.5568 7.5676 k = 0.0931 0.2716 0.3233 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4646 -17.4646 -17.3439 -17.3439 -17.3248 -17.3248 -11.3263 -11.3259 -11.1946 -11.1946 -11.1682 -11.1681 -11.1583 -11.1583 -6.2869 -6.2812 -6.1108 -6.0904 -6.0459 -6.0446 -4.9885 -4.9694 -4.8215 -4.7877 -4.6414 -4.6389 -4.6324 -4.5892 -4.5574 -4.5478 -4.4994 -4.4748 -0.0484 -0.0302 0.0423 0.0639 0.0910 0.1199 0.3354 0.3534 0.4003 0.4123 0.4373 0.4539 0.4801 0.5200 0.5335 0.5790 0.6590 0.7005 0.7101 0.7317 0.7675 0.8227 0.8240 0.8509 6.0996 6.1057 6.6050 6.6111 6.7357 6.7417 7.2861 7.3049 7.4336 7.4580 7.4901 7.4995 k = 0.0860 0.2507 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4660 -17.4660 -17.3453 -17.3453 -17.3260 -17.3260 -11.3280 -11.3275 -11.1945 -11.1945 -11.1688 -11.1687 -11.1596 -11.1596 -6.2846 -6.2794 -6.1060 -6.0869 -6.0416 -6.0404 -4.9894 -4.9722 -4.8103 -4.7790 -4.6333 -4.6314 -4.6221 -4.5782 -4.5540 -4.5430 -4.4976 -4.4721 -0.0398 -0.0253 0.0452 0.0601 0.0949 0.1262 0.3473 0.3665 0.4119 0.4240 0.4373 0.4511 0.4889 0.5305 0.5388 0.5841 0.6638 0.7039 0.7166 0.7364 0.7692 0.8234 0.8278 0.8519 6.0769 6.0825 6.5422 6.5484 6.6982 6.7039 7.2335 7.2485 7.3715 7.3940 7.4271 7.4348 k = 0.0788 0.2298 0.3233 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4674 -17.4674 -17.3466 -17.3465 -17.3271 -17.3271 -11.3295 -11.3291 -11.1944 -11.1944 -11.1695 -11.1694 -11.1608 -11.1608 -6.2825 -6.2778 -6.1014 -6.0836 -6.0375 -6.0365 -4.9903 -4.9750 -4.7996 -4.7710 -4.6259 -4.6244 -4.6121 -4.5677 -4.5504 -4.5379 -4.4953 -4.4693 -0.0331 -0.0231 0.0461 0.0558 0.1031 0.1344 0.3592 0.3792 0.4199 0.4304 0.4400 0.4532 0.4975 0.5335 0.5513 0.5894 0.6690 0.7074 0.7229 0.7408 0.7708 0.8235 0.8308 0.8521 6.0555 6.0606 6.4823 6.4885 6.6619 6.6671 7.1776 7.1889 7.3122 7.3328 7.3690 7.3747 k = 0.0716 0.2089 0.3233 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4687 -17.4687 -17.3477 -17.3477 -17.3282 -17.3282 -11.3310 -11.3306 -11.1943 -11.1943 -11.1701 -11.1700 -11.1620 -11.1620 -6.2806 -6.2763 -6.0971 -6.0807 -6.0337 -6.0328 -4.9913 -4.9776 -4.7898 -4.7639 -4.6191 -4.6180 -4.6023 -4.5577 -4.5467 -4.5326 -4.4924 -4.4664 -0.0283 -0.0226 0.0448 0.0511 0.1149 0.1441 0.3704 0.3901 0.4238 0.4306 0.4472 0.4614 0.5056 0.5348 0.5648 0.5947 0.6743 0.7110 0.7287 0.7449 0.7722 0.8230 0.8330 0.8515 6.0355 6.0402 6.4259 6.4319 6.6270 6.6318 7.1210 7.1292 7.2565 7.2752 7.3158 7.3200 k = 0.0645 0.1880 0.3233 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4699 -17.4699 -17.3489 -17.3489 -17.3292 -17.3292 -11.3323 -11.3320 -11.1943 -11.1943 -11.1707 -11.1706 -11.1631 -11.1631 -6.2788 -6.2749 -6.0930 -6.0780 -6.0301 -6.0294 -4.9922 -4.9802 -4.7807 -4.7576 -4.6130 -4.6123 -4.5928 -4.5487 -4.5427 -4.5273 -4.4889 -4.4635 -0.0251 -0.0230 0.0421 0.0463 0.1288 0.1550 0.3797 0.3969 0.4280 0.4297 0.4567 0.4715 0.5130 0.5359 0.5780 0.6002 0.6799 0.7147 0.7337 0.7484 0.7740 0.8220 0.8345 0.8502 6.0171 6.0212 6.3735 6.3792 6.5941 6.5984 7.0657 7.0716 7.2050 7.2219 7.2675 7.2705 k = 0.0573 0.1671 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4711 -17.4710 -17.3499 -17.3499 -17.3301 -17.3301 -11.3335 -11.3332 -11.1942 -11.1942 -11.1713 -11.1712 -11.1641 -11.1641 -6.2771 -6.2737 -6.0892 -6.0757 -6.0269 -6.0263 -4.9931 -4.9827 -4.7725 -4.7522 -4.6076 -4.6073 -4.5839 -4.5422 -4.5373 -4.5221 -4.4848 -4.4606 -0.0239 -0.0233 0.0387 0.0415 0.1434 0.1665 0.3857 0.3984 0.4308 0.4353 0.4665 0.4815 0.5197 0.5368 0.5906 0.6056 0.6855 0.7184 0.7376 0.7511 0.7764 0.8207 0.8352 0.8482 6.0002 6.0038 6.3255 6.3308 6.5635 6.5674 7.0134 7.0175 7.1583 7.1733 7.2242 7.2263 k = 0.0501 0.1462 0.3233 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4721 -17.4720 -17.3508 -17.3508 -17.3310 -17.3310 -11.3346 -11.3343 -11.1942 -11.1942 -11.1718 -11.1717 -11.1650 -11.1650 -6.2757 -6.2727 -6.0857 -6.0738 -6.0240 -6.0235 -4.9939 -4.9849 -4.7652 -4.7477 -4.6029 -4.6029 -4.5756 -4.5388 -4.5300 -4.5171 -4.4802 -4.4579 -0.0250 -0.0225 0.0350 0.0369 0.1581 0.1780 0.3876 0.3965 0.4351 0.4442 0.4761 0.4907 0.5256 0.5377 0.6022 0.6111 0.6912 0.7220 0.7400 0.7528 0.7797 0.8193 0.8352 0.8457 5.9850 5.9881 6.2823 6.2871 6.5356 6.5390 6.9654 6.9682 7.1167 7.1298 7.1858 7.1872 k = 0.0430 0.1253 0.3233 ( 38530 PWs) bands (ev): -43.4454 -43.4454 -17.4729 -17.4729 -17.3516 -17.3516 -17.3317 -17.3317 -11.3356 -11.3353 -11.1942 -11.1942 -11.1722 -11.1722 -11.1658 -11.1657 -6.2744 -6.2718 -6.0825 -6.0722 -6.0214 -6.0210 -4.9946 -4.9870 -4.7588 -4.7441 -4.5991 -4.5989 -4.5679 -4.5366 -4.5229 -4.5125 -4.4755 -4.4555 -0.0261 -0.0225 0.0314 0.0327 0.1722 0.1892 0.3864 0.3931 0.4418 0.4527 0.4853 0.4989 0.5308 0.5386 0.6128 0.6166 0.6969 0.7255 0.7409 0.7536 0.7840 0.8181 0.8344 0.8426 5.9715 5.9742 6.2443 6.2485 6.5108 6.5137 6.9224 6.9243 7.0805 7.0917 7.1524 7.1533 k = 0.0358 0.1045 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4737 -17.4737 -17.3523 -17.3523 -17.3323 -17.3323 -11.3364 -11.3362 -11.1941 -11.1941 -11.1726 -11.1726 -11.1664 -11.1664 -6.2732 -6.2711 -6.0796 -6.0710 -6.0193 -6.0189 -4.9951 -4.9889 -4.7533 -4.7412 -4.5959 -4.5956 -4.5609 -4.5351 -4.5167 -4.5084 -4.4707 -4.4535 -0.0270 -0.0230 0.0282 0.0290 0.1853 0.1995 0.3837 0.3891 0.4492 0.4599 0.4939 0.5058 0.5352 0.5397 0.6220 0.6222 0.7025 0.7288 0.7402 0.7535 0.7890 0.8173 0.8328 0.8393 5.9599 5.9621 6.2116 6.2152 6.4893 6.4918 6.8853 6.8865 7.0497 7.0590 7.1239 7.1245 k = 0.0287 0.0836 0.3233 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4743 -17.4743 -17.3529 -17.3529 -17.3328 -17.3328 -11.3371 -11.3369 -11.1941 -11.1941 -11.1730 -11.1729 -11.1670 -11.1670 -6.2723 -6.2706 -6.0771 -6.0701 -6.0175 -6.0172 -4.9955 -4.9906 -4.7487 -4.7391 -4.5932 -4.5930 -4.5547 -4.5343 -4.5113 -4.5050 -4.4661 -4.4520 -0.0278 -0.0238 0.0254 0.0259 0.1971 0.2085 0.3805 0.3850 0.4562 0.4655 0.5016 0.5114 0.5387 0.5408 0.6273 0.6300 0.7078 0.7318 0.7383 0.7526 0.7944 0.8171 0.8306 0.8358 5.9502 5.9520 6.1847 6.1876 6.4715 6.4734 6.8544 6.8552 7.0246 7.0321 7.1005 7.1008 k = 0.0215 0.0627 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4748 -17.4748 -17.3534 -17.3534 -17.3333 -17.3333 -11.3376 -11.3375 -11.1941 -11.1941 -11.1732 -11.1732 -11.1674 -11.1674 -6.2715 -6.2702 -6.0749 -6.0697 -6.0160 -6.0158 -4.9957 -4.9920 -4.7448 -4.7378 -4.5912 -4.5909 -4.5493 -4.5342 -4.5069 -4.5024 -4.4619 -4.4511 -0.0282 -0.0249 0.0231 0.0234 0.2071 0.2158 0.3775 0.3812 0.4623 0.4695 0.5082 0.5156 0.5414 0.5419 0.6323 0.6362 0.7129 0.7346 0.7357 0.7509 0.8000 0.8175 0.8277 0.8322 5.9427 5.9440 6.1636 6.1658 6.4574 6.4588 6.8300 6.8305 7.0052 7.0108 7.0822 7.0824 k = 0.0143 0.0418 0.3233 ( 38486 PWs) bands (ev): -43.4454 -43.4454 -17.4752 -17.4752 -17.3537 -17.3537 -17.3335 -17.3335 -11.3379 -11.3379 -11.1941 -11.1941 -11.1734 -11.1734 -11.1677 -11.1677 -6.2709 -6.2700 -6.0731 -6.0696 -6.0150 -6.0149 -4.9956 -4.9932 -4.7418 -4.7372 -4.5897 -4.5895 -4.5447 -4.5348 -4.5036 -4.5006 -4.4582 -4.4510 -0.0283 -0.0259 0.0214 0.0216 0.2150 0.2209 0.3753 0.3779 0.4671 0.4720 0.5134 0.5182 0.5430 0.5431 0.6367 0.6403 0.7176 0.7326 0.7374 0.7486 0.8054 0.8186 0.8242 0.8288 5.9373 5.9381 6.1485 6.1500 6.4473 6.4482 6.8125 6.8128 6.9916 6.9953 7.0691 7.0692 k = 0.0072 0.0209 0.3233 ( 38514 PWs) bands (ev): -43.4454 -43.4454 -17.4754 -17.4754 -17.3539 -17.3539 -17.3337 -17.3337 -11.3382 -11.3381 -11.1941 -11.1941 -11.1735 -11.1735 -11.1679 -11.1679 -6.2704 -6.2700 -6.0716 -6.0699 -6.0144 -6.0143 -4.9954 -4.9942 -4.7396 -4.7373 -4.5888 -4.5887 -4.5410 -4.5361 -4.5013 -4.4998 -4.4552 -4.4516 -0.0281 -0.0269 0.0204 0.0204 0.2205 0.2235 0.3741 0.3755 0.4705 0.4729 0.5170 0.5194 0.5438 0.5440 0.6401 0.6422 0.7219 0.7293 0.7401 0.7458 0.8107 0.8201 0.8204 0.8256 5.9341 5.9345 6.1396 6.1404 6.4413 6.4417 6.8019 6.8021 6.9838 6.9857 7.0612 7.0613 k = 0.0000 0.0000 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3539 -17.3539 -17.3338 -17.3338 -11.3382 -11.3382 -11.1941 -11.1941 -11.1736 -11.1736 -11.1680 -11.1680 -6.2701 -6.2701 -6.0706 -6.0706 -6.0141 -6.0141 -4.9949 -4.9949 -4.7381 -4.7381 -4.5885 -4.5885 -4.5381 -4.5381 -4.5000 -4.5000 -4.4530 -4.4530 -0.0276 -0.0276 0.0201 0.0201 0.2234 0.2234 0.3742 0.3742 0.4724 0.4724 0.5190 0.5190 0.5442 0.5442 0.6421 0.6421 0.7257 0.7257 0.7429 0.7429 0.8156 0.8156 0.8228 0.8228 5.9332 5.9332 6.1369 6.1369 6.4394 6.4394 6.7985 6.7985 6.9818 6.9818 7.0586 7.0586 k = 0.0000 0.0000 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3539 -17.3539 -17.3338 -17.3338 -11.3382 -11.3382 -11.1941 -11.1941 -11.1736 -11.1736 -11.1680 -11.1680 -6.2701 -6.2701 -6.0706 -6.0706 -6.0141 -6.0141 -4.9949 -4.9949 -4.7381 -4.7381 -4.5885 -4.5885 -4.5381 -4.5381 -4.5000 -4.5000 -4.4530 -4.4530 -0.0276 -0.0276 0.0201 0.0201 0.2234 0.2234 0.3742 0.3742 0.4724 0.4724 0.5190 0.5190 0.5442 0.5442 0.6421 0.6421 0.7257 0.7257 0.7429 0.7429 0.8156 0.8156 0.8228 0.8228 5.9332 5.9332 6.1369 6.1369 6.4394 6.4394 6.7985 6.7985 6.9818 6.9818 7.0586 7.0586 k = 0.0000 0.0000 0.3017 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3539 -17.3539 -17.3338 -17.3338 -11.3382 -11.3382 -11.1941 -11.1941 -11.1743 -11.1742 -11.1674 -11.1672 -6.2706 -6.2696 -6.0725 -6.0688 -6.0155 -6.0127 -4.9961 -4.9935 -4.7403 -4.7363 -4.5887 -4.5879 -4.5387 -4.5378 -4.5007 -4.4994 -4.4535 -4.4524 -0.0348 -0.0236 0.0153 0.0289 0.2226 0.2242 0.3691 0.3757 0.4726 0.4754 0.5170 0.5173 0.5415 0.5489 0.6390 0.6448 0.7212 0.7307 0.7396 0.7473 0.8117 0.8139 0.8248 0.8269 5.9120 5.9154 6.1540 6.1564 6.4425 6.4448 6.7917 6.7931 6.9862 6.9895 7.0585 7.0611 k = 0.0000 0.0000 0.2802 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3538 -17.3538 -17.3339 -17.3339 -11.3382 -11.3382 -11.1941 -11.1941 -11.1759 -11.1757 -11.1659 -11.1657 -6.2710 -6.2689 -6.0745 -6.0674 -6.0166 -6.0112 -4.9969 -4.9920 -4.7429 -4.7350 -4.5885 -4.5870 -4.5395 -4.5377 -4.5013 -4.4990 -4.4537 -4.4518 -0.0429 -0.0251 0.0172 0.0396 0.2218 0.2250 0.3614 0.3735 0.4762 0.4801 0.5115 0.5133 0.5416 0.5539 0.6358 0.6470 0.7174 0.7353 0.7379 0.7523 0.8071 0.8095 0.8301 0.8323 5.8664 5.8713 6.1948 6.1974 6.4543 6.4589 6.7754 6.7776 7.0008 7.0068 7.0608 7.0659 k = 0.0000 0.0000 0.2586 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3536 -17.3536 -17.3341 -17.3341 -11.3382 -11.3381 -11.1941 -11.1941 -11.1777 -11.1774 -11.1642 -11.1639 -6.2712 -6.2683 -6.0766 -6.0664 -6.0174 -6.0097 -4.9975 -4.9903 -4.7457 -4.7343 -4.5880 -4.5858 -4.5406 -4.5378 -4.5020 -4.4986 -4.4538 -4.4510 -0.0510 -0.0310 0.0243 0.0512 0.2210 0.2258 0.3523 0.3682 0.4826 0.4844 0.5029 0.5097 0.5429 0.5582 0.6328 0.6484 0.7145 0.7361 0.7413 0.7574 0.8032 0.8054 0.8358 0.8379 5.8124 5.8177 6.2418 6.2435 6.4751 6.4819 6.7537 6.7562 7.0215 7.0297 7.0651 7.0729 k = 0.0000 0.0000 0.2371 ( 38532 PWs) bands (ev): -43.4454 -43.4454 -17.4756 -17.4756 -17.3533 -17.3533 -17.3344 -17.3344 -11.3381 -11.3381 -11.1941 -11.1941 -11.1795 -11.1793 -11.1624 -11.1621 -6.2713 -6.2677 -6.0786 -6.0658 -6.0178 -6.0083 -4.9977 -4.9885 -4.7486 -4.7342 -4.5870 -4.5844 -4.5418 -4.5382 -4.5026 -4.4984 -4.4537 -4.4502 -0.0587 -0.0387 0.0341 0.0632 0.2201 0.2266 0.3429 0.3610 0.4849 0.4904 0.4928 0.5093 0.5446 0.5611 0.6301 0.6490 0.7128 0.7363 0.7458 0.7620 0.8007 0.8023 0.8415 0.8434 5.7566 5.7619 6.2870 6.2874 6.5044 6.5130 6.7299 6.7327 7.0457 7.0550 7.0712 7.0812 k = 0.0000 0.0000 0.2155 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4756 -17.4756 -17.3529 -17.3529 -17.3347 -17.3347 -11.3381 -11.3380 -11.1941 -11.1941 -11.1813 -11.1811 -11.1606 -11.1604 -6.2714 -6.2670 -6.0804 -6.0659 -6.0179 -6.0071 -4.9976 -4.9868 -4.7515 -4.7347 -4.5856 -4.5828 -4.5432 -4.5389 -4.5032 -4.4983 -4.4534 -4.4494 -0.0659 -0.0467 0.0449 0.0752 0.2193 0.2275 0.3338 0.3531 0.4799 0.4815 0.4993 0.5134 0.5462 0.5627 0.6280 0.6487 0.7123 0.7372 0.7496 0.7650 0.8002 0.8006 0.8470 0.8487 5.7021 5.7070 6.3272 6.3279 6.5401 6.5493 6.7067 6.7097 7.0724 7.0752 7.0845 7.0895 k = 0.0000 0.0000 0.1940 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4757 -17.4757 -17.3525 -17.3525 -17.3351 -17.3351 -11.3380 -11.3380 -11.1941 -11.1941 -11.1831 -11.1828 -11.1590 -11.1587 -6.2712 -6.2665 -6.0821 -6.0664 -6.0175 -6.0060 -4.9972 -4.9851 -4.7543 -4.7358 -4.5838 -4.5811 -4.5447 -4.5399 -4.5036 -4.4984 -4.4529 -4.4486 -0.0723 -0.0545 0.0560 0.0868 0.2186 0.2285 0.3255 0.3452 0.4696 0.4716 0.5079 0.5195 0.5475 0.5629 0.6266 0.6476 0.7130 0.7385 0.7524 0.7661 0.8007 0.8023 0.8523 0.8537 5.6503 5.6548 6.3636 6.3649 6.5769 6.5853 6.6870 6.6906 7.0804 7.0936 7.1038 7.1130 k = 0.0000 0.0000 0.1724 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4757 -17.4757 -17.3520 -17.3520 -17.3355 -17.3355 -11.3379 -11.3379 -11.1941 -11.1941 -11.1847 -11.1845 -11.1574 -11.1572 -6.2710 -6.2660 -6.0834 -6.0674 -6.0167 -6.0051 -4.9964 -4.9837 -4.7567 -4.7375 -4.5818 -4.5792 -4.5463 -4.5412 -4.5040 -4.4987 -4.4523 -4.4479 -0.0781 -0.0618 0.0671 0.0977 0.2181 0.2295 0.3186 0.3381 0.4572 0.4614 0.5160 0.5260 0.5485 0.5620 0.6258 0.6459 0.7146 0.7397 0.7541 0.7654 0.8028 0.8064 0.8572 0.8584 5.6022 5.6063 6.3980 6.3996 6.6046 6.6102 6.6777 6.6830 7.0801 7.0940 7.1377 7.1456 k = 0.0000 0.0000 0.1509 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4758 -17.4758 -17.3515 -17.3515 -17.3359 -17.3359 -11.3379 -11.3378 -11.1941 -11.1940 -11.1862 -11.1860 -11.1560 -11.1558 -6.2706 -6.2656 -6.0845 -6.0689 -6.0157 -6.0044 -4.9954 -4.9825 -4.7588 -4.7395 -4.5794 -4.5773 -4.5481 -4.5427 -4.5042 -4.4990 -4.4516 -4.4472 -0.0830 -0.0685 0.0777 0.1075 0.2181 0.2306 0.3134 0.3321 0.4443 0.4502 0.5233 0.5322 0.5494 0.5603 0.6255 0.6438 0.7168 0.7403 0.7551 0.7639 0.8066 0.8116 0.8618 0.8627 5.5585 5.5621 6.4317 6.4335 6.6095 6.6125 6.6898 6.6957 7.0724 7.0859 7.1772 7.1827 k = 0.0000 0.0000 0.1293 ( 38472 PWs) bands (ev): -43.4454 -43.4454 -17.4759 -17.4759 -17.3509 -17.3509 -17.3364 -17.3364 -11.3378 -11.3377 -11.1941 -11.1940 -11.1875 -11.1873 -11.1547 -11.1545 -6.2702 -6.2653 -6.0853 -6.0706 -6.0144 -6.0040 -4.9941 -4.9816 -4.7605 -4.7420 -4.5768 -4.5752 -4.5499 -4.5444 -4.5044 -4.4995 -4.4507 -4.4467 -0.0871 -0.0745 0.0876 0.1156 0.2188 0.2316 0.3102 0.3278 0.4312 0.4381 0.5296 0.5378 0.5503 0.5582 0.6256 0.6417 0.7192 0.7402 0.7558 0.7622 0.8113 0.8170 0.8658 0.8665 5.5197 5.5228 6.4652 6.4670 6.6002 6.6028 6.7129 6.7171 7.0562 7.0689 7.2209 7.2243 k = 0.0000 0.0000 0.1078 ( 38476 PWs) bands (ev): -43.4454 -43.4454 -17.4759 -17.4759 -17.3504 -17.3504 -17.3369 -17.3369 -11.3377 -11.3377 -11.1941 -11.1940 -11.1887 -11.1885 -11.1536 -11.1534 -6.2696 -6.2652 -6.0856 -6.0726 -6.0129 -6.0038 -4.9925 -4.9811 -4.7615 -4.7447 -4.5740 -4.5731 -4.5518 -4.5464 -4.5044 -4.5000 -4.4499 -4.4462 -0.0905 -0.0798 0.0967 0.1218 0.2201 0.2325 0.3090 0.3253 0.4181 0.4257 0.5347 0.5428 0.5513 0.5560 0.6260 0.6395 0.7217 0.7393 0.7565 0.7607 0.8165 0.8221 0.8694 0.8698 5.4862 5.4888 6.4975 6.4997 6.5900 6.5930 6.7335 6.7354 7.0325 7.0440 7.2666 7.2687 k = 0.0000 0.0000 0.0862 ( 38452 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3499 -17.3499 -17.3374 -17.3373 -11.3377 -11.3376 -11.1940 -11.1940 -11.1897 -11.1895 -11.1527 -11.1525 -6.2690 -6.2652 -6.0857 -6.0746 -6.0115 -6.0038 -4.9909 -4.9809 -4.7620 -4.7475 -4.5711 -4.5710 -4.5538 -4.5486 -4.5043 -4.5006 -4.4491 -4.4460 -0.0930 -0.0844 0.1046 0.1259 0.2222 0.2331 0.3101 0.3249 0.4053 0.4132 0.5385 0.5469 0.5525 0.5538 0.6266 0.6374 0.7241 0.7378 0.7573 0.7595 0.8215 0.8265 0.8723 0.8726 5.4585 5.4605 6.5246 6.5273 6.5869 6.5906 6.7472 6.7474 7.0043 7.0144 7.3097 7.3123 k = 0.0000 0.0000 0.0647 ( 38450 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3494 -17.3494 -17.3378 -17.3378 -11.3376 -11.3376 -11.1940 -11.1939 -11.1905 -11.1903 -11.1519 -11.1518 -6.2684 -6.2653 -6.0853 -6.0767 -6.0100 -6.0041 -4.9891 -4.9812 -4.7619 -4.7504 -4.5688 -4.5681 -4.5559 -4.5510 -4.5042 -4.5013 -4.4483 -4.4458 -0.0947 -0.0882 0.1114 0.1281 0.2246 0.2333 0.3133 0.3262 0.3933 0.4010 0.5413 0.5503 0.5517 0.5537 0.6274 0.6354 0.7262 0.7362 0.7578 0.7588 0.8260 0.8301 0.8747 0.8749 5.4366 5.4382 6.5375 6.5397 6.6017 6.6052 6.7509 6.7530 6.9758 6.9843 7.3447 7.3489 k = 0.0000 0.0000 0.0431 ( 38426 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3491 -17.3491 -17.3381 -17.3381 -11.3376 -11.3375 -11.1939 -11.1939 -11.1911 -11.1910 -11.1514 -11.1513 -6.2678 -6.2656 -6.0846 -6.0787 -6.0086 -6.0046 -4.9874 -4.9818 -4.7611 -4.7532 -4.5667 -4.5651 -4.5580 -4.5536 -4.5039 -4.5019 -4.4475 -4.4459 -0.0956 -0.0912 0.1170 0.1284 0.2271 0.2331 0.3182 0.3285 0.3830 0.3899 0.5433 0.5497 0.5528 0.5547 0.6284 0.6337 0.7280 0.7345 0.7582 0.7584 0.8296 0.8325 0.8764 0.8765 5.4210 5.4220 6.5386 6.5397 6.6308 6.6336 6.7459 6.7489 6.9518 6.9581 7.3685 7.3732 k = 0.0000 0.0000 0.0216 ( 38413 PWs) bands (ev): -43.4454 -43.4454 -17.4761 -17.4761 -17.3488 -17.3488 -17.3383 -17.3383 -11.3375 -11.3375 -11.1939 -11.1939 -11.1914 -11.1913 -11.1511 -11.1510 -6.2671 -6.2660 -6.0835 -6.0805 -6.0073 -6.0053 -4.9857 -4.9828 -4.7598 -4.7557 -4.5645 -4.5622 -4.5600 -4.5563 -4.5035 -4.5025 -4.4469 -4.4461 -0.0957 -0.0935 0.1216 0.1273 0.2293 0.2323 0.3238 0.3300 0.3764 0.3809 0.5449 0.5480 0.5545 0.5553 0.6295 0.6321 0.7297 0.7328 0.7583 0.7584 0.8322 0.8336 0.8774 0.8775 5.4116 5.4121 6.5370 6.5375 6.6616 6.6638 6.7329 6.7357 6.9366 6.9401 7.3825 7.3855 k = 0.0000 0.0000 0.0000 ( 38409 PWs) bands (ev): -43.4454 -43.4454 -17.4761 -17.4761 -17.3488 -17.3488 -17.3384 -17.3384 -11.3375 -11.3375 -11.1939 -11.1939 -11.1915 -11.1915 -11.1509 -11.1509 -6.2665 -6.2665 -6.0821 -6.0821 -6.0062 -6.0062 -4.9841 -4.9841 -4.7580 -4.7580 -4.5624 -4.5624 -4.5591 -4.5591 -4.5030 -4.5030 -4.4464 -4.4464 -0.0950 -0.0950 0.1250 0.1250 0.2310 0.2310 0.3285 0.3285 0.3757 0.3757 0.5464 0.5464 0.5553 0.5553 0.6307 0.6307 0.7312 0.7312 0.7584 0.7584 0.8335 0.8335 0.8778 0.8778 5.4087 5.4087 6.5364 6.5364 6.6799 6.6799 6.7233 6.7233 6.9326 6.9326 7.3883 7.3883 k = 0.0000 0.0000 0.0000 ( 38409 PWs) bands (ev): -43.4454 -43.4454 -17.4761 -17.4761 -17.3488 -17.3488 -17.3384 -17.3384 -11.3375 -11.3375 -11.1939 -11.1939 -11.1915 -11.1915 -11.1509 -11.1509 -6.2665 -6.2665 -6.0821 -6.0821 -6.0062 -6.0062 -4.9841 -4.9841 -4.7580 -4.7580 -4.5624 -4.5624 -4.5591 -4.5591 -4.5030 -4.5030 -4.4464 -4.4464 -0.0950 -0.0950 0.1250 0.1250 0.2310 0.2310 0.3285 0.3285 0.3757 0.3757 0.5464 0.5464 0.5553 0.5553 0.6307 0.6307 0.7312 0.7312 0.7584 0.7584 0.8335 0.8335 0.8778 0.8778 5.4087 5.4087 6.5364 6.5364 6.6799 6.6799 6.7233 6.7233 6.9326 6.9326 7.3883 7.3883 k =-0.0208 0.0071 0.0000 ( 38421 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3487 -17.3487 -17.3384 -17.3384 -11.3376 -11.3376 -11.1939 -11.1939 -11.1915 -11.1915 -11.1510 -11.1510 -6.2663 -6.2663 -6.0820 -6.0820 -6.0062 -6.0062 -4.9837 -4.9837 -4.7578 -4.7578 -4.5623 -4.5623 -4.5590 -4.5590 -4.5030 -4.5030 -4.4463 -4.4463 -0.0954 -0.0954 0.1240 0.1240 0.2309 0.2309 0.3289 0.3289 0.3755 0.3755 0.5456 0.5456 0.5554 0.5554 0.6308 0.6308 0.7312 0.7312 0.7578 0.7578 0.8329 0.8329 0.8775 0.8775 5.4118 5.4118 6.5373 6.5373 6.6795 6.6795 6.7251 6.7251 6.9343 6.9343 7.3873 7.3873 k =-0.0417 0.0143 0.0000 ( 38415 PWs) bands (ev): -43.4454 -43.4454 -17.4760 -17.4760 -17.3487 -17.3487 -17.3384 -17.3384 -11.3376 -11.3376 -11.1942 -11.1942 -11.1917 -11.1917 -11.1513 -11.1513 -6.2655 -6.2655 -6.0817 -6.0817 -6.0063 -6.0063 -4.9823 -4.9823 -4.7574 -4.7574 -4.5620 -4.5620 -4.5588 -4.5588 -4.5028 -4.5028 -4.4461 -4.4461 -0.0966 -0.0966 0.1210 0.1210 0.2304 0.2304 0.3302 0.3302 0.3752 0.3752 0.5434 0.5434 0.5555 0.5555 0.6312 0.6312 0.7312 0.7312 0.7559 0.7559 0.8310 0.8310 0.8767 0.8767 5.4209 5.4209 6.5397 6.5397 6.6784 6.6784 6.7306 6.7306 6.9393 6.9393 7.3843 7.3843 k =-0.0625 0.0214 0.0000 ( 38419 PWs) bands (ev): -43.4454 -43.4454 -17.4758 -17.4758 -17.3487 -17.3487 -17.3385 -17.3385 -11.3378 -11.3378 -11.1945 -11.1945 -11.1919 -11.1919 -11.1516 -11.1516 -6.2641 -6.2641 -6.0811 -6.0811 -6.0064 -6.0064 -4.9799 -4.9799 -4.7568 -4.7568 -4.5616 -4.5616 -4.5585 -4.5585 -4.5027 -4.5027 -4.4457 -4.4457 -0.0987 -0.0987 0.1161 0.1161 0.2298 0.2298 0.3322 0.3322 0.3745 0.3745 0.5400 0.5400 0.5554 0.5554 0.6318 0.6318 0.7310 0.7310 0.7529 0.7529 0.8279 0.8279 0.8754 0.8754 5.4362 5.4362 6.5431 6.5431 6.6770 6.6770 6.7397 6.7397 6.9476 6.9476 7.3795 7.3795 k =-0.0833 0.0286 0.0000 ( 38441 PWs) bands (ev): -43.4454 -43.4454 -17.4756 -17.4756 -17.3487 -17.3487 -17.3387 -17.3387 -11.3380 -11.3380 -11.1950 -11.1950 -11.1921 -11.1921 -11.1522 -11.1522 -6.2623 -6.2623 -6.0803 -6.0803 -6.0065 -6.0065 -4.9767 -4.9767 -4.7559 -4.7559 -4.5612 -4.5612 -4.5578 -4.5578 -4.5024 -4.5024 -4.4451 -4.4451 -0.1015 -0.1015 0.1092 0.1092 0.2292 0.2292 0.3346 0.3346 0.3734 0.3734 0.5356 0.5356 0.5551 0.5551 0.6326 0.6326 0.7303 0.7303 0.7491 0.7491 0.8239 0.8239 0.8740 0.8740 5.4572 5.4572 6.5466 6.5466 6.6762 6.6762 6.7524 6.7524 6.9594 6.9594 7.3729 7.3729 k =-0.1042 0.0357 0.0000 ( 38457 PWs) bands (ev): -43.4454 -43.4454 -17.4754 -17.4754 -17.3486 -17.3486 -17.3388 -17.3388 -11.3383 -11.3383 -11.1957 -11.1957 -11.1925 -11.1925 -11.1528 -11.1528 -6.2600 -6.2600 -6.0794 -6.0794 -6.0067 -6.0067 -4.9726 -4.9726 -4.7547 -4.7547 -4.5608 -4.5608 -4.5568 -4.5568 -4.5020 -4.5020 -4.4444 -4.4444 -0.1050 -0.1050 0.1007 0.1007 0.2287 0.2287 0.3370 0.3370 0.3720 0.3720 0.5304 0.5304 0.5545 0.5545 0.6337 0.6337 0.7281 0.7281 0.7451 0.7451 0.8192 0.8192 0.8725 0.8725 5.4838 5.4838 6.5487 6.5487 6.6771 6.6771 6.7684 6.7684 6.9744 6.9744 7.3648 7.3648 k =-0.1250 0.0429 0.0000 ( 38467 PWs) bands (ev): -43.4454 -43.4454 -17.4751 -17.4751 -17.3486 -17.3486 -17.3390 -17.3390 -11.3386 -11.3386 -11.1964 -11.1964 -11.1929 -11.1929 -11.1536 -11.1536 -6.2572 -6.2572 -6.0782 -6.0782 -6.0069 -6.0069 -4.9677 -4.9677 -4.7534 -4.7534 -4.5607 -4.5607 -4.5554 -4.5554 -4.5015 -4.5015 -4.4435 -4.4435 -0.1092 -0.1092 0.0907 0.0907 0.2285 0.2285 0.3393 0.3393 0.3703 0.3703 0.5242 0.5242 0.5537 0.5537 0.6349 0.6349 0.7230 0.7230 0.7425 0.7425 0.8143 0.8143 0.8709 0.8709 5.5156 5.5156 6.5478 6.5478 6.6813 6.6813 6.7876 6.7876 6.9922 6.9922 7.3559 7.3559 k =-0.1458 0.0500 0.0000 ( 38475 PWs) bands (ev): -43.4454 -43.4454 -17.4748 -17.4748 -17.3485 -17.3485 -17.3393 -17.3393 -11.3389 -11.3389 -11.1973 -11.1973 -11.1933 -11.1933 -11.1545 -11.1545 -6.2541 -6.2541 -6.0769 -6.0769 -6.0072 -6.0072 -4.9621 -4.9621 -4.7519 -4.7519 -4.5608 -4.5608 -4.5537 -4.5537 -4.5009 -4.5009 -4.4426 -4.4426 -0.1139 -0.1139 0.0793 0.0793 0.2284 0.2284 0.3410 0.3410 0.3682 0.3682 0.5171 0.5171 0.5529 0.5529 0.6364 0.6364 0.7149 0.7149 0.7414 0.7414 0.8094 0.8094 0.8695 0.8695 5.5524 5.5524 6.5427 6.5427 6.6898 6.6898 6.8098 6.8098 7.0119 7.0119 7.3471 7.3471 k =-0.1667 0.0572 0.0000 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4744 -17.4744 -17.3485 -17.3485 -17.3395 -17.3395 -11.3393 -11.3393 -11.1982 -11.1982 -11.1938 -11.1938 -11.1555 -11.1555 -6.2506 -6.2506 -6.0755 -6.0755 -6.0076 -6.0076 -4.9558 -4.9558 -4.7503 -4.7503 -4.5611 -4.5611 -4.5516 -4.5516 -4.5001 -4.5001 -4.4415 -4.4415 -0.1190 -0.1190 0.0668 0.0668 0.2286 0.2286 0.3418 0.3418 0.3660 0.3660 0.5091 0.5091 0.5522 0.5522 0.6378 0.6378 0.7048 0.7048 0.7414 0.7414 0.8048 0.8048 0.8681 0.8681 5.5937 5.5937 6.5334 6.5334 6.7027 6.7027 6.8347 6.8347 7.0324 7.0324 7.3397 7.3397 k =-0.1875 0.0643 0.0000 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4740 -17.4740 -17.3484 -17.3484 -17.3398 -17.3398 -11.3398 -11.3398 -11.1992 -11.1992 -11.1943 -11.1943 -11.1565 -11.1565 -6.2468 -6.2468 -6.0739 -6.0739 -6.0079 -6.0079 -4.9490 -4.9490 -4.7485 -4.7485 -4.5615 -4.5615 -4.5491 -4.5491 -4.4992 -4.4992 -4.4403 -4.4403 -0.1245 -0.1245 0.0534 0.0534 0.2290 0.2290 0.3412 0.3412 0.3639 0.3639 0.5001 0.5001 0.5516 0.5516 0.6390 0.6390 0.6941 0.6941 0.7417 0.7417 0.8006 0.8006 0.8667 0.8667 5.6390 5.6390 6.5205 6.5205 6.7191 6.7191 6.8619 6.8619 7.0518 7.0518 7.3356 7.3356 k =-0.2083 0.0714 0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4736 -17.4736 -17.3483 -17.3483 -17.3401 -17.3401 -11.3402 -11.3402 -11.2003 -11.2003 -11.1949 -11.1949 -11.1577 -11.1577 -6.2428 -6.2428 -6.0723 -6.0723 -6.0084 -6.0084 -4.9417 -4.9417 -4.7468 -4.7468 -4.5622 -4.5622 -4.5465 -4.5465 -4.4982 -4.4982 -4.4391 -4.4391 -0.1303 -0.1303 0.0394 0.0394 0.2296 0.2296 0.3391 0.3391 0.3622 0.3622 0.4900 0.4900 0.5513 0.5513 0.6395 0.6395 0.6840 0.6840 0.7421 0.7421 0.7969 0.7969 0.8655 0.8655 5.6879 5.6879 6.5050 6.5050 6.7377 6.7377 6.8909 6.8909 7.0679 7.0679 7.3370 7.3370 k =-0.2292 0.0786 0.0000 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4732 -17.4732 -17.3482 -17.3482 -17.3404 -17.3404 -11.3407 -11.3407 -11.2014 -11.2014 -11.1955 -11.1955 -11.1588 -11.1588 -6.2386 -6.2386 -6.0706 -6.0706 -6.0089 -6.0089 -4.9340 -4.9340 -4.7449 -4.7449 -4.5630 -4.5630 -4.5436 -4.5436 -4.4972 -4.4972 -4.4378 -4.4378 -0.1363 -0.1363 0.0250 0.0250 0.2304 0.2304 0.3354 0.3354 0.3607 0.3607 0.4787 0.4787 0.5512 0.5512 0.6388 0.6388 0.6758 0.6758 0.7425 0.7425 0.7938 0.7938 0.8642 0.8642 5.7399 5.7399 6.4878 6.4878 6.7570 6.7570 6.9213 6.9213 7.0790 7.0790 7.3458 7.3458 k =-0.2500 0.0857 0.0000 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4728 -17.4728 -17.3481 -17.3481 -17.3407 -17.3407 -11.3412 -11.3412 -11.2026 -11.2026 -11.1961 -11.1961 -11.1600 -11.1600 -6.2344 -6.2344 -6.0690 -6.0690 -6.0094 -6.0094 -4.9261 -4.9261 -4.7431 -4.7431 -4.5640 -4.5640 -4.5405 -4.5405 -4.4960 -4.4960 -4.4365 -4.4365 -0.1424 -0.1424 0.0105 0.0105 0.2313 0.2313 0.3306 0.3306 0.3593 0.3593 0.4661 0.4661 0.5515 0.5515 0.6359 0.6359 0.6708 0.6708 0.7425 0.7425 0.7912 0.7912 0.8630 0.8630 5.7944 5.7944 6.4697 6.4697 6.7753 6.7753 6.9524 6.9524 7.0847 7.0847 7.3624 7.3624 k =-0.2708 0.0929 0.0000 ( 38438 PWs) bands (ev): -43.4454 -43.4454 -17.4723 -17.4723 -17.3481 -17.3481 -17.3410 -17.3410 -11.3417 -11.3417 -11.2037 -11.2037 -11.1966 -11.1966 -11.1612 -11.1612 -6.2301 -6.2301 -6.0673 -6.0673 -6.0100 -6.0100 -4.9181 -4.9181 -4.7413 -4.7413 -4.5652 -4.5652 -4.5372 -4.5372 -4.4949 -4.4949 -4.4353 -4.4353 -0.1484 -0.1484 -0.0040 -0.0040 0.2322 0.2322 0.3251 0.3251 0.3577 0.3577 0.4525 0.4525 0.5521 0.5521 0.6314 0.6314 0.6690 0.6690 0.7423 0.7423 0.7892 0.7892 0.8619 0.8619 5.8510 5.8510 6.4513 6.4513 6.7908 6.7908 6.9835 6.9835 7.0866 7.0866 7.3854 7.3854 k =-0.2917 0.1000 0.0000 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4719 -17.4719 -17.3480 -17.3480 -17.3413 -17.3413 -11.3422 -11.3422 -11.2048 -11.2048 -11.1972 -11.1972 -11.1623 -11.1623 -6.2258 -6.2258 -6.0657 -6.0657 -6.0106 -6.0106 -4.9102 -4.9102 -4.7396 -4.7396 -4.5664 -4.5664 -4.5338 -4.5338 -4.4939 -4.4939 -4.4340 -4.4340 -0.1543 -0.1543 -0.0181 -0.0181 0.2331 0.2331 0.3191 0.3191 0.3559 0.3559 0.4380 0.4380 0.5530 0.5530 0.6263 0.6263 0.6695 0.6695 0.7417 0.7417 0.7877 0.7877 0.8607 0.8607 5.9091 5.9091 6.4333 6.4333 6.8014 6.8014 7.0138 7.0138 7.0873 7.0873 7.4120 7.4120 k =-0.3125 0.1072 0.0000 ( 38476 PWs) bands (ev): -43.4454 -43.4454 -17.4715 -17.4715 -17.3479 -17.3479 -17.3416 -17.3416 -11.3427 -11.3427 -11.2059 -11.2059 -11.1977 -11.1977 -11.1634 -11.1634 -6.2216 -6.2216 -6.0641 -6.0641 -6.0112 -6.0112 -4.9024 -4.9024 -4.7379 -4.7379 -4.5678 -4.5678 -4.5302 -4.5302 -4.4929 -4.4929 -4.4327 -4.4327 -0.1600 -0.1600 -0.0318 -0.0318 0.2340 0.2340 0.3132 0.3132 0.3537 0.3537 0.4230 0.4230 0.5541 0.5541 0.6216 0.6216 0.6712 0.6712 0.7406 0.7406 0.7868 0.7868 0.8597 0.8597 5.9680 5.9680 6.4160 6.4160 6.8051 6.8051 7.0423 7.0423 7.0898 7.0898 7.4391 7.4391 k =-0.3333 0.1143 0.0000 ( 38468 PWs) bands (ev): -43.4454 -43.4454 -17.4711 -17.4711 -17.3478 -17.3478 -17.3419 -17.3419 -11.3432 -11.3432 -11.2069 -11.2069 -11.1982 -11.1982 -11.1645 -11.1645 -6.2177 -6.2177 -6.0626 -6.0626 -6.0119 -6.0119 -4.8949 -4.8949 -4.7364 -4.7364 -4.5692 -4.5692 -4.5266 -4.5266 -4.4922 -4.4922 -4.4316 -4.4316 -0.1654 -0.1654 -0.0446 -0.0446 0.2349 0.2349 0.3076 0.3076 0.3510 0.3510 0.4082 0.4082 0.5554 0.5554 0.6177 0.6177 0.6735 0.6735 0.7393 0.7393 0.7862 0.7862 0.8587 0.8587 6.0272 6.0272 6.3998 6.3998 6.8007 6.8007 7.0684 7.0684 7.0958 7.0958 7.4645 7.4645 k =-0.3542 0.1215 0.0000 ( 38480 PWs) bands (ev): -43.4454 -43.4454 -17.4707 -17.4707 -17.3478 -17.3478 -17.3421 -17.3421 -11.3436 -11.3436 -11.2078 -11.2078 -11.1987 -11.1987 -11.1655 -11.1655 -6.2140 -6.2140 -6.0613 -6.0613 -6.0125 -6.0125 -4.8879 -4.8879 -4.7350 -4.7350 -4.5706 -4.5706 -4.5230 -4.5230 -4.4917 -4.4917 -4.4305 -4.4305 -0.1704 -0.1704 -0.0565 -0.0565 0.2356 0.2356 0.3026 0.3026 0.3477 0.3477 0.3941 0.3941 0.5568 0.5568 0.6147 0.6147 0.6760 0.6760 0.7376 0.7376 0.7861 0.7861 0.8578 0.8578 6.0860 6.0860 6.3852 6.3852 6.7884 6.7884 7.0911 7.0911 7.1057 7.1057 7.4866 7.4866 k =-0.3750 0.1286 0.0000 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4703 -17.4703 -17.3477 -17.3477 -17.3424 -17.3424 -11.3440 -11.3440 -11.2087 -11.2087 -11.1991 -11.1991 -11.1663 -11.1663 -6.2106 -6.2106 -6.0601 -6.0601 -6.0131 -6.0131 -4.8814 -4.8814 -4.7337 -4.7337 -4.5720 -4.5720 -4.5194 -4.5194 -4.4915 -4.4915 -4.4294 -4.4294 -0.1750 -0.1750 -0.0673 -0.0673 0.2363 0.2363 0.2984 0.2984 0.3433 0.3433 0.3816 0.3816 0.5582 0.5582 0.6124 0.6124 0.6787 0.6787 0.7357 0.7357 0.7861 0.7861 0.8570 0.8570 6.1435 6.1435 6.3727 6.3727 6.7692 6.7692 7.1096 7.1096 7.1190 7.1190 7.5048 7.5048 k =-0.3958 0.1357 0.0000 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4700 -17.4700 -17.3477 -17.3477 -17.3426 -17.3426 -11.3443 -11.3443 -11.2094 -11.2094 -11.1995 -11.1995 -11.1671 -11.1671 -6.2076 -6.2076 -6.0590 -6.0590 -6.0137 -6.0137 -4.8757 -4.8757 -4.7326 -4.7326 -4.5732 -4.5732 -4.5159 -4.5159 -4.4918 -4.4918 -4.4285 -4.4285 -0.1790 -0.1790 -0.0767 -0.0767 0.2368 0.2368 0.2952 0.2952 0.3376 0.3376 0.3717 0.3717 0.5596 0.5596 0.6108 0.6108 0.6812 0.6812 0.7338 0.7338 0.7864 0.7864 0.8563 0.8563 6.1983 6.1983 6.3630 6.3630 6.7444 6.7444 7.1247 7.1247 7.1332 7.1332 7.5194 7.5194 k =-0.4167 0.1429 0.0000 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4698 -17.4698 -17.3476 -17.3476 -17.3428 -17.3428 -11.3446 -11.3446 -11.2100 -11.2100 -11.1998 -11.1998 -11.1677 -11.1677 -6.2051 -6.2051 -6.0581 -6.0581 -6.0142 -6.0142 -4.8709 -4.8709 -4.7317 -4.7317 -4.5743 -4.5743 -4.5124 -4.5124 -4.4923 -4.4923 -4.4277 -4.4277 -0.1823 -0.1823 -0.0846 -0.0846 0.2372 0.2372 0.2932 0.2932 0.3304 0.3304 0.3646 0.3646 0.5608 0.5608 0.6097 0.6097 0.6835 0.6835 0.7319 0.7319 0.7867 0.7867 0.8557 0.8557 6.2480 6.2480 6.3576 6.3576 6.7159 6.7159 7.1376 7.1376 7.1457 7.1457 7.5307 7.5307 k =-0.4375 0.1500 0.0000 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4696 -17.4696 -17.3476 -17.3476 -17.3429 -17.3429 -11.3448 -11.3448 -11.2105 -11.2105 -11.2000 -11.2000 -11.1683 -11.1683 -6.2030 -6.2030 -6.0574 -6.0574 -6.0146 -6.0146 -4.8670 -4.8670 -4.7310 -4.7310 -4.5752 -4.5752 -4.5092 -4.5092 -4.4933 -4.4933 -4.4271 -4.4271 -0.1850 -0.1850 -0.0910 -0.0910 0.2375 0.2375 0.2925 0.2925 0.3226 0.3226 0.3601 0.3601 0.5619 0.5619 0.6090 0.6090 0.6855 0.6855 0.7302 0.7302 0.7870 0.7870 0.8552 0.8552 6.2865 6.2865 6.3614 6.3614 6.6855 6.6855 7.1483 7.1483 7.1555 7.1555 7.5391 7.5391 k =-0.4583 0.1572 0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4694 -17.4694 -17.3476 -17.3476 -17.3430 -17.3430 -11.3450 -11.3450 -11.2109 -11.2109 -11.2002 -11.2002 -11.1686 -11.1686 -6.2015 -6.2015 -6.0569 -6.0569 -6.0149 -6.0149 -4.8641 -4.8641 -4.7305 -4.7305 -4.5759 -4.5759 -4.5063 -4.5063 -4.4945 -4.4945 -4.4266 -4.4266 -0.1869 -0.1869 -0.0955 -0.0955 0.2378 0.2378 0.2930 0.2930 0.3152 0.3152 0.3573 0.3573 0.5627 0.5627 0.6085 0.6085 0.6871 0.6871 0.7289 0.7289 0.7872 0.7872 0.8548 0.8548 6.3056 6.3056 6.3801 6.3801 6.6561 6.6561 7.1563 7.1563 7.1625 7.1625 7.5449 7.5449 k =-0.4792 0.1643 0.0000 ( 38514 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3476 -17.3476 -17.3431 -17.3431 -11.3451 -11.3451 -11.2111 -11.2111 -11.2003 -11.2003 -11.1689 -11.1689 -6.2006 -6.2006 -6.0566 -6.0566 -6.0151 -6.0151 -4.8624 -4.8624 -4.7301 -4.7301 -4.5763 -4.5763 -4.5040 -4.5040 -4.4958 -4.4958 -4.4263 -4.4263 -0.1881 -0.1881 -0.0983 -0.0983 0.2379 0.2379 0.2945 0.2945 0.3093 0.3093 0.3559 0.3559 0.5631 0.5631 0.6083 0.6083 0.6881 0.6881 0.7280 0.7280 0.7874 0.7874 0.8546 0.8546 6.3107 6.3107 6.4032 6.4032 6.6329 6.6329 7.1612 7.1612 7.1668 7.1668 7.5483 7.5483 k =-0.5000 0.1715 0.0000 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3475 -17.3475 -17.3431 -17.3431 -11.3452 -11.3452 -11.2112 -11.2112 -11.2003 -11.2003 -11.1689 -11.1689 -6.2003 -6.2003 -6.0565 -6.0565 -6.0151 -6.0151 -4.8618 -4.8618 -4.7300 -4.7300 -4.5765 -4.5765 -4.5030 -4.5030 -4.4965 -4.4965 -4.4262 -4.4262 -0.1885 -0.1885 -0.0993 -0.0993 0.2379 0.2379 0.2956 0.2956 0.3068 0.3068 0.3554 0.3554 0.5633 0.5633 0.6082 0.6082 0.6884 0.6884 0.7277 0.7277 0.7875 0.7875 0.8545 0.8545 6.3115 6.3115 6.4134 6.4134 6.6235 6.6235 7.1628 7.1628 7.1682 7.1682 7.5494 7.5494 k =-0.5000 0.1715 0.0000 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3475 -17.3475 -17.3431 -17.3431 -11.3452 -11.3452 -11.2112 -11.2112 -11.2003 -11.2003 -11.1689 -11.1689 -6.2003 -6.2003 -6.0565 -6.0565 -6.0151 -6.0151 -4.8618 -4.8618 -4.7300 -4.7300 -4.5765 -4.5765 -4.5030 -4.5030 -4.4965 -4.4965 -4.4262 -4.4262 -0.1885 -0.1885 -0.0993 -0.0993 0.2379 0.2379 0.2956 0.2956 0.3068 0.3068 0.3554 0.3554 0.5633 0.5633 0.6082 0.6082 0.6884 0.6884 0.7277 0.7277 0.7875 0.7875 0.8545 0.8545 6.3115 6.3115 6.4134 6.4134 6.6235 6.6235 7.1628 7.1628 7.1682 7.1682 7.5494 7.5494 k =-0.4929 0.1922-0.0000 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3475 -17.3475 -17.3430 -17.3430 -11.3451 -11.3450 -11.2111 -11.2111 -11.2003 -11.2003 -11.1690 -11.1689 -6.2011 -6.1999 -6.0579 -6.0556 -6.0154 -6.0152 -4.8623 -4.8614 -4.7319 -4.7290 -4.5776 -4.5757 -4.5036 -4.5031 -4.4972 -4.4968 -4.4271 -4.4264 -0.1893 -0.1872 -0.0988 -0.0981 0.2347 0.2374 0.2947 0.2954 0.3062 0.3106 0.3550 0.3560 0.5626 0.5633 0.6039 0.6118 0.6869 0.6892 0.7237 0.7307 0.7844 0.7899 0.8537 0.8540 6.3143 6.3151 6.4151 6.4157 6.6262 6.6272 7.1641 7.1651 7.1706 7.1709 7.5493 7.5512 k =-0.4858 0.2130-0.0000 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4691 -17.4691 -17.3473 -17.3473 -17.3428 -17.3428 -11.3448 -11.3447 -11.2110 -11.2108 -11.2003 -11.2001 -11.1690 -11.1688 -6.2022 -6.1998 -6.0598 -6.0553 -6.0160 -6.0156 -4.8629 -4.8611 -4.7347 -4.7288 -4.5791 -4.5752 -4.5051 -4.5041 -4.4990 -4.4980 -4.4288 -4.4276 -0.1896 -0.1855 -0.0968 -0.0955 0.2279 0.2337 0.2933 0.2952 0.3084 0.3163 0.3547 0.3570 0.5611 0.5625 0.5990 0.6145 0.6846 0.6889 0.7187 0.7327 0.7807 0.7916 0.8517 0.8523 6.3234 6.3250 6.4210 6.4223 6.6353 6.6372 7.1676 7.1696 7.1795 7.1801 7.5510 7.5548 k =-0.4787 0.2337-0.0000 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4687 -17.4687 -17.3470 -17.3470 -17.3425 -17.3425 -11.3443 -11.3441 -11.2106 -11.2104 -11.2002 -11.1999 -11.1690 -11.1687 -6.2036 -6.2001 -6.0622 -6.0554 -6.0168 -6.0163 -4.8636 -4.8609 -4.7384 -4.7295 -4.5810 -4.5751 -4.5073 -4.5061 -4.5017 -4.4998 -4.4314 -4.4298 -0.1895 -0.1833 -0.0933 -0.0913 0.2182 0.2274 0.2923 0.2954 0.3117 0.3222 0.3547 0.3585 0.5587 0.5611 0.5937 0.6162 0.6817 0.6876 0.7128 0.7336 0.7765 0.7926 0.8484 0.8494 6.3388 6.3410 6.4309 6.4330 6.6506 6.6535 7.1721 7.1750 7.1953 7.1964 7.5545 7.5604 k =-0.4715 0.2545-0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4683 -17.4683 -17.3466 -17.3466 -17.3421 -17.3420 -11.3435 -11.3433 -11.2101 -11.2098 -11.2000 -11.1997 -11.1690 -11.1686 -6.2054 -6.2007 -6.0651 -6.0560 -6.0180 -6.0173 -4.8644 -4.8607 -4.7429 -4.7311 -4.5833 -4.5753 -4.5105 -4.5094 -4.5050 -4.5019 -4.4348 -4.4329 -0.1891 -0.1807 -0.0883 -0.0857 0.2063 0.2194 0.2919 0.2960 0.3153 0.3276 0.3548 0.3607 0.5554 0.5591 0.5882 0.6167 0.6781 0.6851 0.7060 0.7334 0.7719 0.7930 0.8440 0.8454 6.3601 6.3628 6.4450 6.4479 6.6719 6.6758 7.1773 7.1812 7.2178 7.2192 7.5604 7.5685 k =-0.4644 0.2752-0.0000 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4677 -17.4677 -17.3460 -17.3460 -17.3415 -17.3415 -11.3426 -11.3424 -11.2094 -11.2091 -11.1998 -11.1994 -11.1689 -11.1685 -6.2075 -6.2016 -6.0684 -6.0572 -6.0195 -6.0186 -4.8654 -4.8607 -4.7483 -4.7336 -4.5862 -4.5761 -4.5151 -4.5141 -4.5084 -4.5043 -4.4387 -4.4369 -0.1883 -0.1778 -0.0819 -0.0787 0.1931 0.2102 0.2920 0.2970 0.3185 0.3316 0.3552 0.3640 0.5514 0.5563 0.5826 0.6161 0.6739 0.6813 0.6985 0.7318 0.7672 0.7927 0.8387 0.8406 6.3869 6.3900 6.4634 6.4675 6.6990 6.7040 7.1825 7.1871 7.2465 7.2482 7.5694 7.5797 k =-0.4573 0.2960-0.0000 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4671 -17.4671 -17.3454 -17.3454 -17.3408 -17.3408 -11.3415 -11.3412 -11.2086 -11.2082 -11.1995 -11.1991 -11.1688 -11.1683 -6.2099 -6.2029 -6.0722 -6.0588 -6.0212 -6.0202 -4.8666 -4.8608 -4.7546 -4.7369 -4.5895 -4.5773 -4.5210 -4.5199 -4.5119 -4.5069 -4.4431 -4.4415 -0.1875 -0.1747 -0.0743 -0.0705 0.1789 0.2000 0.2925 0.2983 0.3212 0.3343 0.3560 0.3682 0.5465 0.5529 0.5769 0.6144 0.6691 0.6761 0.6903 0.7287 0.7625 0.7918 0.8327 0.8351 6.4186 6.4216 6.4864 6.4920 6.7315 6.7375 7.1864 7.1917 7.2811 7.2827 7.5824 7.5950 k =-0.4502 0.3167-0.0000 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4663 -17.4663 -17.3446 -17.3446 -17.3400 -17.3400 -11.3402 -11.3398 -11.2077 -11.2072 -11.1993 -11.1988 -11.1686 -11.1680 -6.2127 -6.2045 -6.0764 -6.0610 -6.0232 -6.0222 -4.8680 -4.8610 -4.7617 -4.7412 -4.5935 -4.5791 -4.5281 -4.5268 -4.5154 -4.5097 -4.4477 -4.4467 -0.1867 -0.1716 -0.0655 -0.0613 0.1641 0.1893 0.2933 0.2999 0.3233 0.3360 0.3572 0.3729 0.5409 0.5488 0.5712 0.6115 0.6635 0.6695 0.6815 0.7241 0.7582 0.7903 0.8262 0.8290 6.4536 6.4563 6.5151 6.5227 6.7687 6.7758 7.1882 7.1938 7.3207 7.3220 7.6005 7.6152 k =-0.4431 0.3375-0.0000 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4654 -17.4654 -17.3438 -17.3438 -17.3390 -17.3390 -11.3387 -11.3383 -11.2066 -11.2061 -11.1990 -11.1985 -11.1683 -11.1677 -6.2157 -6.2064 -6.0811 -6.0636 -6.0254 -6.0244 -4.8697 -4.8613 -4.7697 -4.7463 -4.5981 -4.5816 -4.5363 -4.5345 -4.5188 -4.5127 -4.4523 -4.4523 -0.1860 -0.1686 -0.0558 -0.0512 0.1490 0.1782 0.2944 0.3017 0.3247 0.3369 0.3586 0.3777 0.5349 0.5439 0.5655 0.6075 0.6570 0.6614 0.6725 0.7178 0.7543 0.7881 0.8195 0.8226 6.4901 6.4923 6.5510 6.5607 6.8100 6.8181 7.1870 7.1924 7.3643 7.3647 7.6249 7.6413 k =-0.4360 0.3582-0.0000 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4644 -17.4644 -17.3428 -17.3428 -17.3380 -17.3380 -11.3370 -11.3366 -11.2054 -11.2048 -11.1988 -11.1982 -11.1680 -11.1673 -6.2191 -6.2086 -6.0861 -6.0667 -6.0279 -6.0269 -4.8717 -4.8619 -4.7784 -4.7523 -4.6034 -4.5849 -4.5453 -4.5430 -4.5222 -4.5159 -4.4580 -4.4568 -0.1857 -0.1660 -0.0452 -0.0403 0.1339 0.1670 0.2957 0.3037 0.3257 0.3376 0.3603 0.3822 0.5283 0.5381 0.5597 0.6026 0.6497 0.6519 0.6633 0.7102 0.7508 0.7853 0.8130 0.8159 6.5262 6.5281 6.5952 6.6068 6.8540 6.8633 7.1827 7.1874 7.4079 7.4094 7.6558 7.6736 k =-0.4288 0.3790-0.0000 ( 38460 PWs) bands (ev): -43.4454 -43.4454 -17.4633 -17.4633 -17.3418 -17.3418 -17.3369 -17.3369 -11.3352 -11.3347 -11.2041 -11.2034 -11.1986 -11.1980 -11.1675 -11.1668 -6.2227 -6.2112 -6.0915 -6.0703 -6.0305 -6.0296 -4.8741 -4.8627 -4.7879 -4.7591 -4.6093 -4.5890 -4.5550 -4.5521 -4.5254 -4.5192 -4.4637 -4.4610 -0.1858 -0.1640 -0.0341 -0.0289 0.1192 0.1559 0.2973 0.3058 0.3263 0.3382 0.3619 0.3862 0.5212 0.5312 0.5540 0.5966 0.6410 0.6415 0.6541 0.7016 0.7476 0.7818 0.8067 0.8092 6.5616 6.5637 6.6475 6.6606 6.8988 6.9093 7.1764 7.1801 7.4464 7.4511 7.6848 7.6878 k =-0.4217 0.3997-0.0000 ( 38448 PWs) bands (ev): -43.4454 -43.4454 -17.4622 -17.4621 -17.3407 -17.3407 -17.3357 -17.3357 -11.3332 -11.3327 -11.2027 -11.2020 -11.1984 -11.1978 -11.1669 -11.1662 -6.2267 -6.2140 -6.0973 -6.0743 -6.0334 -6.0326 -4.8770 -4.8637 -4.7981 -4.7667 -4.6158 -4.5939 -4.5654 -4.5617 -4.5286 -4.5227 -4.4691 -4.4648 -0.1867 -0.1629 -0.0225 -0.0172 0.1052 0.1451 0.2991 0.3081 0.3269 0.3391 0.3635 0.3896 0.5135 0.5233 0.5484 0.5895 0.6290 0.6327 0.6453 0.6922 0.7446 0.7777 0.8011 0.8024 6.5968 6.5994 6.7066 6.7208 6.9408 6.9522 7.1712 7.1737 7.4719 7.4806 7.6951 7.7095 k =-0.4146 0.4205-0.0000 ( 38456 PWs) bands (ev): -43.4454 -43.4454 -17.4609 -17.4609 -17.3395 -17.3395 -17.3344 -17.3344 -11.3311 -11.3306 -11.2012 -11.2004 -11.1984 -11.1977 -11.1662 -11.1655 -6.2309 -6.2171 -6.1034 -6.0787 -6.0364 -6.0358 -4.8803 -4.8650 -4.8090 -4.7751 -4.6228 -4.5998 -4.5762 -4.5717 -4.5317 -4.5261 -4.4741 -4.4681 -0.1885 -0.1629 -0.0107 -0.0054 0.0922 0.1348 0.3012 0.3104 0.3276 0.3405 0.3649 0.3924 0.5050 0.5141 0.5431 0.5811 0.6160 0.6237 0.6370 0.6823 0.7417 0.7730 0.7956 0.7961 6.6323 6.6356 6.7710 6.7864 6.9738 6.9853 7.1730 7.1752 7.4784 7.4895 7.7282 7.7470 k =-0.4075 0.4412-0.0000 ( 38452 PWs) bands (ev): -43.4454 -43.4454 -17.4596 -17.4596 -17.3382 -17.3382 -17.3331 -17.3331 -11.3289 -11.3283 -11.1996 -11.1988 -11.1983 -11.1978 -11.1654 -11.1647 -6.2353 -6.2205 -6.1097 -6.0835 -6.0396 -6.0392 -4.8841 -4.8666 -4.8203 -4.7842 -4.6302 -4.6063 -4.5874 -4.5820 -4.5347 -4.5296 -4.4785 -4.4709 -0.1913 -0.1644 0.0009 0.0062 0.0806 0.1252 0.3033 0.3127 0.3287 0.3424 0.3661 0.3946 0.4956 0.5036 0.5381 0.5713 0.6025 0.6147 0.6295 0.6723 0.7389 0.7678 0.7889 0.7917 6.6683 6.6722 6.8396 6.8563 6.9899 6.9998 7.1894 7.1932 7.4685 7.4800 7.7816 7.8021 k =-0.4004 0.4620-0.0000 ( 38440 PWs) bands (ev): -43.4454 -43.4454 -17.4583 -17.4583 -17.3370 -17.3370 -17.3317 -17.3317 -11.3266 -11.3260 -11.1986 -11.1979 -11.1978 -11.1971 -11.1644 -11.1637 -6.2399 -6.2241 -6.1163 -6.0887 -6.0429 -6.0428 -4.8885 -4.8687 -4.8320 -4.7939 -4.6378 -4.6135 -4.5989 -4.5924 -4.5377 -4.5330 -4.4822 -4.4732 -0.1952 -0.1676 0.0122 0.0174 0.0708 0.1165 0.3055 0.3149 0.3303 0.3451 0.3669 0.3962 0.4851 0.4918 0.5330 0.5598 0.5890 0.6062 0.6230 0.6623 0.7363 0.7625 0.7821 0.7878 6.7045 6.7090 6.9108 6.9296 6.9877 6.9957 7.2219 7.2283 7.4484 7.4594 7.8460 7.8663 k =-0.3933 0.4827-0.0000 ( 38440 PWs) bands (ev): -43.4454 -43.4454 -17.4569 -17.4569 -17.3356 -17.3356 -17.3302 -17.3302 -11.3242 -11.3236 -11.1986 -11.1981 -11.1962 -11.1953 -11.1633 -11.1627 -6.2448 -6.2280 -6.1230 -6.0941 -6.0466 -6.0463 -4.8936 -4.8711 -4.8441 -4.8042 -4.6454 -4.6212 -4.6105 -4.6029 -4.5407 -4.5364 -4.4852 -4.4749 -0.2003 -0.1726 0.0226 0.0280 0.0633 0.1090 0.3076 0.3169 0.3325 0.3486 0.3675 0.3974 0.4737 0.4790 0.5271 0.5468 0.5765 0.5980 0.6177 0.6525 0.7337 0.7570 0.7754 0.7844 6.7407 6.7455 6.9648 6.9711 6.9990 7.0074 7.2637 7.2728 7.4227 7.4332 7.9104 7.9279 k =-0.3861 0.5035-0.0000 ( 38464 PWs) bands (ev): -43.4454 -43.4454 -17.4555 -17.4555 -17.3343 -17.3343 -17.3287 -17.3287 -11.3217 -11.3211 -11.1988 -11.1983 -11.1944 -11.1935 -11.1621 -11.1615 -6.2497 -6.2321 -6.1299 -6.0998 -6.0505 -6.0498 -4.8993 -4.8740 -4.8563 -4.8148 -4.6530 -4.6292 -4.6221 -4.6133 -4.5438 -4.5398 -4.4874 -4.4762 -0.2067 -0.1795 0.0312 0.0376 0.0589 0.1026 0.3094 0.3186 0.3355 0.3530 0.3678 0.3984 0.4614 0.4653 0.5191 0.5326 0.5663 0.5903 0.6137 0.6430 0.7313 0.7514 0.7686 0.7813 6.7758 6.7806 6.9494 6.9511 7.0680 7.0846 7.3078 7.3195 7.3942 7.4047 7.9256 7.9611 k =-0.3790 0.5242-0.0000 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4541 -17.4541 -17.3329 -17.3329 -17.3272 -17.3272 -11.3193 -11.3186 -11.1991 -11.1987 -11.1926 -11.1917 -11.1608 -11.1603 -6.2549 -6.2363 -6.1368 -6.1058 -6.0545 -6.0533 -4.9057 -4.8774 -4.8686 -4.8257 -4.6603 -4.6374 -4.6336 -4.6236 -4.5469 -4.5431 -4.4889 -4.4771 -0.2141 -0.1880 0.0366 0.0459 0.0588 0.0978 0.3109 0.3200 0.3392 0.3581 0.3678 0.3994 0.4485 0.4513 0.5084 0.5176 0.5593 0.5828 0.6109 0.6340 0.7290 0.7458 0.7619 0.7785 6.8079 6.8116 6.9270 6.9309 7.1446 7.1631 7.3458 7.3609 7.3673 7.3788 7.9178 7.9525 k =-0.3719 0.5450-0.0000 ( 38434 PWs) bands (ev): -43.4454 -43.4454 -17.4527 -17.4527 -17.3315 -17.3315 -17.3257 -17.3257 -11.3168 -11.3161 -11.1995 -11.1991 -11.1908 -11.1898 -11.1594 -11.1589 -6.2601 -6.2408 -6.1438 -6.1119 -6.0586 -6.0569 -4.9127 -4.8813 -4.8807 -4.8368 -4.6672 -4.6459 -4.6446 -4.6337 -4.5501 -4.5463 -4.4898 -4.4776 -0.2226 -0.1980 0.0382 0.0528 0.0633 0.0946 0.3119 0.3208 0.3430 0.3636 0.3678 0.4006 0.4354 0.4373 0.4951 0.5022 0.5551 0.5755 0.6092 0.6257 0.7268 0.7401 0.7553 0.7761 6.8299 6.8307 6.9126 6.9207 7.2211 7.2410 7.3340 7.3381 7.3931 7.4033 7.9143 7.9479 k =-0.3648 0.5657-0.0000 ( 38436 PWs) bands (ev): -43.4454 -43.4454 -17.4513 -17.4513 -17.3301 -17.3301 -17.3242 -17.3242 -11.3143 -11.3136 -11.1998 -11.1995 -11.1889 -11.1879 -11.1580 -11.1575 -6.2653 -6.2453 -6.1508 -6.1181 -6.0627 -6.0605 -4.9205 -4.8925 -4.8857 -4.8479 -4.6737 -4.6566 -4.6531 -4.6435 -4.5532 -4.5494 -4.4902 -4.4778 -0.2319 -0.2091 0.0384 0.0577 0.0699 0.0933 0.3123 0.3211 0.3458 0.3683 0.3691 0.4023 0.4226 0.4243 0.4805 0.4871 0.5526 0.5685 0.6084 0.6182 0.7245 0.7345 0.7490 0.7740 6.8271 6.8284 6.9208 6.9321 7.2892 7.3092 7.3110 7.3169 7.4225 7.4357 7.9133 7.9445 k =-0.3577 0.5865-0.0000 ( 38462 PWs) bands (ev): -43.4454 -43.4454 -17.4499 -17.4499 -17.3288 -17.3288 -17.3227 -17.3227 -11.3118 -11.3112 -11.2002 -11.2000 -11.1871 -11.1861 -11.1565 -11.1561 -6.2706 -6.2499 -6.1577 -6.1245 -6.0669 -6.0640 -4.9288 -4.9039 -4.8907 -4.8589 -4.6797 -4.6675 -4.6608 -4.6529 -4.5562 -4.5525 -4.4901 -4.4777 -0.2418 -0.2209 0.0386 0.0605 0.0766 0.0939 0.3120 0.3204 0.3456 0.3700 0.3734 0.4029 0.4129 0.4133 0.4655 0.4727 0.5508 0.5616 0.6083 0.6118 0.7220 0.7289 0.7432 0.7723 6.8079 6.8090 6.9467 6.9586 7.2721 7.2798 7.3702 7.3881 7.4477 7.4618 7.9095 7.9359 k =-0.3506 0.6072-0.0000 ( 38464 PWs) bands (ev): -43.4454 -43.4454 -17.4485 -17.4485 -17.3274 -17.3274 -17.3212 -17.3212 -11.3094 -11.3088 -11.2006 -11.2004 -11.1853 -11.1842 -11.1550 -11.1547 -6.2758 -6.2546 -6.1645 -6.1308 -6.0710 -6.0675 -4.9377 -4.9147 -4.8962 -4.8695 -4.6852 -4.6780 -4.6681 -4.6619 -4.5592 -4.5554 -4.4898 -4.4774 -0.2521 -0.2332 0.0392 0.0616 0.0829 0.0960 0.3107 0.3186 0.3415 0.3724 0.3753 0.3963 0.4060 0.4140 0.4512 0.4598 0.5490 0.5549 0.6067 0.6088 0.7190 0.7233 0.7383 0.7711 6.7840 6.7845 6.9778 6.9895 7.2440 7.2511 7.4327 7.4428 7.4792 7.4860 7.8983 7.9185 k =-0.3434 0.6280-0.0000 ( 38474 PWs) bands (ev): -43.4454 -43.4454 -17.4472 -17.4472 -17.3261 -17.3261 -17.3198 -17.3198 -11.3071 -11.3065 -11.2010 -11.2009 -11.1835 -11.1824 -11.1534 -11.1532 -6.2810 -6.2593 -6.1711 -6.1371 -6.0751 -6.0708 -4.9470 -4.9248 -4.9023 -4.8797 -4.6903 -4.6882 -4.6749 -4.6704 -4.5622 -4.5583 -4.4892 -4.4770 -0.2624 -0.2455 0.0403 0.0615 0.0885 0.0989 0.3077 0.3152 0.3344 0.3730 0.3731 0.3894 0.4040 0.4200 0.4390 0.4493 0.5467 0.5484 0.6031 0.6096 0.7150 0.7179 0.7348 0.7702 6.7594 6.7594 7.0096 7.0212 7.2169 7.2235 7.4646 7.4714 7.5244 7.5336 7.8798 7.8944 k =-0.3363 0.6487-0.0000 ( 38452 PWs) bands (ev): -43.4454 -43.4454 -17.4459 -17.4459 -17.3249 -17.3249 -17.3184 -17.3184 -11.3049 -11.3043 -11.2014 -11.2013 -11.1817 -11.1807 -11.1519 -11.1517 -6.2860 -6.2640 -6.1774 -6.1433 -6.0791 -6.0741 -4.9565 -4.9342 -4.9090 -4.8892 -4.6980 -4.6949 -4.6812 -4.6783 -4.5650 -4.5611 -4.4883 -4.4765 -0.2727 -0.2575 0.0417 0.0608 0.0934 0.1021 0.3021 0.3098 0.3265 0.3674 0.3704 0.3847 0.4070 0.4224 0.4348 0.4419 0.5422 0.5436 0.6010 0.6107 0.7100 0.7126 0.7328 0.7697 6.7353 6.7354 7.0409 7.0523 7.1910 7.1974 7.4752 7.4866 7.5768 7.5897 7.8578 7.8682 k =-0.3292 0.6695-0.0000 ( 38458 PWs) bands (ev): -43.4454 -43.4454 -17.4447 -17.4447 -17.3237 -17.3237 -17.3171 -17.3171 -11.3028 -11.3022 -11.2017 -11.2016 -11.1800 -11.1790 -11.1505 -11.1503 -6.2909 -6.2686 -6.1835 -6.1493 -6.0830 -6.0772 -4.9660 -4.9430 -4.9162 -4.8979 -4.7072 -4.6992 -4.6870 -4.6856 -4.5678 -4.5638 -4.4874 -4.4759 -0.2826 -0.2690 0.0433 0.0596 0.0975 0.1051 0.2931 0.3023 0.3196 0.3612 0.3658 0.3794 0.4116 0.4174 0.4390 0.4425 0.5363 0.5397 0.6002 0.6118 0.7045 0.7077 0.7320 0.7697 6.7126 6.7128 7.0710 7.0822 7.1669 7.1727 7.4827 7.4948 7.6272 7.6395 7.8360 7.8428 k =-0.3221 0.6902-0.0000 ( 38446 PWs) bands (ev): -43.4454 -43.4454 -17.4436 -17.4436 -17.3226 -17.3226 -17.3158 -17.3158 -11.3009 -11.3003 -11.2019 -11.2019 -11.1784 -11.1774 -11.1490 -11.1489 -6.2956 -6.2731 -6.1892 -6.1551 -6.0867 -6.0801 -4.9753 -4.9511 -4.9238 -4.9057 -4.7159 -4.7031 -4.6923 -4.6922 -4.5705 -4.5664 -4.4863 -4.4752 -0.2920 -0.2798 0.0450 0.0581 0.1007 0.1079 0.2815 0.2933 0.3137 0.3559 0.3606 0.3726 0.4141 0.4152 0.4413 0.4528 0.5307 0.5353 0.6004 0.6128 0.6989 0.7033 0.7322 0.7701 6.6917 6.6920 7.0992 7.1107 7.1450 7.1498 7.4889 7.5004 7.6707 7.6802 7.8181 7.8213 k =-0.3150 0.7110-0.0000 ( 38450 PWs) bands (ev): -43.4454 -43.4454 -17.4426 -17.4426 -17.3215 -17.3215 -17.3146 -17.3146 -11.2991 -11.2986 -11.2021 -11.2021 -11.1769 -11.1758 -11.1476 -11.1476 -6.3001 -6.2775 -6.1945 -6.1606 -6.0902 -6.0828 -4.9841 -4.9585 -4.9315 -4.9128 -4.7241 -4.7068 -4.6981 -4.6972 -4.5731 -4.5690 -4.4852 -4.4745 -0.3007 -0.2896 0.0468 0.0563 0.1029 0.1103 0.2691 0.2834 0.3078 0.3509 0.3558 0.3658 0.4129 0.4173 0.4479 0.4637 0.5255 0.5304 0.6010 0.6134 0.6935 0.6995 0.7330 0.7710 6.6729 6.6730 7.1160 7.1278 7.1351 7.1384 7.4946 7.5048 7.7033 7.7077 7.8080 7.8098 k =-0.3079 0.7318-0.0000 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4417 -17.4416 -17.3206 -17.3206 -17.3135 -17.3135 -11.2975 -11.2971 -11.2022 -11.2021 -11.1754 -11.1744 -11.1463 -11.1463 -6.3042 -6.2817 -6.1993 -6.1659 -6.0935 -6.0853 -4.9924 -4.9653 -4.9391 -4.9191 -4.7317 -4.7103 -4.7032 -4.7017 -4.5756 -4.5715 -4.4840 -4.4738 -0.3084 -0.2983 0.0485 0.0542 0.1041 0.1122 0.2571 0.2733 0.3014 0.3450 0.3520 0.3606 0.4130 0.4189 0.4567 0.4748 0.5206 0.5255 0.6018 0.6134 0.6889 0.6966 0.7345 0.7722 6.6560 6.6562 7.1013 7.1087 7.1571 7.1638 7.4997 7.5083 7.7177 7.7195 7.8092 7.8164 k =-0.3007 0.7525-0.0000 ( 38458 PWs) bands (ev): -43.4454 -43.4454 -17.4408 -17.4408 -17.3197 -17.3197 -17.3125 -17.3125 -11.2962 -11.2957 -11.2021 -11.2021 -11.1740 -11.1731 -11.1451 -11.1451 -6.3081 -6.2856 -6.2037 -6.1707 -6.0966 -6.0875 -4.9999 -4.9714 -4.9463 -4.9249 -4.7386 -4.7138 -4.7075 -4.7058 -4.5780 -4.5739 -4.4829 -4.4732 -0.3151 -0.3059 0.0502 0.0519 0.1040 0.1133 0.2462 0.2638 0.2945 0.3382 0.3495 0.3579 0.4137 0.4206 0.4664 0.4857 0.5162 0.5207 0.6022 0.6128 0.6851 0.6947 0.7364 0.7737 6.6411 6.6416 7.0843 7.0909 7.1820 7.1884 7.5040 7.5107 7.7158 7.7209 7.8244 7.8336 k =-0.2936 0.7733-0.0000 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4401 -17.4401 -17.3189 -17.3189 -17.3116 -17.3116 -11.2950 -11.2946 -11.2020 -11.2020 -11.1728 -11.1718 -11.1440 -11.1440 -6.3116 -6.2894 -6.2076 -6.1752 -6.0993 -6.0894 -5.0067 -4.9768 -4.9530 -4.9301 -4.7450 -4.7170 -4.7112 -4.7095 -4.5804 -4.5762 -4.4818 -4.4726 -0.3206 -0.3120 0.0494 0.0519 0.1023 0.1137 0.2371 0.2555 0.2874 0.3312 0.3481 0.3570 0.4148 0.4227 0.4763 0.4962 0.5124 0.5163 0.6020 0.6114 0.6826 0.6938 0.7388 0.7756 6.6283 6.6291 7.0688 7.0749 7.2064 7.2121 7.5067 7.5116 7.7115 7.7175 7.8440 7.8529 k =-0.2865 0.7940-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4395 -17.4395 -17.3183 -17.3183 -17.3108 -17.3108 -11.2941 -11.2938 -11.2017 -11.2017 -11.1716 -11.1707 -11.1430 -11.1429 -6.3147 -6.2928 -6.2109 -6.1792 -6.1017 -6.0910 -5.0126 -4.9814 -4.9590 -4.9347 -4.7507 -4.7199 -4.7143 -4.7129 -4.5827 -4.5785 -4.4807 -4.4721 -0.3248 -0.3168 0.0466 0.0535 0.0990 0.1131 0.2303 0.2488 0.2804 0.3244 0.3478 0.3573 0.4159 0.4251 0.4859 0.5054 0.5092 0.5132 0.6011 0.6093 0.6814 0.6940 0.7414 0.7776 6.6175 6.6187 7.0549 7.0607 7.2302 7.2351 7.5076 7.5108 7.7097 7.7158 7.8621 7.8699 k =-0.2794 0.8148-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3177 -17.3177 -17.3101 -17.3101 -11.2934 -11.2932 -11.2014 -11.2013 -11.1706 -11.1697 -11.1420 -11.1420 -6.3175 -6.2960 -6.2136 -6.1827 -6.1038 -6.0923 -5.0177 -4.9853 -4.9642 -4.9387 -4.7557 -4.7223 -4.7170 -4.7159 -4.5849 -4.5807 -4.4797 -4.4716 -0.3276 -0.3200 0.0437 0.0551 0.0940 0.1116 0.2260 0.2440 0.2737 0.3182 0.3482 0.3587 0.4169 0.4276 0.4943 0.5064 0.5075 0.5182 0.5993 0.6067 0.6816 0.6952 0.7443 0.7799 6.6086 6.6103 7.0429 7.0483 7.2534 7.2576 7.5062 7.5080 7.7121 7.7181 7.8762 7.8826 k =-0.2794 0.8148-0.0000 ( 38494 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3177 -17.3177 -17.3101 -17.3101 -11.2934 -11.2932 -11.2014 -11.2013 -11.1706 -11.1697 -11.1420 -11.1420 -6.3175 -6.2960 -6.2136 -6.1827 -6.1038 -6.0923 -5.0177 -4.9853 -4.9642 -4.9387 -4.7557 -4.7223 -4.7170 -4.7159 -4.5849 -4.5807 -4.4797 -4.4716 -0.3276 -0.3200 0.0437 0.0551 0.0940 0.1116 0.2260 0.2440 0.2737 0.3182 0.3482 0.3587 0.4169 0.4276 0.4943 0.5064 0.5075 0.5182 0.5993 0.6067 0.6816 0.6952 0.7443 0.7799 6.6086 6.6103 7.0429 7.0483 7.2534 7.2576 7.5062 7.5080 7.7121 7.7181 7.8762 7.8826 k =-0.2794 0.8148 0.0216 ( 38495 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3178 -17.3178 -17.3101 -17.3100 -11.2934 -11.2932 -11.2014 -11.2014 -11.1706 -11.1697 -11.1420 -11.1420 -6.3175 -6.2960 -6.2133 -6.1825 -6.1041 -6.0924 -5.0175 -4.9853 -4.9640 -4.9387 -4.7560 -4.7246 -4.7189 -4.7120 -4.5846 -4.5803 -4.4804 -4.4713 -0.3277 -0.3199 0.0407 0.0540 0.0975 0.1142 0.2255 0.2437 0.2734 0.3185 0.3475 0.3590 0.4158 0.4286 0.4940 0.5043 0.5095 0.5180 0.5999 0.6079 0.6814 0.6948 0.7437 0.7793 6.6100 6.6118 7.0396 7.0452 7.2542 7.2590 7.5053 7.5083 7.7118 7.7185 7.8756 7.8819 k =-0.2794 0.8148 0.0431 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3180 -17.3180 -17.3099 -17.3099 -11.2934 -11.2932 -11.2014 -11.2014 -11.1705 -11.1697 -11.1421 -11.1420 -6.3176 -6.2963 -6.2125 -6.1818 -6.1047 -6.0930 -5.0169 -4.9854 -4.9631 -4.9389 -4.7568 -4.7298 -4.7191 -4.7078 -4.5838 -4.5793 -4.4823 -4.4707 -0.3277 -0.3197 0.0343 0.0506 0.1065 0.1213 0.2239 0.2428 0.2723 0.3191 0.3458 0.3598 0.4132 0.4306 0.4936 0.5010 0.5109 0.5189 0.6017 0.6111 0.6808 0.6937 0.7418 0.7774 6.6144 6.6162 7.0305 7.0364 7.2562 7.2623 7.5030 7.5084 7.7109 7.7195 7.8741 7.8800 k =-0.2794 0.8148 0.0647 ( 38486 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3183 -17.3183 -17.3096 -17.3096 -11.2934 -11.2931 -11.2014 -11.2014 -11.1705 -11.1696 -11.1421 -11.1421 -6.3177 -6.2966 -6.2112 -6.1807 -6.1058 -6.0938 -5.0159 -4.9856 -4.9619 -4.9391 -4.7581 -4.7357 -4.7188 -4.7043 -4.5824 -4.5775 -4.4849 -4.4701 -0.3278 -0.3194 0.0272 0.0463 0.1186 0.1310 0.2214 0.2413 0.2706 0.3199 0.3436 0.3609 0.4104 0.4326 0.4926 0.4982 0.5092 0.5231 0.6045 0.6156 0.6799 0.6918 0.7388 0.7743 6.6216 6.6234 7.0170 7.0232 7.2583 7.2661 7.4994 7.5076 7.7098 7.7210 7.8723 7.8775 k =-0.2794 0.8148 0.0862 ( 38486 PWs) bands (ev): -43.4454 -43.4454 -17.4390 -17.4390 -17.3186 -17.3186 -17.3093 -17.3093 -11.2934 -11.2931 -11.2014 -11.2014 -11.1704 -11.1695 -11.1422 -11.1421 -6.3179 -6.2970 -6.2094 -6.1791 -6.1072 -6.0950 -5.0147 -4.9857 -4.9602 -4.9395 -4.7600 -4.7415 -4.7182 -4.7015 -4.5807 -4.5751 -4.4879 -4.4699 -0.3280 -0.3190 0.0208 0.0421 0.1318 0.1422 0.2179 0.2390 0.2686 0.3205 0.3414 0.3621 0.4078 0.4342 0.4887 0.4988 0.5061 0.5289 0.6078 0.6206 0.6788 0.6895 0.7347 0.7700 6.6316 6.6334 7.0004 7.0070 7.2592 7.2687 7.4942 7.5055 7.7085 7.7226 7.8708 7.8754 k =-0.2794 0.8148 0.1078 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4389 -17.4389 -17.3190 -17.3190 -17.3089 -17.3089 -11.2934 -11.2931 -11.2015 -11.2015 -11.1703 -11.1695 -11.1422 -11.1422 -6.3182 -6.2976 -6.2072 -6.1772 -6.1091 -6.0965 -5.0131 -4.9857 -4.9582 -4.9400 -4.7624 -4.7471 -4.7175 -4.6995 -4.5787 -4.5719 -4.4912 -4.4701 -0.3284 -0.3186 0.0158 0.0389 0.1450 0.1541 0.2135 0.2358 0.2666 0.3206 0.3395 0.3635 0.4057 0.4352 0.4837 0.5007 0.5041 0.5354 0.6110 0.6253 0.6774 0.6871 0.7295 0.7648 6.6441 6.6460 6.9823 6.9892 7.2578 7.2686 7.4871 7.5015 7.7069 7.7241 7.8706 7.8746 k =-0.2794 0.8148 0.1293 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4389 -17.4389 -17.3194 -17.3194 -17.3086 -17.3086 -11.2933 -11.2931 -11.2015 -11.2015 -11.1702 -11.1693 -11.1423 -11.1423 -6.3184 -6.2982 -6.2047 -6.1750 -6.1112 -6.0983 -5.0112 -4.9857 -4.9561 -4.9406 -4.7655 -4.7520 -4.7167 -4.6984 -4.5764 -4.5681 -4.4946 -4.4708 -0.3288 -0.3183 0.0125 0.0370 0.1571 0.1657 0.2087 0.2319 0.2652 0.3201 0.3378 0.3650 0.4042 0.4358 0.4788 0.4985 0.5076 0.5422 0.6135 0.6292 0.6753 0.6856 0.7236 0.7588 6.6590 6.6609 6.9637 6.9708 7.2534 7.2652 7.4782 7.4951 7.7052 7.7250 7.8719 7.8759 k =-0.2794 0.8148 0.1509 ( 38493 PWs) bands (ev): -43.4454 -43.4454 -17.4389 -17.4389 -17.3198 -17.3198 -17.3082 -17.3082 -11.2933 -11.2931 -11.2016 -11.2016 -11.1701 -11.1692 -11.1424 -11.1423 -6.3187 -6.2988 -6.2018 -6.1726 -6.1136 -6.1003 -5.0092 -4.9855 -4.9539 -4.9413 -4.7691 -4.7563 -4.7158 -4.6979 -4.5740 -4.5638 -4.4980 -4.4720 -0.3294 -0.3180 0.0109 0.0366 0.1669 0.1751 0.2047 0.2284 0.2648 0.3191 0.3364 0.3662 0.4034 0.4362 0.4749 0.4960 0.5131 0.5490 0.6147 0.6320 0.6723 0.6856 0.7171 0.7523 6.6760 6.6779 6.9454 6.9526 7.2460 7.2580 7.4678 7.4863 7.7033 7.7248 7.8747 7.8796 k =-0.2794 0.8148 0.1724 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4388 -17.4388 -17.3202 -17.3202 -17.3078 -17.3078 -11.2933 -11.2931 -11.2016 -11.2016 -11.1700 -11.1691 -11.1425 -11.1424 -6.3189 -6.2995 -6.1987 -6.1700 -6.1163 -6.1025 -5.0071 -4.9852 -4.9517 -4.9421 -4.7730 -4.7599 -4.7149 -4.6980 -4.5715 -4.5592 -4.5013 -4.4737 -0.3300 -0.3179 0.0111 0.0377 0.1708 0.1812 0.2030 0.2279 0.2657 0.3180 0.3348 0.3664 0.4037 0.4367 0.4721 0.4940 0.5194 0.5558 0.6143 0.6334 0.6686 0.6871 0.7102 0.7455 6.6947 6.6967 6.9280 6.9353 7.2356 7.2473 7.4566 7.4755 7.7013 7.7235 7.8784 7.8850 k =-0.2794 0.8148 0.1940 ( 38495 PWs) bands (ev): -43.4454 -43.4454 -17.4388 -17.4388 -17.3206 -17.3205 -17.3075 -17.3075 -11.2933 -11.2930 -11.2017 -11.2017 -11.1699 -11.1690 -11.1426 -11.1425 -6.3192 -6.3001 -6.1954 -6.1673 -6.1190 -6.1049 -5.0051 -4.9846 -4.9498 -4.9428 -4.7768 -4.7631 -4.7139 -4.6986 -4.5689 -4.5546 -4.5043 -4.4758 -0.3308 -0.3179 0.0130 0.0402 0.1666 0.1836 0.2038 0.2324 0.2681 0.3171 0.3327 0.3652 0.4050 0.4376 0.4705 0.4926 0.5263 0.5625 0.6123 0.6331 0.6647 0.6897 0.7032 0.7387 6.7146 6.7167 6.9117 6.9192 7.2228 7.2334 7.4453 7.4634 7.6996 7.7213 7.8826 7.8911 k =-0.2794 0.8148 0.2155 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4388 -17.4388 -17.3209 -17.3209 -17.3072 -17.3072 -11.2933 -11.2930 -11.2017 -11.2017 -11.1698 -11.1689 -11.1427 -11.1426 -6.3193 -6.3007 -6.1922 -6.1646 -6.1217 -6.1073 -5.0032 -4.9838 -4.9483 -4.9434 -4.7803 -4.7659 -4.7128 -4.6995 -4.5663 -4.5503 -4.5069 -4.4783 -0.3315 -0.3179 0.0165 0.0440 0.1587 0.1796 0.2082 0.2392 0.2725 0.3165 0.3303 0.3621 0.4075 0.4387 0.4700 0.4917 0.5336 0.5692 0.6087 0.6312 0.6610 0.6923 0.6970 0.7323 6.7351 6.7374 6.8970 6.9045 7.2085 7.2174 7.4345 7.4511 7.6983 7.7185 7.8868 7.8967 k =-0.2794 0.8148 0.2371 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3212 -17.3211 -17.3070 -17.3070 -11.2932 -11.2930 -11.2018 -11.2017 -11.1697 -11.1688 -11.1427 -11.1426 -6.3195 -6.3012 -6.1891 -6.1622 -6.1243 -6.1096 -5.0015 -4.9829 -4.9477 -4.9434 -4.7831 -4.7684 -4.7118 -4.7006 -4.5638 -4.5466 -4.5087 -4.4810 -0.3323 -0.3181 0.0211 0.0484 0.1497 0.1718 0.2142 0.2450 0.2790 0.3163 0.3277 0.3573 0.4110 0.4396 0.4707 0.4911 0.5411 0.5758 0.6039 0.6278 0.6578 0.6892 0.6973 0.7266 6.7555 6.7580 6.8837 6.8913 7.1935 7.2007 7.4250 7.4395 7.6975 7.7155 7.8909 7.9016 k =-0.2794 0.8148 0.2586 ( 38501 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3214 -17.3214 -17.3068 -17.3068 -11.2932 -11.2930 -11.2018 -11.2018 -11.1697 -11.1688 -11.1428 -11.1427 -6.3196 -6.3017 -6.1863 -6.1600 -6.1266 -6.1118 -5.0002 -4.9819 -4.9480 -4.9428 -4.7854 -4.7705 -4.7107 -4.7018 -4.5614 -4.5439 -4.5096 -4.4839 -0.3329 -0.3182 0.0265 0.0531 0.1412 0.1630 0.2200 0.2488 0.2870 0.3166 0.3252 0.3511 0.4152 0.4395 0.4727 0.4905 0.5487 0.5824 0.5984 0.6231 0.6549 0.6838 0.7006 0.7217 6.7749 6.7776 6.8720 6.8797 7.1793 7.1848 7.4172 7.4296 7.6972 7.7128 7.8946 7.9056 k =-0.2794 0.8148 0.2802 ( 38523 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3215 -17.3215 -17.3066 -17.3066 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1687 -11.1428 -11.1427 -6.3197 -6.3020 -6.1840 -6.1583 -6.1284 -6.1135 -4.9993 -4.9809 -4.9487 -4.9421 -4.7870 -4.7721 -4.7097 -4.7029 -4.5595 -4.5423 -4.5094 -4.4867 -0.3334 -0.3184 0.0319 0.0571 0.1344 0.1548 0.2246 0.2510 0.2946 0.3179 0.3234 0.3440 0.4198 0.4380 0.4755 0.4896 0.5561 0.5878 0.5934 0.6176 0.6527 0.6795 0.7039 0.7175 6.7921 6.7948 6.8617 6.8697 7.1672 7.1716 7.4115 7.4220 7.6972 7.7105 7.8977 7.9086 k =-0.2794 0.8148 0.3017 ( 38521 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3216 -17.3216 -17.3066 -17.3066 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1687 -11.1429 -11.1428 -6.3198 -6.3022 -6.1825 -6.1572 -6.1295 -6.1147 -4.9987 -4.9802 -4.9492 -4.9416 -4.7879 -4.7731 -4.7088 -4.7039 -4.5581 -4.5416 -4.5088 -4.4887 -0.3338 -0.3185 0.0360 0.0596 0.1302 0.1487 0.2276 0.2521 0.2997 0.3212 0.3225 0.3365 0.4243 0.4353 0.4783 0.4886 0.5627 0.5852 0.5965 0.6118 0.6513 0.6767 0.7071 0.7140 6.8054 6.8076 6.8534 6.8618 7.1589 7.1630 7.4080 7.4172 7.6975 7.7090 7.8997 7.9105 k =-0.2794 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3217 -17.3217 -17.3065 -17.3065 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1686 -11.1429 -11.1428 -6.3198 -6.3023 -6.1820 -6.1569 -6.1299 -6.1151 -4.9986 -4.9799 -4.9494 -4.9414 -4.7882 -4.7734 -4.7085 -4.7043 -4.5576 -4.5414 -4.5085 -4.4895 -0.3339 -0.3186 0.0376 0.0605 0.1288 0.1463 0.2287 0.2524 0.3014 0.3219 0.3254 0.3312 0.4269 0.4334 0.4796 0.4880 0.5660 0.5824 0.6002 0.6081 0.6508 0.6757 0.7094 0.7116 6.8111 6.8126 6.8497 6.8584 7.1560 7.1600 7.4068 7.4156 7.6976 7.7084 7.9004 7.9112 k =-0.2794 0.8148 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4387 -17.4387 -17.3217 -17.3217 -17.3065 -17.3065 -11.2932 -11.2930 -11.2018 -11.2018 -11.1696 -11.1686 -11.1429 -11.1428 -6.3198 -6.3023 -6.1820 -6.1569 -6.1299 -6.1151 -4.9986 -4.9799 -4.9494 -4.9414 -4.7882 -4.7734 -4.7085 -4.7043 -4.5576 -4.5414 -4.5085 -4.4895 -0.3339 -0.3186 0.0376 0.0605 0.1288 0.1463 0.2287 0.2524 0.3014 0.3219 0.3254 0.3312 0.4269 0.4334 0.4796 0.4880 0.5660 0.5824 0.6002 0.6081 0.6508 0.6757 0.7094 0.7116 6.8111 6.8126 6.8497 6.8584 7.1560 7.1600 7.4068 7.4156 7.6976 7.7084 7.9004 7.9112 k =-0.2865 0.7940 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4392 -17.4391 -17.3222 -17.3222 -17.3072 -17.3072 -11.2940 -11.2937 -11.2022 -11.2022 -11.1704 -11.1694 -11.1440 -11.1439 -6.3168 -6.2992 -6.1788 -6.1544 -6.1283 -6.1131 -4.9935 -4.9753 -4.9456 -4.9372 -4.7844 -4.7710 -4.7040 -4.7012 -4.5561 -4.5392 -4.5096 -4.4887 -0.3331 -0.3168 0.0347 0.0575 0.1385 0.1555 0.2297 0.2460 0.3028 0.3283 0.3377 0.3413 0.4253 0.4342 0.4795 0.4857 0.5584 0.5748 0.5952 0.5995 0.6539 0.6766 0.7110 0.7131 6.8086 6.8104 6.8488 6.8576 7.1569 7.1570 7.4264 7.4297 7.6940 7.7053 7.8981 7.9109 k =-0.2936 0.7733 0.3233 ( 38508 PWs) bands (ev): -43.4454 -43.4454 -17.4398 -17.4397 -17.3229 -17.3229 -17.3080 -17.3080 -11.2949 -11.2946 -11.2026 -11.2025 -11.1712 -11.1701 -11.1452 -11.1451 -6.3135 -6.2959 -6.1751 -6.1514 -6.1262 -6.1107 -4.9875 -4.9701 -4.9416 -4.9320 -4.7799 -4.7680 -4.6993 -4.6977 -4.5545 -4.5370 -4.5108 -4.4878 -0.3311 -0.3139 0.0321 0.0551 0.1477 0.1621 0.2326 0.2402 0.3050 0.3337 0.3501 0.3523 0.4244 0.4354 0.4797 0.4837 0.5502 0.5667 0.5917 0.5920 0.6579 0.6782 0.7127 0.7148 6.8092 6.8113 6.8482 6.8570 7.1462 7.1498 7.4507 7.4525 7.6926 7.7043 7.8930 7.9077 k =-0.3007 0.7525 0.3233 ( 38484 PWs) bands (ev): -43.4454 -43.4454 -17.4405 -17.4405 -17.3237 -17.3237 -17.3088 -17.3088 -11.2961 -11.2957 -11.2029 -11.2029 -11.1720 -11.1709 -11.1465 -11.1464 -6.3099 -6.2922 -6.1710 -6.1480 -6.1237 -6.1079 -4.9806 -4.9645 -4.9373 -4.9258 -4.7745 -4.7643 -4.6942 -4.6937 -4.5528 -4.5347 -4.5120 -4.4869 -0.3278 -0.3097 0.0300 0.0533 0.1548 0.1645 0.2364 0.2390 0.3081 0.3396 0.3623 0.3624 0.4245 0.4372 0.4804 0.4820 0.5417 0.5581 0.5859 0.5895 0.6628 0.6806 0.7147 0.7168 6.8130 6.8152 6.8484 6.8570 7.1307 7.1367 7.4750 7.4812 7.6930 7.7052 7.8855 7.9021 k =-0.3079 0.7318 0.3233 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4413 -17.4413 -17.3246 -17.3246 -17.3098 -17.3098 -11.2975 -11.2970 -11.2033 -11.2032 -11.1727 -11.1716 -11.1480 -11.1479 -6.3059 -6.2883 -6.1665 -6.1443 -6.1209 -6.1049 -4.9730 -4.9584 -4.9330 -4.9186 -4.7683 -4.7602 -4.6892 -4.6888 -4.5511 -4.5325 -4.5131 -4.4859 -0.3233 -0.3043 0.0283 0.0519 0.1578 0.1622 0.2368 0.2491 0.3121 0.3460 0.3706 0.3737 0.4259 0.4394 0.4805 0.4814 0.5330 0.5496 0.5811 0.5887 0.6684 0.6835 0.7169 0.7192 6.8197 6.8221 6.8494 6.8577 7.1126 7.1200 7.4994 7.5092 7.6946 7.7073 7.8760 7.8944 k =-0.3150 0.7110 0.3233 ( 38474 PWs) bands (ev): -43.4454 -43.4454 -17.4422 -17.4422 -17.3256 -17.3256 -17.3109 -17.3109 -11.2991 -11.2986 -11.2036 -11.2036 -11.1735 -11.1723 -11.1496 -11.1495 -6.3016 -6.2842 -6.1615 -6.1402 -6.1176 -6.1015 -4.9647 -4.9519 -4.9286 -4.9105 -4.7613 -4.7555 -4.6842 -4.6831 -4.5493 -4.5303 -4.5141 -4.4848 -0.3175 -0.2978 0.0271 0.0510 0.1551 0.1561 0.2424 0.2621 0.3169 0.3529 0.3765 0.3840 0.4288 0.4423 0.4791 0.4828 0.5245 0.5416 0.5776 0.5892 0.6745 0.6868 0.7194 0.7221 6.8294 6.8318 6.8513 6.8592 7.0934 7.1013 7.5214 7.5344 7.6963 7.7095 7.8648 7.8851 k =-0.3221 0.6902 0.3233 ( 38472 PWs) bands (ev): -43.4454 -43.4454 -17.4433 -17.4433 -17.3267 -17.3267 -17.3120 -17.3120 -11.3009 -11.3003 -11.2040 -11.2040 -11.1742 -11.1730 -11.1512 -11.1511 -6.2971 -6.2798 -6.1563 -6.1358 -6.1140 -6.0980 -4.9560 -4.9449 -4.9241 -4.9015 -4.7535 -4.7504 -4.6785 -4.6770 -4.5475 -4.5281 -4.5151 -4.4836 -0.3105 -0.2900 0.0263 0.0504 0.1472 0.1476 0.2526 0.2767 0.3226 0.3601 0.3801 0.3930 0.4330 0.4458 0.4774 0.4847 0.5163 0.5348 0.5755 0.5911 0.6810 0.6904 0.7222 0.7258 6.8418 6.8440 6.8540 6.8614 7.0741 7.0820 7.5399 7.5556 7.6965 7.7096 7.8528 7.8747 k =-0.3292 0.6695 0.3233 ( 38468 PWs) bands (ev): -43.4454 -43.4454 -17.4444 -17.4444 -17.3279 -17.3279 -17.3133 -17.3132 -11.3028 -11.3022 -11.2043 -11.2043 -11.1749 -11.1737 -11.1529 -11.1529 -6.2923 -6.2753 -6.1507 -6.1312 -6.1101 -6.0941 -4.9471 -4.9372 -4.9196 -4.8919 -4.7451 -4.7449 -4.6723 -4.6705 -4.5457 -4.5259 -4.5159 -4.4823 -0.3024 -0.2812 0.0259 0.0502 0.1364 0.1367 0.2656 0.2918 0.3290 0.3673 0.3817 0.4003 0.4381 0.4501 0.4751 0.4868 0.5091 0.5298 0.5750 0.5944 0.6879 0.6942 0.7255 0.7302 6.8547 6.8569 6.8593 6.8656 7.0557 7.0629 7.5546 7.5727 7.6923 7.7042 7.8420 7.8646 k =-0.3363 0.6487 0.3233 ( 38480 PWs) bands (ev): -43.4454 -43.4454 -17.4456 -17.4456 -17.3291 -17.3291 -17.3145 -17.3145 -11.3049 -11.3042 -11.2047 -11.2047 -11.1756 -11.1744 -11.1548 -11.1547 -6.2873 -6.2707 -6.1449 -6.1263 -6.1059 -6.0902 -4.9386 -4.9285 -4.9152 -4.8816 -4.7390 -4.7359 -4.6654 -4.6636 -4.5438 -4.5237 -4.5165 -4.4809 -0.2931 -0.2712 0.0259 0.0501 0.1237 0.1243 0.2799 0.3062 0.3363 0.3739 0.3820 0.4058 0.4437 0.4551 0.4719 0.4885 0.5039 0.5272 0.5761 0.5990 0.6951 0.6981 0.7291 0.7353 6.8587 6.8619 6.8758 6.8794 7.0390 7.0449 7.5658 7.5860 7.6798 7.6886 7.8354 7.8569 k =-0.3434 0.6280 0.3233 ( 38480 PWs) bands (ev): -43.4454 -43.4454 -17.4468 -17.4468 -17.3304 -17.3304 -17.3159 -17.3159 -11.3071 -11.3064 -11.2051 -11.2051 -11.1762 -11.1750 -11.1566 -11.1565 -6.2823 -6.2660 -6.1389 -6.1213 -6.1014 -6.0861 -4.9309 -4.9185 -4.9108 -4.8709 -4.7327 -4.7262 -4.6579 -4.6564 -4.5419 -4.5215 -4.5169 -4.4792 -0.2827 -0.2602 0.0261 0.0501 0.1094 0.1114 0.2944 0.3187 0.3446 0.3783 0.3827 0.4097 0.4496 0.4604 0.4683 0.4882 0.5025 0.5271 0.5790 0.6048 0.7022 0.7024 0.7331 0.7411 6.8602 6.8619 6.8958 6.8989 7.0250 7.0290 7.5744 7.5961 7.6552 7.6596 7.8348 7.8540 k =-0.3506 0.6072 0.3233 ( 38472 PWs) bands (ev): -43.4454 -43.4454 -17.4481 -17.4481 -17.3318 -17.3318 -17.3173 -17.3173 -11.3094 -11.3087 -11.2054 -11.2054 -11.1768 -11.1756 -11.1585 -11.1585 -6.2771 -6.2613 -6.1328 -6.1161 -6.0968 -6.0818 -4.9239 -4.9075 -4.9066 -4.8597 -4.7261 -4.7158 -4.6497 -4.6488 -4.5400 -4.5194 -4.5170 -4.4774 -0.2713 -0.2481 0.0267 0.0498 0.0943 0.0983 0.3081 0.3281 0.3539 0.3778 0.3863 0.4121 0.4559 0.4629 0.4678 0.4863 0.5050 0.5296 0.5837 0.6118 0.7064 0.7098 0.7375 0.7474 6.8591 6.8596 6.9180 6.9207 7.0142 7.0159 7.5799 7.6004 7.6184 7.6207 7.8389 7.8561 k =-0.3577 0.5865 0.3233 ( 38472 PWs) bands (ev): -43.4454 -43.4454 -17.4495 -17.4495 -17.3332 -17.3332 -17.3187 -17.3187 -11.3118 -11.3111 -11.2058 -11.2058 -11.1774 -11.1762 -11.1605 -11.1604 -6.2718 -6.2566 -6.1266 -6.1109 -6.0920 -6.0776 -4.9175 -4.9025 -4.8958 -4.8483 -4.7192 -4.7050 -4.6409 -4.6409 -4.5381 -4.5172 -4.5167 -4.4754 -0.2591 -0.2352 0.0273 0.0484 0.0788 0.0859 0.3197 0.3343 0.3632 0.3757 0.3900 0.4134 0.4605 0.4627 0.4734 0.4850 0.5099 0.5343 0.5903 0.6196 0.7110 0.7173 0.7422 0.7542 6.8530 6.8559 6.9417 6.9441 7.0065 7.0072 7.5565 7.5607 7.5939 7.6165 7.8430 7.8616 k =-0.3648 0.5657 0.3233 ( 38460 PWs) bands (ev): -43.4454 -43.4454 -17.4509 -17.4509 -17.3346 -17.3346 -17.3201 -17.3201 -11.3142 -11.3135 -11.2062 -11.2061 -11.1780 -11.1767 -11.1624 -11.1624 -6.2666 -6.2519 -6.1203 -6.1056 -6.0871 -6.0733 -4.9116 -4.8987 -4.8836 -4.8366 -4.7120 -4.6937 -4.6327 -4.6315 -4.5362 -4.5159 -4.5151 -4.4732 -0.2459 -0.2215 0.0279 0.0443 0.0634 0.0760 0.3280 0.3375 0.3709 0.3728 0.3936 0.4140 0.4595 0.4696 0.4795 0.4856 0.5164 0.5413 0.5986 0.6283 0.7157 0.7247 0.7471 0.7613 6.8437 6.8487 6.9666 6.9686 7.0008 7.0037 7.4947 7.4991 7.5990 7.6239 7.8150 7.8181 k =-0.3719 0.5450 0.3233 ( 38468 PWs) bands (ev): -43.4454 -43.4454 -17.4523 -17.4523 -17.3360 -17.3360 -17.3216 -17.3216 -11.3167 -11.3160 -11.2065 -11.2065 -11.1785 -11.1773 -11.1644 -11.1643 -6.2613 -6.2473 -6.1140 -6.1004 -6.0822 -6.0690 -4.9062 -4.8952 -4.8712 -4.8249 -4.7046 -4.6821 -4.6244 -4.6216 -4.5344 -4.5146 -4.5130 -4.4708 -0.2321 -0.2070 0.0274 0.0359 0.0492 0.0705 0.3321 0.3380 0.3692 0.3760 0.3978 0.4142 0.4605 0.4756 0.4859 0.4890 0.5246 0.5505 0.6084 0.6374 0.7208 0.7321 0.7522 0.7686 6.8315 6.8381 6.9918 6.9934 6.9984 7.0028 7.4248 7.4293 7.6071 7.6329 7.7599 7.7606 k =-0.3790 0.5242 0.3233 ( 38476 PWs) bands (ev): -43.4454 -43.4454 -17.4537 -17.4537 -17.3375 -17.3375 -17.3231 -17.3231 -11.3192 -11.3185 -11.2069 -11.2069 -11.1790 -11.1778 -11.1663 -11.1663 -6.2562 -6.2428 -6.1077 -6.0952 -6.0772 -6.0647 -4.9012 -4.8920 -4.8585 -4.8133 -4.6970 -4.6703 -4.6162 -4.6113 -4.5325 -4.5126 -4.5110 -4.4681 -0.2177 -0.1921 0.0219 0.0238 0.0402 0.0688 0.3318 0.3357 0.3649 0.3785 0.4028 0.4142 0.4630 0.4799 0.4929 0.4954 0.5349 0.5615 0.6195 0.6470 0.7262 0.7394 0.7573 0.7759 6.8173 6.8248 6.9978 7.0035 7.0164 7.0176 7.3510 7.3548 7.6168 7.6429 7.6944 7.6972 k =-0.3861 0.5035 0.3233 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4551 -17.4551 -17.3389 -17.3389 -17.3245 -17.3245 -11.3217 -11.3210 -11.2073 -11.2072 -11.1794 -11.1783 -11.1682 -11.1682 -6.2511 -6.2384 -6.1016 -6.0901 -6.0722 -6.0606 -4.8968 -4.8891 -4.8459 -4.8018 -4.6892 -4.6585 -4.6080 -4.6006 -4.5304 -4.5099 -4.5089 -4.4653 -0.2028 -0.1767 0.0093 0.0099 0.0389 0.0691 0.3281 0.3312 0.3599 0.3787 0.4082 0.4143 0.4662 0.4832 0.5011 0.5039 0.5469 0.5740 0.6318 0.6568 0.7318 0.7466 0.7623 0.7832 6.8018 6.8096 6.9983 7.0044 7.0381 7.0397 7.2765 7.2785 7.6214 7.6222 7.6358 7.6573 k =-0.3933 0.4827 0.3233 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4565 -17.4565 -17.3403 -17.3403 -17.3259 -17.3259 -11.3242 -11.3235 -11.2076 -11.2076 -11.1799 -11.1788 -11.1701 -11.1701 -6.2461 -6.2342 -6.0956 -6.0851 -6.0673 -6.0565 -4.8929 -4.8864 -4.8334 -4.7906 -4.6814 -4.6467 -4.6001 -4.5898 -4.5281 -4.5069 -4.5066 -4.4622 -0.1877 -0.1611 -0.0055 -0.0046 0.0404 0.0706 0.3221 0.3247 0.3542 0.3769 0.4131 0.4147 0.4690 0.4858 0.5106 0.5141 0.5604 0.5872 0.6451 0.6666 0.7375 0.7536 0.7671 0.7903 6.7854 6.7931 6.9985 7.0047 7.0530 7.0568 7.2041 7.2061 7.5517 7.5566 7.6443 7.6705 k =-0.4004 0.4620 0.3233 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4579 -17.4579 -17.3417 -17.3417 -17.3273 -17.3273 -11.3266 -11.3260 -11.2080 -11.2079 -11.1803 -11.1793 -11.1719 -11.1719 -6.2414 -6.2302 -6.0898 -6.0804 -6.0625 -6.0526 -4.8895 -4.8841 -4.8211 -4.7799 -4.6735 -4.6353 -4.5926 -4.5788 -4.5253 -4.5048 -4.5026 -4.4589 -0.1725 -0.1455 -0.0205 -0.0192 0.0431 0.0727 0.3146 0.3170 0.3481 0.3736 0.4154 0.4172 0.4711 0.4877 0.5214 0.5256 0.5747 0.6008 0.6591 0.6763 0.7433 0.7604 0.7716 0.7973 6.7687 6.7760 6.9973 7.0035 7.0482 7.0586 7.1418 7.1526 7.4817 7.4869 7.6603 7.6863 k =-0.4075 0.4412 0.3233 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4592 -17.4592 -17.3430 -17.3430 -17.3287 -17.3287 -11.3289 -11.3284 -11.2083 -11.2082 -11.1807 -11.1797 -11.1737 -11.1737 -6.2368 -6.2264 -6.0842 -6.0758 -6.0579 -6.0488 -4.8865 -4.8821 -4.8091 -4.7697 -4.6658 -4.6244 -4.5855 -4.5679 -4.5219 -4.5028 -4.4980 -4.4555 -0.1574 -0.1303 -0.0352 -0.0335 0.0466 0.0755 0.3064 0.3084 0.3414 0.3688 0.4164 0.4205 0.4727 0.4891 0.5331 0.5381 0.5895 0.6141 0.6737 0.6859 0.7491 0.7669 0.7758 0.8040 6.7518 6.7585 6.9932 7.0000 7.0072 7.0191 7.1173 7.1327 7.4147 7.4197 7.6783 7.7037 k =-0.4146 0.4205 0.3233 ( 38476 PWs) bands (ev): -43.4454 -43.4454 -17.4605 -17.4605 -17.3443 -17.3443 -17.3300 -17.3300 -11.3312 -11.3307 -11.2087 -11.2086 -11.1810 -11.1801 -11.1754 -11.1754 -6.2325 -6.2229 -6.0789 -6.0714 -6.0534 -6.0452 -4.8840 -4.8804 -4.7975 -4.7601 -4.6582 -4.6146 -4.5786 -4.5572 -4.5181 -4.5008 -4.4928 -4.4520 -0.1427 -0.1156 -0.0494 -0.0473 0.0510 0.0789 0.2977 0.2994 0.3343 0.3628 0.4175 0.4230 0.4738 0.4900 0.5454 0.5513 0.6042 0.6270 0.6884 0.6950 0.7548 0.7733 0.7796 0.8104 6.7349 6.7409 6.9437 6.9549 6.9895 6.9937 7.1134 7.1280 7.3523 7.3567 7.6976 7.7220 k =-0.4217 0.3997 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4617 -17.4617 -17.3456 -17.3456 -17.3312 -17.3312 -11.3334 -11.3328 -11.2090 -11.2089 -11.1813 -11.1805 -11.1770 -11.1770 -6.2284 -6.2196 -6.0739 -6.0673 -6.0491 -6.0418 -4.8819 -4.8789 -4.7865 -4.7513 -4.6508 -4.6063 -4.5716 -4.5467 -4.5137 -4.4989 -4.4870 -4.4484 -0.1286 -0.1019 -0.0629 -0.0605 0.0565 0.0830 0.2889 0.2903 0.3267 0.3558 0.4188 0.4249 0.4747 0.4906 0.5580 0.5649 0.6186 0.6393 0.7028 0.7036 0.7605 0.7793 0.7832 0.8165 6.7182 6.7234 6.8795 6.8885 6.9807 6.9840 7.1073 7.1210 7.2960 7.2995 7.7117 7.7234 k =-0.4288 0.3790 0.3233 ( 38510 PWs) bands (ev): -43.4454 -43.4454 -17.4629 -17.4629 -17.3467 -17.3467 -17.3324 -17.3324 -11.3354 -11.3349 -11.2093 -11.2092 -11.1816 -11.1809 -11.1784 -11.1784 -6.2245 -6.2166 -6.0692 -6.0635 -6.0451 -6.0387 -4.8801 -4.8777 -4.7760 -4.7433 -4.6438 -4.5997 -4.5641 -4.5367 -4.5091 -4.4971 -4.4808 -4.4448 -0.1156 -0.0896 -0.0756 -0.0727 0.0632 0.0878 0.2803 0.2813 0.3188 0.3480 0.4200 0.4263 0.4754 0.4907 0.5706 0.5784 0.6324 0.6509 0.7115 0.7164 0.7659 0.7844 0.7872 0.8222 6.7017 6.7061 6.8174 6.8250 6.9688 6.9707 7.0947 7.1073 7.2468 7.2491 7.6847 7.7206 k =-0.4360 0.3582 0.3233 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4640 -17.4640 -17.3478 -17.3478 -17.3335 -17.3335 -11.3373 -11.3368 -11.2096 -11.2095 -11.1819 -11.1813 -11.1798 -11.1797 -6.2210 -6.2138 -6.0649 -6.0600 -6.0414 -6.0358 -4.8786 -4.8767 -4.7662 -4.7362 -4.6371 -4.5951 -4.5563 -4.5272 -4.5043 -4.4954 -4.4743 -4.4413 -0.1047 -0.0880 -0.0831 -0.0781 0.0713 0.0935 0.2720 0.2727 0.3107 0.3394 0.4212 0.4273 0.4761 0.4907 0.5830 0.5917 0.6454 0.6618 0.7185 0.7285 0.7712 0.7876 0.7929 0.8276 6.6856 6.6890 6.7595 6.7657 6.9535 6.9540 7.0758 7.0868 7.2054 7.2064 7.6611 7.6927 k =-0.4431 0.3375 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4650 -17.4650 -17.3488 -17.3488 -17.3344 -17.3344 -11.3390 -11.3386 -11.2099 -11.2098 -11.1822 -11.1818 -11.1811 -11.1808 -6.2177 -6.2114 -6.0609 -6.0568 -6.0380 -6.0332 -4.8774 -4.8758 -4.7571 -4.7300 -4.6309 -4.5921 -4.5481 -4.5184 -4.4996 -4.4938 -4.4676 -4.4380 -0.1015 -0.0987 -0.0860 -0.0691 0.0808 0.1001 0.2641 0.2644 0.3023 0.3301 0.4223 0.4281 0.4767 0.4903 0.5950 0.6044 0.6576 0.6720 0.7244 0.7384 0.7761 0.7900 0.7994 0.8327 6.6698 6.6719 6.7069 6.7117 6.9344 6.9353 7.0523 7.0615 7.1714 7.1718 7.6417 7.6687 k =-0.4502 0.3167 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4658 -17.4658 -17.3497 -17.3497 -17.3353 -17.3353 -11.3406 -11.3402 -11.2101 -11.2100 -11.1825 -11.1824 -11.1821 -11.1815 -6.2148 -6.2093 -6.0574 -6.0540 -6.0349 -6.0308 -4.8764 -4.8752 -4.7488 -4.7247 -4.6251 -4.5903 -4.5400 -4.5105 -4.4950 -4.4924 -4.4609 -4.4349 -0.1085 -0.1084 -0.0790 -0.0616 0.0915 0.1076 0.2567 0.2568 0.2938 0.3204 0.4234 0.4286 0.4774 0.4898 0.6064 0.6162 0.6690 0.6815 0.7292 0.7456 0.7807 0.7921 0.8065 0.8373 6.6506 6.6527 6.6647 6.6652 6.9133 6.9154 7.0264 7.0339 7.1439 7.1453 7.6249 7.6473 k =-0.4573 0.2960 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4666 -17.4666 -17.3505 -17.3505 -17.3361 -17.3361 -11.3419 -11.3416 -11.2103 -11.2102 -11.1834 -11.1832 -11.1825 -11.1819 -6.2122 -6.2074 -6.0543 -6.0515 -6.0322 -6.0288 -4.8756 -4.8746 -4.7414 -4.7205 -4.6197 -4.5895 -4.5322 -4.5038 -4.4910 -4.4907 -4.4545 -4.4322 -0.1171 -0.1165 -0.0712 -0.0558 0.1032 0.1159 0.2496 0.2500 0.2854 0.3102 0.4243 0.4289 0.4781 0.4892 0.6171 0.6269 0.6797 0.6903 0.7327 0.7500 0.7849 0.7941 0.8141 0.8414 6.6136 6.6182 6.6429 6.6449 6.8923 6.8951 7.0004 7.0063 7.1226 7.1247 7.6097 7.6279 k =-0.4644 0.2752 0.3233 ( 38500 PWs) bands (ev): -43.4454 -43.4454 -17.4673 -17.4673 -17.3511 -17.3511 -17.3368 -17.3368 -11.3431 -11.3428 -11.2105 -11.2104 -11.1842 -11.1841 -11.1827 -11.1822 -6.2099 -6.2060 -6.0516 -6.0494 -6.0298 -6.0271 -4.8749 -4.8742 -4.7347 -4.7171 -4.6148 -4.5895 -4.5249 -4.4987 -4.4893 -4.4868 -4.4486 -4.4300 -0.1245 -0.1238 -0.0644 -0.0516 0.1154 0.1247 0.2432 0.2439 0.2773 0.2999 0.4252 0.4291 0.4789 0.4884 0.6267 0.6362 0.6897 0.6985 0.7350 0.7516 0.7885 0.7958 0.8217 0.8449 6.5783 6.5820 6.6296 6.6310 6.8728 6.8759 6.9759 6.9804 7.1065 7.1088 7.5960 7.6106 k =-0.4715 0.2545 0.3233 ( 38520 PWs) bands (ev): -43.4454 -43.4454 -17.4679 -17.4679 -17.3517 -17.3517 -17.3374 -17.3374 -11.3441 -11.3438 -11.2107 -11.2106 -11.1849 -11.1848 -11.1828 -11.1824 -6.2080 -6.2048 -6.0494 -6.0477 -6.0278 -6.0257 -4.8745 -4.8739 -4.7290 -4.7148 -4.6104 -4.5901 -4.5184 -4.4959 -4.4867 -4.4835 -4.4432 -4.4283 -0.1306 -0.1300 -0.0587 -0.0486 0.1276 0.1338 0.2375 0.2382 0.2700 0.2897 0.4259 0.4291 0.4797 0.4875 0.6352 0.6437 0.6991 0.7059 0.7360 0.7510 0.7917 0.7972 0.8290 0.8476 6.5489 6.5517 6.6182 6.6191 6.8560 6.8590 6.9544 6.9578 7.0944 7.0967 7.5843 7.5956 k =-0.4787 0.2337 0.3233 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4683 -17.4683 -17.3521 -17.3521 -17.3378 -17.3378 -11.3448 -11.3446 -11.2108 -11.2107 -11.1854 -11.1853 -11.1828 -11.1826 -6.2064 -6.2040 -6.0476 -6.0464 -6.0262 -6.0246 -4.8741 -4.8737 -4.7241 -4.7134 -4.6064 -4.5911 -4.5126 -4.4953 -4.4836 -4.4809 -4.4384 -4.4274 -0.1354 -0.1349 -0.0543 -0.0467 0.1391 0.1426 0.2325 0.2330 0.2641 0.2800 0.4266 0.4291 0.4806 0.4866 0.6424 0.6494 0.7081 0.7125 0.7359 0.7484 0.7942 0.7982 0.8355 0.8495 6.5258 6.5279 6.6089 6.6095 6.8427 6.8451 6.9369 6.9392 7.0858 7.0877 7.5750 7.5832 k =-0.4858 0.2130 0.3233 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4686 -17.4686 -17.3525 -17.3525 -17.3381 -17.3381 -11.3453 -11.3452 -11.2109 -11.2108 -11.1858 -11.1857 -11.1829 -11.1827 -6.2051 -6.2035 -6.0463 -6.0455 -6.0250 -6.0240 -4.8738 -4.8736 -4.7200 -4.7129 -4.6028 -4.5927 -4.5076 -4.4959 -4.4809 -4.4791 -4.4345 -4.4271 -0.1389 -0.1385 -0.0508 -0.0459 0.1488 0.1503 0.2283 0.2285 0.2602 0.2714 0.4273 0.4289 0.4815 0.4856 0.6480 0.6530 0.7164 0.7184 0.7347 0.7444 0.7962 0.7988 0.8410 0.8503 6.5093 6.5107 6.6020 6.6023 6.8331 6.8349 6.9240 6.9255 7.0800 7.0814 7.5685 7.5738 k =-0.4929 0.1922 0.3233 ( 38520 PWs) bands (ev): -43.4454 -43.4454 -17.4688 -17.4688 -17.3527 -17.3527 -17.3383 -17.3383 -11.3457 -11.3456 -11.2109 -11.2109 -11.1860 -11.1860 -11.1829 -11.1828 -6.2042 -6.2034 -6.0455 -6.0451 -6.0241 -6.0236 -4.8737 -4.8735 -4.7169 -4.7133 -4.5997 -4.5946 -4.5034 -4.4976 -4.4790 -4.4781 -4.4313 -4.4277 -0.1409 -0.1407 -0.0483 -0.0458 0.1555 0.1559 0.2253 0.2253 0.2588 0.2646 0.4278 0.4286 0.4825 0.4845 0.6521 0.6547 0.7234 0.7238 0.7329 0.7392 0.7976 0.7989 0.8453 0.8499 6.4995 6.5002 6.5977 6.5978 6.8275 6.8284 6.9163 6.9170 7.0768 7.0775 7.5649 7.5676 k =-0.5000 0.1715 0.3233 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3527 -17.3527 -17.3384 -17.3384 -11.3457 -11.3457 -11.2109 -11.2109 -11.1861 -11.1861 -11.1829 -11.1829 -6.2036 -6.2036 -6.0450 -6.0450 -6.0237 -6.0237 -4.8736 -4.8736 -4.7147 -4.7147 -4.5969 -4.5969 -4.5001 -4.5001 -4.4781 -4.4781 -4.4291 -4.4291 -0.1415 -0.1415 -0.0467 -0.0467 0.1580 0.1580 0.2241 0.2241 0.2603 0.2603 0.4282 0.4282 0.4835 0.4835 0.6543 0.6543 0.7267 0.7267 0.7338 0.7338 0.7985 0.7985 0.8483 0.8483 6.4965 6.4965 6.5963 6.5963 6.8260 6.8260 6.9139 6.9139 7.0760 7.0760 7.5646 7.5646 k =-0.5000 0.1715 0.3233 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3527 -17.3527 -17.3384 -17.3384 -11.3457 -11.3457 -11.2109 -11.2109 -11.1861 -11.1861 -11.1829 -11.1829 -6.2036 -6.2036 -6.0450 -6.0450 -6.0237 -6.0237 -4.8736 -4.8736 -4.7147 -4.7147 -4.5969 -4.5969 -4.5001 -4.5001 -4.4781 -4.4781 -4.4291 -4.4291 -0.1415 -0.1415 -0.0467 -0.0467 0.1580 0.1580 0.2241 0.2241 0.2603 0.2603 0.4282 0.4282 0.4835 0.4835 0.6543 0.6543 0.7267 0.7267 0.7338 0.7338 0.7985 0.7985 0.8483 0.8483 6.4965 6.4965 6.5963 6.5963 6.8260 6.8260 6.9139 6.9139 7.0760 7.0760 7.5646 7.5646 k =-0.5000 0.1715 0.3017 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3527 -17.3527 -17.3384 -17.3384 -11.3457 -11.3457 -11.2109 -11.2109 -11.1870 -11.1865 -11.1824 -11.1820 -6.2038 -6.2033 -6.0469 -6.0432 -6.0253 -6.0221 -4.8743 -4.8726 -4.7165 -4.7131 -4.5990 -4.5944 -4.5011 -4.4992 -4.4794 -4.4771 -4.4298 -4.4283 -0.1438 -0.1417 -0.0476 -0.0446 0.1559 0.1592 0.2249 0.2261 0.2586 0.2627 0.4275 0.4282 0.4839 0.4841 0.6533 0.6553 0.7257 0.7272 0.7333 0.7337 0.7983 0.7986 0.8483 0.8484 6.4927 6.4936 6.5932 6.5947 6.8290 6.8301 6.9062 6.9070 7.0819 7.0821 7.5638 7.5675 k =-0.5000 0.1715 0.2802 ( 38480 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3526 -17.3526 -17.3385 -17.3385 -11.3457 -11.3457 -11.2109 -11.2109 -11.1884 -11.1878 -11.1811 -11.1806 -6.2040 -6.2030 -6.0487 -6.0417 -6.0268 -6.0205 -4.8747 -4.8714 -4.7186 -4.7119 -4.6005 -4.5916 -4.5022 -4.4984 -4.4810 -4.4765 -4.4304 -4.4275 -0.1481 -0.1443 -0.0474 -0.0421 0.1541 0.1596 0.2274 0.2308 0.2575 0.2659 0.4260 0.4275 0.4854 0.4858 0.6523 0.6562 0.7238 0.7273 0.7325 0.7327 0.7979 0.7984 0.8483 0.8485 6.4829 6.4846 6.5855 6.5883 6.8389 6.8408 6.8874 6.8886 7.0969 7.0974 7.5649 7.5712 k =-0.5000 0.1715 0.2586 ( 38496 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3524 -17.3524 -17.3387 -17.3387 -11.3457 -11.3457 -11.2109 -11.2109 -11.1898 -11.1893 -11.1797 -11.1791 -6.2040 -6.2026 -6.0505 -6.0405 -6.0280 -6.0190 -4.8749 -4.8701 -4.7209 -4.7112 -4.6015 -4.5886 -4.5032 -4.4978 -4.4829 -4.4763 -4.4310 -4.4267 -0.1536 -0.1488 -0.0468 -0.0403 0.1538 0.1601 0.2305 0.2374 0.2572 0.2701 0.4238 0.4260 0.4880 0.4884 0.6512 0.6571 0.7208 0.7273 0.7306 0.7318 0.7975 0.7979 0.8483 0.8488 6.4686 6.4708 6.5734 6.5772 6.8513 6.8515 6.8667 6.8680 7.1161 7.1171 7.5663 7.5738 k =-0.5000 0.1715 0.2371 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4690 -17.4690 -17.3521 -17.3521 -17.3389 -17.3389 -11.3457 -11.3456 -11.2110 -11.2110 -11.1913 -11.1908 -11.1782 -11.1777 -6.2040 -6.2022 -6.0522 -6.0400 -6.0285 -6.0177 -4.8747 -4.8686 -4.7232 -4.7109 -4.6019 -4.5854 -4.5043 -4.4974 -4.4850 -4.4764 -4.4313 -4.4260 -0.1597 -0.1544 -0.0468 -0.0402 0.1562 0.1621 0.2333 0.2439 0.2585 0.2751 0.4208 0.4238 0.4916 0.4920 0.6500 0.6579 0.7166 0.7268 0.7278 0.7313 0.7970 0.7971 0.8485 0.8492 6.4515 6.4540 6.5577 6.5623 6.8291 6.8317 6.8789 6.8830 7.1361 7.1376 7.5670 7.5741 k =-0.5000 0.1715 0.2155 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4690 -17.4690 -17.3518 -17.3518 -17.3392 -17.3392 -11.3456 -11.3455 -11.2110 -11.2110 -11.1928 -11.1922 -11.1768 -11.1763 -6.2039 -6.2018 -6.0538 -6.0404 -6.0282 -6.0165 -4.8743 -4.8671 -4.7254 -4.7112 -4.6016 -4.5823 -4.5053 -4.4973 -4.4872 -4.4770 -4.4315 -4.4253 -0.1657 -0.1604 -0.0482 -0.0423 0.1621 0.1664 0.2355 0.2476 0.2632 0.2808 0.4171 0.4208 0.4961 0.4965 0.6485 0.6584 0.7115 0.7234 0.7271 0.7310 0.7959 0.7965 0.8487 0.8498 6.4329 6.4356 6.5395 6.5445 6.7996 6.8023 6.9033 6.9078 7.1549 7.1571 7.5662 7.5723 k =-0.5000 0.1715 0.1940 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4690 -17.4690 -17.3514 -17.3514 -17.3395 -17.3395 -11.3456 -11.3455 -11.2110 -11.2110 -11.1941 -11.1936 -11.1754 -11.1750 -6.2036 -6.2013 -6.0552 -6.0416 -6.0272 -6.0155 -4.8736 -4.8656 -4.7275 -4.7120 -4.6007 -4.5793 -4.5062 -4.4973 -4.4895 -4.4779 -4.4315 -4.4248 -0.1714 -0.1663 -0.0515 -0.0468 0.1714 0.1733 0.2370 0.2487 0.2706 0.2866 0.4127 0.4170 0.5016 0.5019 0.6466 0.6584 0.7058 0.7188 0.7269 0.7307 0.7946 0.7958 0.8491 0.8504 6.4139 6.4165 6.5200 6.5252 6.7702 6.7727 6.9305 6.9353 7.1715 7.1743 7.5643 7.5690 k =-0.5000 0.1715 0.1724 ( 38476 PWs) bands (ev): -43.4454 -43.4454 -17.4691 -17.4691 -17.3510 -17.3510 -17.3399 -17.3399 -11.3455 -11.3454 -11.2110 -11.2110 -11.1954 -11.1949 -11.1742 -11.1738 -6.2034 -6.2009 -6.0563 -6.0432 -6.0259 -6.0147 -4.8727 -4.8641 -4.7294 -4.7133 -4.5992 -4.5765 -4.5069 -4.4975 -4.4917 -4.4792 -4.4314 -4.4244 -0.1763 -0.1717 -0.0564 -0.0530 0.1828 0.1836 0.2379 0.2489 0.2787 0.2921 0.4075 0.4124 0.5079 0.5082 0.6441 0.6576 0.7000 0.7137 0.7268 0.7305 0.7931 0.7950 0.8495 0.8511 6.3952 6.3977 6.5003 6.5054 6.7420 6.7444 6.9593 6.9643 7.1852 7.1885 7.5618 7.5652 k =-0.5000 0.1715 0.1509 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4691 -17.4691 -17.3505 -17.3505 -17.3403 -17.3403 -11.3455 -11.3454 -11.2111 -11.2110 -11.1965 -11.1961 -11.1730 -11.1727 -6.2030 -6.2006 -6.0573 -6.0450 -6.0243 -6.0140 -4.8715 -4.8628 -4.7309 -4.7149 -4.5972 -4.5741 -4.5075 -4.4979 -4.4938 -4.4808 -4.4311 -4.4241 -0.1804 -0.1763 -0.0627 -0.0605 0.1942 0.1981 0.2385 0.2491 0.2865 0.2971 0.4015 0.4067 0.5148 0.5152 0.6408 0.6554 0.6947 0.7087 0.7267 0.7302 0.7916 0.7941 0.8502 0.8519 6.3774 6.3798 6.4814 6.4862 6.7158 6.7181 6.9886 6.9938 7.1955 7.1992 7.5591 7.5615 k =-0.5000 0.1715 0.1293 ( 38502 PWs) bands (ev): -43.4454 -43.4454 -17.4692 -17.4692 -17.3500 -17.3500 -17.3408 -17.3408 -11.3454 -11.3453 -11.2111 -11.2111 -11.1975 -11.1971 -11.1720 -11.1717 -6.2027 -6.2003 -6.0580 -6.0469 -6.0227 -6.0136 -4.8702 -4.8617 -4.7322 -4.7169 -4.5947 -4.5722 -4.5077 -4.4985 -4.4956 -4.4827 -4.4306 -4.4240 -0.1836 -0.1801 -0.0698 -0.0686 0.2067 0.2142 0.2390 0.2497 0.2936 0.3013 0.3948 0.4001 0.5224 0.5228 0.6366 0.6513 0.6906 0.7040 0.7266 0.7300 0.7902 0.7931 0.8509 0.8526 6.3611 6.3632 6.4641 6.4684 6.6923 6.6943 7.0178 7.0232 7.2021 7.2062 7.5566 7.5581 k =-0.5000 0.1715 0.1078 ( 38492 PWs) bands (ev): -43.4454 -43.4454 -17.4692 -17.4692 -17.3494 -17.3494 -17.3413 -17.3413 -11.3453 -11.3453 -11.2111 -11.2111 -11.1984 -11.1980 -11.1711 -11.1708 -6.2022 -6.2001 -6.0584 -6.0489 -6.0212 -6.0134 -4.8687 -4.8609 -4.7330 -4.7191 -4.5919 -4.5710 -4.5075 -4.4992 -4.4970 -4.4848 -4.4300 -4.4241 -0.1860 -0.1831 -0.0771 -0.0766 0.2189 0.2305 0.2397 0.2517 0.2997 0.3045 0.3873 0.3926 0.5304 0.5310 0.6314 0.6452 0.6880 0.6998 0.7266 0.7296 0.7890 0.7920 0.8516 0.8533 6.3466 6.3484 6.4488 6.4525 6.6717 6.6734 7.0463 7.0518 7.2049 7.2094 7.5544 7.5553 k =-0.5000 0.1715 0.0862 ( 38482 PWs) bands (ev): -43.4454 -43.4454 -17.4692 -17.4692 -17.3489 -17.3489 -17.3418 -17.3418 -11.3453 -11.3452 -11.2112 -11.2111 -11.1991 -11.1988 -11.1704 -11.1701 -6.2018 -6.1999 -6.0586 -6.0507 -6.0197 -6.0133 -4.8672 -4.8604 -4.7333 -4.7215 -4.5888 -4.5706 -4.5070 -4.4999 -4.4981 -4.4872 -4.4293 -4.4242 -0.1875 -0.1852 -0.0841 -0.0841 0.2286 0.2379 0.2497 0.2566 0.3049 0.3066 0.3793 0.3841 0.5386 0.5395 0.6253 0.6374 0.6868 0.6963 0.7266 0.7293 0.7881 0.7909 0.8524 0.8539 6.3342 6.3357 6.4360 6.4390 6.6545 6.6559 7.0737 7.0793 7.2039 7.2086 7.5525 7.5531 k =-0.5000 0.1715 0.0647 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3484 -17.3484 -17.3423 -17.3423 -11.3452 -11.3452 -11.2112 -11.2112 -11.1997 -11.1995 -11.1698 -11.1696 -6.2014 -6.1999 -6.0585 -6.0524 -6.0184 -6.0135 -4.8657 -4.8602 -4.7332 -4.7238 -4.5856 -4.5710 -4.5062 -4.5006 -4.4987 -4.4897 -4.4285 -4.4246 -0.1883 -0.1867 -0.0904 -0.0902 0.2341 0.2383 0.2655 0.2661 0.3073 0.3088 0.3711 0.3750 0.5467 0.5480 0.6188 0.6287 0.6865 0.6936 0.7268 0.7289 0.7874 0.7898 0.8531 0.8543 6.3244 6.3254 6.4259 6.4282 6.6410 6.6420 7.0994 7.1050 7.1990 7.2039 7.5512 7.5514 k =-0.5000 0.1715 0.0431 ( 38490 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3480 -17.3480 -17.3427 -17.3427 -11.3452 -11.3452 -11.2112 -11.2112 -11.2001 -11.1999 -11.1693 -11.1692 -6.2010 -6.2000 -6.0581 -6.0540 -6.0171 -6.0138 -4.8642 -4.8604 -4.7326 -4.7261 -4.5824 -4.5722 -4.5051 -4.5014 -4.4987 -4.4921 -4.4277 -4.4250 -0.1887 -0.1876 -0.0953 -0.0950 0.2364 0.2383 0.2766 0.2817 0.3065 0.3112 0.3634 0.3659 0.5543 0.5558 0.6127 0.6201 0.6868 0.6914 0.7270 0.7285 0.7871 0.7889 0.8537 0.8546 6.3172 6.3179 6.4187 6.4203 6.6312 6.6319 7.1231 7.1286 7.1904 7.1955 7.5502 7.5503 k =-0.5000 0.1715 0.0216 ( 38478 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3477 -17.3477 -17.3430 -17.3430 -11.3452 -11.3452 -11.2112 -11.2112 -11.2003 -11.2002 -11.1690 -11.1690 -6.2006 -6.2001 -6.0575 -6.0554 -6.0160 -6.0144 -4.8629 -4.8610 -4.7315 -4.7282 -4.5793 -4.5740 -4.5039 -4.5022 -4.4980 -4.4945 -4.4270 -4.4256 -0.1887 -0.1882 -0.0983 -0.0981 0.2375 0.2382 0.2873 0.2944 0.3040 0.3110 0.3575 0.3586 0.5604 0.5615 0.6085 0.6126 0.6874 0.6898 0.7273 0.7281 0.7871 0.7881 0.8542 0.8547 6.3129 6.3132 6.4145 6.4153 6.6253 6.6257 7.1443 7.1498 7.1782 7.1835 7.5496 7.5497 k =-0.5000 0.1715 0.0000 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3475 -17.3475 -17.3431 -17.3431 -11.3452 -11.3452 -11.2112 -11.2112 -11.2003 -11.2003 -11.1689 -11.1689 -6.2003 -6.2003 -6.0565 -6.0565 -6.0151 -6.0151 -4.8618 -4.8618 -4.7300 -4.7300 -4.5765 -4.5765 -4.5030 -4.5030 -4.4965 -4.4965 -4.4262 -4.4262 -0.1885 -0.1885 -0.0993 -0.0993 0.2379 0.2379 0.2956 0.2956 0.3068 0.3068 0.3554 0.3554 0.5633 0.5633 0.6082 0.6082 0.6884 0.6884 0.7277 0.7277 0.7875 0.7875 0.8545 0.8545 6.3115 6.3115 6.4134 6.4134 6.6235 6.6235 7.1628 7.1628 7.1682 7.1682 7.5494 7.5494 k = 0.0000 0.0000 0.3233 ( 38518 PWs) bands (ev): -43.4454 -43.4454 -17.4755 -17.4755 -17.3539 -17.3539 -17.3338 -17.3338 -11.3382 -11.3382 -11.1941 -11.1941 -11.1736 -11.1736 -11.1680 -11.1680 -6.2701 -6.2701 -6.0706 -6.0706 -6.0141 -6.0141 -4.9949 -4.9949 -4.7381 -4.7381 -4.5885 -4.5885 -4.5381 -4.5381 -4.5000 -4.5000 -4.4530 -4.4530 -0.0276 -0.0276 0.0201 0.0201 0.2234 0.2234 0.3742 0.3742 0.4724 0.4724 0.5190 0.5190 0.5442 0.5442 0.6421 0.6421 0.7257 0.7257 0.7429 0.7429 0.8156 0.8156 0.8228 0.8228 5.9332 5.9332 6.1369 6.1369 6.4394 6.4394 6.7985 6.7985 6.9818 6.9818 7.0586 7.0586 k =-0.0208 0.0071 0.3233 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4754 -17.4754 -17.3539 -17.3539 -17.3338 -17.3338 -11.3382 -11.3382 -11.1942 -11.1942 -11.1736 -11.1736 -11.1681 -11.1681 -6.2698 -6.2698 -6.0704 -6.0704 -6.0142 -6.0142 -4.9944 -4.9944 -4.7380 -4.7380 -4.5884 -4.5884 -4.5380 -4.5380 -4.4999 -4.4999 -4.4529 -4.4529 -0.0278 -0.0278 0.0196 0.0196 0.2235 0.2235 0.3735 0.3735 0.4713 0.4713 0.5188 0.5188 0.5438 0.5438 0.6421 0.6421 0.7255 0.7255 0.7428 0.7428 0.8155 0.8155 0.8229 0.8229 5.9355 5.9355 6.1395 6.1395 6.4407 6.4407 6.7994 6.7994 6.9830 6.9830 7.0578 7.0578 k =-0.0417 0.0143 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4754 -17.4754 -17.3539 -17.3539 -17.3339 -17.3339 -11.3383 -11.3383 -11.1944 -11.1944 -11.1737 -11.1737 -11.1683 -11.1683 -6.2690 -6.2690 -6.0701 -6.0701 -6.0142 -6.0142 -4.9930 -4.9930 -4.7376 -4.7376 -4.5883 -4.5883 -4.5378 -4.5378 -4.4997 -4.4997 -4.4526 -4.4526 -0.0283 -0.0283 0.0181 0.0181 0.2238 0.2238 0.3716 0.3716 0.4680 0.4680 0.5181 0.5181 0.5425 0.5425 0.6422 0.6422 0.7250 0.7250 0.7426 0.7426 0.8151 0.8151 0.8231 0.8231 5.9425 5.9425 6.1475 6.1475 6.4447 6.4447 6.8021 6.8021 6.9865 6.9865 7.0557 7.0557 k =-0.0625 0.0214 0.3233 ( 38532 PWs) bands (ev): -43.4454 -43.4454 -17.4752 -17.4752 -17.3539 -17.3539 -17.3340 -17.3340 -11.3385 -11.3385 -11.1947 -11.1947 -11.1739 -11.1739 -11.1687 -11.1687 -6.2677 -6.2677 -6.0695 -6.0695 -6.0143 -6.0143 -4.9907 -4.9907 -4.7370 -4.7370 -4.5881 -4.5881 -4.5374 -4.5374 -4.4993 -4.4993 -4.4522 -4.4522 -0.0292 -0.0292 0.0156 0.0156 0.2243 0.2243 0.3684 0.3684 0.4625 0.4625 0.5170 0.5170 0.5404 0.5404 0.6424 0.6424 0.7242 0.7242 0.7421 0.7421 0.8144 0.8144 0.8235 0.8235 5.9541 5.9541 6.1605 6.1605 6.4513 6.4513 6.8064 6.8064 6.9922 6.9922 7.0527 7.0527 k =-0.0833 0.0286 0.3233 ( 38536 PWs) bands (ev): -43.4454 -43.4454 -17.4750 -17.4750 -17.3539 -17.3539 -17.3341 -17.3341 -11.3387 -11.3387 -11.1952 -11.1952 -11.1742 -11.1742 -11.1693 -11.1693 -6.2658 -6.2658 -6.0688 -6.0688 -6.0145 -6.0145 -4.9875 -4.9875 -4.7362 -4.7362 -4.5878 -4.5878 -4.5368 -4.5368 -4.4987 -4.4987 -4.4515 -4.4515 -0.0304 -0.0304 0.0122 0.0122 0.2249 0.2249 0.3639 0.3639 0.4549 0.4549 0.5155 0.5155 0.5375 0.5375 0.6426 0.6426 0.7232 0.7232 0.7415 0.7415 0.8135 0.8135 0.8240 0.8240 5.9702 5.9702 6.1785 6.1785 6.4603 6.4603 6.8115 6.8115 7.0000 7.0000 7.0497 7.0497 k =-0.1042 0.0357 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4748 -17.4748 -17.3538 -17.3538 -17.3342 -17.3342 -11.3390 -11.3390 -11.1958 -11.1958 -11.1746 -11.1746 -11.1699 -11.1699 -6.2635 -6.2635 -6.0678 -6.0678 -6.0147 -6.0147 -4.9835 -4.9835 -4.7352 -4.7352 -4.5875 -4.5875 -4.5361 -4.5361 -4.4979 -4.4979 -4.4507 -4.4507 -0.0320 -0.0320 0.0079 0.0079 0.2257 0.2257 0.3581 0.3581 0.4455 0.4455 0.5135 0.5135 0.5337 0.5337 0.6428 0.6428 0.7221 0.7221 0.7407 0.7407 0.8125 0.8125 0.8247 0.8247 5.9907 5.9907 6.2010 6.2010 6.4715 6.4715 6.8167 6.8167 7.0096 7.0096 7.0476 7.0476 k =-0.1250 0.0429 0.3233 ( 38526 PWs) bands (ev): -43.4454 -43.4454 -17.4745 -17.4745 -17.3538 -17.3538 -17.3344 -17.3344 -11.3393 -11.3393 -11.1965 -11.1965 -11.1750 -11.1750 -11.1707 -11.1707 -6.2608 -6.2608 -6.0666 -6.0666 -6.0150 -6.0150 -4.9786 -4.9786 -4.7341 -4.7341 -4.5873 -4.5873 -4.5351 -4.5351 -4.4969 -4.4969 -4.4497 -4.4497 -0.0339 -0.0339 0.0028 0.0028 0.2267 0.2267 0.3509 0.3509 0.4345 0.4345 0.5110 0.5110 0.5294 0.5294 0.6430 0.6430 0.7211 0.7211 0.7399 0.7399 0.8114 0.8114 0.8256 0.8256 6.0153 6.0153 6.2276 6.2276 6.4848 6.4848 6.8211 6.8211 7.0208 7.0208 7.0478 7.0478 k =-0.1458 0.0500 0.3233 ( 38512 PWs) bands (ev): -43.4454 -43.4454 -17.4742 -17.4742 -17.3537 -17.3537 -17.3346 -17.3346 -11.3396 -11.3396 -11.1973 -11.1973 -11.1755 -11.1755 -11.1716 -11.1716 -6.2576 -6.2576 -6.0653 -6.0653 -6.0153 -6.0153 -4.9731 -4.9731 -4.7328 -4.7328 -4.5871 -4.5871 -4.5340 -4.5340 -4.4958 -4.4958 -4.4485 -4.4485 -0.0361 -0.0361 -0.0032 -0.0032 0.2278 0.2278 0.3424 0.3424 0.4221 0.4221 0.5078 0.5078 0.5246 0.5246 0.6432 0.6432 0.7203 0.7203 0.7390 0.7390 0.8103 0.8103 0.8267 0.8267 6.0439 6.0439 6.2577 6.2577 6.4998 6.4998 6.8238 6.8238 7.0332 7.0332 7.0517 7.0517 k =-0.1667 0.0572 0.3233 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4739 -17.4739 -17.3536 -17.3536 -17.3349 -17.3349 -11.3400 -11.3400 -11.1982 -11.1982 -11.1760 -11.1760 -11.1726 -11.1726 -6.2541 -6.2541 -6.0639 -6.0639 -6.0157 -6.0157 -4.9669 -4.9669 -4.7314 -4.7314 -4.5869 -4.5869 -4.5326 -4.5326 -4.4946 -4.4946 -4.4473 -4.4473 -0.0388 -0.0388 -0.0097 -0.0097 0.2290 0.2290 0.3327 0.3327 0.4085 0.4085 0.5038 0.5038 0.5198 0.5198 0.6435 0.6435 0.7196 0.7196 0.7381 0.7381 0.8092 0.8092 0.8279 0.8279 6.0760 6.0760 6.2905 6.2905 6.5163 6.5163 6.8244 6.8244 7.0465 7.0465 7.0599 7.0599 k =-0.1875 0.0643 0.3233 ( 38474 PWs) bands (ev): -43.4454 -43.4454 -17.4735 -17.4735 -17.3536 -17.3536 -17.3351 -17.3351 -11.3405 -11.3405 -11.1992 -11.1992 -11.1766 -11.1766 -11.1737 -11.1737 -6.2503 -6.2503 -6.0623 -6.0623 -6.0161 -6.0161 -4.9601 -4.9601 -4.7299 -4.7299 -4.5869 -4.5869 -4.5310 -4.5310 -4.4932 -4.4932 -4.4459 -4.4459 -0.0421 -0.0421 -0.0166 -0.0166 0.2303 0.2303 0.3217 0.3217 0.3942 0.3942 0.4989 0.4989 0.5152 0.5152 0.6438 0.6438 0.7193 0.7193 0.7372 0.7372 0.8081 0.8081 0.8292 0.8292 6.1116 6.1116 6.3252 6.3252 6.5339 6.5339 6.8231 6.8231 7.0607 7.0607 7.0723 7.0723 k =-0.2083 0.0714 0.3233 ( 38464 PWs) bands (ev): -43.4454 -43.4454 -17.4731 -17.4731 -17.3535 -17.3535 -17.3354 -17.3354 -11.3409 -11.3409 -11.2002 -11.2002 -11.1772 -11.1772 -11.1748 -11.1748 -6.2463 -6.2463 -6.0607 -6.0607 -6.0166 -6.0166 -4.9529 -4.9529 -4.7284 -4.7284 -4.5871 -4.5871 -4.5292 -4.5292 -4.4917 -4.4917 -4.4444 -4.4444 -0.0463 -0.0463 -0.0232 -0.0232 0.2316 0.2316 0.3096 0.3096 0.3792 0.3792 0.4930 0.4930 0.5110 0.5110 0.6442 0.6442 0.7192 0.7192 0.7363 0.7363 0.8070 0.8070 0.8307 0.8307 6.1500 6.1500 6.3604 6.3604 6.5524 6.5524 6.8207 6.8207 7.0760 7.0760 7.0880 7.0880 k =-0.2292 0.0786 0.3233 ( 38464 PWs) bands (ev): -43.4454 -43.4454 -17.4727 -17.4727 -17.3534 -17.3534 -17.3357 -17.3357 -11.3414 -11.3414 -11.2013 -11.2013 -11.1778 -11.1778 -11.1760 -11.1760 -6.2421 -6.2421 -6.0590 -6.0590 -6.0171 -6.0171 -4.9453 -4.9453 -4.7269 -4.7269 -4.5874 -4.5874 -4.5271 -4.5271 -4.4900 -4.4900 -4.4429 -4.4429 -0.0519 -0.0519 -0.0292 -0.0292 0.2329 0.2329 0.2965 0.2965 0.3640 0.3640 0.4864 0.4864 0.5073 0.5073 0.6447 0.6447 0.7195 0.7195 0.7356 0.7356 0.8060 0.8060 0.8323 0.8323 6.1910 6.1910 6.3948 6.3948 6.5714 6.5714 6.8187 6.8187 7.0915 7.0915 7.1068 7.1068 k =-0.2500 0.0857 0.3233 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4722 -17.4722 -17.3533 -17.3533 -17.3360 -17.3360 -11.3419 -11.3419 -11.2024 -11.2024 -11.1784 -11.1784 -11.1772 -11.1772 -6.2378 -6.2378 -6.0573 -6.0573 -6.0177 -6.0177 -4.9375 -4.9375 -4.7253 -4.7253 -4.5878 -4.5878 -4.5249 -4.5249 -4.4884 -4.4884 -4.4414 -4.4414 -0.0591 -0.0591 -0.0339 -0.0339 0.2342 0.2342 0.2826 0.2826 0.3489 0.3489 0.4795 0.4795 0.5038 0.5038 0.6454 0.6454 0.7200 0.7200 0.7349 0.7349 0.8050 0.8050 0.8340 0.8340 6.2340 6.2340 6.4266 6.4266 6.5907 6.5907 6.8184 6.8184 7.1057 7.1057 7.1289 7.1289 k =-0.2708 0.0929 0.3233 ( 38466 PWs) bands (ev): -43.4454 -43.4454 -17.4718 -17.4718 -17.3533 -17.3533 -17.3363 -17.3363 -11.3424 -11.3424 -11.2035 -11.2035 -11.1791 -11.1791 -11.1783 -11.1783 -6.2335 -6.2335 -6.0556 -6.0556 -6.0184 -6.0184 -4.9295 -4.9295 -4.7238 -4.7238 -4.5885 -4.5885 -4.5225 -4.5225 -4.4867 -4.4867 -4.4399 -4.4399 -0.0676 -0.0676 -0.0374 -0.0374 0.2355 0.2355 0.2682 0.2682 0.3340 0.3340 0.4725 0.4725 0.5006 0.5006 0.6462 0.6462 0.7207 0.7207 0.7343 0.7343 0.8041 0.8041 0.8358 0.8358 6.2785 6.2785 6.4540 6.4540 6.6101 6.6101 6.8214 6.8214 7.1181 7.1181 7.1542 7.1542 k =-0.2917 0.1000 0.3233 ( 38472 PWs) bands (ev): -43.4454 -43.4454 -17.4714 -17.4714 -17.3532 -17.3532 -17.3366 -17.3366 -11.3429 -11.3429 -11.2046 -11.2046 -11.1798 -11.1798 -11.1793 -11.1793 -6.2292 -6.2292 -6.0540 -6.0540 -6.0190 -6.0190 -4.9216 -4.9216 -4.7224 -4.7224 -4.5893 -4.5893 -4.5200 -4.5200 -4.4850 -4.4850 -4.4383 -4.4383 -0.0770 -0.0770 -0.0401 -0.0401 0.2365 0.2365 0.2535 0.2535 0.3198 0.3198 0.4656 0.4656 0.4977 0.4977 0.6471 0.6471 0.7215 0.7215 0.7339 0.7339 0.8032 0.8032 0.8375 0.8375 6.3237 6.3237 6.4758 6.4758 6.6294 6.6294 6.8282 6.8282 7.1282 7.1282 7.1829 7.1829 k =-0.3125 0.1072 0.3233 ( 38462 PWs) bands (ev): -43.4454 -43.4454 -17.4710 -17.4710 -17.3531 -17.3531 -17.3369 -17.3369 -11.3433 -11.3433 -11.2056 -11.2056 -11.1807 -11.1807 -11.1800 -11.1800 -6.2250 -6.2250 -6.0524 -6.0524 -6.0197 -6.0197 -4.9139 -4.9139 -4.7210 -4.7210 -4.5902 -4.5902 -4.5173 -4.5173 -4.4834 -4.4834 -4.4369 -4.4369 -0.0867 -0.0867 -0.0421 -0.0421 0.2370 0.2370 0.2390 0.2390 0.3066 0.3066 0.4590 0.4590 0.4951 0.4951 0.6481 0.6481 0.7224 0.7224 0.7335 0.7335 0.8024 0.8024 0.8392 0.8392 6.3688 6.3688 6.4912 6.4912 6.6489 6.6489 6.8388 6.8388 7.1354 7.1354 7.2153 7.2153 k =-0.3333 0.1143 0.3233 ( 38488 PWs) bands (ev): -43.4454 -43.4454 -17.4706 -17.4706 -17.3530 -17.3530 -17.3372 -17.3372 -11.3438 -11.3438 -11.2066 -11.2066 -11.1817 -11.1817 -11.1806 -11.1806 -6.2211 -6.2211 -6.0510 -6.0510 -6.0204 -6.0204 -4.9065 -4.9065 -4.7197 -4.7197 -4.5912 -4.5912 -4.5147 -4.5147 -4.4820 -4.4820 -4.4355 -4.4355 -0.0964 -0.0964 -0.0437 -0.0437 0.2243 0.2243 0.2377 0.2377 0.2945 0.2945 0.4529 0.4529 0.4927 0.4927 0.6491 0.6491 0.7233 0.7233 0.7332 0.7332 0.8016 0.8016 0.8409 0.8409 6.4129 6.4129 6.5006 6.5006 6.6685 6.6685 6.8518 6.8518 7.1393 7.1393 7.2521 7.2521 k =-0.3542 0.1215 0.3233 ( 38516 PWs) bands (ev): -43.4454 -43.4454 -17.4702 -17.4702 -17.3530 -17.3530 -17.3374 -17.3374 -11.3442 -11.3442 -11.2076 -11.2076 -11.1827 -11.1827 -11.1811 -11.1811 -6.2173 -6.2173 -6.0496 -6.0496 -6.0211 -6.0211 -4.8995 -4.8995 -4.7186 -4.7186 -4.5923 -4.5923 -4.5120 -4.5120 -4.4808 -4.4808 -4.4341 -4.4341 -0.1058 -0.1058 -0.0449 -0.0449 0.2106 0.2106 0.2375 0.2375 0.2841 0.2841 0.4474 0.4474 0.4905 0.4905 0.6501 0.6501 0.7241 0.7241 0.7331 0.7331 0.8009 0.8009 0.8425 0.8425 6.4545 6.4545 6.5052 6.5052 6.6889 6.6889 6.8656 6.8656 7.1394 7.1394 7.2937 7.2937 k =-0.3750 0.1286 0.3233 ( 38522 PWs) bands (ev): -43.4454 -43.4454 -17.4699 -17.4699 -17.3529 -17.3529 -17.3377 -17.3377 -11.3446 -11.3446 -11.2084 -11.2084 -11.1835 -11.1835 -11.1816 -11.1816 -6.2139 -6.2139 -6.0485 -6.0485 -6.0217 -6.0217 -4.8931 -4.8931 -4.7176 -4.7176 -4.5933 -4.5933 -4.5094 -4.5094 -4.4798 -4.4798 -4.4329 -4.4329 -0.1145 -0.1145 -0.0457 -0.0457 0.1979 0.1979 0.2365 0.2365 0.2756 0.2756 0.4424 0.4424 0.4887 0.4887 0.6511 0.6511 0.7249 0.7249 0.7331 0.7331 0.8003 0.8003 0.8439 0.8439 6.4919 6.4919 6.5068 6.5068 6.7105 6.7105 6.8786 6.8786 7.1355 7.1355 7.3397 7.3397 k =-0.3958 0.1357 0.3233 ( 38506 PWs) bands (ev): -43.4454 -43.4454 -17.4696 -17.4696 -17.3528 -17.3528 -17.3379 -17.3379 -11.3449 -11.3449 -11.2091 -11.2091 -11.1843 -11.1843 -11.1819 -11.1819 -6.2109 -6.2109 -6.0474 -6.0474 -6.0223 -6.0223 -4.8874 -4.8874 -4.7167 -4.7167 -4.5943 -4.5943 -4.5069 -4.5069 -4.4790 -4.4790 -4.4318 -4.4318 -0.1222 -0.1222 -0.0462 -0.0462 0.1865 0.1865 0.2346 0.2346 0.2692 0.2692 0.4381 0.4381 0.4871 0.4871 0.6520 0.6520 0.7255 0.7255 0.7332 0.7332 0.7998 0.7998 0.8452 0.8452 6.5045 6.5045 6.5260 6.5260 6.7336 6.7336 6.8899 6.8899 7.1277 7.1277 7.3890 7.3890 k =-0.4167 0.1429 0.3233 ( 38498 PWs) bands (ev): -43.4454 -43.4454 -17.4693 -17.4693 -17.3528 -17.3528 -17.3380 -17.3380 -11.3452 -11.3452 -11.2098 -11.2098 -11.1849 -11.1849 -11.1823 -11.1823 -6.2084 -6.2084 -6.0466 -6.0466 -6.0227 -6.0227 -4.8826 -4.8826 -4.7160 -4.7160 -4.5952 -4.5952 -4.5047 -4.5047 -4.4785 -4.4785 -4.4309 -4.4309 -0.1289 -0.1289 -0.0465 -0.0465 0.1766 0.1766 0.2319 0.2319 0.2651 0.2651 0.4346 0.4346 0.4858 0.4858 0.6528 0.6528 0.7260 0.7260 0.7333 0.7333 0.7994 0.7994 0.8463 0.8463 6.5026 6.5026 6.5523 6.5523 6.7581 6.7581 6.8989 6.8989 7.1165 7.1165 7.4394 7.4394 k =-0.4375 0.1500 0.3233 ( 38486 PWs) bands (ev): -43.4454 -43.4454 -17.4691 -17.4691 -17.3528 -17.3528 -17.3382 -17.3382 -11.3454 -11.3454 -11.2103 -11.2103 -11.1854 -11.1854 -11.1825 -11.1825 -6.2063 -6.2063 -6.0459 -6.0459 -6.0232 -6.0232 -4.8787 -4.8787 -4.7154 -4.7154 -4.5959 -4.5959 -4.5028 -4.5028 -4.4782 -4.4782 -4.4301 -4.4301 -0.1343 -0.1343 -0.0466 -0.0466 0.1687 0.1687 0.2289 0.2289 0.2625 0.2625 0.4318 0.4318 0.4848 0.4848 0.6534 0.6534 0.7263 0.7263 0.7335 0.7335 0.7990 0.7990 0.8471 0.8471 6.5003 6.5003 6.5722 6.5722 6.7826 6.7826 6.9057 6.9057 7.1032 7.1032 7.4873 7.4873 k =-0.4583 0.1572 0.3233 ( 38504 PWs) bands (ev): -43.4454 -43.4454 -17.4690 -17.4690 -17.3527 -17.3527 -17.3383 -17.3383 -11.3456 -11.3456 -11.2106 -11.2106 -11.1858 -11.1858 -11.1827 -11.1827 -6.2048 -6.2048 -6.0454 -6.0454 -6.0234 -6.0234 -4.8759 -4.8759 -4.7150 -4.7150 -4.5965 -4.5965 -4.5013 -4.5013 -4.4781 -4.4781 -4.4295 -4.4295 -0.1383 -0.1383 -0.0467 -0.0467 0.1628 0.1628 0.2264 0.2264 0.2612 0.2612 0.4298 0.4298 0.4841 0.4841 0.6539 0.6539 0.7265 0.7265 0.7337 0.7337 0.7988 0.7988 0.8478 0.8478 6.4983 6.4983 6.5859 6.5859 6.8045 6.8045 6.9103 6.9103 7.0900 7.0900 7.5278 7.5278 k =-0.4792 0.1643 0.3233 ( 38520 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3527 -17.3527 -17.3383 -17.3383 -11.3457 -11.3457 -11.2108 -11.2108 -11.1860 -11.1860 -11.1828 -11.1828 -6.2039 -6.2039 -6.0451 -6.0451 -6.0236 -6.0236 -4.8741 -4.8741 -4.7147 -4.7147 -4.5968 -4.5968 -4.5004 -4.5004 -4.4781 -4.4781 -4.4292 -4.4292 -0.1407 -0.1407 -0.0467 -0.0467 0.1592 0.1592 0.2247 0.2247 0.2605 0.2605 0.4286 0.4286 0.4836 0.4836 0.6542 0.6542 0.7267 0.7267 0.7338 0.7338 0.7986 0.7986 0.8482 0.8482 6.4970 6.4970 6.5937 6.5937 6.8202 6.8202 6.9130 6.9130 7.0799 7.0799 7.5550 7.5550 k =-0.5000 0.1715 0.3233 ( 38524 PWs) bands (ev): -43.4454 -43.4454 -17.4689 -17.4689 -17.3527 -17.3527 -17.3384 -17.3384 -11.3457 -11.3457 -11.2109 -11.2109 -11.1861 -11.1861 -11.1829 -11.1829 -6.2036 -6.2036 -6.0450 -6.0450 -6.0237 -6.0237 -4.8736 -4.8736 -4.7147 -4.7147 -4.5969 -4.5969 -4.5001 -4.5001 -4.4781 -4.4781 -4.4291 -4.4291 -0.1415 -0.1415 -0.0467 -0.0467 0.1580 0.1580 0.2241 0.2241 0.2603 0.2603 0.4282 0.4282 0.4835 0.4835 0.6543 0.6543 0.7267 0.7267 0.7338 0.7338 0.7985 0.7985 0.8483 0.8483 6.4965 6.4965 6.5963 6.5963 6.8260 6.8260 6.9139 6.9139 7.0760 7.0760 7.5646 7.5646 Writing output data file Cs3LiCl4.save init_run : 1.60s CPU 1.95s WALL ( 1 calls) electrons : 4092.68s CPU 4140.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.08s CPU 0.16s WALL ( 1 calls) Called by electrons: c_bands : 4092.67s CPU 4140.90s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.04s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.04s WALL ( 1 calls) newd : 0.81s CPU 0.82s WALL ( 1 calls) Called by c_bands: init_us_2 : 1.18s CPU 1.35s WALL ( 286 calls) cegterg : 3910.48s CPU 3955.57s WALL ( 1013 calls) Called by sum_band: Called by *egterg: h_psi : 2762.96s CPU 2777.06s WALL ( 18289 calls) s_psi : 230.71s CPU 230.81s WALL ( 18289 calls) g_psi : 5.89s CPU 5.80s WALL ( 16990 calls) cdiaghg : 337.01s CPU 342.74s WALL ( 17276 calls) cegterg:over : 247.49s CPU 248.30s WALL ( 16990 calls) cegterg:upda : 237.69s CPU 238.71s WALL ( 16990 calls) cegterg:last : 153.25s CPU 153.75s WALL ( 2351 calls) cdiaghg:chol : 17.04s CPU 16.87s WALL ( 17276 calls) cdiaghg:inve : 13.82s CPU 14.29s WALL ( 17276 calls) cdiaghg:para : 29.49s CPU 29.94s WALL ( 34552 calls) Called by h_psi: h_psi:vloc : 2234.01s CPU 2244.90s WALL ( 18289 calls) h_psi:vnl : 515.37s CPU 518.63s WALL ( 18289 calls) add_vuspsi : 254.49s CPU 255.73s WALL ( 18289 calls) General routines calbec : 260.70s CPU 262.73s WALL ( 18289 calls) fft : 0.07s CPU 0.08s WALL ( 15 calls) fftw : 2030.55s CPU 2039.62s WALL ( 1944028 calls) davcio : 0.35s CPU 4.19s WALL ( 572 calls) Parallel routines fft_scatter : 671.42s CPU 673.85s WALL ( 1944043 calls) PWSCF : 1h11m CPU 1h13m WALL This run was terminated on: 13:11:13 26Oct2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=