Program PWSCF v.5.1.1 starts on 21Jul2015 at 6: 6:38 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./ZrAl.save/ file Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 29 20 6 821 462 76 Max 30 21 8 826 474 80 Sum 1405 965 291 39479 22523 3737 bravais-lattice index = 14 lattice parameter (alat) = 10.8323 a.u. unit-cell volume = 532.8571 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 30.00 number of Kohn-Sham states= 38 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 268.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.832314 celldm(2)= 1.000000 celldm(3)= 0.748053 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.828208 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.828208 0.560421 0.000000 ) a(3) = ( 0.000000 0.000000 0.748053 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.477831 -0.000000 ) b(2) = ( 0.000000 1.784372 -0.000000 ) b(3) = ( 0.000000 0.000000 1.336804 ) PseudoPot. # 1 for Zr read from file: /home/autes/Pseudo/Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8b6e13b1b49db219b5566974d4b37ab4 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 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 Al read from file: /home/autes/Pseudo/Al.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: d18dd1d035d87b93e5ebab176be81bd5 Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 12.00 91.22400 Zr( 1.00) Al 3.00 26.98150 Al( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion 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_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 438 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 2) = ( 0.0052595 0.0171574 -0.0000000), wk = 0.0022831 k( 3) = ( 0.0105189 0.0343148 -0.0000000), wk = 0.0022831 k( 4) = ( 0.0157784 0.0514723 -0.0000000), wk = 0.0022831 k( 5) = ( 0.0210378 0.0686297 -0.0000000), wk = 0.0022831 k( 6) = ( 0.0262973 0.0857871 -0.0000000), wk = 0.0022831 k( 7) = ( 0.0315568 0.1029445 -0.0000000), wk = 0.0022831 k( 8) = ( 0.0368162 0.1201020 -0.0000000), wk = 0.0022831 k( 9) = ( 0.0420757 0.1372594 -0.0000000), wk = 0.0022831 k( 10) = ( 0.0473351 0.1544168 -0.0000000), wk = 0.0022831 k( 11) = ( 0.0525946 0.1715742 -0.0000000), wk = 0.0022831 k( 12) = ( 0.0578541 0.1887317 -0.0000000), wk = 0.0022831 k( 13) = ( 0.0631135 0.2058891 -0.0000000), wk = 0.0022831 k( 14) = ( 0.0683730 0.2230465 -0.0000000), wk = 0.0022831 k( 15) = ( 0.0736324 0.2402039 -0.0000000), wk = 0.0022831 k( 16) = ( 0.0788919 0.2573613 -0.0000000), wk = 0.0022831 k( 17) = ( 0.0841513 0.2745187 -0.0000000), wk = 0.0022831 k( 18) = ( 0.0894108 0.2916762 -0.0000000), wk = 0.0022831 k( 19) = ( 0.0946703 0.3088336 -0.0000000), wk = 0.0022831 k( 20) = ( 0.0999297 0.3259910 -0.0000000), wk = 0.0022831 k( 21) = ( 0.1051892 0.3431484 -0.0000000), wk = 0.0022831 k( 22) = ( 0.1104486 0.3603058 -0.0000000), wk = 0.0022831 k( 23) = ( 0.1157081 0.3774633 -0.0000000), wk = 0.0022831 k( 24) = ( 0.1209676 0.3946207 -0.0000000), wk = 0.0022831 k( 25) = ( 0.1262270 0.4117781 -0.0000000), wk = 0.0022831 k( 26) = ( 0.1314865 0.4289355 -0.0000000), wk = 0.0022831 k( 27) = ( 0.1367460 0.4460930 -0.0000000), wk = 0.0022831 k( 28) = ( 0.1420054 0.4632504 -0.0000000), wk = 0.0022831 k( 29) = ( 0.1472649 0.4804078 -0.0000000), wk = 0.0022831 k( 30) = ( 0.1525243 0.4975652 -0.0000000), wk = 0.0022831 k( 31) = ( 0.1577838 0.5147227 -0.0000000), wk = 0.0022831 k( 32) = ( 0.1630433 0.5318801 -0.0000000), wk = 0.0022831 k( 33) = ( 0.1683027 0.5490375 -0.0000000), wk = 0.0022831 k( 34) = ( 0.1735622 0.5661949 -0.0000000), wk = 0.0022831 k( 35) = ( 0.1788216 0.5833523 -0.0000000), wk = 0.0022831 k( 36) = ( 0.1840811 0.6005098 -0.0000000), wk = 0.0022831 k( 37) = ( 0.1893405 0.6176672 -0.0000000), wk = 0.0022831 k( 38) = ( 0.1946000 0.6348246 -0.0000000), wk = 0.0022831 k( 39) = ( 0.1998595 0.6519820 -0.0000000), wk = 0.0022831 k( 40) = ( 0.2051189 0.6691395 -0.0000000), wk = 0.0022831 k( 41) = ( 0.2103784 0.6862969 -0.0000000), wk = 0.0022831 k( 42) = ( 0.2156378 0.7034543 -0.0000000), wk = 0.0022831 k( 43) = ( 0.2208973 0.7206117 -0.0000000), wk = 0.0022831 k( 44) = ( 0.2261568 0.7377692 -0.0000000), wk = 0.0022831 k( 45) = ( 0.2314162 0.7549266 -0.0000000), wk = 0.0022831 k( 46) = ( 0.2366757 0.7720840 -0.0000000), wk = 0.0022831 k( 47) = ( 0.2419351 0.7892414 -0.0000000), wk = 0.0022831 k( 48) = ( 0.2471946 0.8063988 -0.0000000), wk = 0.0022831 k( 49) = ( 0.2524541 0.8235562 -0.0000000), wk = 0.0022831 k( 50) = ( 0.2577135 0.8407137 -0.0000000), wk = 0.0022831 k( 51) = ( 0.2629730 0.8578711 -0.0000000), wk = 0.0022831 k( 52) = ( 0.2682324 0.8750285 -0.0000000), wk = 0.0022831 k( 53) = ( 0.2734919 0.8921859 -0.0000000), wk = 0.0022831 k( 54) = ( 0.2734919 0.8921859 -0.0000000), wk = 0.0022831 k( 55) = ( 0.2552591 0.8921859 -0.0000000), wk = 0.0022831 k( 56) = ( 0.2370263 0.8921859 -0.0000000), wk = 0.0022831 k( 57) = ( 0.2187935 0.8921859 -0.0000000), wk = 0.0022831 k( 58) = ( 0.2005607 0.8921859 -0.0000000), wk = 0.0022831 k( 59) = ( 0.1823279 0.8921859 -0.0000000), wk = 0.0022831 k( 60) = ( 0.1640951 0.8921859 -0.0000000), wk = 0.0022831 k( 61) = ( 0.1458624 0.8921859 -0.0000000), wk = 0.0022831 k( 62) = ( 0.1276296 0.8921859 -0.0000000), wk = 0.0022831 k( 63) = ( 0.1093968 0.8921859 -0.0000000), wk = 0.0022831 k( 64) = ( 0.0911640 0.8921859 -0.0000000), wk = 0.0022831 k( 65) = ( 0.0729312 0.8921859 -0.0000000), wk = 0.0022831 k( 66) = ( 0.0546984 0.8921859 -0.0000000), wk = 0.0022831 k( 67) = ( 0.0364656 0.8921859 -0.0000000), wk = 0.0022831 k( 68) = ( 0.0182328 0.8921859 -0.0000000), wk = 0.0022831 k( 69) = ( 0.0000000 0.8921859 -0.0000000), wk = 0.0022831 k( 70) = ( 0.0000000 0.8921859 -0.0000000), wk = 0.0022831 k( 71) = ( 0.0000000 0.8921859 0.0180649), wk = 0.0022831 k( 72) = ( 0.0000000 0.8921859 0.0361298), wk = 0.0022831 k( 73) = ( 0.0000000 0.8921859 0.0541947), wk = 0.0022831 k( 74) = ( 0.0000000 0.8921859 0.0722597), wk = 0.0022831 k( 75) = ( 0.0000000 0.8921859 0.0903246), wk = 0.0022831 k( 76) = ( 0.0000000 0.8921859 0.1083895), wk = 0.0022831 k( 77) = ( 0.0000000 0.8921859 0.1264544), wk = 0.0022831 k( 78) = ( 0.0000000 0.8921859 0.1445193), wk = 0.0022831 k( 79) = ( 0.0000000 0.8921859 0.1625842), wk = 0.0022831 k( 80) = ( 0.0000000 0.8921859 0.1806492), wk = 0.0022831 k( 81) = ( 0.0000000 0.8921859 0.1987141), wk = 0.0022831 k( 82) = ( 0.0000000 0.8921859 0.2167790), wk = 0.0022831 k( 83) = ( 0.0000000 0.8921859 0.2348439), wk = 0.0022831 k( 84) = ( 0.0000000 0.8921859 0.2529088), wk = 0.0022831 k( 85) = ( 0.0000000 0.8921859 0.2709737), wk = 0.0022831 k( 86) = ( 0.0000000 0.8921859 0.2890386), wk = 0.0022831 k( 87) = ( 0.0000000 0.8921859 0.3071036), wk = 0.0022831 k( 88) = ( 0.0000000 0.8921859 0.3251685), wk = 0.0022831 k( 89) = ( 0.0000000 0.8921859 0.3432334), wk = 0.0022831 k( 90) = ( 0.0000000 0.8921859 0.3612983), wk = 0.0022831 k( 91) = ( 0.0000000 0.8921859 0.3793632), wk = 0.0022831 k( 92) = ( 0.0000000 0.8921859 0.3974281), wk = 0.0022831 k( 93) = ( 0.0000000 0.8921859 0.4154930), wk = 0.0022831 k( 94) = ( 0.0000000 0.8921859 0.4335580), wk = 0.0022831 k( 95) = ( 0.0000000 0.8921859 0.4516229), wk = 0.0022831 k( 96) = ( 0.0000000 0.8921859 0.4696878), wk = 0.0022831 k( 97) = ( 0.0000000 0.8921859 0.4877527), wk = 0.0022831 k( 98) = ( 0.0000000 0.8921859 0.5058176), wk = 0.0022831 k( 99) = ( 0.0000000 0.8921859 0.5238825), wk = 0.0022831 k( 100) = ( 0.0000000 0.8921859 0.5419475), wk = 0.0022831 k( 101) = ( 0.0000000 0.8921859 0.5600124), wk = 0.0022831 k( 102) = ( 0.0000000 0.8921859 0.5780773), wk = 0.0022831 k( 103) = ( 0.0000000 0.8921859 0.5961422), wk = 0.0022831 k( 104) = ( 0.0000000 0.8921859 0.6142071), wk = 0.0022831 k( 105) = ( 0.0000000 0.8921859 0.6322720), wk = 0.0022831 k( 106) = ( 0.0000000 0.8921859 0.6503369), wk = 0.0022831 k( 107) = ( 0.0000000 0.8921859 0.6684018), wk = 0.0022831 k( 108) = ( 0.0000000 0.8921859 0.6684018), wk = 0.0022831 k( 109) = ( 0.0182328 0.8921859 0.6684018), wk = 0.0022831 k( 110) = ( 0.0364656 0.8921859 0.6684018), wk = 0.0022831 k( 111) = ( 0.0546984 0.8921859 0.6684018), wk = 0.0022831 k( 112) = ( 0.0729312 0.8921859 0.6684018), wk = 0.0022831 k( 113) = ( 0.0911640 0.8921859 0.6684018), wk = 0.0022831 k( 114) = ( 0.1093968 0.8921859 0.6684018), wk = 0.0022831 k( 115) = ( 0.1276296 0.8921859 0.6684018), wk = 0.0022831 k( 116) = ( 0.1458624 0.8921859 0.6684018), wk = 0.0022831 k( 117) = ( 0.1640951 0.8921859 0.6684018), wk = 0.0022831 k( 118) = ( 0.1823279 0.8921859 0.6684018), wk = 0.0022831 k( 119) = ( 0.2005607 0.8921859 0.6684018), wk = 0.0022831 k( 120) = ( 0.2187935 0.8921859 0.6684018), wk = 0.0022831 k( 121) = ( 0.2370263 0.8921859 0.6684018), wk = 0.0022831 k( 122) = ( 0.2552591 0.8921859 0.6684018), wk = 0.0022831 k( 123) = ( 0.2734919 0.8921859 0.6684018), wk = 0.0022831 k( 124) = ( 0.2734919 0.8921859 0.6684018), wk = 0.0022831 k( 125) = ( 0.2682324 0.8750285 0.6684018), wk = 0.0022831 k( 126) = ( 0.2629730 0.8578711 0.6684018), wk = 0.0022831 k( 127) = ( 0.2577135 0.8407137 0.6684018), wk = 0.0022831 k( 128) = ( 0.2524541 0.8235562 0.6684018), wk = 0.0022831 k( 129) = ( 0.2471946 0.8063988 0.6684018), wk = 0.0022831 k( 130) = ( 0.2419351 0.7892414 0.6684018), wk = 0.0022831 k( 131) = ( 0.2366757 0.7720840 0.6684018), wk = 0.0022831 k( 132) = ( 0.2314162 0.7549266 0.6684018), wk = 0.0022831 k( 133) = ( 0.2261568 0.7377692 0.6684018), wk = 0.0022831 k( 134) = ( 0.2208973 0.7206117 0.6684018), wk = 0.0022831 k( 135) = ( 0.2156378 0.7034543 0.6684018), wk = 0.0022831 k( 136) = ( 0.2103784 0.6862969 0.6684018), wk = 0.0022831 k( 137) = ( 0.2051189 0.6691395 0.6684018), wk = 0.0022831 k( 138) = ( 0.1998595 0.6519820 0.6684018), wk = 0.0022831 k( 139) = ( 0.1946000 0.6348246 0.6684018), wk = 0.0022831 k( 140) = ( 0.1893405 0.6176672 0.6684018), wk = 0.0022831 k( 141) = ( 0.1840811 0.6005098 0.6684018), wk = 0.0022831 k( 142) = ( 0.1788216 0.5833523 0.6684018), wk = 0.0022831 k( 143) = ( 0.1735622 0.5661949 0.6684018), wk = 0.0022831 k( 144) = ( 0.1683027 0.5490375 0.6684018), wk = 0.0022831 k( 145) = ( 0.1630433 0.5318801 0.6684018), wk = 0.0022831 k( 146) = ( 0.1577838 0.5147227 0.6684018), wk = 0.0022831 k( 147) = ( 0.1525243 0.4975652 0.6684018), wk = 0.0022831 k( 148) = ( 0.1472649 0.4804078 0.6684018), wk = 0.0022831 k( 149) = ( 0.1420054 0.4632504 0.6684018), wk = 0.0022831 k( 150) = ( 0.1367460 0.4460930 0.6684018), wk = 0.0022831 k( 151) = ( 0.1314865 0.4289355 0.6684018), wk = 0.0022831 k( 152) = ( 0.1262270 0.4117781 0.6684018), wk = 0.0022831 k( 153) = ( 0.1209676 0.3946207 0.6684018), wk = 0.0022831 k( 154) = ( 0.1157081 0.3774633 0.6684018), wk = 0.0022831 k( 155) = ( 0.1104486 0.3603058 0.6684018), wk = 0.0022831 k( 156) = ( 0.1051892 0.3431484 0.6684018), wk = 0.0022831 k( 157) = ( 0.0999297 0.3259910 0.6684018), wk = 0.0022831 k( 158) = ( 0.0946703 0.3088336 0.6684018), wk = 0.0022831 k( 159) = ( 0.0894108 0.2916762 0.6684018), wk = 0.0022831 k( 160) = ( 0.0841513 0.2745187 0.6684018), wk = 0.0022831 k( 161) = ( 0.0788919 0.2573613 0.6684018), wk = 0.0022831 k( 162) = ( 0.0736324 0.2402039 0.6684018), wk = 0.0022831 k( 163) = ( 0.0683730 0.2230465 0.6684018), wk = 0.0022831 k( 164) = ( 0.0631135 0.2058891 0.6684018), wk = 0.0022831 k( 165) = ( 0.0578541 0.1887317 0.6684018), wk = 0.0022831 k( 166) = ( 0.0525946 0.1715742 0.6684018), wk = 0.0022831 k( 167) = ( 0.0473351 0.1544168 0.6684018), wk = 0.0022831 k( 168) = ( 0.0420757 0.1372594 0.6684018), wk = 0.0022831 k( 169) = ( 0.0368162 0.1201020 0.6684018), wk = 0.0022831 k( 170) = ( 0.0315568 0.1029445 0.6684018), wk = 0.0022831 k( 171) = ( 0.0262973 0.0857871 0.6684018), wk = 0.0022831 k( 172) = ( 0.0210378 0.0686297 0.6684018), wk = 0.0022831 k( 173) = ( 0.0157784 0.0514723 0.6684018), wk = 0.0022831 k( 174) = ( 0.0105189 0.0343148 0.6684018), wk = 0.0022831 k( 175) = ( 0.0052595 0.0171574 0.6684018), wk = 0.0022831 k( 176) = ( 0.0000000 0.0000000 0.6684018), wk = 0.0022831 k( 177) = ( 0.0000000 0.0000000 0.6684018), wk = 0.0022831 k( 178) = ( 0.0000000 0.0000000 0.6503369), wk = 0.0022831 k( 179) = ( 0.0000000 0.0000000 0.6322720), wk = 0.0022831 k( 180) = ( 0.0000000 0.0000000 0.6142071), wk = 0.0022831 k( 181) = ( 0.0000000 0.0000000 0.5961422), wk = 0.0022831 k( 182) = ( 0.0000000 0.0000000 0.5780773), wk = 0.0022831 k( 183) = ( 0.0000000 0.0000000 0.5600124), wk = 0.0022831 k( 184) = ( 0.0000000 0.0000000 0.5419475), wk = 0.0022831 k( 185) = ( 0.0000000 0.0000000 0.5238825), wk = 0.0022831 k( 186) = ( 0.0000000 0.0000000 0.5058176), wk = 0.0022831 k( 187) = ( 0.0000000 0.0000000 0.4877527), wk = 0.0022831 k( 188) = ( 0.0000000 0.0000000 0.4696878), wk = 0.0022831 k( 189) = ( 0.0000000 0.0000000 0.4516229), wk = 0.0022831 k( 190) = ( 0.0000000 0.0000000 0.4335580), wk = 0.0022831 k( 191) = ( 0.0000000 0.0000000 0.4154930), wk = 0.0022831 k( 192) = ( 0.0000000 0.0000000 0.3974281), wk = 0.0022831 k( 193) = ( 0.0000000 0.0000000 0.3793632), wk = 0.0022831 k( 194) = ( 0.0000000 0.0000000 0.3612983), wk = 0.0022831 k( 195) = ( 0.0000000 0.0000000 0.3432334), wk = 0.0022831 k( 196) = ( 0.0000000 0.0000000 0.3251685), wk = 0.0022831 k( 197) = ( 0.0000000 0.0000000 0.3071036), wk = 0.0022831 k( 198) = ( 0.0000000 0.0000000 0.2890386), wk = 0.0022831 k( 199) = ( 0.0000000 0.0000000 0.2709737), wk = 0.0022831 k( 200) = ( 0.0000000 0.0000000 0.2529088), wk = 0.0022831 k( 201) = ( 0.0000000 0.0000000 0.2348439), wk = 0.0022831 k( 202) = ( 0.0000000 0.0000000 0.2167790), wk = 0.0022831 k( 203) = ( 0.0000000 0.0000000 0.1987141), wk = 0.0022831 k( 204) = ( 0.0000000 0.0000000 0.1806492), wk = 0.0022831 k( 205) = ( 0.0000000 0.0000000 0.1625842), wk = 0.0022831 k( 206) = ( 0.0000000 0.0000000 0.1445193), wk = 0.0022831 k( 207) = ( 0.0000000 0.0000000 0.1264544), wk = 0.0022831 k( 208) = ( 0.0000000 0.0000000 0.1083895), wk = 0.0022831 k( 209) = ( 0.0000000 0.0000000 0.0903246), wk = 0.0022831 k( 210) = ( 0.0000000 0.0000000 0.0722597), wk = 0.0022831 k( 211) = ( 0.0000000 0.0000000 0.0541947), wk = 0.0022831 k( 212) = ( 0.0000000 0.0000000 0.0361298), wk = 0.0022831 k( 213) = ( 0.0000000 0.0000000 0.0180649), wk = 0.0022831 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 216) = ( -0.0172414 0.0052852 -0.0000000), wk = 0.0022831 k( 217) = ( -0.0344828 0.0105704 -0.0000000), wk = 0.0022831 k( 218) = ( -0.0517241 0.0158556 -0.0000000), wk = 0.0022831 k( 219) = ( -0.0689655 0.0211408 -0.0000000), wk = 0.0022831 k( 220) = ( -0.0862069 0.0264260 -0.0000000), wk = 0.0022831 k( 221) = ( -0.1034483 0.0317112 -0.0000000), wk = 0.0022831 k( 222) = ( -0.1206897 0.0369964 -0.0000000), wk = 0.0022831 k( 223) = ( -0.1379310 0.0422816 -0.0000000), wk = 0.0022831 k( 224) = ( -0.1551724 0.0475668 -0.0000000), wk = 0.0022831 k( 225) = ( -0.1724138 0.0528520 -0.0000000), wk = 0.0022831 k( 226) = ( -0.1896552 0.0581372 -0.0000000), wk = 0.0022831 k( 227) = ( -0.2068966 0.0634224 -0.0000000), wk = 0.0022831 k( 228) = ( -0.2241379 0.0687075 -0.0000000), wk = 0.0022831 k( 229) = ( -0.2413793 0.0739927 -0.0000000), wk = 0.0022831 k( 230) = ( -0.2586207 0.0792779 -0.0000000), wk = 0.0022831 k( 231) = ( -0.2758621 0.0845631 -0.0000000), wk = 0.0022831 k( 232) = ( -0.2931034 0.0898483 -0.0000000), wk = 0.0022831 k( 233) = ( -0.3103448 0.0951335 -0.0000000), wk = 0.0022831 k( 234) = ( -0.3275862 0.1004187 -0.0000000), wk = 0.0022831 k( 235) = ( -0.3448276 0.1057039 -0.0000000), wk = 0.0022831 k( 236) = ( -0.3620690 0.1109891 -0.0000000), wk = 0.0022831 k( 237) = ( -0.3793103 0.1162743 -0.0000000), wk = 0.0022831 k( 238) = ( -0.3965517 0.1215595 -0.0000000), wk = 0.0022831 k( 239) = ( -0.4137931 0.1268447 -0.0000000), wk = 0.0022831 k( 240) = ( -0.4310345 0.1321299 -0.0000000), wk = 0.0022831 k( 241) = ( -0.4482759 0.1374151 -0.0000000), wk = 0.0022831 k( 242) = ( -0.4655172 0.1427003 -0.0000000), wk = 0.0022831 k( 243) = ( -0.4827586 0.1479855 -0.0000000), wk = 0.0022831 k( 244) = ( -0.5000000 0.1532707 -0.0000000), wk = 0.0022831 k( 245) = ( -0.5000000 0.1532707 -0.0000000), wk = 0.0022831 k( 246) = ( -0.4947324 0.1704548 -0.0000000), wk = 0.0022831 k( 247) = ( -0.4894647 0.1876388 -0.0000000), wk = 0.0022831 k( 248) = ( -0.4841971 0.2048229 -0.0000000), wk = 0.0022831 k( 249) = ( -0.4789295 0.2220070 -0.0000000), wk = 0.0022831 k( 250) = ( -0.4736618 0.2391911 -0.0000000), wk = 0.0022831 k( 251) = ( -0.4683942 0.2563751 -0.0000000), wk = 0.0022831 k( 252) = ( -0.4631266 0.2735592 -0.0000000), wk = 0.0022831 k( 253) = ( -0.4578590 0.2907433 -0.0000000), wk = 0.0022831 k( 254) = ( -0.4525913 0.3079274 -0.0000000), wk = 0.0022831 k( 255) = ( -0.4473237 0.3251114 -0.0000000), wk = 0.0022831 k( 256) = ( -0.4420561 0.3422955 -0.0000000), wk = 0.0022831 k( 257) = ( -0.4367884 0.3594796 -0.0000000), wk = 0.0022831 k( 258) = ( -0.4315208 0.3766637 -0.0000000), wk = 0.0022831 k( 259) = ( -0.4262532 0.3938477 -0.0000000), wk = 0.0022831 k( 260) = ( -0.4209855 0.4110318 -0.0000000), wk = 0.0022831 k( 261) = ( -0.4157179 0.4282159 -0.0000000), wk = 0.0022831 k( 262) = ( -0.4104503 0.4454000 -0.0000000), wk = 0.0022831 k( 263) = ( -0.4051827 0.4625840 -0.0000000), wk = 0.0022831 k( 264) = ( -0.3999150 0.4797681 -0.0000000), wk = 0.0022831 k( 265) = ( -0.3946474 0.4969522 -0.0000000), wk = 0.0022831 k( 266) = ( -0.3893798 0.5141363 -0.0000000), wk = 0.0022831 k( 267) = ( -0.3841121 0.5313203 -0.0000000), wk = 0.0022831 k( 268) = ( -0.3788445 0.5485044 -0.0000000), wk = 0.0022831 k( 269) = ( -0.3735769 0.5656885 -0.0000000), wk = 0.0022831 k( 270) = ( -0.3683092 0.5828726 -0.0000000), wk = 0.0022831 k( 271) = ( -0.3630416 0.6000566 -0.0000000), wk = 0.0022831 k( 272) = ( -0.3577740 0.6172407 -0.0000000), wk = 0.0022831 k( 273) = ( -0.3525064 0.6344248 -0.0000000), wk = 0.0022831 k( 274) = ( -0.3472387 0.6516089 -0.0000000), wk = 0.0022831 k( 275) = ( -0.3419711 0.6687929 -0.0000000), wk = 0.0022831 k( 276) = ( -0.3367035 0.6859770 -0.0000000), wk = 0.0022831 k( 277) = ( -0.3314358 0.7031611 -0.0000000), wk = 0.0022831 k( 278) = ( -0.3261682 0.7203452 -0.0000000), wk = 0.0022831 k( 279) = ( -0.3209006 0.7375293 -0.0000000), wk = 0.0022831 k( 280) = ( -0.3156329 0.7547133 -0.0000000), wk = 0.0022831 k( 281) = ( -0.3103653 0.7718974 -0.0000000), wk = 0.0022831 k( 282) = ( -0.3050977 0.7890815 -0.0000000), wk = 0.0022831 k( 283) = ( -0.2998301 0.8062656 -0.0000000), wk = 0.0022831 k( 284) = ( -0.2945624 0.8234496 -0.0000000), wk = 0.0022831 k( 285) = ( -0.2892948 0.8406337 -0.0000000), wk = 0.0022831 k( 286) = ( -0.2840272 0.8578178 -0.0000000), wk = 0.0022831 k( 287) = ( -0.2787595 0.8750019 -0.0000000), wk = 0.0022831 k( 288) = ( -0.2734919 0.8921860 -0.0000000), wk = 0.0022831 k( 289) = ( -0.2734919 0.8921860 -0.0000000), wk = 0.0022831 k( 290) = ( -0.2734919 0.8921860 0.0180649), wk = 0.0022831 k( 291) = ( -0.2734919 0.8921860 0.0361298), wk = 0.0022831 k( 292) = ( -0.2734919 0.8921860 0.0541947), wk = 0.0022831 k( 293) = ( -0.2734919 0.8921860 0.0722597), wk = 0.0022831 k( 294) = ( -0.2734919 0.8921860 0.0903246), wk = 0.0022831 k( 295) = ( -0.2734919 0.8921860 0.1083895), wk = 0.0022831 k( 296) = ( -0.2734919 0.8921860 0.1264544), wk = 0.0022831 k( 297) = ( -0.2734919 0.8921860 0.1445193), wk = 0.0022831 k( 298) = ( -0.2734919 0.8921860 0.1625842), wk = 0.0022831 k( 299) = ( -0.2734919 0.8921860 0.1806492), wk = 0.0022831 k( 300) = ( -0.2734919 0.8921860 0.1987141), wk = 0.0022831 k( 301) = ( -0.2734919 0.8921860 0.2167790), wk = 0.0022831 k( 302) = ( -0.2734919 0.8921860 0.2348439), wk = 0.0022831 k( 303) = ( -0.2734919 0.8921860 0.2529088), wk = 0.0022831 k( 304) = ( -0.2734919 0.8921860 0.2709737), wk = 0.0022831 k( 305) = ( -0.2734919 0.8921860 0.2890386), wk = 0.0022831 k( 306) = ( -0.2734919 0.8921860 0.3071036), wk = 0.0022831 k( 307) = ( -0.2734919 0.8921860 0.3251685), wk = 0.0022831 k( 308) = ( -0.2734919 0.8921860 0.3432334), wk = 0.0022831 k( 309) = ( -0.2734919 0.8921860 0.3612983), wk = 0.0022831 k( 310) = ( -0.2734919 0.8921860 0.3793632), wk = 0.0022831 k( 311) = ( -0.2734919 0.8921860 0.3974281), wk = 0.0022831 k( 312) = ( -0.2734919 0.8921860 0.4154930), wk = 0.0022831 k( 313) = ( -0.2734919 0.8921860 0.4335580), wk = 0.0022831 k( 314) = ( -0.2734919 0.8921860 0.4516229), wk = 0.0022831 k( 315) = ( -0.2734919 0.8921860 0.4696878), wk = 0.0022831 k( 316) = ( -0.2734919 0.8921860 0.4877527), wk = 0.0022831 k( 317) = ( -0.2734919 0.8921860 0.5058176), wk = 0.0022831 k( 318) = ( -0.2734919 0.8921860 0.5238825), wk = 0.0022831 k( 319) = ( -0.2734919 0.8921860 0.5419475), wk = 0.0022831 k( 320) = ( -0.2734919 0.8921860 0.5600124), wk = 0.0022831 k( 321) = ( -0.2734919 0.8921860 0.5780773), wk = 0.0022831 k( 322) = ( -0.2734919 0.8921860 0.5961422), wk = 0.0022831 k( 323) = ( -0.2734919 0.8921860 0.6142071), wk = 0.0022831 k( 324) = ( -0.2734919 0.8921860 0.6322720), wk = 0.0022831 k( 325) = ( -0.2734919 0.8921860 0.6503369), wk = 0.0022831 k( 326) = ( -0.2734919 0.8921860 0.6684018), wk = 0.0022831 k( 327) = ( -0.2734919 0.8921860 0.6684018), wk = 0.0022831 k( 328) = ( -0.2787595 0.8750019 0.6684018), wk = 0.0022831 k( 329) = ( -0.2840272 0.8578178 0.6684018), wk = 0.0022831 k( 330) = ( -0.2892948 0.8406337 0.6684018), wk = 0.0022831 k( 331) = ( -0.2945624 0.8234496 0.6684018), wk = 0.0022831 k( 332) = ( -0.2998301 0.8062656 0.6684018), wk = 0.0022831 k( 333) = ( -0.3050977 0.7890815 0.6684018), wk = 0.0022831 k( 334) = ( -0.3103653 0.7718974 0.6684018), wk = 0.0022831 k( 335) = ( -0.3156329 0.7547133 0.6684018), wk = 0.0022831 k( 336) = ( -0.3209006 0.7375293 0.6684018), wk = 0.0022831 k( 337) = ( -0.3261682 0.7203452 0.6684018), wk = 0.0022831 k( 338) = ( -0.3314358 0.7031611 0.6684018), wk = 0.0022831 k( 339) = ( -0.3367035 0.6859770 0.6684018), wk = 0.0022831 k( 340) = ( -0.3419711 0.6687929 0.6684018), wk = 0.0022831 k( 341) = ( -0.3472387 0.6516089 0.6684018), wk = 0.0022831 k( 342) = ( -0.3525064 0.6344248 0.6684018), wk = 0.0022831 k( 343) = ( -0.3577740 0.6172407 0.6684018), wk = 0.0022831 k( 344) = ( -0.3630416 0.6000566 0.6684018), wk = 0.0022831 k( 345) = ( -0.3683092 0.5828726 0.6684018), wk = 0.0022831 k( 346) = ( -0.3735769 0.5656885 0.6684018), wk = 0.0022831 k( 347) = ( -0.3788445 0.5485044 0.6684018), wk = 0.0022831 k( 348) = ( -0.3841121 0.5313203 0.6684018), wk = 0.0022831 k( 349) = ( -0.3893798 0.5141363 0.6684018), wk = 0.0022831 k( 350) = ( -0.3946474 0.4969522 0.6684018), wk = 0.0022831 k( 351) = ( -0.3999150 0.4797681 0.6684018), wk = 0.0022831 k( 352) = ( -0.4051827 0.4625840 0.6684018), wk = 0.0022831 k( 353) = ( -0.4104503 0.4454000 0.6684018), wk = 0.0022831 k( 354) = ( -0.4157179 0.4282159 0.6684018), wk = 0.0022831 k( 355) = ( -0.4209855 0.4110318 0.6684018), wk = 0.0022831 k( 356) = ( -0.4262532 0.3938477 0.6684018), wk = 0.0022831 k( 357) = ( -0.4315208 0.3766637 0.6684018), wk = 0.0022831 k( 358) = ( -0.4367884 0.3594796 0.6684018), wk = 0.0022831 k( 359) = ( -0.4420561 0.3422955 0.6684018), wk = 0.0022831 k( 360) = ( -0.4473237 0.3251114 0.6684018), wk = 0.0022831 k( 361) = ( -0.4525913 0.3079274 0.6684018), wk = 0.0022831 k( 362) = ( -0.4578590 0.2907433 0.6684018), wk = 0.0022831 k( 363) = ( -0.4631266 0.2735592 0.6684018), wk = 0.0022831 k( 364) = ( -0.4683942 0.2563751 0.6684018), wk = 0.0022831 k( 365) = ( -0.4736618 0.2391911 0.6684018), wk = 0.0022831 k( 366) = ( -0.4789295 0.2220070 0.6684018), wk = 0.0022831 k( 367) = ( -0.4841971 0.2048229 0.6684018), wk = 0.0022831 k( 368) = ( -0.4894647 0.1876388 0.6684018), wk = 0.0022831 k( 369) = ( -0.4947324 0.1704548 0.6684018), wk = 0.0022831 k( 370) = ( -0.5000000 0.1532707 0.6684018), wk = 0.0022831 k( 371) = ( -0.5000000 0.1532707 0.6684018), wk = 0.0022831 k( 372) = ( -0.5000000 0.1532707 0.6503369), wk = 0.0022831 k( 373) = ( -0.5000000 0.1532707 0.6322720), wk = 0.0022831 k( 374) = ( -0.5000000 0.1532707 0.6142071), wk = 0.0022831 k( 375) = ( -0.5000000 0.1532707 0.5961422), wk = 0.0022831 k( 376) = ( -0.5000000 0.1532707 0.5780773), wk = 0.0022831 k( 377) = ( -0.5000000 0.1532707 0.5600124), wk = 0.0022831 k( 378) = ( -0.5000000 0.1532707 0.5419475), wk = 0.0022831 k( 379) = ( -0.5000000 0.1532707 0.5238825), wk = 0.0022831 k( 380) = ( -0.5000000 0.1532707 0.5058176), wk = 0.0022831 k( 381) = ( -0.5000000 0.1532707 0.4877527), wk = 0.0022831 k( 382) = ( -0.5000000 0.1532707 0.4696878), wk = 0.0022831 k( 383) = ( -0.5000000 0.1532707 0.4516229), wk = 0.0022831 k( 384) = ( -0.5000000 0.1532707 0.4335580), wk = 0.0022831 k( 385) = ( -0.5000000 0.1532707 0.4154930), wk = 0.0022831 k( 386) = ( -0.5000000 0.1532707 0.3974281), wk = 0.0022831 k( 387) = ( -0.5000000 0.1532707 0.3793632), wk = 0.0022831 k( 388) = ( -0.5000000 0.1532707 0.3612983), wk = 0.0022831 k( 389) = ( -0.5000000 0.1532707 0.3432334), wk = 0.0022831 k( 390) = ( -0.5000000 0.1532707 0.3251685), wk = 0.0022831 k( 391) = ( -0.5000000 0.1532707 0.3071036), wk = 0.0022831 k( 392) = ( -0.5000000 0.1532707 0.2890386), wk = 0.0022831 k( 393) = ( -0.5000000 0.1532707 0.2709737), wk = 0.0022831 k( 394) = ( -0.5000000 0.1532707 0.2529088), wk = 0.0022831 k( 395) = ( -0.5000000 0.1532707 0.2348439), wk = 0.0022831 k( 396) = ( -0.5000000 0.1532707 0.2167790), wk = 0.0022831 k( 397) = ( -0.5000000 0.1532707 0.1987141), wk = 0.0022831 k( 398) = ( -0.5000000 0.1532707 0.1806492), wk = 0.0022831 k( 399) = ( -0.5000000 0.1532707 0.1625842), wk = 0.0022831 k( 400) = ( -0.5000000 0.1532707 0.1445193), wk = 0.0022831 k( 401) = ( -0.5000000 0.1532707 0.1264544), wk = 0.0022831 k( 402) = ( -0.5000000 0.1532707 0.1083895), wk = 0.0022831 k( 403) = ( -0.5000000 0.1532707 0.0903246), wk = 0.0022831 k( 404) = ( -0.5000000 0.1532707 0.0722597), wk = 0.0022831 k( 405) = ( -0.5000000 0.1532707 0.0541947), wk = 0.0022831 k( 406) = ( -0.5000000 0.1532707 0.0361298), wk = 0.0022831 k( 407) = ( -0.5000000 0.1532707 0.0180649), wk = 0.0022831 k( 408) = ( -0.5000000 0.1532707 -0.0000000), wk = 0.0022831 k( 409) = ( 0.0000000 0.0000000 0.6684018), wk = 0.0022831 k( 410) = ( -0.0172414 0.0052852 0.6684018), wk = 0.0022831 k( 411) = ( -0.0344828 0.0105704 0.6684018), wk = 0.0022831 k( 412) = ( -0.0517241 0.0158556 0.6684018), wk = 0.0022831 k( 413) = ( -0.0689655 0.0211408 0.6684018), wk = 0.0022831 k( 414) = ( -0.0862069 0.0264260 0.6684018), wk = 0.0022831 k( 415) = ( -0.1034483 0.0317112 0.6684018), wk = 0.0022831 k( 416) = ( -0.1206897 0.0369964 0.6684018), wk = 0.0022831 k( 417) = ( -0.1379310 0.0422816 0.6684018), wk = 0.0022831 k( 418) = ( -0.1551724 0.0475668 0.6684018), wk = 0.0022831 k( 419) = ( -0.1724138 0.0528520 0.6684018), wk = 0.0022831 k( 420) = ( -0.1896552 0.0581372 0.6684018), wk = 0.0022831 k( 421) = ( -0.2068966 0.0634224 0.6684018), wk = 0.0022831 k( 422) = ( -0.2241379 0.0687075 0.6684018), wk = 0.0022831 k( 423) = ( -0.2413793 0.0739927 0.6684018), wk = 0.0022831 k( 424) = ( -0.2586207 0.0792779 0.6684018), wk = 0.0022831 k( 425) = ( -0.2758621 0.0845631 0.6684018), wk = 0.0022831 k( 426) = ( -0.2931034 0.0898483 0.6684018), wk = 0.0022831 k( 427) = ( -0.3103448 0.0951335 0.6684018), wk = 0.0022831 k( 428) = ( -0.3275862 0.1004187 0.6684018), wk = 0.0022831 k( 429) = ( -0.3448276 0.1057039 0.6684018), wk = 0.0022831 k( 430) = ( -0.3620690 0.1109891 0.6684018), wk = 0.0022831 k( 431) = ( -0.3793103 0.1162743 0.6684018), wk = 0.0022831 k( 432) = ( -0.3965517 0.1215595 0.6684018), wk = 0.0022831 k( 433) = ( -0.4137931 0.1268447 0.6684018), wk = 0.0022831 k( 434) = ( -0.4310345 0.1321299 0.6684018), wk = 0.0022831 k( 435) = ( -0.4482759 0.1374151 0.6684018), wk = 0.0022831 k( 436) = ( -0.4655172 0.1427003 0.6684018), wk = 0.0022831 k( 437) = ( -0.4827586 0.1479855 0.6684018), wk = 0.0022831 k( 438) = ( -0.5000000 0.1532707 0.6684018), wk = 0.0022831 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 2) = ( 0.0052595 0.0052595 0.0000000), wk = 0.0022831 k( 3) = ( 0.0105189 0.0105189 0.0000000), wk = 0.0022831 k( 4) = ( 0.0157784 0.0157784 -0.0000000), wk = 0.0022831 k( 5) = ( 0.0210378 0.0210378 0.0000000), wk = 0.0022831 k( 6) = ( 0.0262973 0.0262973 0.0000000), wk = 0.0022831 k( 7) = ( 0.0315568 0.0315568 -0.0000000), wk = 0.0022831 k( 8) = ( 0.0368162 0.0368162 0.0000000), wk = 0.0022831 k( 9) = ( 0.0420757 0.0420757 0.0000000), wk = 0.0022831 k( 10) = ( 0.0473351 0.0473351 0.0000000), wk = 0.0022831 k( 11) = ( 0.0525946 0.0525946 0.0000000), wk = 0.0022831 k( 12) = ( 0.0578541 0.0578541 -0.0000000), wk = 0.0022831 k( 13) = ( 0.0631135 0.0631135 -0.0000000), wk = 0.0022831 k( 14) = ( 0.0683730 0.0683730 0.0000000), wk = 0.0022831 k( 15) = ( 0.0736324 0.0736324 0.0000000), wk = 0.0022831 k( 16) = ( 0.0788919 0.0788919 0.0000000), wk = 0.0022831 k( 17) = ( 0.0841513 0.0841513 0.0000000), wk = 0.0022831 k( 18) = ( 0.0894108 0.0894108 0.0000000), wk = 0.0022831 k( 19) = ( 0.0946703 0.0946703 0.0000000), wk = 0.0022831 k( 20) = ( 0.0999297 0.0999297 0.0000000), wk = 0.0022831 k( 21) = ( 0.1051892 0.1051892 0.0000000), wk = 0.0022831 k( 22) = ( 0.1104486 0.1104486 0.0000000), wk = 0.0022831 k( 23) = ( 0.1157081 0.1157081 0.0000000), wk = 0.0022831 k( 24) = ( 0.1209676 0.1209676 0.0000000), wk = 0.0022831 k( 25) = ( 0.1262270 0.1262270 0.0000000), wk = 0.0022831 k( 26) = ( 0.1314865 0.1314865 0.0000000), wk = 0.0022831 k( 27) = ( 0.1367460 0.1367459 0.0000000), wk = 0.0022831 k( 28) = ( 0.1420054 0.1420054 0.0000000), wk = 0.0022831 k( 29) = ( 0.1472649 0.1472649 0.0000000), wk = 0.0022831 k( 30) = ( 0.1525243 0.1525243 0.0000000), wk = 0.0022831 k( 31) = ( 0.1577838 0.1577838 0.0000000), wk = 0.0022831 k( 32) = ( 0.1630433 0.1630433 0.0000000), wk = 0.0022831 k( 33) = ( 0.1683027 0.1683027 0.0000000), wk = 0.0022831 k( 34) = ( 0.1735622 0.1735622 0.0000000), wk = 0.0022831 k( 35) = ( 0.1788216 0.1788216 0.0000000), wk = 0.0022831 k( 36) = ( 0.1840811 0.1840811 0.0000000), wk = 0.0022831 k( 37) = ( 0.1893405 0.1893405 0.0000000), wk = 0.0022831 k( 38) = ( 0.1946000 0.1946000 0.0000000), wk = 0.0022831 k( 39) = ( 0.1998595 0.1998595 0.0000000), wk = 0.0022831 k( 40) = ( 0.2051189 0.2051189 0.0000000), wk = 0.0022831 k( 41) = ( 0.2103784 0.2103784 0.0000000), wk = 0.0022831 k( 42) = ( 0.2156378 0.2156378 0.0000000), wk = 0.0022831 k( 43) = ( 0.2208973 0.2208973 0.0000000), wk = 0.0022831 k( 44) = ( 0.2261568 0.2261568 -0.0000000), wk = 0.0022831 k( 45) = ( 0.2314162 0.2314162 -0.0000000), wk = 0.0022831 k( 46) = ( 0.2366757 0.2366757 0.0000000), wk = 0.0022831 k( 47) = ( 0.2419351 0.2419351 -0.0000000), wk = 0.0022831 k( 48) = ( 0.2471946 0.2471946 0.0000000), wk = 0.0022831 k( 49) = ( 0.2524541 0.2524541 0.0000000), wk = 0.0022831 k( 50) = ( 0.2577135 0.2577135 0.0000000), wk = 0.0022831 k( 51) = ( 0.2629730 0.2629730 0.0000000), wk = 0.0022831 k( 52) = ( 0.2682324 0.2682324 0.0000000), wk = 0.0022831 k( 53) = ( 0.2734919 0.2734919 0.0000000), wk = 0.0022831 k( 54) = ( 0.2734919 0.2734919 0.0000000), wk = 0.0022831 k( 55) = ( 0.2552591 0.2885924 0.0000000), wk = 0.0022831 k( 56) = ( 0.2370263 0.3036930 0.0000000), wk = 0.0022831 k( 57) = ( 0.2187935 0.3187935 0.0000000), wk = 0.0022831 k( 58) = ( 0.2005607 0.3338941 0.0000000), wk = 0.0022831 k( 59) = ( 0.1823279 0.3489946 0.0000000), wk = 0.0022831 k( 60) = ( 0.1640951 0.3640951 0.0000000), wk = 0.0022831 k( 61) = ( 0.1458624 0.3791957 -0.0000000), wk = 0.0022831 k( 62) = ( 0.1276296 0.3942962 0.0000000), wk = 0.0022831 k( 63) = ( 0.1093968 0.4093968 0.0000000), wk = 0.0022831 k( 64) = ( 0.0911640 0.4244973 0.0000000), wk = 0.0022831 k( 65) = ( 0.0729312 0.4395978 0.0000000), wk = 0.0022831 k( 66) = ( 0.0546984 0.4546984 -0.0000000), wk = 0.0022831 k( 67) = ( 0.0364656 0.4697989 0.0000000), wk = 0.0022831 k( 68) = ( 0.0182328 0.4848995 0.0000000), wk = 0.0022831 k( 69) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022831 k( 70) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022831 k( 71) = ( 0.0000000 0.5000000 0.0135135), wk = 0.0022831 k( 72) = ( 0.0000000 0.5000000 0.0270270), wk = 0.0022831 k( 73) = ( 0.0000000 0.5000000 0.0405405), wk = 0.0022831 k( 74) = ( 0.0000000 0.5000000 0.0540540), wk = 0.0022831 k( 75) = ( 0.0000000 0.5000000 0.0675676), wk = 0.0022831 k( 76) = ( 0.0000000 0.5000000 0.0810811), wk = 0.0022831 k( 77) = ( 0.0000000 0.5000000 0.0945946), wk = 0.0022831 k( 78) = ( 0.0000000 0.5000000 0.1081081), wk = 0.0022831 k( 79) = ( 0.0000000 0.5000000 0.1216216), wk = 0.0022831 k( 80) = ( 0.0000000 0.5000000 0.1351351), wk = 0.0022831 k( 81) = ( 0.0000000 0.5000000 0.1486486), wk = 0.0022831 k( 82) = ( 0.0000000 0.5000000 0.1621622), wk = 0.0022831 k( 83) = ( 0.0000000 0.5000000 0.1756757), wk = 0.0022831 k( 84) = ( 0.0000000 0.5000000 0.1891892), wk = 0.0022831 k( 85) = ( 0.0000000 0.5000000 0.2027027), wk = 0.0022831 k( 86) = ( 0.0000000 0.5000000 0.2162162), wk = 0.0022831 k( 87) = ( 0.0000000 0.5000000 0.2297297), wk = 0.0022831 k( 88) = ( 0.0000000 0.5000000 0.2432432), wk = 0.0022831 k( 89) = ( 0.0000000 0.5000000 0.2567568), wk = 0.0022831 k( 90) = ( 0.0000000 0.5000000 0.2702703), wk = 0.0022831 k( 91) = ( 0.0000000 0.5000000 0.2837838), wk = 0.0022831 k( 92) = ( 0.0000000 0.5000000 0.2972973), wk = 0.0022831 k( 93) = ( 0.0000000 0.5000000 0.3108108), wk = 0.0022831 k( 94) = ( 0.0000000 0.5000000 0.3243243), wk = 0.0022831 k( 95) = ( 0.0000000 0.5000000 0.3378378), wk = 0.0022831 k( 96) = ( 0.0000000 0.5000000 0.3513514), wk = 0.0022831 k( 97) = ( 0.0000000 0.5000000 0.3648649), wk = 0.0022831 k( 98) = ( 0.0000000 0.5000000 0.3783784), wk = 0.0022831 k( 99) = ( 0.0000000 0.5000000 0.3918919), wk = 0.0022831 k( 100) = ( 0.0000000 0.5000000 0.4054054), wk = 0.0022831 k( 101) = ( 0.0000000 0.5000000 0.4189189), wk = 0.0022831 k( 102) = ( 0.0000000 0.5000000 0.4324324), wk = 0.0022831 k( 103) = ( 0.0000000 0.5000000 0.4459459), wk = 0.0022831 k( 104) = ( 0.0000000 0.5000000 0.4594595), wk = 0.0022831 k( 105) = ( 0.0000000 0.5000000 0.4729730), wk = 0.0022831 k( 106) = ( 0.0000000 0.5000000 0.4864865), wk = 0.0022831 k( 107) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022831 k( 108) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022831 k( 109) = ( 0.0182328 0.4848995 0.5000000), wk = 0.0022831 k( 110) = ( 0.0364656 0.4697989 0.5000000), wk = 0.0022831 k( 111) = ( 0.0546984 0.4546984 0.5000000), wk = 0.0022831 k( 112) = ( 0.0729312 0.4395978 0.5000000), wk = 0.0022831 k( 113) = ( 0.0911640 0.4244973 0.5000000), wk = 0.0022831 k( 114) = ( 0.1093968 0.4093968 0.5000000), wk = 0.0022831 k( 115) = ( 0.1276296 0.3942962 0.5000000), wk = 0.0022831 k( 116) = ( 0.1458624 0.3791957 0.5000000), wk = 0.0022831 k( 117) = ( 0.1640951 0.3640951 0.5000000), wk = 0.0022831 k( 118) = ( 0.1823279 0.3489946 0.5000000), wk = 0.0022831 k( 119) = ( 0.2005607 0.3338941 0.5000000), wk = 0.0022831 k( 120) = ( 0.2187935 0.3187935 0.5000000), wk = 0.0022831 k( 121) = ( 0.2370263 0.3036930 0.5000000), wk = 0.0022831 k( 122) = ( 0.2552591 0.2885924 0.5000000), wk = 0.0022831 k( 123) = ( 0.2734919 0.2734919 0.5000000), wk = 0.0022831 k( 124) = ( 0.2734919 0.2734919 0.5000000), wk = 0.0022831 k( 125) = ( 0.2682324 0.2682324 0.5000000), wk = 0.0022831 k( 126) = ( 0.2629730 0.2629730 0.5000000), wk = 0.0022831 k( 127) = ( 0.2577135 0.2577135 0.5000000), wk = 0.0022831 k( 128) = ( 0.2524541 0.2524541 0.5000000), wk = 0.0022831 k( 129) = ( 0.2471946 0.2471946 0.5000000), wk = 0.0022831 k( 130) = ( 0.2419351 0.2419351 0.5000000), wk = 0.0022831 k( 131) = ( 0.2366757 0.2366757 0.5000000), wk = 0.0022831 k( 132) = ( 0.2314162 0.2314162 0.5000000), wk = 0.0022831 k( 133) = ( 0.2261568 0.2261568 0.5000000), wk = 0.0022831 k( 134) = ( 0.2208973 0.2208973 0.5000000), wk = 0.0022831 k( 135) = ( 0.2156378 0.2156378 0.5000000), wk = 0.0022831 k( 136) = ( 0.2103784 0.2103784 0.5000000), wk = 0.0022831 k( 137) = ( 0.2051189 0.2051189 0.5000000), wk = 0.0022831 k( 138) = ( 0.1998595 0.1998595 0.5000000), wk = 0.0022831 k( 139) = ( 0.1946000 0.1946000 0.5000000), wk = 0.0022831 k( 140) = ( 0.1893405 0.1893405 0.5000000), wk = 0.0022831 k( 141) = ( 0.1840811 0.1840811 0.5000000), wk = 0.0022831 k( 142) = ( 0.1788216 0.1788216 0.5000000), wk = 0.0022831 k( 143) = ( 0.1735622 0.1735622 0.5000000), wk = 0.0022831 k( 144) = ( 0.1683027 0.1683027 0.5000000), wk = 0.0022831 k( 145) = ( 0.1630433 0.1630433 0.5000000), wk = 0.0022831 k( 146) = ( 0.1577838 0.1577838 0.5000000), wk = 0.0022831 k( 147) = ( 0.1525243 0.1525243 0.5000000), wk = 0.0022831 k( 148) = ( 0.1472649 0.1472649 0.5000000), wk = 0.0022831 k( 149) = ( 0.1420054 0.1420054 0.5000000), wk = 0.0022831 k( 150) = ( 0.1367460 0.1367459 0.5000000), wk = 0.0022831 k( 151) = ( 0.1314865 0.1314865 0.5000000), wk = 0.0022831 k( 152) = ( 0.1262270 0.1262270 0.5000000), wk = 0.0022831 k( 153) = ( 0.1209676 0.1209676 0.5000000), wk = 0.0022831 k( 154) = ( 0.1157081 0.1157081 0.5000000), wk = 0.0022831 k( 155) = ( 0.1104486 0.1104486 0.5000000), wk = 0.0022831 k( 156) = ( 0.1051892 0.1051892 0.5000000), wk = 0.0022831 k( 157) = ( 0.0999297 0.0999297 0.5000000), wk = 0.0022831 k( 158) = ( 0.0946703 0.0946703 0.5000000), wk = 0.0022831 k( 159) = ( 0.0894108 0.0894108 0.5000000), wk = 0.0022831 k( 160) = ( 0.0841513 0.0841513 0.5000000), wk = 0.0022831 k( 161) = ( 0.0788919 0.0788919 0.5000000), wk = 0.0022831 k( 162) = ( 0.0736324 0.0736324 0.5000000), wk = 0.0022831 k( 163) = ( 0.0683730 0.0683730 0.5000000), wk = 0.0022831 k( 164) = ( 0.0631135 0.0631135 0.5000000), wk = 0.0022831 k( 165) = ( 0.0578541 0.0578541 0.5000000), wk = 0.0022831 k( 166) = ( 0.0525946 0.0525946 0.5000000), wk = 0.0022831 k( 167) = ( 0.0473351 0.0473351 0.5000000), wk = 0.0022831 k( 168) = ( 0.0420757 0.0420757 0.5000000), wk = 0.0022831 k( 169) = ( 0.0368162 0.0368162 0.5000000), wk = 0.0022831 k( 170) = ( 0.0315568 0.0315568 0.5000000), wk = 0.0022831 k( 171) = ( 0.0262973 0.0262973 0.5000000), wk = 0.0022831 k( 172) = ( 0.0210378 0.0210378 0.5000000), wk = 0.0022831 k( 173) = ( 0.0157784 0.0157784 0.5000000), wk = 0.0022831 k( 174) = ( 0.0105189 0.0105189 0.5000000), wk = 0.0022831 k( 175) = ( 0.0052595 0.0052595 0.5000000), wk = 0.0022831 k( 176) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022831 k( 177) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022831 k( 178) = ( 0.0000000 0.0000000 0.4864865), wk = 0.0022831 k( 179) = ( 0.0000000 0.0000000 0.4729730), wk = 0.0022831 k( 180) = ( 0.0000000 0.0000000 0.4594595), wk = 0.0022831 k( 181) = ( 0.0000000 0.0000000 0.4459459), wk = 0.0022831 k( 182) = ( 0.0000000 0.0000000 0.4324324), wk = 0.0022831 k( 183) = ( 0.0000000 0.0000000 0.4189189), wk = 0.0022831 k( 184) = ( 0.0000000 0.0000000 0.4054054), wk = 0.0022831 k( 185) = ( 0.0000000 0.0000000 0.3918919), wk = 0.0022831 k( 186) = ( 0.0000000 0.0000000 0.3783784), wk = 0.0022831 k( 187) = ( 0.0000000 0.0000000 0.3648649), wk = 0.0022831 k( 188) = ( 0.0000000 0.0000000 0.3513514), wk = 0.0022831 k( 189) = ( 0.0000000 0.0000000 0.3378378), wk = 0.0022831 k( 190) = ( 0.0000000 0.0000000 0.3243243), wk = 0.0022831 k( 191) = ( 0.0000000 0.0000000 0.3108108), wk = 0.0022831 k( 192) = ( 0.0000000 0.0000000 0.2972973), wk = 0.0022831 k( 193) = ( 0.0000000 0.0000000 0.2837838), wk = 0.0022831 k( 194) = ( 0.0000000 0.0000000 0.2702703), wk = 0.0022831 k( 195) = ( 0.0000000 0.0000000 0.2567568), wk = 0.0022831 k( 196) = ( 0.0000000 0.0000000 0.2432432), wk = 0.0022831 k( 197) = ( 0.0000000 0.0000000 0.2297297), wk = 0.0022831 k( 198) = ( 0.0000000 0.0000000 0.2162162), wk = 0.0022831 k( 199) = ( 0.0000000 0.0000000 0.2027027), wk = 0.0022831 k( 200) = ( 0.0000000 0.0000000 0.1891892), wk = 0.0022831 k( 201) = ( 0.0000000 0.0000000 0.1756757), wk = 0.0022831 k( 202) = ( 0.0000000 0.0000000 0.1621622), wk = 0.0022831 k( 203) = ( 0.0000000 0.0000000 0.1486486), wk = 0.0022831 k( 204) = ( 0.0000000 0.0000000 0.1351351), wk = 0.0022831 k( 205) = ( 0.0000000 0.0000000 0.1216216), wk = 0.0022831 k( 206) = ( 0.0000000 0.0000000 0.1081081), wk = 0.0022831 k( 207) = ( 0.0000000 0.0000000 0.0945946), wk = 0.0022831 k( 208) = ( 0.0000000 0.0000000 0.0810811), wk = 0.0022831 k( 209) = ( 0.0000000 0.0000000 0.0675676), wk = 0.0022831 k( 210) = ( 0.0000000 0.0000000 0.0540540), wk = 0.0022831 k( 211) = ( 0.0000000 0.0000000 0.0405405), wk = 0.0022831 k( 212) = ( 0.0000000 0.0000000 0.0270270), wk = 0.0022831 k( 213) = ( 0.0000000 0.0000000 0.0135135), wk = 0.0022831 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022831 k( 216) = ( -0.0172414 0.0172414 -0.0000000), wk = 0.0022831 k( 217) = ( -0.0344828 0.0344828 -0.0000000), wk = 0.0022831 k( 218) = ( -0.0517241 0.0517241 -0.0000000), wk = 0.0022831 k( 219) = ( -0.0689655 0.0689655 -0.0000000), wk = 0.0022831 k( 220) = ( -0.0862069 0.0862069 -0.0000000), wk = 0.0022831 k( 221) = ( -0.1034483 0.1034483 -0.0000000), wk = 0.0022831 k( 222) = ( -0.1206897 0.1206897 -0.0000000), wk = 0.0022831 k( 223) = ( -0.1379310 0.1379310 -0.0000000), wk = 0.0022831 k( 224) = ( -0.1551724 0.1551724 -0.0000000), wk = 0.0022831 k( 225) = ( -0.1724138 0.1724138 -0.0000000), wk = 0.0022831 k( 226) = ( -0.1896552 0.1896552 -0.0000000), wk = 0.0022831 k( 227) = ( -0.2068966 0.2068966 -0.0000000), wk = 0.0022831 k( 228) = ( -0.2241379 0.2241379 -0.0000000), wk = 0.0022831 k( 229) = ( -0.2413793 0.2413793 -0.0000000), wk = 0.0022831 k( 230) = ( -0.2586207 0.2586207 -0.0000000), wk = 0.0022831 k( 231) = ( -0.2758621 0.2758621 -0.0000000), wk = 0.0022831 k( 232) = ( -0.2931034 0.2931034 -0.0000000), wk = 0.0022831 k( 233) = ( -0.3103448 0.3103448 -0.0000000), wk = 0.0022831 k( 234) = ( -0.3275862 0.3275862 -0.0000000), wk = 0.0022831 k( 235) = ( -0.3448276 0.3448276 -0.0000000), wk = 0.0022831 k( 236) = ( -0.3620690 0.3620690 -0.0000000), wk = 0.0022831 k( 237) = ( -0.3793103 0.3793103 -0.0000000), wk = 0.0022831 k( 238) = ( -0.3965517 0.3965517 -0.0000000), wk = 0.0022831 k( 239) = ( -0.4137931 0.4137931 -0.0000000), wk = 0.0022831 k( 240) = ( -0.4310345 0.4310345 -0.0000000), wk = 0.0022831 k( 241) = ( -0.4482759 0.4482759 -0.0000000), wk = 0.0022831 k( 242) = ( -0.4655172 0.4655172 -0.0000000), wk = 0.0022831 k( 243) = ( -0.4827586 0.4827586 -0.0000000), wk = 0.0022831 k( 244) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022831 k( 245) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022831 k( 246) = ( -0.4947324 0.5052676 -0.0000000), wk = 0.0022831 k( 247) = ( -0.4894647 0.5105353 -0.0000000), wk = 0.0022831 k( 248) = ( -0.4841971 0.5158029 -0.0000000), wk = 0.0022831 k( 249) = ( -0.4789295 0.5210705 -0.0000000), wk = 0.0022831 k( 250) = ( -0.4736618 0.5263381 -0.0000000), wk = 0.0022831 k( 251) = ( -0.4683942 0.5316058 -0.0000000), wk = 0.0022831 k( 252) = ( -0.4631266 0.5368734 -0.0000000), wk = 0.0022831 k( 253) = ( -0.4578590 0.5421410 -0.0000000), wk = 0.0022831 k( 254) = ( -0.4525913 0.5474087 -0.0000000), wk = 0.0022831 k( 255) = ( -0.4473237 0.5526763 -0.0000000), wk = 0.0022831 k( 256) = ( -0.4420561 0.5579439 -0.0000000), wk = 0.0022831 k( 257) = ( -0.4367884 0.5632116 -0.0000000), wk = 0.0022831 k( 258) = ( -0.4315208 0.5684792 -0.0000000), wk = 0.0022831 k( 259) = ( -0.4262532 0.5737468 -0.0000000), wk = 0.0022831 k( 260) = ( -0.4209855 0.5790144 -0.0000000), wk = 0.0022831 k( 261) = ( -0.4157179 0.5842821 0.0000000), wk = 0.0022831 k( 262) = ( -0.4104503 0.5895497 -0.0000000), wk = 0.0022831 k( 263) = ( -0.4051827 0.5948173 -0.0000000), wk = 0.0022831 k( 264) = ( -0.3999150 0.6000850 -0.0000000), wk = 0.0022831 k( 265) = ( -0.3946474 0.6053526 -0.0000000), wk = 0.0022831 k( 266) = ( -0.3893798 0.6106202 -0.0000000), wk = 0.0022831 k( 267) = ( -0.3841121 0.6158879 -0.0000000), wk = 0.0022831 k( 268) = ( -0.3788445 0.6211555 -0.0000000), wk = 0.0022831 k( 269) = ( -0.3735769 0.6264231 -0.0000000), wk = 0.0022831 k( 270) = ( -0.3683092 0.6316907 0.0000000), wk = 0.0022831 k( 271) = ( -0.3630416 0.6369584 0.0000000), wk = 0.0022831 k( 272) = ( -0.3577740 0.6422260 -0.0000000), wk = 0.0022831 k( 273) = ( -0.3525064 0.6474936 -0.0000000), wk = 0.0022831 k( 274) = ( -0.3472387 0.6527613 -0.0000000), wk = 0.0022831 k( 275) = ( -0.3419711 0.6580289 0.0000000), wk = 0.0022831 k( 276) = ( -0.3367035 0.6632965 -0.0000000), wk = 0.0022831 k( 277) = ( -0.3314358 0.6685642 -0.0000000), wk = 0.0022831 k( 278) = ( -0.3261682 0.6738318 -0.0000000), wk = 0.0022831 k( 279) = ( -0.3209006 0.6790994 -0.0000000), wk = 0.0022831 k( 280) = ( -0.3156329 0.6843671 -0.0000000), wk = 0.0022831 k( 281) = ( -0.3103653 0.6896347 -0.0000000), wk = 0.0022831 k( 282) = ( -0.3050977 0.6949023 0.0000000), wk = 0.0022831 k( 283) = ( -0.2998301 0.7001700 -0.0000000), wk = 0.0022831 k( 284) = ( -0.2945624 0.7054376 0.0000000), wk = 0.0022831 k( 285) = ( -0.2892948 0.7107052 -0.0000000), wk = 0.0022831 k( 286) = ( -0.2840272 0.7159728 -0.0000000), wk = 0.0022831 k( 287) = ( -0.2787595 0.7212405 -0.0000000), wk = 0.0022831 k( 288) = ( -0.2734919 0.7265081 -0.0000000), wk = 0.0022831 k( 289) = ( -0.2734919 0.7265081 -0.0000000), wk = 0.0022831 k( 290) = ( -0.2734919 0.7265081 0.0135135), wk = 0.0022831 k( 291) = ( -0.2734919 0.7265081 0.0270270), wk = 0.0022831 k( 292) = ( -0.2734919 0.7265081 0.0405405), wk = 0.0022831 k( 293) = ( -0.2734919 0.7265081 0.0540540), wk = 0.0022831 k( 294) = ( -0.2734919 0.7265081 0.0675676), wk = 0.0022831 k( 295) = ( -0.2734919 0.7265081 0.0810811), wk = 0.0022831 k( 296) = ( -0.2734919 0.7265081 0.0945946), wk = 0.0022831 k( 297) = ( -0.2734919 0.7265081 0.1081081), wk = 0.0022831 k( 298) = ( -0.2734919 0.7265081 0.1216216), wk = 0.0022831 k( 299) = ( -0.2734919 0.7265081 0.1351351), wk = 0.0022831 k( 300) = ( -0.2734919 0.7265081 0.1486486), wk = 0.0022831 k( 301) = ( -0.2734919 0.7265081 0.1621622), wk = 0.0022831 k( 302) = ( -0.2734919 0.7265081 0.1756757), wk = 0.0022831 k( 303) = ( -0.2734919 0.7265081 0.1891892), wk = 0.0022831 k( 304) = ( -0.2734919 0.7265081 0.2027027), wk = 0.0022831 k( 305) = ( -0.2734919 0.7265081 0.2162162), wk = 0.0022831 k( 306) = ( -0.2734919 0.7265081 0.2297297), wk = 0.0022831 k( 307) = ( -0.2734919 0.7265081 0.2432432), wk = 0.0022831 k( 308) = ( -0.2734919 0.7265081 0.2567568), wk = 0.0022831 k( 309) = ( -0.2734919 0.7265081 0.2702703), wk = 0.0022831 k( 310) = ( -0.2734919 0.7265081 0.2837838), wk = 0.0022831 k( 311) = ( -0.2734919 0.7265081 0.2972973), wk = 0.0022831 k( 312) = ( -0.2734919 0.7265081 0.3108108), wk = 0.0022831 k( 313) = ( -0.2734919 0.7265081 0.3243243), wk = 0.0022831 k( 314) = ( -0.2734919 0.7265081 0.3378378), wk = 0.0022831 k( 315) = ( -0.2734919 0.7265081 0.3513514), wk = 0.0022831 k( 316) = ( -0.2734919 0.7265081 0.3648649), wk = 0.0022831 k( 317) = ( -0.2734919 0.7265081 0.3783784), wk = 0.0022831 k( 318) = ( -0.2734919 0.7265081 0.3918919), wk = 0.0022831 k( 319) = ( -0.2734919 0.7265081 0.4054054), wk = 0.0022831 k( 320) = ( -0.2734919 0.7265081 0.4189189), wk = 0.0022831 k( 321) = ( -0.2734919 0.7265081 0.4324324), wk = 0.0022831 k( 322) = ( -0.2734919 0.7265081 0.4459460), wk = 0.0022831 k( 323) = ( -0.2734919 0.7265081 0.4594595), wk = 0.0022831 k( 324) = ( -0.2734919 0.7265081 0.4729730), wk = 0.0022831 k( 325) = ( -0.2734919 0.7265081 0.4864865), wk = 0.0022831 k( 326) = ( -0.2734919 0.7265081 0.5000000), wk = 0.0022831 k( 327) = ( -0.2734919 0.7265081 0.5000000), wk = 0.0022831 k( 328) = ( -0.2787595 0.7212405 0.5000000), wk = 0.0022831 k( 329) = ( -0.2840272 0.7159728 0.5000000), wk = 0.0022831 k( 330) = ( -0.2892948 0.7107052 0.5000000), wk = 0.0022831 k( 331) = ( -0.2945624 0.7054376 0.5000000), wk = 0.0022831 k( 332) = ( -0.2998301 0.7001700 0.5000000), wk = 0.0022831 k( 333) = ( -0.3050977 0.6949023 0.5000000), wk = 0.0022831 k( 334) = ( -0.3103653 0.6896347 0.5000000), wk = 0.0022831 k( 335) = ( -0.3156329 0.6843671 0.5000000), wk = 0.0022831 k( 336) = ( -0.3209006 0.6790994 0.5000000), wk = 0.0022831 k( 337) = ( -0.3261682 0.6738318 0.5000000), wk = 0.0022831 k( 338) = ( -0.3314358 0.6685642 0.5000000), wk = 0.0022831 k( 339) = ( -0.3367035 0.6632965 0.5000000), wk = 0.0022831 k( 340) = ( -0.3419711 0.6580289 0.5000000), wk = 0.0022831 k( 341) = ( -0.3472387 0.6527613 0.5000000), wk = 0.0022831 k( 342) = ( -0.3525064 0.6474936 0.5000000), wk = 0.0022831 k( 343) = ( -0.3577740 0.6422260 0.5000000), wk = 0.0022831 k( 344) = ( -0.3630416 0.6369584 0.5000000), wk = 0.0022831 k( 345) = ( -0.3683092 0.6316907 0.5000000), wk = 0.0022831 k( 346) = ( -0.3735769 0.6264231 0.5000000), wk = 0.0022831 k( 347) = ( -0.3788445 0.6211555 0.5000000), wk = 0.0022831 k( 348) = ( -0.3841121 0.6158879 0.5000000), wk = 0.0022831 k( 349) = ( -0.3893798 0.6106202 0.5000000), wk = 0.0022831 k( 350) = ( -0.3946474 0.6053526 0.5000000), wk = 0.0022831 k( 351) = ( -0.3999150 0.6000850 0.5000000), wk = 0.0022831 k( 352) = ( -0.4051827 0.5948173 0.5000000), wk = 0.0022831 k( 353) = ( -0.4104503 0.5895497 0.5000000), wk = 0.0022831 k( 354) = ( -0.4157179 0.5842821 0.5000000), wk = 0.0022831 k( 355) = ( -0.4209855 0.5790144 0.5000000), wk = 0.0022831 k( 356) = ( -0.4262532 0.5737468 0.5000000), wk = 0.0022831 k( 357) = ( -0.4315208 0.5684792 0.5000000), wk = 0.0022831 k( 358) = ( -0.4367884 0.5632116 0.5000000), wk = 0.0022831 k( 359) = ( -0.4420561 0.5579439 0.5000000), wk = 0.0022831 k( 360) = ( -0.4473237 0.5526763 0.5000000), wk = 0.0022831 k( 361) = ( -0.4525913 0.5474087 0.5000000), wk = 0.0022831 k( 362) = ( -0.4578590 0.5421410 0.5000000), wk = 0.0022831 k( 363) = ( -0.4631266 0.5368734 0.5000000), wk = 0.0022831 k( 364) = ( -0.4683942 0.5316058 0.5000000), wk = 0.0022831 k( 365) = ( -0.4736618 0.5263381 0.5000000), wk = 0.0022831 k( 366) = ( -0.4789295 0.5210705 0.5000000), wk = 0.0022831 k( 367) = ( -0.4841971 0.5158029 0.5000000), wk = 0.0022831 k( 368) = ( -0.4894647 0.5105353 0.5000000), wk = 0.0022831 k( 369) = ( -0.4947324 0.5052676 0.5000000), wk = 0.0022831 k( 370) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022831 k( 371) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022831 k( 372) = ( -0.5000000 0.5000000 0.4864865), wk = 0.0022831 k( 373) = ( -0.5000000 0.5000000 0.4729730), wk = 0.0022831 k( 374) = ( -0.5000000 0.5000000 0.4594595), wk = 0.0022831 k( 375) = ( -0.5000000 0.5000000 0.4459459), wk = 0.0022831 k( 376) = ( -0.5000000 0.5000000 0.4324324), wk = 0.0022831 k( 377) = ( -0.5000000 0.5000000 0.4189189), wk = 0.0022831 k( 378) = ( -0.5000000 0.5000000 0.4054054), wk = 0.0022831 k( 379) = ( -0.5000000 0.5000000 0.3918919), wk = 0.0022831 k( 380) = ( -0.5000000 0.5000000 0.3783784), wk = 0.0022831 k( 381) = ( -0.5000000 0.5000000 0.3648649), wk = 0.0022831 k( 382) = ( -0.5000000 0.5000000 0.3513514), wk = 0.0022831 k( 383) = ( -0.5000000 0.5000000 0.3378378), wk = 0.0022831 k( 384) = ( -0.5000000 0.5000000 0.3243243), wk = 0.0022831 k( 385) = ( -0.5000000 0.5000000 0.3108108), wk = 0.0022831 k( 386) = ( -0.5000000 0.5000000 0.2972973), wk = 0.0022831 k( 387) = ( -0.5000000 0.5000000 0.2837838), wk = 0.0022831 k( 388) = ( -0.5000000 0.5000000 0.2702703), wk = 0.0022831 k( 389) = ( -0.5000000 0.5000000 0.2567568), wk = 0.0022831 k( 390) = ( -0.5000000 0.5000000 0.2432432), wk = 0.0022831 k( 391) = ( -0.5000000 0.5000000 0.2297297), wk = 0.0022831 k( 392) = ( -0.5000000 0.5000000 0.2162162), wk = 0.0022831 k( 393) = ( -0.5000000 0.5000000 0.2027027), wk = 0.0022831 k( 394) = ( -0.5000000 0.5000000 0.1891892), wk = 0.0022831 k( 395) = ( -0.5000000 0.5000000 0.1756757), wk = 0.0022831 k( 396) = ( -0.5000000 0.5000000 0.1621622), wk = 0.0022831 k( 397) = ( -0.5000000 0.5000000 0.1486486), wk = 0.0022831 k( 398) = ( -0.5000000 0.5000000 0.1351351), wk = 0.0022831 k( 399) = ( -0.5000000 0.5000000 0.1216216), wk = 0.0022831 k( 400) = ( -0.5000000 0.5000000 0.1081081), wk = 0.0022831 k( 401) = ( -0.5000000 0.5000000 0.0945946), wk = 0.0022831 k( 402) = ( -0.5000000 0.5000000 0.0810811), wk = 0.0022831 k( 403) = ( -0.5000000 0.5000000 0.0675676), wk = 0.0022831 k( 404) = ( -0.5000000 0.5000000 0.0540540), wk = 0.0022831 k( 405) = ( -0.5000000 0.5000000 0.0405405), wk = 0.0022831 k( 406) = ( -0.5000000 0.5000000 0.0270270), wk = 0.0022831 k( 407) = ( -0.5000000 0.5000000 0.0135135), wk = 0.0022831 k( 408) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022831 k( 409) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022831 k( 410) = ( -0.0172414 0.0172414 0.5000000), wk = 0.0022831 k( 411) = ( -0.0344828 0.0344828 0.5000000), wk = 0.0022831 k( 412) = ( -0.0517241 0.0517241 0.5000000), wk = 0.0022831 k( 413) = ( -0.0689655 0.0689655 0.5000000), wk = 0.0022831 k( 414) = ( -0.0862069 0.0862069 0.5000000), wk = 0.0022831 k( 415) = ( -0.1034483 0.1034483 0.5000000), wk = 0.0022831 k( 416) = ( -0.1206897 0.1206897 0.5000000), wk = 0.0022831 k( 417) = ( -0.1379310 0.1379310 0.5000000), wk = 0.0022831 k( 418) = ( -0.1551724 0.1551724 0.5000000), wk = 0.0022831 k( 419) = ( -0.1724138 0.1724138 0.5000000), wk = 0.0022831 k( 420) = ( -0.1896552 0.1896552 0.5000000), wk = 0.0022831 k( 421) = ( -0.2068966 0.2068966 0.5000000), wk = 0.0022831 k( 422) = ( -0.2241379 0.2241379 0.5000000), wk = 0.0022831 k( 423) = ( -0.2413793 0.2413793 0.5000000), wk = 0.0022831 k( 424) = ( -0.2586207 0.2586207 0.5000000), wk = 0.0022831 k( 425) = ( -0.2758621 0.2758621 0.5000000), wk = 0.0022831 k( 426) = ( -0.2931034 0.2931034 0.5000000), wk = 0.0022831 k( 427) = ( -0.3103448 0.3103448 0.5000000), wk = 0.0022831 k( 428) = ( -0.3275862 0.3275862 0.5000000), wk = 0.0022831 k( 429) = ( -0.3448276 0.3448276 0.5000000), wk = 0.0022831 k( 430) = ( -0.3620690 0.3620690 0.5000000), wk = 0.0022831 k( 431) = ( -0.3793103 0.3793103 0.5000000), wk = 0.0022831 k( 432) = ( -0.3965517 0.3965517 0.5000000), wk = 0.0022831 k( 433) = ( -0.4137931 0.4137931 0.5000000), wk = 0.0022831 k( 434) = ( -0.4310345 0.4310345 0.5000000), wk = 0.0022831 k( 435) = ( -0.4482759 0.4482759 0.5000000), wk = 0.0022831 k( 436) = ( -0.4655172 0.4655172 0.5000000), wk = 0.0022831 k( 437) = ( -0.4827586 0.4827586 0.5000000), wk = 0.0022831 k( 438) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022831 Dense grid: 39479 G-vectors FFT dimensions: ( 60, 60, 45) Smooth grid: 22523 G-vectors FFT dimensions: ( 48, 48, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.07 Mb ( 128, 38) NL pseudopotentials 0.09 Mb ( 64, 96) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 823) G-vector shells 0.00 Mb ( 426) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.30 Mb ( 128, 152) Each subspace H/S matrix 0.35 Mb ( 152, 152) Each matrix 0.11 Mb ( 96, 2, 38) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./ZrAl.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.2 secs Computing kpt #: 2 total cpu time spent up to now is 42.4 secs Computing kpt #: 3 total cpu time spent up to now is 43.5 secs Computing kpt #: 4 total cpu time spent up to now is 44.5 secs Computing kpt #: 5 total cpu time spent up to now is 45.4 secs Computing kpt #: 6 total cpu time spent up to now is 46.3 secs Computing kpt #: 7 total cpu time spent up to now is 47.1 secs Computing kpt #: 8 total cpu time spent up to now is 48.0 secs Computing kpt #: 9 total cpu time spent up to now is 49.0 secs Computing kpt #: 10 total cpu time spent up to now is 49.9 secs Computing kpt #: 11 total cpu time spent up to now is 50.8 secs Computing kpt #: 12 total cpu time spent up to now is 51.7 secs Computing kpt #: 13 total cpu time spent up to now is 52.6 secs Computing kpt #: 14 total cpu time spent up to now is 53.4 secs Computing kpt #: 15 total cpu time spent up to now is 54.3 secs Computing kpt #: 16 total cpu time spent up to now is 55.4 secs Computing kpt #: 17 total cpu time spent up to now is 56.3 secs Computing kpt #: 18 total cpu time spent up to now is 57.2 secs Computing kpt #: 19 total cpu time spent up to now is 58.1 secs Computing kpt #: 20 total cpu time spent up to now is 59.0 secs Computing kpt #: 21 total cpu time spent up to now is 59.9 secs Computing kpt #: 22 total cpu time spent up to now is 60.9 secs Computing kpt #: 23 total cpu time spent up to now is 61.8 secs Computing kpt #: 24 total cpu time spent up to now is 62.6 secs Computing kpt #: 25 total cpu time spent up to now is 63.4 secs Computing kpt #: 26 total cpu time spent up to now is 64.3 secs Computing kpt #: 27 total cpu time spent up to now is 65.2 secs Computing kpt #: 28 total cpu time spent up to now is 66.1 secs Computing kpt #: 29 total cpu time spent up to now is 67.0 secs Computing kpt #: 30 total cpu time spent up to now is 68.0 secs Computing kpt #: 31 total cpu time spent up to now is 68.9 secs Computing kpt #: 32 total cpu time spent up to now is 70.3 secs Computing kpt #: 33 total cpu time spent up to now is 71.3 secs Computing kpt #: 34 total cpu time spent up to now is 72.3 secs Computing kpt #: 35 total cpu time spent up to now is 73.3 secs Computing kpt #: 36 total cpu time spent up to now is 74.2 secs Computing kpt #: 37 total cpu time spent up to now is 75.0 secs Computing kpt #: 38 total cpu time spent up to now is 75.9 secs Computing kpt #: 39 total cpu time spent up to now is 76.7 secs Computing kpt #: 40 total cpu time spent up to now is 77.7 secs Computing kpt #: 41 total cpu time spent up to now is 78.6 secs Computing kpt #: 42 total cpu time spent up to now is 79.6 secs Computing kpt #: 43 total cpu time spent up to now is 80.4 secs Computing kpt #: 44 total cpu time spent up to now is 81.2 secs Computing kpt #: 45 total cpu time spent up to now is 82.0 secs Computing kpt #: 46 total cpu time spent up to now is 82.7 secs Computing kpt #: 47 total cpu time spent up to now is 83.5 secs Computing kpt #: 48 total cpu time spent up to now is 84.2 secs Computing kpt #: 49 total cpu time spent up to now is 85.0 secs Computing kpt #: 50 total cpu time spent up to now is 85.9 secs Computing kpt #: 51 total cpu time spent up to now is 86.7 secs Computing kpt #: 52 total cpu time spent up to now is 87.5 secs Computing kpt #: 53 total cpu time spent up to now is 88.6 secs Computing kpt #: 54 total cpu time spent up to now is 89.8 secs Computing kpt #: 55 total cpu time spent up to now is 90.8 secs Computing kpt #: 56 total cpu time spent up to now is 92.0 secs Computing kpt #: 57 total cpu time spent up to now is 92.8 secs Computing kpt #: 58 total cpu time spent up to now is 94.0 secs Computing kpt #: 59 total cpu time spent up to now is 94.9 secs Computing kpt #: 60 total cpu time spent up to now is 95.8 secs Computing kpt #: 61 total cpu time spent up to now is 96.7 secs Computing kpt #: 62 total cpu time spent up to now is 97.4 secs Computing kpt #: 63 total cpu time spent up to now is 98.2 secs Computing kpt #: 64 total cpu time spent up to now is 99.0 secs Computing kpt #: 65 total cpu time spent up to now is 99.8 secs Computing kpt #: 66 total cpu time spent up to now is 100.5 secs Computing kpt #: 67 total cpu time spent up to now is 101.3 secs Computing kpt #: 68 total cpu time spent up to now is 102.0 secs Computing kpt #: 69 total cpu time spent up to now is 102.7 secs Computing kpt #: 70 total cpu time spent up to now is 103.5 secs Computing kpt #: 71 total cpu time spent up to now is 104.3 secs Computing kpt #: 72 total cpu time spent up to now is 105.3 secs Computing kpt #: 73 total cpu time spent up to now is 106.0 secs Computing kpt #: 74 total cpu time spent up to now is 106.8 secs Computing kpt #: 75 total cpu time spent up to now is 107.6 secs Computing kpt #: 76 total cpu time spent up to now is 108.4 secs Computing kpt #: 77 total cpu time spent up to now is 109.2 secs Computing kpt #: 78 total cpu time spent up to now is 110.1 secs Computing kpt #: 79 total cpu time spent up to now is 111.0 secs Computing kpt #: 80 total cpu time spent up to now is 111.7 secs Computing kpt #: 81 total cpu time spent up to now is 112.5 secs Computing kpt #: 82 total cpu time spent up to now is 113.3 secs Computing kpt #: 83 total cpu time spent up to now is 114.0 secs Computing kpt #: 84 total cpu time spent up to now is 114.8 secs Computing kpt #: 85 total cpu time spent up to now is 116.2 secs Computing kpt #: 86 total cpu time spent up to now is 117.3 secs Computing kpt #: 87 total cpu time spent up to now is 118.2 secs Computing kpt #: 88 total cpu time spent up to now is 119.3 secs Computing kpt #: 89 total cpu time spent up to now is 121.0 secs Computing kpt #: 90 total cpu time spent up to now is 122.6 secs Computing kpt #: 91 total cpu time spent up to now is 123.5 secs Computing kpt #: 92 total cpu time spent up to now is 124.4 secs Computing kpt #: 93 total cpu time spent up to now is 125.1 secs Computing kpt #: 94 total cpu time spent up to now is 126.0 secs Computing kpt #: 95 total cpu time spent up to now is 126.7 secs Computing kpt #: 96 total cpu time spent up to now is 127.5 secs Computing kpt #: 97 total cpu time spent up to now is 128.3 secs Computing kpt #: 98 total cpu time spent up to now is 129.1 secs Computing kpt #: 99 total cpu time spent up to now is 129.8 secs Computing kpt #: 100 total cpu time spent up to now is 130.8 secs Computing kpt #: 101 total cpu time spent up to now is 131.9 secs Computing kpt #: 102 total cpu time spent up to now is 132.7 secs Computing kpt #: 103 total cpu time spent up to now is 133.8 secs Computing kpt #: 104 total cpu time spent up to now is 134.6 secs Computing kpt #: 105 total cpu time spent up to now is 135.5 secs Computing kpt #: 106 total cpu time spent up to now is 136.6 secs Computing kpt #: 107 total cpu time spent up to now is 137.6 secs Computing kpt #: 108 total cpu time spent up to now is 138.4 secs Computing kpt #: 109 total cpu time spent up to now is 139.6 secs Computing kpt #: 110 total cpu time spent up to now is 141.0 secs Computing kpt #: 111 total cpu time spent up to now is 142.1 secs Computing kpt #: 112 total cpu time spent up to now is 143.1 secs Computing kpt #: 113 total cpu time spent up to now is 144.1 secs Computing kpt #: 114 total cpu time spent up to now is 145.3 secs Computing kpt #: 115 total cpu time spent up to now is 146.2 secs Computing kpt #: 116 total cpu time spent up to now is 147.1 secs Computing kpt #: 117 total cpu time spent up to now is 147.9 secs Computing kpt #: 118 total cpu time spent up to now is 148.8 secs Computing kpt #: 119 total cpu time spent up to now is 149.6 secs Computing kpt #: 120 total cpu time spent up to now is 150.5 secs Computing kpt #: 121 total cpu time spent up to now is 151.5 secs Computing kpt #: 122 total cpu time spent up to now is 152.3 secs Computing kpt #: 123 total cpu time spent up to now is 153.4 secs Computing kpt #: 124 total cpu time spent up to now is 154.3 secs Computing kpt #: 125 total cpu time spent up to now is 155.1 secs Computing kpt #: 126 total cpu time spent up to now is 156.3 secs Computing kpt #: 127 total cpu time spent up to now is 157.4 secs Computing kpt #: 128 total cpu time spent up to now is 158.3 secs Computing kpt #: 129 total cpu time spent up to now is 159.2 secs Computing kpt #: 130 total cpu time spent up to now is 160.2 secs Computing kpt #: 131 total cpu time spent up to now is 161.1 secs Computing kpt #: 132 total cpu time spent up to now is 162.2 secs Computing kpt #: 133 total cpu time spent up to now is 163.1 secs Computing kpt #: 134 total cpu time spent up to now is 164.3 secs Computing kpt #: 135 total cpu time spent up to now is 165.4 secs Computing kpt #: 136 total cpu time spent up to now is 166.5 secs Computing kpt #: 137 total cpu time spent up to now is 167.7 secs Computing kpt #: 138 total cpu time spent up to now is 168.9 secs Computing kpt #: 139 total cpu time spent up to now is 170.1 secs Computing kpt #: 140 total cpu time spent up to now is 171.1 secs Computing kpt #: 141 total cpu time spent up to now is 172.3 secs Computing kpt #: 142 total cpu time spent up to now is 173.3 secs Computing kpt #: 143 total cpu time spent up to now is 174.5 secs Computing kpt #: 144 total cpu time spent up to now is 175.3 secs Computing kpt #: 145 total cpu time spent up to now is 176.7 secs Computing kpt #: 146 total cpu time spent up to now is 178.2 secs Computing kpt #: 147 total cpu time spent up to now is 179.4 secs Computing kpt #: 148 total cpu time spent up to now is 180.6 secs Computing kpt #: 149 total cpu time spent up to now is 181.8 secs Computing kpt #: 150 total cpu time spent up to now is 183.3 secs Computing kpt #: 151 total cpu time spent up to now is 184.3 secs Computing kpt #: 152 total cpu time spent up to now is 185.2 secs Computing kpt #: 153 total cpu time spent up to now is 186.2 secs Computing kpt #: 154 total cpu time spent up to now is 187.3 secs Computing kpt #: 155 total cpu time spent up to now is 188.3 secs Computing kpt #: 156 total cpu time spent up to now is 189.4 secs Computing kpt #: 157 total cpu time spent up to now is 191.5 secs Computing kpt #: 158 total cpu time spent up to now is 192.4 secs Computing kpt #: 159 total cpu time spent up to now is 193.6 secs Computing kpt #: 160 total cpu time spent up to now is 194.7 secs Computing kpt #: 161 total cpu time spent up to now is 195.7 secs Computing kpt #: 162 total cpu time spent up to now is 196.7 secs Computing kpt #: 163 total cpu time spent up to now is 197.8 secs Computing kpt #: 164 total cpu time spent up to now is 199.0 secs Computing kpt #: 165 total cpu time spent up to now is 200.1 secs Computing kpt #: 166 total cpu time spent up to now is 201.1 secs Computing kpt #: 167 total cpu time spent up to now is 202.1 secs Computing kpt #: 168 total cpu time spent up to now is 203.0 secs Computing kpt #: 169 total cpu time spent up to now is 203.9 secs Computing kpt #: 170 total cpu time spent up to now is 204.8 secs Computing kpt #: 171 total cpu time spent up to now is 206.6 secs Computing kpt #: 172 total cpu time spent up to now is 207.5 secs Computing kpt #: 173 total cpu time spent up to now is 208.5 secs Computing kpt #: 174 total cpu time spent up to now is 209.5 secs Computing kpt #: 175 total cpu time spent up to now is 210.6 secs Computing kpt #: 176 total cpu time spent up to now is 211.3 secs Computing kpt #: 177 total cpu time spent up to now is 212.0 secs Computing kpt #: 178 total cpu time spent up to now is 212.8 secs Computing kpt #: 179 total cpu time spent up to now is 213.7 secs Computing kpt #: 180 total cpu time spent up to now is 214.7 secs Computing kpt #: 181 total cpu time spent up to now is 215.6 secs Computing kpt #: 182 total cpu time spent up to now is 216.3 secs Computing kpt #: 183 total cpu time spent up to now is 217.1 secs Computing kpt #: 184 total cpu time spent up to now is 217.8 secs Computing kpt #: 185 total cpu time spent up to now is 218.8 secs Computing kpt #: 186 total cpu time spent up to now is 219.6 secs Computing kpt #: 187 total cpu time spent up to now is 220.3 secs Computing kpt #: 188 total cpu time spent up to now is 221.1 secs Computing kpt #: 189 total cpu time spent up to now is 221.8 secs Computing kpt #: 190 total cpu time spent up to now is 222.7 secs Computing kpt #: 191 total cpu time spent up to now is 223.5 secs Computing kpt #: 192 total cpu time spent up to now is 224.5 secs Computing kpt #: 193 total cpu time spent up to now is 225.5 secs Computing kpt #: 194 total cpu time spent up to now is 226.5 secs Computing kpt #: 195 total cpu time spent up to now is 227.5 secs Computing kpt #: 196 total cpu time spent up to now is 228.6 secs Computing kpt #: 197 total cpu time spent up to now is 229.4 secs Computing kpt #: 198 total cpu time spent up to now is 230.4 secs Computing kpt #: 199 total cpu time spent up to now is 231.4 secs Computing kpt #: 200 total cpu time spent up to now is 232.7 secs Computing kpt #: 201 total cpu time spent up to now is 233.6 secs Computing kpt #: 202 total cpu time spent up to now is 234.5 secs Computing kpt #: 203 total cpu time spent up to now is 235.5 secs Computing kpt #: 204 total cpu time spent up to now is 236.7 secs Computing kpt #: 205 total cpu time spent up to now is 237.6 secs Computing kpt #: 206 total cpu time spent up to now is 238.4 secs Computing kpt #: 207 total cpu time spent up to now is 239.3 secs Computing kpt #: 208 total cpu time spent up to now is 240.2 secs Computing kpt #: 209 total cpu time spent up to now is 241.0 secs Computing kpt #: 210 total cpu time spent up to now is 242.1 secs Computing kpt #: 211 total cpu time spent up to now is 243.0 secs Computing kpt #: 212 total cpu time spent up to now is 243.8 secs Computing kpt #: 213 total cpu time spent up to now is 244.8 secs Computing kpt #: 214 total cpu time spent up to now is 245.8 secs Computing kpt #: 215 total cpu time spent up to now is 246.7 secs Computing kpt #: 216 total cpu time spent up to now is 247.6 secs Computing kpt #: 217 total cpu time spent up to now is 248.4 secs Computing kpt #: 218 total cpu time spent up to now is 249.4 secs Computing kpt #: 219 total cpu time spent up to now is 250.3 secs Computing kpt #: 220 total cpu time spent up to now is 251.5 secs Computing kpt #: 221 total cpu time spent up to now is 252.6 secs Computing kpt #: 222 total cpu time spent up to now is 253.9 secs Computing kpt #: 223 total cpu time spent up to now is 255.2 secs Computing kpt #: 224 total cpu time spent up to now is 256.4 secs Computing kpt #: 225 total cpu time spent up to now is 257.3 secs Computing kpt #: 226 total cpu time spent up to now is 258.3 secs Computing kpt #: 227 total cpu time spent up to now is 259.3 secs Computing kpt #: 228 total cpu time spent up to now is 260.2 secs Computing kpt #: 229 total cpu time spent up to now is 261.1 secs Computing kpt #: 230 total cpu time spent up to now is 262.0 secs Computing kpt #: 231 total cpu time spent up to now is 262.9 secs Computing kpt #: 232 total cpu time spent up to now is 263.8 secs Computing kpt #: 233 total cpu time spent up to now is 264.7 secs Computing kpt #: 234 total cpu time spent up to now is 265.7 secs Computing kpt #: 235 total cpu time spent up to now is 266.8 secs Computing kpt #: 236 total cpu time spent up to now is 267.7 secs Computing kpt #: 237 total cpu time spent up to now is 268.7 secs Computing kpt #: 238 total cpu time spent up to now is 269.7 secs Computing kpt #: 239 total cpu time spent up to now is 270.6 secs Computing kpt #: 240 total cpu time spent up to now is 271.4 secs Computing kpt #: 241 total cpu time spent up to now is 272.3 secs Computing kpt #: 242 total cpu time spent up to now is 273.3 secs Computing kpt #: 243 total cpu time spent up to now is 274.1 secs Computing kpt #: 244 total cpu time spent up to now is 275.1 secs Computing kpt #: 245 total cpu time spent up to now is 276.0 secs Computing kpt #: 246 total cpu time spent up to now is 277.0 secs Computing kpt #: 247 total cpu time spent up to now is 278.4 secs Computing kpt #: 248 total cpu time spent up to now is 279.8 secs Computing kpt #: 249 total cpu time spent up to now is 281.1 secs Computing kpt #: 250 total cpu time spent up to now is 282.1 secs Computing kpt #: 251 total cpu time spent up to now is 283.0 secs Computing kpt #: 252 total cpu time spent up to now is 283.9 secs Computing kpt #: 253 total cpu time spent up to now is 284.8 secs Computing kpt #: 254 total cpu time spent up to now is 285.6 secs Computing kpt #: 255 total cpu time spent up to now is 286.5 secs Computing kpt #: 256 total cpu time spent up to now is 287.4 secs Computing kpt #: 257 total cpu time spent up to now is 288.3 secs Computing kpt #: 258 total cpu time spent up to now is 289.5 secs Computing kpt #: 259 total cpu time spent up to now is 290.6 secs Computing kpt #: 260 total cpu time spent up to now is 291.5 secs Computing kpt #: 261 total cpu time spent up to now is 292.5 secs Computing kpt #: 262 total cpu time spent up to now is 293.4 secs Computing kpt #: 263 total cpu time spent up to now is 294.3 secs Computing kpt #: 264 total cpu time spent up to now is 295.2 secs Computing kpt #: 265 total cpu time spent up to now is 296.1 secs Computing kpt #: 266 total cpu time spent up to now is 297.0 secs Computing kpt #: 267 total cpu time spent up to now is 297.9 secs Computing kpt #: 268 total cpu time spent up to now is 298.8 secs Computing kpt #: 269 total cpu time spent up to now is 299.6 secs Computing kpt #: 270 total cpu time spent up to now is 300.6 secs Computing kpt #: 271 total cpu time spent up to now is 301.4 secs Computing kpt #: 272 total cpu time spent up to now is 302.3 secs Computing kpt #: 273 total cpu time spent up to now is 303.1 secs Computing kpt #: 274 total cpu time spent up to now is 304.1 secs Computing kpt #: 275 total cpu time spent up to now is 305.0 secs Computing kpt #: 276 total cpu time spent up to now is 305.8 secs Computing kpt #: 277 total cpu time spent up to now is 306.6 secs Computing kpt #: 278 total cpu time spent up to now is 307.5 secs Computing kpt #: 279 total cpu time spent up to now is 308.7 secs Computing kpt #: 280 total cpu time spent up to now is 310.4 secs Computing kpt #: 281 total cpu time spent up to now is 311.2 secs Computing kpt #: 282 total cpu time spent up to now is 311.9 secs Computing kpt #: 283 total cpu time spent up to now is 312.6 secs Computing kpt #: 284 total cpu time spent up to now is 313.3 secs Computing kpt #: 285 total cpu time spent up to now is 314.0 secs Computing kpt #: 286 total cpu time spent up to now is 314.7 secs Computing kpt #: 287 total cpu time spent up to now is 315.4 secs Computing kpt #: 288 total cpu time spent up to now is 316.3 secs Computing kpt #: 289 total cpu time spent up to now is 317.3 secs Computing kpt #: 290 total cpu time spent up to now is 318.0 secs Computing kpt #: 291 total cpu time spent up to now is 318.8 secs Computing kpt #: 292 total cpu time spent up to now is 319.5 secs Computing kpt #: 293 total cpu time spent up to now is 320.3 secs Computing kpt #: 294 total cpu time spent up to now is 321.1 secs Computing kpt #: 295 total cpu time spent up to now is 321.8 secs Computing kpt #: 296 total cpu time spent up to now is 322.8 secs Computing kpt #: 297 total cpu time spent up to now is 323.7 secs Computing kpt #: 298 total cpu time spent up to now is 324.7 secs Computing kpt #: 299 total cpu time spent up to now is 325.8 secs Computing kpt #: 300 total cpu time spent up to now is 326.9 secs Computing kpt #: 301 total cpu time spent up to now is 327.8 secs Computing kpt #: 302 total cpu time spent up to now is 328.7 secs Computing kpt #: 303 total cpu time spent up to now is 329.5 secs Computing kpt #: 304 total cpu time spent up to now is 330.4 secs Computing kpt #: 305 total cpu time spent up to now is 331.3 secs Computing kpt #: 306 total cpu time spent up to now is 332.1 secs Computing kpt #: 307 total cpu time spent up to now is 333.0 secs Computing kpt #: 308 total cpu time spent up to now is 333.8 secs Computing kpt #: 309 total cpu time spent up to now is 334.5 secs Computing kpt #: 310 total cpu time spent up to now is 335.3 secs Computing kpt #: 311 total cpu time spent up to now is 336.2 secs Computing kpt #: 312 total cpu time spent up to now is 336.9 secs Computing kpt #: 313 total cpu time spent up to now is 337.7 secs Computing kpt #: 314 total cpu time spent up to now is 338.5 secs Computing kpt #: 315 total cpu time spent up to now is 339.3 secs Computing kpt #: 316 total cpu time spent up to now is 340.1 secs Computing kpt #: 317 total cpu time spent up to now is 340.9 secs Computing kpt #: 318 total cpu time spent up to now is 341.7 secs Computing kpt #: 319 total cpu time spent up to now is 342.7 secs Computing kpt #: 320 total cpu time spent up to now is 343.5 secs Computing kpt #: 321 total cpu time spent up to now is 344.2 secs Computing kpt #: 322 total cpu time spent up to now is 345.0 secs Computing kpt #: 323 total cpu time spent up to now is 345.8 secs Computing kpt #: 324 total cpu time spent up to now is 346.7 secs Computing kpt #: 325 total cpu time spent up to now is 347.6 secs Computing kpt #: 326 total cpu time spent up to now is 348.5 secs Computing kpt #: 327 total cpu time spent up to now is 349.3 secs Computing kpt #: 328 total cpu time spent up to now is 350.3 secs Computing kpt #: 329 total cpu time spent up to now is 351.1 secs Computing kpt #: 330 total cpu time spent up to now is 352.0 secs Computing kpt #: 331 total cpu time spent up to now is 352.9 secs Computing kpt #: 332 total cpu time spent up to now is 353.8 secs Computing kpt #: 333 total cpu time spent up to now is 354.6 secs Computing kpt #: 334 total cpu time spent up to now is 355.7 secs Computing kpt #: 335 total cpu time spent up to now is 356.6 secs Computing kpt #: 336 total cpu time spent up to now is 357.5 secs Computing kpt #: 337 total cpu time spent up to now is 358.3 secs Computing kpt #: 338 total cpu time spent up to now is 359.2 secs Computing kpt #: 339 total cpu time spent up to now is 360.1 secs Computing kpt #: 340 total cpu time spent up to now is 361.0 secs Computing kpt #: 341 total cpu time spent up to now is 362.3 secs Computing kpt #: 342 total cpu time spent up to now is 363.4 secs Computing kpt #: 343 total cpu time spent up to now is 364.2 secs Computing kpt #: 344 total cpu time spent up to now is 365.2 secs Computing kpt #: 345 total cpu time spent up to now is 366.1 secs Computing kpt #: 346 total cpu time spent up to now is 366.9 secs Computing kpt #: 347 total cpu time spent up to now is 367.8 secs Computing kpt #: 348 total cpu time spent up to now is 368.8 secs Computing kpt #: 349 total cpu time spent up to now is 369.7 secs Computing kpt #: 350 total cpu time spent up to now is 370.8 secs Computing kpt #: 351 total cpu time spent up to now is 371.8 secs Computing kpt #: 352 total cpu time spent up to now is 372.7 secs Computing kpt #: 353 total cpu time spent up to now is 373.6 secs Computing kpt #: 354 total cpu time spent up to now is 374.5 secs Computing kpt #: 355 total cpu time spent up to now is 375.6 secs Computing kpt #: 356 total cpu time spent up to now is 376.7 secs Computing kpt #: 357 total cpu time spent up to now is 377.9 secs Computing kpt #: 358 total cpu time spent up to now is 379.0 secs Computing kpt #: 359 total cpu time spent up to now is 379.8 secs Computing kpt #: 360 total cpu time spent up to now is 380.7 secs Computing kpt #: 361 total cpu time spent up to now is 381.6 secs Computing kpt #: 362 total cpu time spent up to now is 382.4 secs Computing kpt #: 363 total cpu time spent up to now is 383.4 secs Computing kpt #: 364 total cpu time spent up to now is 384.5 secs Computing kpt #: 365 total cpu time spent up to now is 385.4 secs Computing kpt #: 366 total cpu time spent up to now is 386.2 secs Computing kpt #: 367 total cpu time spent up to now is 387.0 secs Computing kpt #: 368 total cpu time spent up to now is 387.9 secs Computing kpt #: 369 total cpu time spent up to now is 389.0 secs Computing kpt #: 370 total cpu time spent up to now is 390.0 secs Computing kpt #: 371 total cpu time spent up to now is 390.7 secs Computing kpt #: 372 total cpu time spent up to now is 391.6 secs Computing kpt #: 373 total cpu time spent up to now is 392.4 secs Computing kpt #: 374 total cpu time spent up to now is 393.3 secs Computing kpt #: 375 total cpu time spent up to now is 394.1 secs Computing kpt #: 376 total cpu time spent up to now is 394.8 secs Computing kpt #: 377 total cpu time spent up to now is 395.6 secs Computing kpt #: 378 total cpu time spent up to now is 396.3 secs Computing kpt #: 379 total cpu time spent up to now is 397.0 secs Computing kpt #: 380 total cpu time spent up to now is 397.9 secs Computing kpt #: 381 total cpu time spent up to now is 398.8 secs Computing kpt #: 382 total cpu time spent up to now is 399.6 secs Computing kpt #: 383 total cpu time spent up to now is 400.5 secs Computing kpt #: 384 total cpu time spent up to now is 401.4 secs Computing kpt #: 385 total cpu time spent up to now is 402.4 secs Computing kpt #: 386 total cpu time spent up to now is 403.4 secs Computing kpt #: 387 total cpu time spent up to now is 404.3 secs Computing kpt #: 388 total cpu time spent up to now is 405.3 secs Computing kpt #: 389 total cpu time spent up to now is 406.3 secs Computing kpt #: 390 total cpu time spent up to now is 407.3 secs Computing kpt #: 391 total cpu time spent up to now is 408.2 secs Computing kpt #: 392 total cpu time spent up to now is 409.1 secs Computing kpt #: 393 total cpu time spent up to now is 410.0 secs Computing kpt #: 394 total cpu time spent up to now is 410.9 secs Computing kpt #: 395 total cpu time spent up to now is 412.0 secs Computing kpt #: 396 total cpu time spent up to now is 413.1 secs Computing kpt #: 397 total cpu time spent up to now is 414.0 secs Computing kpt #: 398 total cpu time spent up to now is 414.9 secs Computing kpt #: 399 total cpu time spent up to now is 415.9 secs Computing kpt #: 400 total cpu time spent up to now is 416.9 secs Computing kpt #: 401 total cpu time spent up to now is 418.0 secs Computing kpt #: 402 total cpu time spent up to now is 419.3 secs Computing kpt #: 403 total cpu time spent up to now is 420.9 secs Computing kpt #: 404 total cpu time spent up to now is 422.0 secs Computing kpt #: 405 total cpu time spent up to now is 422.9 secs Computing kpt #: 406 total cpu time spent up to now is 423.7 secs Computing kpt #: 407 total cpu time spent up to now is 424.6 secs Computing kpt #: 408 total cpu time spent up to now is 425.5 secs Computing kpt #: 409 total cpu time spent up to now is 426.2 secs Computing kpt #: 410 total cpu time spent up to now is 427.0 secs Computing kpt #: 411 total cpu time spent up to now is 427.8 secs Computing kpt #: 412 total cpu time spent up to now is 428.6 secs Computing kpt #: 413 total cpu time spent up to now is 429.4 secs Computing kpt #: 414 total cpu time spent up to now is 430.1 secs Computing kpt #: 415 total cpu time spent up to now is 430.9 secs Computing kpt #: 416 total cpu time spent up to now is 431.6 secs Computing kpt #: 417 total cpu time spent up to now is 432.3 secs Computing kpt #: 418 total cpu time spent up to now is 433.0 secs Computing kpt #: 419 total cpu time spent up to now is 434.0 secs Computing kpt #: 420 total cpu time spent up to now is 434.9 secs Computing kpt #: 421 total cpu time spent up to now is 435.6 secs Computing kpt #: 422 total cpu time spent up to now is 436.3 secs Computing kpt #: 423 total cpu time spent up to now is 437.0 secs Computing kpt #: 424 total cpu time spent up to now is 437.7 secs Computing kpt #: 425 total cpu time spent up to now is 438.5 secs Computing kpt #: 426 total cpu time spent up to now is 439.3 secs Computing kpt #: 427 total cpu time spent up to now is 440.2 secs Computing kpt #: 428 total cpu time spent up to now is 440.9 secs Computing kpt #: 429 total cpu time spent up to now is 441.6 secs Computing kpt #: 430 total cpu time spent up to now is 442.3 secs Computing kpt #: 431 total cpu time spent up to now is 443.2 secs Computing kpt #: 432 total cpu time spent up to now is 443.9 secs Computing kpt #: 433 total cpu time spent up to now is 444.9 secs Computing kpt #: 434 total cpu time spent up to now is 445.8 secs Computing kpt #: 435 total cpu time spent up to now is 446.8 secs Computing kpt #: 436 total cpu time spent up to now is 447.7 secs Computing kpt #: 437 total cpu time spent up to now is 448.4 secs Computing kpt #: 438 total cpu time spent up to now is 449.3 secs ethr = 3.33E-11, avg # of iterations = 26.5 total cpu time spent up to now is 449.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2801 PWs) bands (ev): -37.4557 -37.4557 -37.3998 -37.3998 -16.7272 -16.7272 -16.5559 -16.5559 -15.0844 -15.0844 -14.8495 -14.8495 -14.8453 -14.8453 -14.6971 -14.6971 2.8280 2.8280 6.5732 6.5732 8.9283 8.9283 9.3516 9.3516 9.5436 9.5436 11.1163 11.1163 12.1424 12.1424 12.5742 12.5742 12.7387 12.7387 13.0786 13.0786 13.3704 13.3704 k = 0.0053 0.0172-0.0000 ( 2805 PWs) bands (ev): -37.4557 -37.4557 -37.3998 -37.3998 -16.7272 -16.7272 -16.5561 -16.5561 -15.0843 -15.0843 -14.8509 -14.8509 -14.8442 -14.8442 -14.6974 -14.6974 2.8296 2.8296 6.5746 6.5746 8.9284 8.9284 9.3537 9.3537 9.5446 9.5446 11.1139 11.1139 12.1362 12.1362 12.5744 12.5744 12.7173 12.7173 13.1004 13.1004 13.3187 13.3187 k = 0.0105 0.0343-0.0000 ( 2805 PWs) bands (ev): -37.4556 -37.4556 -37.3998 -37.3998 -16.7273 -16.7273 -16.5564 -16.5564 -15.0840 -15.0840 -14.8536 -14.8536 -14.8422 -14.8422 -14.6983 -14.6983 2.8344 2.8344 6.5787 6.5787 8.9286 8.9286 9.3600 9.3600 9.5475 9.5475 11.1066 11.1066 12.1179 12.1179 12.5730 12.5730 12.6668 12.6668 13.1535 13.1535 13.2344 13.2344 k = 0.0158 0.0515-0.0000 ( 2809 PWs) bands (ev): -37.4554 -37.4554 -37.3997 -37.3997 -16.7273 -16.7273 -16.5570 -16.5570 -15.0835 -15.0835 -14.8567 -14.8567 -14.8403 -14.8403 -14.6998 -14.6998 2.8423 2.8423 6.5854 6.5854 8.9290 8.9290 9.3706 9.3706 9.5523 9.5523 11.0946 11.0946 12.0882 12.0882 12.5528 12.5528 12.6214 12.6214 13.1419 13.1419 13.2252 13.2252 k = 0.0210 0.0686-0.0000 ( 2813 PWs) bands (ev): -37.4551 -37.4551 -37.3997 -37.3997 -16.7275 -16.7275 -16.5578 -16.5578 -15.0829 -15.0829 -14.8602 -14.8602 -14.8386 -14.8386 -14.7019 -14.7019 2.8535 2.8535 6.5949 6.5949 8.9293 8.9293 9.3852 9.3852 9.5591 9.5591 11.0779 11.0779 12.0483 12.0483 12.4892 12.4892 12.6144 12.6144 13.0514 13.0514 13.3002 13.3002 k = 0.0263 0.0858-0.0000 ( 2813 PWs) bands (ev): -37.4547 -37.4547 -37.3995 -37.3995 -16.7276 -16.7276 -16.5588 -16.5588 -15.0821 -15.0821 -14.8639 -14.8639 -14.8370 -14.8370 -14.7046 -14.7046 2.8677 2.8677 6.6071 6.6071 8.9295 8.9295 9.4040 9.4040 9.5677 9.5677 11.0569 11.0569 11.9996 11.9996 12.4088 12.4088 12.6232 12.6232 12.9599 12.9599 13.3783 13.3783 k = 0.0316 0.1029-0.0000 ( 2809 PWs) bands (ev): -37.4543 -37.4543 -37.3993 -37.3993 -16.7278 -16.7278 -16.5601 -16.5601 -15.0811 -15.0811 -14.8680 -14.8680 -14.8356 -14.8356 -14.7079 -14.7079 2.8852 2.8852 6.6219 6.6219 8.9294 8.9294 9.4267 9.4267 9.5782 9.5782 11.0316 11.0316 11.9434 11.9434 12.3238 12.3238 12.6376 12.6376 12.8688 12.8688 13.4572 13.4572 k = 0.0368 0.1201-0.0000 ( 2803 PWs) bands (ev): -37.4537 -37.4537 -37.3991 -37.3991 -16.7280 -16.7280 -16.5616 -16.5616 -15.0799 -15.0799 -14.8723 -14.8723 -14.8343 -14.8343 -14.7117 -14.7117 2.9057 2.9057 6.6394 6.6394 8.9286 8.9286 9.4533 9.4533 9.5905 9.5905 11.0026 11.0026 11.8813 11.8813 12.2369 12.2369 12.6541 12.6541 12.7801 12.7801 13.5356 13.5356 k = 0.0421 0.1373-0.0000 ( 2797 PWs) bands (ev): -37.4530 -37.4530 -37.3989 -37.3989 -16.7282 -16.7282 -16.5633 -16.5633 -15.0785 -15.0785 -14.8769 -14.8769 -14.8333 -14.8333 -14.7161 -14.7161 2.9293 2.9293 6.6595 6.6595 8.9269 8.9269 9.4836 9.4836 9.6045 9.6045 10.9703 10.9703 11.8145 11.8145 12.1492 12.1492 12.6538 12.6538 12.7127 12.7127 13.6129 13.6129 k = 0.0473 0.1544-0.0000 ( 2797 PWs) bands (ev): -37.4523 -37.4523 -37.3987 -37.3987 -16.7285 -16.7285 -16.5652 -16.5652 -15.0770 -15.0770 -14.8817 -14.8817 -14.8323 -14.8323 -14.7209 -14.7209 2.9560 2.9560 6.6822 6.6822 8.9241 8.9241 9.5174 9.5174 9.6203 9.6203 10.9351 10.9351 11.7441 11.7441 12.0614 12.0614 12.5829 12.5829 12.7207 12.7207 13.6886 13.6886 k = 0.0526 0.1716-0.0000 ( 2803 PWs) bands (ev): -37.4516 -37.4516 -37.3985 -37.3985 -16.7288 -16.7288 -16.5674 -16.5674 -15.0754 -15.0754 -14.8868 -14.8868 -14.8316 -14.8316 -14.7263 -14.7263 2.9858 2.9858 6.7075 6.7075 8.9196 8.9196 9.5545 9.5545 9.6377 9.6377 10.8976 10.8976 11.6712 11.6712 11.9739 11.9739 12.4951 12.4951 12.7504 12.7504 13.7623 13.7623 k = 0.0579 0.1887-0.0000 ( 2801 PWs) bands (ev): -37.4507 -37.4507 -37.3982 -37.3982 -16.7291 -16.7291 -16.5697 -16.5697 -15.0735 -15.0735 -14.8921 -14.8921 -14.8309 -14.8309 -14.7320 -14.7320 3.0185 3.0185 6.7354 6.7354 8.9131 8.9131 9.5947 9.5947 9.6567 9.6567 10.8585 10.8585 11.5967 11.5967 11.8868 11.8868 12.4062 12.4062 12.7866 12.7866 13.8338 13.8338 k = 0.0631 0.2059-0.0000 ( 2801 PWs) bands (ev): -37.4498 -37.4498 -37.3980 -37.3980 -16.7295 -16.7295 -16.5723 -16.5723 -15.0716 -15.0716 -14.8976 -14.8976 -14.8304 -14.8304 -14.7382 -14.7382 3.0541 3.0541 6.7658 6.7658 8.9041 8.9041 9.6373 9.6373 9.6773 9.6773 10.8185 10.8185 11.5214 11.5214 11.8006 11.8006 12.3175 12.3175 12.8277 12.8277 13.9028 13.9028 k = 0.0684 0.2230-0.0000 ( 2799 PWs) bands (ev): -37.4488 -37.4488 -37.3977 -37.3977 -16.7299 -16.7299 -16.5751 -16.5751 -15.0695 -15.0695 -14.9033 -14.9033 -14.8300 -14.8300 -14.7448 -14.7448 3.0927 3.0927 6.7986 6.7986 8.8923 8.8923 9.6807 9.6807 9.7010 9.7010 10.7784 10.7784 11.4459 11.4459 11.7153 11.7153 12.2297 12.2297 12.8737 12.8737 13.9690 13.9690 k = 0.0736 0.2402-0.0000 ( 2799 PWs) bands (ev): -37.4477 -37.4477 -37.3974 -37.3974 -16.7303 -16.7303 -16.5780 -16.5780 -15.0673 -15.0673 -14.9092 -14.9092 -14.8298 -14.8298 -14.7518 -14.7518 3.1341 3.1341 6.8340 6.8340 8.8770 8.8770 9.7151 9.7151 9.7367 9.7367 10.7388 10.7388 11.3711 11.3711 11.6312 11.6312 12.1429 12.1429 12.9242 12.9242 14.0320 14.0320 k = 0.0789 0.2574-0.0000 ( 2801 PWs) bands (ev): -37.4466 -37.4466 -37.3971 -37.3971 -16.7308 -16.7308 -16.5811 -16.5811 -15.0650 -15.0650 -14.9153 -14.9153 -14.8296 -14.8296 -14.7590 -14.7590 3.1784 3.1784 6.8718 6.8718 8.8578 8.8578 9.7402 9.7402 9.7843 9.7843 10.7005 10.7005 11.2976 11.2976 11.5484 11.5484 12.0574 12.0574 12.9793 12.9793 14.0863 14.0863 k = 0.0842 0.2745-0.0000 ( 2805 PWs) bands (ev): -37.4454 -37.4454 -37.3968 -37.3968 -16.7312 -16.7312 -16.5845 -16.5845 -15.0625 -15.0625 -14.9214 -14.9214 -14.8296 -14.8296 -14.7665 -14.7665 3.2254 3.2254 6.9119 6.9119 8.8343 8.8343 9.7640 9.7640 9.8349 9.8349 10.6642 10.6642 11.2260 11.2260 11.4670 11.4670 11.9733 11.9733 13.0387 13.0387 14.0558 14.0558 k = 0.0894 0.2917-0.0000 ( 2797 PWs) bands (ev): -37.4442 -37.4442 -37.3964 -37.3964 -16.7317 -16.7317 -16.5879 -16.5879 -15.0600 -15.0600 -14.9277 -14.9277 -14.8297 -14.8297 -14.7742 -14.7742 3.2750 3.2750 6.9545 6.9545 8.8062 8.8062 9.7874 9.7874 9.8865 9.8865 10.6306 10.6306 11.1570 11.1570 11.3871 11.3871 11.8910 11.8910 13.1023 13.1023 14.0096 14.0096 k = 0.0947 0.3088-0.0000 ( 2801 PWs) bands (ev): -37.4429 -37.4429 -37.3961 -37.3961 -16.7322 -16.7322 -16.5916 -16.5916 -15.0574 -15.0574 -14.9340 -14.9340 -14.8298 -14.8298 -14.7822 -14.7822 3.3274 3.3274 6.9993 6.9993 8.7731 8.7731 9.8101 9.8101 9.9384 9.9384 10.6001 10.6001 11.0915 11.0915 11.3090 11.3090 11.8106 11.8106 13.1695 13.1695 13.9605 13.9605 k = 0.0999 0.3260-0.0000 ( 2801 PWs) bands (ev): -37.4416 -37.4416 -37.3958 -37.3958 -16.7327 -16.7327 -16.5954 -16.5954 -15.0548 -15.0548 -14.9404 -14.9404 -14.8301 -14.8301 -14.7902 -14.7902 3.3823 3.3823 7.0464 7.0464 8.7348 8.7348 9.8315 9.8315 9.9897 9.9897 10.5732 10.5732 11.0301 11.0301 11.2327 11.2327 11.7325 11.7325 13.2396 13.2396 13.9096 13.9096 k = 0.1052 0.3431-0.0000 ( 2799 PWs) bands (ev): -37.4402 -37.4402 -37.3955 -37.3955 -16.7332 -16.7332 -16.5993 -16.5993 -15.0521 -15.0521 -14.9468 -14.9468 -14.8306 -14.8306 -14.7983 -14.7983 3.4396 3.4396 7.0957 7.0957 8.6914 8.6914 9.8508 9.8508 10.0397 10.0397 10.5502 10.5502 10.9740 10.9740 11.1583 11.1583 11.6570 11.6570 13.3110 13.3110 13.8584 13.8584 k = 0.1104 0.3603-0.0000 ( 2801 PWs) bands (ev): -37.4388 -37.4388 -37.3952 -37.3952 -16.7336 -16.7336 -16.6034 -16.6034 -15.0494 -15.0494 -14.9531 -14.9531 -14.8311 -14.8311 -14.8065 -14.8065 3.4995 3.4995 7.1472 7.1472 8.6429 8.6429 9.8672 9.8672 10.0871 10.0871 10.5312 10.5312 10.9242 10.9242 11.0859 11.0859 11.5847 11.5847 13.3802 13.3802 13.8107 13.8107 k = 0.1157 0.3775-0.0000 ( 2801 PWs) bands (ev): -37.4374 -37.4374 -37.3949 -37.3949 -16.7341 -16.7341 -16.6076 -16.6076 -15.0467 -15.0467 -14.9594 -14.9594 -14.8318 -14.8318 -14.8145 -14.8145 3.5616 3.5616 7.2009 7.2009 8.5893 8.5893 9.8796 9.8796 10.1309 10.1309 10.5162 10.5162 10.8818 10.8818 11.0157 11.0157 11.5162 11.5162 13.4385 13.4385 13.7752 13.7752 k = 0.1210 0.3946-0.0000 ( 2797 PWs) bands (ev): -37.4359 -37.4359 -37.3946 -37.3946 -16.7346 -16.7346 -16.6119 -16.6119 -15.0440 -15.0440 -14.9656 -14.9656 -14.8329 -14.8329 -14.8223 -14.8223 3.6260 3.6260 7.2566 7.2566 8.5312 8.5312 9.8870 9.8870 10.1697 10.1697 10.5050 10.5050 10.8479 10.8479 10.9479 10.9479 11.4522 11.4522 13.4680 13.4680 13.7696 13.7696 k = 0.1262 0.4118-0.0000 ( 2805 PWs) bands (ev): -37.4344 -37.4344 -37.3944 -37.3944 -16.7351 -16.7351 -16.6163 -16.6163 -15.0414 -15.0414 -14.9717 -14.9717 -14.8352 -14.8352 -14.8288 -14.8288 3.6926 3.6926 7.3143 7.3143 8.4687 8.4687 9.8883 9.8883 10.2021 10.2021 10.4976 10.4976 10.8234 10.8234 10.8827 10.8827 11.3935 11.3935 13.4541 13.4541 13.8087 13.8087 k = 0.1315 0.4289-0.0000 ( 2809 PWs) bands (ev): -37.4329 -37.4329 -37.3942 -37.3942 -16.7355 -16.7355 -16.6208 -16.6208 -15.0389 -15.0389 -14.9777 -14.9777 -14.8407 -14.8407 -14.8321 -14.8321 3.7612 3.7612 7.3741 7.3741 8.4024 8.4024 9.8830 9.8830 10.2265 10.2265 10.4934 10.4934 10.8046 10.8046 10.8247 10.8247 11.3414 11.3414 13.4075 13.4075 13.8816 13.8816 k = 0.1367 0.4461-0.0000 ( 2813 PWs) bands (ev): -37.4314 -37.4314 -37.3941 -37.3941 -16.7359 -16.7359 -16.6253 -16.6253 -15.0365 -15.0365 -14.9835 -14.9835 -14.8478 -14.8478 -14.8336 -14.8336 3.8318 3.8318 7.4357 7.4357 8.3327 8.3327 9.8708 9.8708 10.2413 10.2413 10.4921 10.4921 10.7548 10.7548 10.8110 10.8110 11.2966 11.2966 13.3439 13.3439 13.9727 13.9727 k = 0.1420 0.4633-0.0000 ( 2813 PWs) bands (ev): -37.4298 -37.4298 -37.3939 -37.3939 -16.7363 -16.7363 -16.6299 -16.6299 -15.0343 -15.0343 -14.9890 -14.9890 -14.8550 -14.8550 -14.8349 -14.8349 3.9042 3.9042 7.4992 7.4992 8.2602 8.2602 9.8520 9.8520 10.2453 10.2453 10.4932 10.4932 10.6972 10.6972 10.8182 10.8182 11.2603 11.2603 13.2713 13.2713 14.0737 14.0737 k = 0.1473 0.4804-0.0000 ( 2813 PWs) bands (ev): -37.4283 -37.4283 -37.3938 -37.3938 -16.7366 -16.7366 -16.6345 -16.6345 -15.0322 -15.0322 -14.9944 -14.9944 -14.8620 -14.8620 -14.8362 -14.8362 3.9784 3.9784 7.5645 7.5645 8.1853 8.1853 9.8273 9.8273 10.2375 10.2375 10.4964 10.4964 10.6415 10.6415 10.8359 10.8359 11.2327 11.2327 13.1930 13.1930 14.1812 14.1812 k = 0.1525 0.4976-0.0000 ( 2813 PWs) bands (ev): -37.4267 -37.4267 -37.3937 -37.3937 -16.7368 -16.7368 -16.6392 -16.6392 -15.0305 -15.0305 -14.9994 -14.9994 -14.8686 -14.8686 -14.8374 -14.8374 4.0540 4.0540 7.6316 7.6316 8.1086 8.1086 9.7977 9.7977 10.2176 10.2176 10.5014 10.5014 10.5884 10.5884 10.8627 10.8627 11.2139 11.2139 13.1108 13.1108 14.2933 14.2933 k = 0.1578 0.5147-0.0000 ( 2813 PWs) bands (ev): -37.4251 -37.4251 -37.3936 -37.3936 -16.7370 -16.7370 -16.6438 -16.6438 -15.0291 -15.0291 -15.0041 -15.0041 -14.8749 -14.8749 -14.8388 -14.8388 4.1310 4.1310 7.7002 7.7002 8.0305 8.0305 9.7644 9.7644 10.1858 10.1858 10.5081 10.5081 10.5378 10.5378 10.8973 10.8973 11.2030 11.2030 13.0254 13.0254 14.4082 14.4082 k = 0.1630 0.5319-0.0000 ( 2815 PWs) bands (ev): -37.4236 -37.4236 -37.3936 -37.3936 -16.7371 -16.7371 -16.6485 -16.6485 -15.0281 -15.0281 -15.0084 -15.0084 -14.8806 -14.8806 -14.8403 -14.8403 4.2093 4.2093 7.7705 7.7705 7.9517 7.9517 9.7284 9.7284 10.1431 10.1431 10.4900 10.4900 10.5164 10.5164 10.9385 10.9385 11.1989 11.1989 12.9375 12.9375 14.5164 14.5164 k = 0.1683 0.5490-0.0000 ( 2815 PWs) bands (ev): -37.4220 -37.4220 -37.3936 -37.3936 -16.7371 -16.7371 -16.6531 -16.6531 -15.0276 -15.0276 -15.0123 -15.0123 -14.8857 -14.8857 -14.8418 -14.8418 4.2884 4.2884 7.8422 7.8422 7.8726 7.8726 9.6906 9.6906 10.0907 10.0907 10.4449 10.4449 10.5261 10.5261 10.9854 10.9854 11.2000 11.2000 12.8474 12.8474 14.5334 14.5334 k = 0.1736 0.5662-0.0000 ( 2815 PWs) bands (ev): -37.4205 -37.4205 -37.3937 -37.3937 -16.7370 -16.7370 -16.6577 -16.6577 -15.0278 -15.0278 -15.0155 -15.0155 -14.8902 -14.8902 -14.8434 -14.8434 4.3683 4.3683 7.7938 7.7938 7.9153 7.9153 9.6518 9.6518 10.0300 10.0300 10.4027 10.4027 10.5371 10.5371 11.0371 11.0371 11.2052 11.2052 12.7556 12.7556 14.5255 14.5255 k = 0.1788 0.5834-0.0000 ( 2807 PWs) bands (ev): -37.4190 -37.4190 -37.3938 -37.3938 -16.7369 -16.7369 -16.6622 -16.6622 -15.0287 -15.0287 -15.0181 -15.0181 -14.8941 -14.8941 -14.8451 -14.8451 4.4486 4.4486 7.7157 7.7157 7.9896 7.9896 9.6127 9.6127 9.9624 9.9624 10.3634 10.3634 10.5492 10.5492 11.0926 11.0926 11.2135 11.2135 12.6622 12.6622 14.5130 14.5130 k = 0.1841 0.6005-0.0000 ( 2815 PWs) bands (ev): -37.4175 -37.4175 -37.3939 -37.3939 -16.7366 -16.7366 -16.6667 -16.6667 -15.0303 -15.0303 -15.0201 -15.0201 -14.8973 -14.8973 -14.8469 -14.8469 4.5289 4.5289 7.6390 7.6390 8.0651 8.0651 9.5738 9.5738 9.8891 9.8891 10.3269 10.3269 10.5623 10.5623 11.1504 11.1504 11.2250 11.2250 12.5675 12.5675 14.4970 14.4970 k = 0.1893 0.6177-0.0000 ( 2817 PWs) bands (ev): -37.4161 -37.4161 -37.3941 -37.3941 -16.7361 -16.7361 -16.6710 -16.6710 -15.0322 -15.0322 -15.0218 -15.0218 -14.8998 -14.8998 -14.8488 -14.8488 4.6088 4.6088 7.5642 7.5642 8.1416 8.1416 9.5355 9.5355 9.8109 9.8109 10.2935 10.2935 10.5762 10.5762 11.2043 11.2043 11.2449 11.2449 12.4718 12.4718 14.4777 14.4777 k = 0.1946 0.6348-0.0000 ( 2829 PWs) bands (ev): -37.4147 -37.4147 -37.3944 -37.3944 -16.7356 -16.7356 -16.6753 -16.6753 -15.0342 -15.0342 -15.0235 -15.0235 -14.9016 -14.9016 -14.8507 -14.8507 4.6879 4.6879 7.4920 7.4920 8.2189 8.2189 9.4981 9.4981 9.7288 9.7288 10.2630 10.2630 10.5908 10.5908 11.2340 11.2340 11.2927 11.2927 12.3753 12.3753 14.4553 14.4553 k = 0.1999 0.6520-0.0000 ( 2833 PWs) bands (ev): -37.4134 -37.4134 -37.3947 -37.3947 -16.7349 -16.7349 -16.6795 -16.6795 -15.0361 -15.0361 -15.0252 -15.0252 -14.9028 -14.9028 -14.8527 -14.8527 4.7655 4.7655 7.4231 7.4231 8.2968 8.2968 9.4620 9.4620 9.6436 9.6436 10.2355 10.2355 10.6061 10.6061 11.2503 11.2503 11.3574 11.3574 12.2781 12.2781 14.4300 14.4300 k = 0.2051 0.6691-0.0000 ( 2831 PWs) bands (ev): -37.4120 -37.4120 -37.3951 -37.3951 -16.7340 -16.7340 -16.6835 -16.6835 -15.0377 -15.0377 -15.0271 -15.0271 -14.9034 -14.9034 -14.8548 -14.8548 4.8409 4.8409 7.3584 7.3584 8.3749 8.3749 9.4272 9.4272 9.5559 9.5559 10.2110 10.2110 10.6221 10.6221 11.2652 11.2652 11.4267 11.4267 12.1806 12.1806 14.4020 14.4020 k = 0.2104 0.6863-0.0000 ( 2827 PWs) bands (ev): -37.4107 -37.4107 -37.3955 -37.3955 -16.7330 -16.7330 -16.6874 -16.6874 -15.0391 -15.0391 -15.0291 -15.0291 -14.9034 -14.9034 -14.8570 -14.8570 4.9134 4.9134 7.2987 7.2987 8.4530 8.4530 9.3937 9.3937 9.4667 9.4667 10.1897 10.1897 10.6386 10.6386 11.2806 11.2806 11.4982 11.4982 12.0829 12.0829 14.3715 14.3715 k = 0.2156 0.7035-0.0000 ( 2827 PWs) bands (ev): -37.4094 -37.4094 -37.3960 -37.3960 -16.7318 -16.7318 -16.6911 -16.6911 -15.0401 -15.0401 -15.0311 -15.0311 -14.9030 -14.9030 -14.8592 -14.8592 4.9819 4.9819 7.2452 7.2452 8.5302 8.5302 9.3592 9.3592 9.3795 9.3795 10.1714 10.1714 10.6557 10.6557 11.2973 11.2973 11.5713 11.5713 11.9854 11.9854 14.3388 14.3388 k = 0.2209 0.7206-0.0000 ( 2825 PWs) bands (ev): -37.4082 -37.4082 -37.3966 -37.3966 -16.7305 -16.7305 -16.6947 -16.6947 -15.0408 -15.0408 -15.0332 -15.0332 -14.9022 -14.9022 -14.8615 -14.8615 5.0453 5.0453 7.1989 7.1989 8.6053 8.6053 9.2842 9.2842 9.3352 9.3352 10.1562 10.1562 10.6734 10.6734 11.3156 11.3156 11.6449 11.6449 11.8889 11.8889 14.3039 14.3039 k = 0.2262 0.7378-0.0000 ( 2825 PWs) bands (ev): -37.4070 -37.4070 -37.3972 -37.3972 -16.7289 -16.7289 -16.6981 -16.6981 -15.0411 -15.0411 -15.0353 -15.0353 -14.9010 -14.9010 -14.8638 -14.8638 5.1025 5.1025 7.1611 7.1611 8.6757 8.6757 9.1985 9.1985 9.3069 9.3069 10.1442 10.1442 10.6916 10.6916 11.3358 11.3358 11.7126 11.7126 11.7996 11.7996 14.2671 14.2671 k = 0.2314 0.7549-0.0000 ( 2825 PWs) bands (ev): -37.4059 -37.4059 -37.3978 -37.3978 -16.7272 -16.7272 -16.7014 -16.7014 -15.0412 -15.0412 -15.0372 -15.0372 -14.8996 -14.8996 -14.8662 -14.8662 5.1521 5.1521 7.1333 7.1333 8.7348 8.7348 9.1224 9.1224 9.2811 9.2811 10.1352 10.1352 10.7104 10.7104 11.3584 11.3584 11.6820 11.6820 11.8097 11.8097 14.2286 14.2286 k = 0.2367 0.7721-0.0000 ( 2825 PWs) bands (ev): -37.4048 -37.4048 -37.3985 -37.3985 -16.7253 -16.7253 -16.7044 -16.7044 -15.0411 -15.0411 -15.0387 -15.0387 -14.8980 -14.8980 -14.8685 -14.8685 5.1930 5.1930 7.1165 7.1165 8.7661 8.7661 9.0729 9.0729 9.2574 9.2574 10.1294 10.1294 10.7298 10.7298 11.3833 11.3833 11.5898 11.5898 11.8826 11.8826 14.1885 14.1885 k = 0.2419 0.7892-0.0000 ( 2825 PWs) bands (ev): -37.4038 -37.4038 -37.3993 -37.3993 -16.7233 -16.7233 -16.7073 -16.7073 -15.0418 -15.0418 -15.0390 -15.0390 -14.8962 -14.8962 -14.8708 -14.8708 5.2240 5.2240 7.1120 7.1120 8.7469 8.7469 9.0728 9.0728 9.2358 9.2358 10.1267 10.1267 10.7498 10.7498 11.4099 11.4099 11.4959 11.4959 11.9589 11.9589 14.1471 14.1471 k = 0.2472 0.8064-0.0000 ( 2823 PWs) bands (ev): -37.4028 -37.4028 -37.4002 -37.4002 -16.7210 -16.7210 -16.7099 -16.7099 -15.0430 -15.0430 -15.0382 -15.0382 -14.8943 -14.8943 -14.8731 -14.8731 5.2444 5.2444 7.1204 7.1204 8.6833 8.6833 9.1161 9.1161 9.2163 9.2163 10.1272 10.1272 10.7704 10.7704 11.3937 11.3937 11.4479 11.4479 12.0355 12.0355 14.1045 14.1045 k = 0.2525 0.8236-0.0000 ( 2831 PWs) bands (ev): -37.4019 -37.4019 -37.4011 -37.4011 -16.7187 -16.7187 -16.7124 -16.7124 -15.0441 -15.0441 -15.0369 -15.0369 -14.8924 -14.8924 -14.8753 -14.8753 5.2539 5.2539 7.1421 7.1421 8.5987 8.5987 9.1782 9.1782 9.2003 9.2003 10.1307 10.1307 10.7916 10.7916 11.3021 11.3021 11.4792 11.4792 12.1117 12.1117 14.0609 14.0609 k = 0.2577 0.8407-0.0000 ( 2835 PWs) bands (ev): -37.4021 -37.4021 -37.4011 -37.4011 -16.7165 -16.7165 -16.7142 -16.7142 -15.0451 -15.0451 -15.0352 -15.0352 -14.8905 -14.8905 -14.8773 -14.8773 5.2525 5.2525 7.1769 7.1769 8.5051 8.5051 9.1822 9.1822 9.2524 9.2524 10.1374 10.1374 10.8135 10.8135 11.2087 11.2087 11.5163 11.5163 12.1867 12.1867 14.0165 14.0165 k = 0.2630 0.8579-0.0000 ( 2827 PWs) bands (ev): -37.4031 -37.4031 -37.4003 -37.4003 -16.7171 -16.7171 -16.7128 -16.7128 -15.0457 -15.0457 -15.0332 -15.0332 -14.8888 -14.8888 -14.8790 -14.8790 5.2411 5.2411 7.2242 7.2242 8.4075 8.4075 9.1690 9.1690 9.3270 9.3270 10.1472 10.1472 10.8360 10.8360 11.1160 11.1160 11.5570 11.5570 12.2602 12.2602 13.9715 13.9715 k = 0.2682 0.8750-0.0000 ( 2823 PWs) bands (ev): -37.4041 -37.4041 -37.3995 -37.3995 -16.7189 -16.7189 -16.7100 -16.7100 -15.0461 -15.0461 -15.0309 -15.0309 -14.8876 -14.8876 -14.8800 -14.8800 5.2204 5.2204 7.2830 7.2830 8.3079 8.3079 9.1575 9.1575 9.4032 9.4032 10.1600 10.1600 10.8590 10.8590 11.0244 11.0244 11.6012 11.6012 12.3314 12.3314 13.9260 13.9260 k = 0.2735 0.8922-0.0000 ( 2823 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0462 -15.0462 -15.0285 -15.0285 -14.8874 -14.8874 -14.8799 -14.8799 5.1916 5.1916 7.3520 7.3520 8.2072 8.2072 9.1479 9.1479 9.4797 9.4797 10.1759 10.1759 10.8825 10.8825 10.9341 10.9341 11.6485 11.6485 12.3998 12.3998 13.8802 13.8802 k = 0.2735 0.8922-0.0000 ( 2823 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0462 -15.0462 -15.0285 -15.0285 -14.8874 -14.8874 -14.8799 -14.8799 5.1916 5.1916 7.3520 7.3520 8.2072 8.2072 9.1479 9.1479 9.4797 9.4797 10.1759 10.1759 10.8825 10.8825 10.9341 10.9341 11.6485 11.6485 12.3998 12.3998 13.8802 13.8802 k = 0.2553 0.8922-0.0000 ( 2826 PWs) bands (ev): -37.4049 -37.4049 -37.3991 -37.3991 -16.7201 -16.7201 -16.7078 -16.7078 -15.0462 -15.0462 -15.0293 -15.0293 -14.8874 -14.8874 -14.8800 -14.8800 5.2008 5.2008 7.3290 7.3290 8.2398 8.2398 9.1511 9.1511 9.4574 9.4574 10.1698 10.1698 10.8740 10.8740 10.9545 10.9545 11.6414 11.6414 12.3823 12.3823 13.8831 13.8831 k = 0.2370 0.8922-0.0000 ( 2830 PWs) bands (ev): -37.4046 -37.4046 -37.3993 -37.3993 -16.7198 -16.7198 -16.7086 -16.7086 -15.0461 -15.0461 -15.0300 -15.0300 -14.8878 -14.8878 -14.8797 -14.8797 5.2089 5.2089 7.3047 7.3047 8.2768 8.2768 9.1557 9.1557 9.4360 9.4360 10.1620 10.1620 10.8626 10.8626 10.9616 10.9616 11.6495 11.6495 12.3697 12.3697 13.8659 13.8659 k = 0.2188 0.8922-0.0000 ( 2832 PWs) bands (ev): -37.4043 -37.4043 -37.3995 -37.3995 -16.7195 -16.7195 -16.7093 -16.7093 -15.0461 -15.0461 -15.0308 -15.0308 -14.8883 -14.8883 -14.8793 -14.8793 5.2162 5.2162 7.2797 7.2797 8.3170 8.3170 9.1615 9.1615 9.4157 9.4157 10.1524 10.1524 10.8485 10.8485 10.9562 10.9562 11.6720 11.6720 12.3623 12.3623 13.8323 13.8323 k = 0.2006 0.8922-0.0000 ( 2830 PWs) bands (ev): -37.4040 -37.4040 -37.3996 -37.3996 -16.7192 -16.7192 -16.7099 -16.7099 -15.0459 -15.0459 -15.0316 -15.0316 -14.8889 -14.8889 -14.8787 -14.8787 5.2226 5.2226 7.2549 7.2549 8.3594 8.3594 9.1682 9.1682 9.3966 9.3966 10.1414 10.1414 10.8321 10.8321 10.9406 10.9406 11.7064 11.7064 12.3600 12.3600 13.7869 13.7869 k = 0.1823 0.8922-0.0000 ( 2827 PWs) bands (ev): -37.4037 -37.4037 -37.3998 -37.3998 -16.7191 -16.7191 -16.7104 -16.7104 -15.0458 -15.0458 -15.0324 -15.0324 -14.8895 -14.8895 -14.8781 -14.8781 5.2282 5.2282 7.2308 7.2308 8.4031 8.4031 9.1758 9.1758 9.3785 9.3785 10.1291 10.1291 10.8138 10.8138 10.9178 10.9178 11.7492 11.7492 12.3627 12.3627 13.7338 13.7338 k = 0.1641 0.8922-0.0000 ( 2825 PWs) bands (ev): -37.4035 -37.4035 -37.3999 -37.3999 -16.7190 -16.7190 -16.7107 -16.7107 -15.0456 -15.0456 -15.0331 -15.0331 -14.8901 -14.8901 -14.8775 -14.8775 5.2331 5.2331 7.2079 7.2079 8.4471 8.4471 9.1840 9.1840 9.3616 9.3616 10.1160 10.1160 10.7942 10.7942 10.8908 10.8908 11.7971 11.7971 12.3701 12.3701 13.6762 13.6762 k = 0.1459 0.8922-0.0000 ( 2822 PWs) bands (ev): -37.4032 -37.4032 -37.4000 -37.4000 -16.7190 -16.7190 -16.7110 -16.7110 -15.0453 -15.0453 -15.0339 -15.0339 -14.8907 -14.8907 -14.8769 -14.8769 5.2374 5.2374 7.1865 7.1865 8.4905 8.4905 9.1925 9.1925 9.3458 9.3458 10.1023 10.1023 10.7740 10.7740 10.8620 10.8620 11.8472 11.8472 12.3815 12.3815 13.6169 13.6169 k = 0.1276 0.8922-0.0000 ( 2818 PWs) bands (ev): -37.4030 -37.4030 -37.4001 -37.4001 -16.7191 -16.7191 -16.7112 -16.7112 -15.0451 -15.0451 -15.0346 -15.0346 -14.8912 -14.8912 -14.8763 -14.8763 5.2410 5.2410 7.1671 7.1671 8.5324 8.5324 9.2011 9.2011 9.3310 9.3310 10.0885 10.0885 10.7538 10.7538 10.8333 10.8333 11.8971 11.8971 12.3963 12.3963 13.5580 13.5580 k = 0.1094 0.8922-0.0000 ( 2820 PWs) bands (ev): -37.4028 -37.4028 -37.4002 -37.4002 -16.7192 -16.7192 -16.7113 -16.7113 -15.0448 -15.0448 -15.0353 -15.0353 -14.8917 -14.8917 -14.8758 -14.8758 5.2441 5.2441 7.1498 7.1498 8.5718 8.5718 9.2094 9.2094 9.3173 9.3173 10.0752 10.0752 10.7345 10.7345 10.8061 10.8061 11.9448 11.9448 12.4136 12.4136 13.5013 13.5013 k = 0.0912 0.8922-0.0000 ( 2824 PWs) bands (ev): -37.4027 -37.4027 -37.4003 -37.4003 -16.7193 -16.7193 -16.7113 -16.7113 -15.0445 -15.0445 -15.0359 -15.0359 -14.8922 -14.8922 -14.8754 -14.8754 5.2466 5.2466 7.1348 7.1348 8.6078 8.6078 9.2172 9.2172 9.3049 9.3049 10.0628 10.0628 10.7167 10.7167 10.7814 10.7814 11.9885 11.9885 12.4323 12.4323 13.4487 13.4487 k = 0.0729 0.8922-0.0000 ( 2826 PWs) bands (ev): -37.4026 -37.4026 -37.4004 -37.4004 -16.7195 -16.7195 -16.7114 -16.7114 -15.0442 -15.0442 -15.0365 -15.0365 -14.8925 -14.8925 -14.8750 -14.8750 5.2487 5.2487 7.1224 7.1224 8.6393 8.6393 9.2242 9.2242 9.2939 9.2939 10.0518 10.0518 10.7010 10.7010 10.7602 10.7602 12.0266 12.0266 12.4510 12.4510 13.4018 13.4018 k = 0.0547 0.8922-0.0000 ( 2824 PWs) bands (ev): -37.4025 -37.4025 -37.4005 -37.4005 -16.7196 -16.7196 -16.7114 -16.7114 -15.0439 -15.0439 -15.0369 -15.0369 -14.8928 -14.8928 -14.8748 -14.8748 5.2502 5.2502 7.1126 7.1126 8.6654 8.6654 9.2300 9.2300 9.2847 9.2847 10.0428 10.0428 10.6882 10.6882 10.7430 10.7430 12.0578 12.0578 12.4681 12.4681 13.3626 13.3626 k = 0.0365 0.8922-0.0000 ( 2820 PWs) bands (ev): -37.4024 -37.4024 -37.4006 -37.4006 -16.7196 -16.7196 -16.7114 -16.7114 -15.0437 -15.0437 -15.0373 -15.0373 -14.8930 -14.8930 -14.8745 -14.8745 5.2513 5.2513 7.1056 7.1056 8.6848 8.6848 9.2344 9.2344 9.2777 9.2777 10.0360 10.0360 10.6787 10.6787 10.7304 10.7304 12.0810 12.0810 12.4820 12.4820 13.3328 13.3328 k = 0.0182 0.8922-0.0000 ( 2820 PWs) bands (ev): -37.4023 -37.4023 -37.4006 -37.4006 -16.7197 -16.7197 -16.7113 -16.7113 -15.0436 -15.0436 -15.0376 -15.0376 -14.8931 -14.8931 -14.8744 -14.8744 5.2520 5.2520 7.1013 7.1013 8.6969 8.6969 9.2371 9.2371 9.2733 9.2733 10.0317 10.0317 10.6728 10.6728 10.7227 10.7227 12.0952 12.0952 12.4912 12.4912 13.3141 13.3141 k = 0.0000 0.8922-0.0000 ( 2822 PWs) bands (ev): -37.4023 -37.4023 -37.4006 -37.4006 -16.7197 -16.7197 -16.7113 -16.7113 -15.0435 -15.0435 -15.0377 -15.0377 -14.8931 -14.8931 -14.8744 -14.8744 5.2522 5.2522 7.0999 7.0999 8.7011 8.7011 9.2381 9.2381 9.2717 9.2717 10.0303 10.0303 10.6708 10.6708 10.7201 10.7201 12.1001 12.1001 12.4943 12.4943 13.3077 13.3077 k = 0.0000 0.8922-0.0000 ( 2822 PWs) bands (ev): -37.4023 -37.4023 -37.4006 -37.4006 -16.7197 -16.7197 -16.7113 -16.7113 -15.0435 -15.0435 -15.0377 -15.0377 -14.8931 -14.8931 -14.8744 -14.8744 5.2522 5.2522 7.0999 7.0999 8.7011 8.7011 9.2381 9.2381 9.2717 9.2717 10.0303 10.0303 10.6708 10.6708 10.7201 10.7201 12.1001 12.1001 12.4943 12.4943 13.3077 13.3077 k = 0.0000 0.8922 0.0181 ( 2822 PWs) bands (ev): -37.4023 -37.4023 -37.4006 -37.4006 -16.7197 -16.7197 -16.7114 -16.7114 -15.0446 -15.0446 -15.0365 -15.0365 -14.8935 -14.8935 -14.8741 -14.8741 5.2530 5.2530 7.1010 7.1010 8.7024 8.7024 9.1860 9.1860 9.3220 9.3220 10.0285 10.0285 10.6699 10.6699 10.7185 10.7185 12.0999 12.0999 12.4978 12.4978 13.3131 13.3131 k = 0.0000 0.8922 0.0361 ( 2816 PWs) bands (ev): -37.4023 -37.4023 -37.4006 -37.4006 -16.7198 -16.7198 -16.7114 -16.7114 -15.0467 -15.0467 -15.0342 -15.0342 -14.8947 -14.8947 -14.8733 -14.8733 5.2557 5.2557 7.1043 7.1043 8.7064 8.7064 9.1189 9.1189 9.3836 9.3836 10.0233 10.0233 10.6673 10.6673 10.7136 10.7136 12.0995 12.0995 12.5081 12.5081 13.3291 13.3291 k = 0.0000 0.8922 0.0542 ( 2812 PWs) bands (ev): -37.4022 -37.4022 -37.4005 -37.4005 -16.7198 -16.7198 -16.7115 -16.7115 -15.0491 -15.0491 -15.0315 -15.0315 -14.8965 -14.8965 -14.8721 -14.8721 5.2600 5.2600 7.1097 7.1097 8.7131 8.7131 9.0503 9.0503 9.4430 9.4430 10.0148 10.0148 10.6632 10.6632 10.7055 10.7055 12.0991 12.0991 12.5250 12.5250 13.3553 13.3553 k = 0.0000 0.8922 0.0723 ( 2814 PWs) bands (ev): -37.4022 -37.4022 -37.4006 -37.4006 -16.7199 -16.7199 -16.7115 -16.7115 -15.0515 -15.0515 -15.0287 -15.0287 -14.8987 -14.8987 -14.8707 -14.8707 5.2662 5.2662 7.1171 7.1171 8.7223 8.7223 8.9809 8.9809 9.4992 9.4992 10.0032 10.0032 10.6579 10.6579 10.6944 10.6944 12.0994 12.0994 12.5484 12.5484 13.3910 13.3910 k = 0.0000 0.8922 0.0903 ( 2816 PWs) bands (ev): -37.4022 -37.4022 -37.4006 -37.4006 -16.7200 -16.7200 -16.7117 -16.7117 -15.0539 -15.0539 -15.0259 -15.0259 -14.9011 -14.9011 -14.8692 -14.8692 5.2740 5.2740 7.1264 7.1264 8.7339 8.7339 8.9114 8.9114 9.5513 9.5513 9.9889 9.9889 10.6517 10.6517 10.6805 10.6805 12.1008 12.1008 12.5779 12.5779 13.4353 13.4353 k = 0.0000 0.8922 0.1084 ( 2818 PWs) bands (ev): -37.4022 -37.4022 -37.4005 -37.4005 -16.7201 -16.7201 -16.7118 -16.7118 -15.0561 -15.0561 -15.0230 -15.0230 -14.9038 -14.9038 -14.8678 -14.8678 5.2836 5.2836 7.1375 7.1375 8.7478 8.7478 8.8422 8.8422 9.5988 9.5988 9.9722 9.9722 10.6452 10.6452 10.6641 10.6641 12.1040 12.1040 12.6131 12.6131 13.4874 13.4874 k = 0.0000 0.8922 0.1265 ( 2818 PWs) bands (ev): -37.4022 -37.4022 -37.4005 -37.4005 -16.7202 -16.7202 -16.7119 -16.7119 -15.0583 -15.0583 -15.0202 -15.0202 -14.9066 -14.9066 -14.8664 -14.8664 5.2949 5.2949 7.1500 7.1500 8.7635 8.7635 8.7740 8.7740 9.6407 9.6407 9.9538 9.9538 10.6384 10.6384 10.6461 10.6461 12.1097 12.1097 12.6535 12.6535 13.5462 13.5462 k = 0.0000 0.8922 0.1445 ( 2818 PWs) bands (ev): -37.4021 -37.4021 -37.4005 -37.4005 -16.7204 -16.7204 -16.7121 -16.7121 -15.0603 -15.0603 -15.0174 -15.0174 -14.9094 -14.9094 -14.8651 -14.8651 5.3079 5.3079 7.1638 7.1638 8.7063 8.7063 8.7817 8.7817 9.6766 9.6766 9.9339 9.9339 10.6232 10.6232 10.6356 10.6356 12.1183 12.1183 12.6985 12.6985 13.6108 13.6108 k = 0.0000 0.8922 0.1626 ( 2814 PWs) bands (ev): -37.4021 -37.4021 -37.4005 -37.4005 -16.7205 -16.7205 -16.7123 -16.7123 -15.0623 -15.0623 -15.0146 -15.0146 -14.9123 -14.9123 -14.8639 -14.8639 5.3227 5.3227 7.1784 7.1784 8.6406 8.6406 8.8010 8.8010 9.7058 9.7058 9.9130 9.9130 10.6014 10.6014 10.6318 10.6318 12.1303 12.1303 12.7477 12.7477 13.6802 13.6802 k = 0.0000 0.8922 0.1806 ( 2814 PWs) bands (ev): -37.4020 -37.4020 -37.4005 -37.4005 -16.7207 -16.7207 -16.7126 -16.7126 -15.0641 -15.0641 -15.0120 -15.0120 -14.9151 -14.9151 -14.8629 -14.8629 5.3391 5.3391 7.1934 7.1934 8.5772 8.5772 8.8215 8.8215 9.7278 9.7278 9.8917 9.8917 10.5782 10.5782 10.6305 10.6305 12.1461 12.1461 12.8003 12.8003 13.7534 13.7534 k = 0.0000 0.8922 0.1987 ( 2816 PWs) bands (ev): -37.4020 -37.4020 -37.4005 -37.4005 -16.7208 -16.7208 -16.7128 -16.7128 -15.0657 -15.0657 -15.0095 -15.0095 -14.9179 -14.9179 -14.8620 -14.8620 5.3572 5.3572 7.2082 7.2082 8.5165 8.5165 8.8429 8.8429 9.7424 9.7424 9.8703 9.8703 10.5544 10.5544 10.6316 10.6316 12.1659 12.1659 12.8557 12.8557 13.8294 13.8294 k = 0.0000 0.8922 0.2168 ( 2818 PWs) bands (ev): -37.4020 -37.4020 -37.4005 -37.4005 -16.7210 -16.7210 -16.7131 -16.7131 -15.0672 -15.0672 -15.0072 -15.0072 -14.9205 -14.9205 -14.8612 -14.8612 5.3769 5.3769 7.2222 7.2222 8.4594 8.4594 8.8647 8.8647 9.7496 9.7496 9.8492 9.8492 10.5308 10.5308 10.6354 10.6354 12.1900 12.1900 12.9133 12.9133 13.9072 13.9072 k = 0.0000 0.8922 0.2348 ( 2820 PWs) bands (ev): -37.4019 -37.4019 -37.4005 -37.4005 -16.7212 -16.7212 -16.7134 -16.7134 -15.0686 -15.0686 -15.0052 -15.0052 -14.9230 -14.9230 -14.8606 -14.8606 5.3983 5.3983 7.2345 7.2345 8.4066 8.4066 8.8864 8.8864 9.7497 9.7497 9.8288 9.8288 10.5079 10.5079 10.6415 10.6415 12.2184 12.2184 12.9724 12.9724 13.9858 13.9858 k = 0.0000 0.8922 0.2529 ( 2820 PWs) bands (ev): -37.4019 -37.4019 -37.4004 -37.4004 -16.7214 -16.7214 -16.7137 -16.7137 -15.0698 -15.0698 -15.0034 -15.0034 -14.9252 -14.9252 -14.8601 -14.8601 5.4214 5.4214 7.2442 7.2442 8.3592 8.3592 8.9076 8.9076 9.7432 9.7432 9.8090 9.8090 10.4867 10.4867 10.6498 10.6498 12.2511 12.2511 13.0322 13.0322 14.0641 14.0641 k = 0.0000 0.8922 0.2710 ( 2818 PWs) bands (ev): -37.4018 -37.4018 -37.4004 -37.4004 -16.7216 -16.7216 -16.7140 -16.7140 -15.0708 -15.0708 -15.0020 -15.0020 -14.9272 -14.9272 -14.8599 -14.8599 5.4460 5.4460 7.2503 7.2503 8.3179 8.3179 8.9278 8.9278 9.7310 9.7310 9.7897 9.7897 10.4679 10.4679 10.6599 10.6599 12.2880 12.2880 13.0921 13.0921 14.1409 14.1409 k = 0.0000 0.8922 0.2890 ( 2814 PWs) bands (ev): -37.4017 -37.4017 -37.4004 -37.4004 -16.7218 -16.7218 -16.7144 -16.7144 -15.0717 -15.0717 -15.0010 -15.0010 -14.9287 -14.9287 -14.8597 -14.8597 5.4722 5.4722 7.2517 7.2517 8.2840 8.2840 8.9466 8.9466 9.7143 9.7143 9.7706 9.7706 10.4523 10.4523 10.6712 10.6712 12.3290 12.3290 13.1512 13.1512 14.2151 14.2151 k = 0.0000 0.8922 0.3071 ( 2810 PWs) bands (ev): -37.4016 -37.4016 -37.4003 -37.4003 -16.7220 -16.7220 -16.7147 -16.7147 -15.0724 -15.0724 -15.0004 -15.0004 -14.9299 -14.9299 -14.8598 -14.8598 5.5000 5.5000 7.2476 7.2476 8.2582 8.2582 8.9636 8.9636 9.6939 9.6939 9.7511 9.7511 10.4408 10.4408 10.6834 10.6834 12.3739 12.3739 13.2087 13.2087 14.2856 14.2856 k = 0.0000 0.8922 0.3252 ( 2808 PWs) bands (ev): -37.4016 -37.4016 -37.4003 -37.4003 -16.7222 -16.7222 -16.7151 -16.7151 -15.0729 -15.0729 -15.0003 -15.0003 -14.9305 -14.9305 -14.8600 -14.8600 5.5294 5.5294 7.2370 7.2370 8.2412 8.2412 8.9785 8.9785 9.6709 9.6709 9.7309 9.7309 10.4342 10.4342 10.6961 10.6961 12.4222 12.4222 13.2636 13.2636 14.3513 14.3513 k = 0.0000 0.8922 0.3432 ( 2810 PWs) bands (ev): -37.4015 -37.4015 -37.4003 -37.4003 -16.7223 -16.7223 -16.7155 -16.7155 -15.0732 -15.0732 -15.0007 -15.0007 -14.9307 -14.9307 -14.8604 -14.8604 5.5603 5.5603 7.2197 7.2197 8.2333 8.2333 8.9910 8.9910 9.6456 9.6456 9.7095 9.7095 10.4332 10.4332 10.7089 10.7089 12.4738 12.4738 13.3149 13.3149 14.4115 14.4115 k = 0.0000 0.8922 0.3613 ( 2812 PWs) bands (ev): -37.4015 -37.4015 -37.4003 -37.4003 -16.7225 -16.7225 -16.7159 -16.7159 -15.0734 -15.0734 -15.0017 -15.0017 -14.9304 -14.9304 -14.8609 -14.8609 5.5926 5.5926 7.1956 7.1956 8.2344 8.2344 9.0012 9.0012 9.6188 9.6188 9.6868 9.6868 10.4383 10.4383 10.7219 10.7219 12.5282 12.5282 13.3615 13.3615 14.4610 14.4610 k = 0.0000 0.8922 0.3794 ( 2812 PWs) bands (ev): -37.4014 -37.4014 -37.4003 -37.4003 -16.7226 -16.7226 -16.7163 -16.7163 -15.0734 -15.0734 -15.0031 -15.0031 -14.9296 -14.9296 -14.8616 -14.8616 5.6265 5.6265 7.1652 7.1652 8.2440 8.2440 9.0091 9.0091 9.5907 9.5907 9.6625 9.6625 10.4496 10.4496 10.7347 10.7347 12.5850 12.5850 13.4023 13.4023 14.4267 14.4267 k = 0.0000 0.8922 0.3974 ( 2820 PWs) bands (ev): -37.4014 -37.4014 -37.4003 -37.4003 -16.7228 -16.7228 -16.7167 -16.7167 -15.0732 -15.0732 -15.0049 -15.0049 -14.9284 -14.9284 -14.8624 -14.8624 5.6618 5.6618 7.1290 7.1290 8.2612 8.2612 9.0148 9.0148 9.5619 9.5619 9.6364 9.6364 10.4670 10.4670 10.7474 10.7474 12.6438 12.6438 13.4360 13.4360 14.3703 14.3703 k = 0.0000 0.8922 0.4155 ( 2822 PWs) bands (ev): -37.4013 -37.4013 -37.4003 -37.4003 -16.7229 -16.7229 -16.7171 -16.7171 -15.0728 -15.0728 -15.0071 -15.0071 -14.9269 -14.9269 -14.8634 -14.8634 5.6985 5.6985 7.0880 7.0880 8.2850 8.2850 9.0186 9.0186 9.5328 9.5328 9.6086 9.6086 10.4899 10.4899 10.7600 10.7600 12.7041 12.7041 13.4616 13.4616 14.3196 14.3196 k = 0.0000 0.8922 0.4336 ( 2818 PWs) bands (ev): -37.4012 -37.4012 -37.4002 -37.4002 -16.7230 -16.7230 -16.7175 -16.7175 -15.0722 -15.0722 -15.0096 -15.0096 -14.9250 -14.9250 -14.8646 -14.8646 5.7366 5.7366 7.0430 7.0430 8.3145 8.3145 9.0206 9.0206 9.5037 9.5037 9.5792 9.5792 10.5178 10.5178 10.7725 10.7725 12.7655 12.7655 13.4785 13.4785 14.2764 14.2764 k = 0.0000 0.8922 0.4516 ( 2822 PWs) bands (ev): -37.4012 -37.4012 -37.4002 -37.4002 -16.7231 -16.7231 -16.7180 -16.7180 -15.0715 -15.0715 -15.0123 -15.0123 -14.9229 -14.9229 -14.8659 -14.8659 5.7761 5.7761 6.9948 6.9948 8.3486 8.3486 9.0210 9.0210 9.4749 9.4749 9.5484 9.5484 10.5496 10.5496 10.7848 10.7848 12.8275 12.8275 13.4864 13.4864 14.2413 14.2413 k = 0.0000 0.8922 0.4697 ( 2818 PWs) bands (ev): -37.4011 -37.4011 -37.4002 -37.4002 -16.7231 -16.7231 -16.7184 -16.7184 -15.0705 -15.0705 -15.0152 -15.0152 -14.9206 -14.9206 -14.8673 -14.8673 5.8169 5.8169 6.9441 6.9441 8.3864 8.3864 9.0202 9.0202 9.4468 9.4468 9.5166 9.5166 10.5844 10.5844 10.7971 10.7971 12.8894 12.8894 13.4862 13.4862 14.2143 14.2143 k = 0.0000 0.8922 0.4878 ( 2814 PWs) bands (ev): -37.4010 -37.4010 -37.4002 -37.4002 -16.7232 -16.7232 -16.7188 -16.7188 -15.0694 -15.0694 -15.0182 -15.0182 -14.9181 -14.9181 -14.8689 -14.8689 5.8590 5.8590 6.8916 6.8916 8.4271 8.4271 9.0181 9.0181 9.4194 9.4194 9.4843 9.4843 10.6210 10.6210 10.8092 10.8092 12.9508 12.9508 13.4792 13.4792 14.1941 14.1941 k = 0.0000 0.8922 0.5058 ( 2812 PWs) bands (ev): -37.4010 -37.4010 -37.4002 -37.4002 -16.7232 -16.7232 -16.7192 -16.7192 -15.0681 -15.0681 -15.0214 -15.0214 -14.9155 -14.9155 -14.8706 -14.8706 5.9024 5.9024 6.8377 6.8377 8.4699 8.4699 9.0148 9.0148 9.3932 9.3932 9.4519 9.4519 10.6582 10.6582 10.8211 10.8211 13.0109 13.0109 13.4678 13.4678 14.1794 14.1794 k = 0.0000 0.8922 0.5239 ( 2814 PWs) bands (ev): -37.4009 -37.4009 -37.4002 -37.4002 -16.7232 -16.7232 -16.7196 -16.7196 -15.0666 -15.0666 -15.0246 -15.0246 -14.9128 -14.9128 -14.8724 -14.8724 5.9470 5.9470 6.7829 6.7829 8.5143 8.5143 9.0100 9.0100 9.3682 9.3682 9.4200 9.4200 10.6949 10.6949 10.8327 10.8327 13.0692 13.0692 13.4539 13.4539 14.1684 14.1684 k = 0.0000 0.8922 0.5419 ( 2820 PWs) bands (ev): -37.4009 -37.4009 -37.4003 -37.4003 -16.7231 -16.7231 -16.7199 -16.7199 -15.0650 -15.0650 -15.0278 -15.0278 -14.9101 -14.9101 -14.8743 -14.8743 5.9928 5.9928 6.7275 6.7275 8.5596 8.5596 9.0034 9.0034 9.3448 9.3448 9.3894 9.3894 10.7302 10.7302 10.8438 10.8438 13.1249 13.1249 13.4398 13.4398 14.1600 14.1600 k = 0.0000 0.8922 0.5600 ( 2814 PWs) bands (ev): -37.4008 -37.4008 -37.4003 -37.4003 -16.7231 -16.7231 -16.7203 -16.7203 -15.0632 -15.0632 -15.0310 -15.0310 -14.9073 -14.9073 -14.8764 -14.8764 6.0397 6.0397 6.6719 6.6719 8.6053 8.6053 8.9946 8.9946 9.3232 9.3232 9.3609 9.3609 10.7629 10.7629 10.8541 10.8541 13.1770 13.1770 13.4269 13.4269 14.1532 14.1532 k = 0.0000 0.8922 0.5781 ( 2812 PWs) bands (ev): -37.4007 -37.4007 -37.4003 -37.4003 -16.7230 -16.7230 -16.7207 -16.7207 -15.0612 -15.0612 -15.0342 -15.0342 -14.9045 -14.9045 -14.8786 -14.8786 6.0878 6.0878 6.6162 6.6162 8.6510 8.6510 8.9828 8.9828 9.3039 9.3039 9.3352 9.3352 10.7924 10.7924 10.8632 10.8632 13.2249 13.2249 13.4160 13.4160 14.1479 14.1479 k = 0.0000 0.8922 0.5961 ( 2808 PWs) bands (ev): -37.4006 -37.4006 -37.4003 -37.4003 -16.7229 -16.7229 -16.7210 -16.7210 -15.0591 -15.0591 -15.0373 -15.0373 -14.9017 -14.9017 -14.8808 -14.8808 6.1369 6.1369 6.5607 6.5607 8.6960 8.6960 8.9672 8.9672 9.2876 9.2876 9.3130 9.3130 10.8180 10.8180 10.8708 10.8708 13.2674 13.2674 13.4074 13.4074 14.1445 14.1445 k = 0.0000 0.8922 0.6142 ( 2798 PWs) bands (ev): -37.4005 -37.4005 -37.4002 -37.4002 -16.7227 -16.7227 -16.7213 -16.7213 -15.0568 -15.0568 -15.0404 -15.0404 -14.8989 -14.8989 -14.8832 -14.8832 6.1870 6.1870 6.5054 6.5054 8.7400 8.7400 8.9473 8.9473 9.2749 9.2749 9.2946 9.2946 10.8392 10.8392 10.8763 10.8763 13.3040 13.3040 13.4004 13.4004 14.1442 14.1442 k = 0.0000 0.8922 0.6323 ( 2802 PWs) bands (ev): -37.4005 -37.4005 -37.4003 -37.4003 -16.7225 -16.7225 -16.7216 -16.7216 -15.0544 -15.0544 -15.0434 -15.0434 -14.8961 -14.8961 -14.8856 -14.8856 6.2381 6.2381 6.4507 6.4507 8.7823 8.7823 8.9225 8.9225 9.2666 9.2666 9.2803 9.2803 10.8558 10.8558 10.8793 10.8793 13.3338 13.3338 13.3937 13.3937 14.1485 14.1485 k = 0.0000 0.8922 0.6503 ( 2804 PWs) bands (ev): -37.4005 -37.4005 -37.4004 -37.4004 -16.7223 -16.7223 -16.7219 -16.7219 -15.0518 -15.0518 -15.0463 -15.0463 -14.8934 -14.8934 -14.8882 -14.8882 6.2901 6.2901 6.3964 6.3964 8.8224 8.8224 8.8932 8.8932 9.2630 9.2630 9.2701 9.2701 10.8679 10.8679 10.8793 10.8793 13.3569 13.3569 13.3854 13.3854 14.1594 14.1594 k = 0.0000 0.8922 0.6684 ( 2804 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7221 -16.7221 -16.7221 -16.7221 -15.0491 -15.0491 -15.0491 -15.0491 -14.8908 -14.8908 -14.8908 -14.8908 6.3429 6.3429 6.3429 6.3429 8.8596 8.8596 8.8596 8.8596 9.2643 9.2643 9.2643 9.2643 10.8756 10.8756 10.8756 10.8756 13.3738 13.3738 13.3738 13.3738 14.1788 14.1788 k = 0.0000 0.8922 0.6684 ( 2804 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7221 -16.7221 -16.7221 -16.7221 -15.0491 -15.0491 -15.0491 -15.0491 -14.8908 -14.8908 -14.8908 -14.8908 6.3429 6.3429 6.3429 6.3429 8.8596 8.8596 8.8596 8.8596 9.2643 9.2643 9.2643 9.2643 10.8756 10.8756 10.8756 10.8756 13.3738 13.3738 13.3738 13.3738 14.1788 14.1788 k = 0.0182 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7222 -16.7222 -16.7221 -16.7221 -15.0506 -15.0506 -15.0477 -15.0477 -14.8922 -14.8922 -14.8893 -14.8893 6.3424 6.3424 6.3441 6.3441 8.8516 8.8516 8.8573 8.8573 9.2656 9.2656 9.2740 9.2740 10.8743 10.8743 10.8752 10.8752 13.3735 13.3735 13.3736 13.3736 14.1690 14.1690 k = 0.0365 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7222 -16.7222 -16.7220 -16.7220 -15.0520 -15.0520 -15.0462 -15.0462 -14.8936 -14.8936 -14.8879 -14.8879 6.3428 6.3428 6.3462 6.3462 8.8348 8.8348 8.8452 8.8452 9.2777 9.2777 9.2935 9.2935 10.8713 10.8713 10.8730 10.8730 13.3728 13.3728 13.3729 13.3729 14.1485 14.1485 k = 0.0547 0.8922 0.6684 ( 2808 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7222 -16.7222 -16.7219 -16.7219 -15.0533 -15.0533 -15.0447 -15.0447 -14.8950 -14.8950 -14.8865 -14.8865 6.3440 6.3440 6.3490 6.3490 8.8115 8.8115 8.8252 8.8252 9.2985 9.2985 9.3202 9.3202 10.8666 10.8666 10.8691 10.8691 13.3715 13.3715 13.3717 13.3717 14.1194 14.1194 k = 0.0729 0.8922 0.6684 ( 2822 PWs) bands (ev): -37.4005 -37.4005 -37.4005 -37.4005 -16.7222 -16.7222 -16.7219 -16.7219 -15.0546 -15.0546 -15.0432 -15.0432 -14.8964 -14.8964 -14.8851 -14.8851 6.3458 6.3458 6.3524 6.3524 8.7841 8.7841 8.7998 8.7998 9.3255 9.3255 9.3518 9.3518 10.8603 10.8603 10.8636 10.8636 13.3696 13.3696 13.3698 13.3698 14.0844 14.0844 k = 0.0912 0.8922 0.6684 ( 2822 PWs) bands (ev): -37.4005 -37.4005 -37.4005 -37.4005 -16.7222 -16.7222 -16.7218 -16.7218 -15.0558 -15.0558 -15.0416 -15.0416 -14.8978 -14.8978 -14.8837 -14.8837 6.3483 6.3483 6.3565 6.3565 8.7546 8.7546 8.7713 8.7713 9.3563 9.3563 9.3862 9.3862 10.8525 10.8525 10.8566 10.8566 13.3668 13.3668 13.3670 13.3670 14.0462 14.0462 k = 0.1094 0.8922 0.6684 ( 2820 PWs) bands (ev): -37.4006 -37.4006 -37.4006 -37.4006 -16.7221 -16.7221 -16.7216 -16.7216 -15.0570 -15.0570 -15.0401 -15.0401 -14.8991 -14.8991 -14.8824 -14.8824 6.3514 6.3514 6.3610 6.3610 8.7243 8.7243 8.7414 8.7414 9.3892 9.3892 9.4219 9.4219 10.8436 10.8436 10.8483 10.8483 13.3630 13.3630 13.3633 13.3633 14.0074 14.0074 k = 0.1276 0.8922 0.6684 ( 2816 PWs) bands (ev): -37.4006 -37.4006 -37.4006 -37.4006 -16.7221 -16.7221 -16.7215 -16.7215 -15.0581 -15.0581 -15.0386 -15.0386 -14.9004 -14.9004 -14.8811 -14.8811 6.3547 6.3547 6.3659 6.3659 8.6944 8.6944 8.7113 8.7113 9.4226 9.4226 9.4575 9.4575 10.8335 10.8335 10.8389 10.8389 13.3580 13.3580 13.3583 13.3583 13.9699 13.9699 k = 0.1459 0.8922 0.6684 ( 2820 PWs) bands (ev): -37.4006 -37.4006 -37.4006 -37.4006 -16.7220 -16.7220 -16.7214 -16.7214 -15.0591 -15.0591 -15.0371 -15.0371 -14.9016 -14.9016 -14.8798 -14.8798 6.3584 6.3584 6.3709 6.3709 8.6657 8.6657 8.6823 8.6823 9.4555 9.4555 9.4922 9.4922 10.8227 10.8227 10.8286 10.8286 13.3517 13.3517 13.3520 13.3520 13.9356 13.9356 k = 0.1641 0.8922 0.6684 ( 2818 PWs) bands (ev): -37.4007 -37.4007 -37.4007 -37.4007 -16.7219 -16.7219 -16.7212 -16.7212 -15.0601 -15.0601 -15.0357 -15.0357 -14.9028 -14.9028 -14.8786 -14.8786 6.3620 6.3620 6.3759 6.3759 8.6388 8.6388 8.6549 8.6549 9.4868 9.4868 9.5251 9.5251 10.8114 10.8114 10.8177 10.8177 13.3439 13.3439 13.3444 13.3444 13.9057 13.9057 k = 0.1823 0.8922 0.6684 ( 2822 PWs) bands (ev): -37.4007 -37.4007 -37.4007 -37.4007 -16.7218 -16.7218 -16.7211 -16.7211 -15.0610 -15.0610 -15.0343 -15.0343 -14.9039 -14.9039 -14.8774 -14.8774 6.3656 6.3656 6.3806 6.3806 8.6143 8.6143 8.6297 8.6297 9.5158 9.5158 9.5554 9.5554 10.8000 10.8000 10.8066 10.8066 13.3349 13.3349 13.3356 13.3356 13.8811 13.8811 k = 0.2006 0.8922 0.6684 ( 2820 PWs) bands (ev): -37.4008 -37.4008 -37.4008 -37.4008 -16.7217 -16.7217 -16.7209 -16.7209 -15.0618 -15.0618 -15.0329 -15.0329 -14.9050 -14.9050 -14.8763 -14.8763 6.3688 6.3688 6.3848 6.3848 8.5926 8.5926 8.6075 8.6075 9.5419 9.5419 9.5825 9.5825 10.7888 10.7888 10.7956 10.7956 13.3250 13.3250 13.3259 13.3259 13.8622 13.8622 k = 0.2188 0.8922 0.6684 ( 2822 PWs) bands (ev): -37.4008 -37.4008 -37.4008 -37.4008 -16.7216 -16.7216 -16.7207 -16.7207 -15.0625 -15.0625 -15.0315 -15.0315 -14.9060 -14.9060 -14.8752 -14.8752 6.3714 6.3714 6.3884 6.3884 8.5741 8.5741 8.5884 8.5884 9.5645 9.5645 9.6059 9.6059 10.7782 10.7782 10.7852 10.7852 13.3145 13.3145 13.3156 13.3156 13.8491 13.8491 k = 0.2370 0.8922 0.6684 ( 2816 PWs) bands (ev): -37.4009 -37.4009 -37.4009 -37.4009 -16.7214 -16.7214 -16.7205 -16.7205 -15.0631 -15.0631 -15.0302 -15.0302 -14.9069 -14.9069 -14.8742 -14.8742 6.3733 6.3733 6.3910 6.3910 8.5592 8.5592 8.5730 8.5730 9.5830 9.5830 9.6251 9.6251 10.7685 10.7685 10.7756 10.7756 13.3040 13.3040 13.3054 13.3054 13.8416 13.8416 k = 0.2553 0.8922 0.6684 ( 2812 PWs) bands (ev): -37.4009 -37.4009 -37.4009 -37.4009 -16.7212 -16.7212 -16.7203 -16.7203 -15.0636 -15.0636 -15.0289 -15.0289 -14.9077 -14.9077 -14.8733 -14.8733 6.3742 6.3742 6.3925 6.3925 8.5482 8.5482 8.5616 8.5616 9.5972 9.5972 9.6396 9.6396 10.7602 10.7602 10.7673 10.7673 13.2941 13.2941 13.2958 13.2958 13.8393 13.8393 k = 0.2735 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4010 -37.4010 -37.4010 -37.4010 -16.7210 -16.7210 -16.7201 -16.7201 -15.0640 -15.0640 -15.0277 -15.0277 -14.9085 -14.9085 -14.8724 -14.8724 6.3739 6.3739 6.3927 6.3927 8.5412 8.5412 8.5543 8.5543 9.6069 9.6069 9.6494 9.6494 10.7533 10.7533 10.7605 10.7605 13.2853 13.2853 13.2872 13.2872 13.8418 13.8418 k = 0.2735 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4010 -37.4010 -37.4010 -37.4010 -16.7210 -16.7210 -16.7201 -16.7201 -15.0640 -15.0640 -15.0277 -15.0277 -14.9085 -14.9085 -14.8724 -14.8724 6.3739 6.3739 6.3927 6.3927 8.5412 8.5412 8.5543 8.5543 9.6069 9.6069 9.6494 9.6494 10.7533 10.7533 10.7605 10.7605 13.2853 13.2853 13.2872 13.2872 13.8418 13.8418 k = 0.2682 0.8750 0.6684 ( 2818 PWs) bands (ev): -37.4008 -37.4008 -37.4008 -37.4008 -16.7216 -16.7216 -16.7208 -16.7208 -15.0626 -15.0626 -15.0315 -15.0315 -14.9060 -14.9060 -14.8752 -14.8752 6.3748 6.3748 6.3924 6.3924 8.5591 8.5591 8.5728 8.5728 9.5837 9.5837 9.6262 9.6262 10.7736 10.7736 10.7807 10.7807 13.3111 13.3111 13.3122 13.3122 13.8252 13.8252 k = 0.2630 0.8579 0.6684 ( 2818 PWs) bands (ev): -37.4006 -37.4006 -37.4006 -37.4006 -16.7221 -16.7221 -16.7213 -16.7213 -15.0609 -15.0609 -15.0351 -15.0351 -14.9035 -14.9035 -14.8780 -14.8780 6.3713 6.3713 6.3877 6.3877 8.5802 8.5802 8.5945 8.5945 9.5634 9.5634 9.6059 9.6059 10.7940 10.7940 10.8007 10.8007 13.3335 13.3335 13.3340 13.3340 13.8078 13.8078 k = 0.2577 0.8407 0.6684 ( 2814 PWs) bands (ev): -37.4005 -37.4005 -37.4005 -37.4005 -16.7223 -16.7223 -16.7217 -16.7217 -15.0588 -15.0588 -15.0383 -15.0383 -14.9010 -14.9010 -14.8808 -14.8808 6.3634 6.3634 6.3785 6.3785 8.6047 8.6047 8.6194 8.6194 9.5460 9.5460 9.5883 9.5883 10.8139 10.8139 10.8202 10.8202 13.3519 13.3519 13.3522 13.3522 13.7908 13.7908 k = 0.2525 0.8236 0.6684 ( 2818 PWs) bands (ev): -37.4005 -37.4005 -37.4005 -37.4005 -16.7224 -16.7224 -16.7218 -16.7218 -15.0565 -15.0565 -15.0412 -15.0412 -14.8985 -14.8985 -14.8835 -14.8835 6.3512 6.3512 6.3651 6.3651 8.6326 8.6326 8.6475 8.6475 9.5315 9.5315 9.5737 9.5737 10.8329 10.8329 10.8386 10.8386 13.3655 13.3655 13.3664 13.3664 13.7754 13.7754 k = 0.2472 0.8064 0.6684 ( 2810 PWs) bands (ev): -37.4004 -37.4004 -37.4004 -37.4004 -16.7223 -16.7223 -16.7218 -16.7218 -15.0539 -15.0539 -15.0438 -15.0438 -14.8959 -14.8959 -14.8862 -14.8862 6.3348 6.3348 6.3475 6.3475 8.6639 8.6639 8.6789 8.6789 9.5201 9.5201 9.5620 9.5620 10.8503 10.8503 10.8554 10.8554 13.3744 13.3744 13.3756 13.3756 13.7628 13.7628 k = 0.2419 0.7892 0.6684 ( 2806 PWs) bands (ev): -37.4005 -37.4005 -37.4005 -37.4005 -16.7221 -16.7221 -16.7217 -16.7217 -15.0509 -15.0509 -15.0460 -15.0460 -14.8933 -14.8933 -14.8888 -14.8888 6.3146 6.3146 6.3260 6.3260 8.6984 8.6984 8.7134 8.7134 9.5118 9.5118 9.5533 9.5533 10.8656 10.8656 10.8700 10.8700 13.3781 13.3781 13.3795 13.3795 13.7541 13.7541 k = 0.2367 0.7721 0.6684 ( 2806 PWs) bands (ev): -37.4006 -37.4006 -37.4006 -37.4006 -16.7216 -16.7216 -16.7213 -16.7213 -15.0480 -15.0480 -15.0476 -15.0476 -14.8914 -14.8914 -14.8906 -14.8906 6.2907 6.2907 6.3008 6.3008 8.7359 8.7359 8.7508 8.7508 9.5067 9.5067 9.5477 9.5477 10.8783 10.8783 10.8818 10.8818 13.3767 13.3767 13.3781 13.3781 13.7499 13.7499 k = 0.2314 0.7549 0.6684 ( 2808 PWs) bands (ev): -37.4008 -37.4008 -37.4008 -37.4008 -16.7210 -16.7210 -16.7208 -16.7208 -15.0496 -15.0496 -15.0440 -15.0440 -14.8939 -14.8939 -14.8879 -14.8879 6.2633 6.2633 6.2722 6.2722 8.7762 8.7762 8.7907 8.7907 9.5048 9.5048 9.5453 9.5453 10.8878 10.8878 10.8904 10.8904 13.3708 13.3708 13.3720 13.3720 13.7502 13.7502 k = 0.2262 0.7378 0.6684 ( 2812 PWs) bands (ev): -37.4010 -37.4010 -37.4010 -37.4010 -16.7203 -16.7203 -16.7202 -16.7202 -15.0509 -15.0509 -15.0401 -15.0401 -14.8964 -14.8964 -14.8852 -14.8852 6.2329 6.2329 6.2406 6.2406 8.8189 8.8189 8.8329 8.8329 9.5063 9.5063 9.5461 9.5461 10.8936 10.8936 10.8952 10.8952 13.3612 13.3612 13.3623 13.3623 13.7548 13.7548 k = 0.2209 0.7206 0.6684 ( 2816 PWs) bands (ev): -37.4013 -37.4013 -37.4013 -37.4013 -16.7194 -16.7194 -16.7193 -16.7193 -15.0520 -15.0520 -15.0358 -15.0358 -14.8989 -14.8989 -14.8823 -14.8823 6.1997 6.1997 6.2063 6.2063 8.8637 8.8637 8.8769 8.8769 9.5114 9.5114 9.5503 9.5503 10.8950 10.8950 10.8957 10.8957 13.3492 13.3492 13.3502 13.3502 13.7628 13.7628 k = 0.2156 0.7035 0.6684 ( 2804 PWs) bands (ev): -37.4016 -37.4016 -37.4016 -37.4016 -16.7183 -16.7183 -16.7183 -16.7183 -15.0527 -15.0527 -15.0313 -15.0313 -14.9014 -14.9014 -14.8794 -14.8794 6.1641 6.1641 6.1695 6.1695 8.9101 8.9101 8.9222 8.9222 9.5204 9.5204 9.5581 9.5581 10.8915 10.8915 10.8917 10.8917 13.3359 13.3359 13.3369 13.3369 13.7736 13.7736 k = 0.2104 0.6863 0.6684 ( 2796 PWs) bands (ev): -37.4020 -37.4020 -37.4020 -37.4020 -16.7172 -16.7172 -16.7171 -16.7171 -15.0532 -15.0532 -15.0264 -15.0264 -14.9038 -14.9038 -14.8765 -14.8765 6.1262 6.1262 6.1306 6.1306 8.9576 8.9576 8.9683 8.9683 9.5334 9.5334 9.5697 9.5697 10.8821 10.8821 10.8833 10.8833 13.3223 13.3223 13.3235 13.3235 13.7864 13.7864 k = 0.2051 0.6691 0.6684 ( 2800 PWs) bands (ev): -37.4024 -37.4024 -37.4024 -37.4024 -16.7159 -16.7159 -16.7157 -16.7157 -15.0535 -15.0535 -15.0213 -15.0213 -14.9062 -14.9062 -14.8734 -14.8734 6.0865 6.0865 6.0899 6.0899 9.0056 9.0056 9.0146 9.0146 9.5508 9.5508 9.5854 9.5854 10.8674 10.8674 10.8695 10.8695 13.3092 13.3092 13.3109 13.3109 13.8005 13.8005 k = 0.1999 0.6520 0.6684 ( 2804 PWs) bands (ev): -37.4030 -37.4030 -37.4030 -37.4030 -16.7145 -16.7145 -16.7142 -16.7142 -15.0535 -15.0535 -15.0158 -15.0158 -14.9085 -14.9085 -14.8703 -14.8703 6.0452 6.0452 6.0476 6.0476 9.0535 9.0535 9.0603 9.0603 9.5730 9.5730 9.6054 9.6054 10.8472 10.8472 10.8502 10.8502 13.2972 13.2972 13.2994 13.2994 13.8156 13.8156 k = 0.1946 0.6348 0.6684 ( 2804 PWs) bands (ev): -37.4035 -37.4035 -37.4035 -37.4035 -16.7130 -16.7130 -16.7126 -16.7126 -15.0533 -15.0533 -15.0101 -15.0101 -14.9108 -14.9108 -14.8671 -14.8671 6.0026 6.0026 6.0040 6.0040 9.1007 9.1007 9.1049 9.1049 9.6003 9.6003 9.6301 9.6301 10.8215 10.8215 10.8252 10.8252 13.2864 13.2864 13.2895 13.2895 13.8311 13.8311 k = 0.1893 0.6177 0.6684 ( 2802 PWs) bands (ev): -37.4041 -37.4041 -37.4041 -37.4041 -16.7114 -16.7114 -16.7109 -16.7109 -15.0529 -15.0529 -15.0042 -15.0042 -14.9129 -14.9129 -14.8637 -14.8637 5.9589 5.9589 5.9595 5.9595 9.1466 9.1466 9.1477 9.1477 9.6329 9.6329 9.6597 9.6597 10.7905 10.7905 10.7949 10.7949 13.2771 13.2771 13.2811 13.2811 13.8466 13.8466 k = 0.1841 0.6005 0.6684 ( 2806 PWs) bands (ev): -37.4047 -37.4047 -37.4047 -37.4047 -16.7096 -16.7096 -16.7090 -16.7090 -15.0523 -15.0523 -14.9981 -14.9981 -14.9151 -14.9151 -14.8603 -14.8603 5.9141 5.9141 5.9143 5.9143 9.1881 9.1881 9.1905 9.1905 9.6712 9.6712 9.6945 9.6945 10.7545 10.7545 10.7595 10.7595 13.2690 13.2690 13.2739 13.2739 13.8614 13.8614 k = 0.1788 0.5834 0.6684 ( 2810 PWs) bands (ev): -37.4054 -37.4054 -37.4054 -37.4054 -16.7078 -16.7078 -16.7071 -16.7071 -15.0515 -15.0515 -14.9918 -14.9918 -14.9170 -14.9170 -14.8568 -14.8568 5.8682 5.8682 5.8691 5.8691 9.2260 9.2260 9.2321 9.2321 9.7149 9.7149 9.7344 9.7344 10.7139 10.7139 10.7193 10.7193 13.2620 13.2620 13.2679 13.2679 13.8750 13.8750 k = 0.1736 0.5662 0.6684 ( 2814 PWs) bands (ev): -37.4061 -37.4061 -37.4061 -37.4061 -16.7059 -16.7059 -16.7051 -16.7051 -15.0505 -15.0505 -14.9854 -14.9854 -14.9188 -14.9188 -14.8532 -14.8532 5.8219 5.8219 5.8235 5.8235 9.2610 9.2610 9.2709 9.2709 9.7639 9.7639 9.7794 9.7794 10.6694 10.6694 10.6751 10.6751 13.2556 13.2556 13.2624 13.2624 13.8867 13.8867 k = 0.1683 0.5490 0.6684 ( 2814 PWs) bands (ev): -37.4068 -37.4068 -37.4068 -37.4068 -16.7039 -16.7039 -16.7031 -16.7031 -15.0494 -15.0494 -14.9790 -14.9790 -14.9204 -14.9204 -14.8494 -14.8494 5.7754 5.7754 5.7777 5.7777 9.2933 9.2933 9.3068 9.3068 9.8174 9.8174 9.8289 9.8289 10.6220 10.6220 10.6277 10.6277 13.2495 13.2495 13.2572 13.2572 13.8957 13.8957 k = 0.1630 0.5319 0.6684 ( 2814 PWs) bands (ev): -37.4076 -37.4076 -37.4076 -37.4076 -16.7018 -16.7018 -16.7010 -16.7010 -15.0482 -15.0482 -14.9728 -14.9728 -14.9216 -14.9216 -14.8456 -14.8456 5.7289 5.7289 5.7318 5.7318 9.3228 9.3228 9.3399 9.3399 9.8748 9.8748 9.8820 9.8820 10.5727 10.5727 10.5779 10.5779 13.2432 13.2432 13.2517 13.2517 13.9013 13.9013 k = 0.1578 0.5147 0.6684 ( 2818 PWs) bands (ev): -37.4084 -37.4084 -37.4084 -37.4084 -16.6997 -16.6997 -16.6988 -16.6988 -15.0469 -15.0469 -14.9669 -14.9669 -14.9221 -14.9221 -14.8416 -14.8416 5.6825 5.6825 5.6860 5.6860 9.3498 9.3498 9.3700 9.3700 9.9349 9.9349 9.9374 9.9374 10.5231 10.5231 10.5273 10.5273 13.2363 13.2363 13.2456 13.2456 13.9031 13.9031 k = 0.1525 0.4976 0.6684 ( 2810 PWs) bands (ev): -37.4092 -37.4092 -37.4092 -37.4092 -16.6976 -16.6976 -16.6966 -16.6966 -15.0455 -15.0455 -14.9617 -14.9617 -14.9218 -14.9218 -14.8375 -14.8375 5.6365 5.6365 5.6405 5.6405 9.3742 9.3742 9.3973 9.3973 9.9929 9.9929 9.9958 9.9958 10.4757 10.4757 10.4777 10.4777 13.2285 13.2285 13.2385 13.2385 13.9006 13.9006 k = 0.1473 0.4804 0.6684 ( 2818 PWs) bands (ev): -37.4100 -37.4100 -37.4100 -37.4100 -16.6954 -16.6954 -16.6944 -16.6944 -15.0440 -15.0440 -14.9576 -14.9576 -14.9203 -14.9203 -14.8333 -14.8333 5.5909 5.5909 5.5953 5.5953 9.3959 9.3959 9.4217 9.4217 10.0447 10.0447 10.0545 10.0545 10.4328 10.4328 10.4349 10.4349 13.2195 13.2195 13.2302 13.2302 13.8938 13.8938 k = 0.1420 0.4633 0.6684 ( 2822 PWs) bands (ev): -37.4109 -37.4109 -37.4109 -37.4109 -16.6932 -16.6932 -16.6922 -16.6922 -15.0424 -15.0424 -14.9549 -14.9549 -14.9171 -14.9171 -14.8291 -14.8291 5.5458 5.5458 5.5507 5.5507 9.4148 9.4148 9.4429 9.4429 10.0855 10.0855 10.1047 10.1047 10.3994 10.3994 10.4083 10.4083 13.2091 13.2091 13.2203 13.2203 13.8833 13.8833 k = 0.1367 0.4461 0.6684 ( 2820 PWs) bands (ev): -37.4118 -37.4118 -37.4118 -37.4118 -16.6911 -16.6911 -16.6900 -16.6900 -15.0408 -15.0408 -14.9537 -14.9537 -14.9124 -14.9124 -14.8247 -14.8247 5.5015 5.5015 5.5067 5.5067 9.4304 9.4304 9.4604 9.4604 10.1051 10.1051 10.1341 10.1341 10.3903 10.3903 10.4069 10.4069 13.1970 13.1970 13.2088 13.2088 13.8696 13.8696 k = 0.1315 0.4289 0.6684 ( 2820 PWs) bands (ev): -37.4126 -37.4126 -37.4126 -37.4126 -16.6889 -16.6889 -16.6878 -16.6878 -15.0391 -15.0391 -14.9535 -14.9535 -14.9064 -14.9064 -14.8203 -14.8203 5.4579 5.4579 5.4635 5.4635 9.4421 9.4421 9.4737 9.4737 10.0994 10.0994 10.1335 10.1335 10.4158 10.4158 10.4357 10.4357 13.1832 13.1832 13.1955 13.1955 13.8535 13.8535 k = 0.1262 0.4118 0.6684 ( 2812 PWs) bands (ev): -37.4135 -37.4135 -37.4135 -37.4135 -16.6867 -16.6867 -16.6856 -16.6856 -15.0375 -15.0375 -14.9542 -14.9542 -14.8996 -14.8996 -14.8158 -14.8158 5.4153 5.4153 5.4211 5.4211 9.4490 9.4490 9.4816 9.4816 10.0768 10.0768 10.1113 10.1113 10.4684 10.4684 10.4874 10.4874 13.1677 13.1677 13.1805 13.1805 13.8359 13.8359 k = 0.1210 0.3946 0.6684 ( 2816 PWs) bands (ev): -37.4143 -37.4143 -37.4143 -37.4143 -16.6846 -16.6846 -16.6835 -16.6835 -15.0358 -15.0358 -14.9553 -14.9553 -14.8922 -14.8922 -14.8113 -14.8113 5.3737 5.3737 5.3797 5.3797 9.4501 9.4501 9.4830 9.4830 10.0485 10.0485 10.0815 10.0815 10.5352 10.5352 10.5523 10.5523 13.1504 13.1504 13.1636 13.1636 13.8176 13.8176 k = 0.1157 0.3775 0.6684 ( 2816 PWs) bands (ev): -37.4152 -37.4152 -37.4152 -37.4152 -16.6825 -16.6825 -16.6814 -16.6814 -15.0340 -15.0340 -14.9568 -14.9568 -14.8844 -14.8844 -14.8067 -14.8067 5.3332 5.3332 5.3393 5.3393 9.4445 9.4445 9.4768 9.4768 10.0216 10.0216 10.0524 10.0524 10.6090 10.6090 10.6243 10.6243 13.1314 13.1314 13.1452 13.1452 13.7994 13.7994 k = 0.1104 0.3603 0.6684 ( 2816 PWs) bands (ev): -37.4161 -37.4161 -37.4161 -37.4161 -16.6805 -16.6805 -16.6793 -16.6793 -15.0323 -15.0323 -14.9585 -14.9585 -14.8764 -14.8764 -14.8022 -14.8022 5.2938 5.2938 5.3001 5.3001 9.4316 9.4316 9.4623 9.4623 10.0000 10.0000 10.0281 10.0281 10.6864 10.6864 10.7005 10.7005 13.1110 13.1110 13.1251 13.1251 13.7819 13.7819 k = 0.1052 0.3431 0.6684 ( 2804 PWs) bands (ev): -37.4169 -37.4169 -37.4169 -37.4169 -16.6785 -16.6785 -16.6773 -16.6773 -15.0306 -15.0306 -14.9604 -14.9604 -14.8683 -14.8683 -14.7976 -14.7976 5.2558 5.2558 5.2621 5.2621 9.4112 9.4112 9.4394 9.4394 9.9855 9.9855 10.0103 10.0103 10.7659 10.7659 10.7789 10.7789 13.0892 13.0892 13.1038 13.1038 13.7655 13.7655 k = 0.0999 0.3260 0.6684 ( 2804 PWs) bands (ev): -37.4177 -37.4177 -37.4177 -37.4177 -16.6766 -16.6766 -16.6754 -16.6754 -15.0289 -15.0289 -14.9623 -14.9623 -14.8602 -14.8602 -14.7931 -14.7931 5.2191 5.2191 5.2254 5.2254 9.3839 9.3839 9.4090 9.4090 9.9782 9.9782 9.9993 9.9993 10.8464 10.8464 10.8587 10.8587 13.0664 13.0664 13.0813 13.0813 13.7506 13.7506 k = 0.0947 0.3088 0.6684 ( 2804 PWs) bands (ev): -37.4185 -37.4185 -37.4185 -37.4185 -16.6747 -16.6747 -16.6736 -16.6736 -15.0273 -15.0273 -14.9643 -14.9643 -14.8521 -14.8521 -14.7887 -14.7887 5.1838 5.1838 5.1901 5.1901 9.3507 9.3507 9.3726 9.3726 9.9773 9.9773 9.9948 9.9948 10.9273 10.9273 10.9390 10.9390 13.0426 13.0426 13.0578 13.0578 13.7373 13.7373 k = 0.0894 0.2917 0.6684 ( 2800 PWs) bands (ev): -37.4193 -37.4193 -37.4193 -37.4193 -16.6729 -16.6729 -16.6718 -16.6718 -15.0256 -15.0256 -14.9663 -14.9663 -14.8441 -14.8441 -14.7844 -14.7844 5.1500 5.1500 5.1562 5.1562 9.3132 9.3132 9.3320 9.3320 9.9815 9.9815 9.9956 9.9956 11.0080 11.0080 11.0193 11.0193 13.0183 13.0183 13.0337 13.0337 13.7258 13.7258 k = 0.0842 0.2745 0.6684 ( 2804 PWs) bands (ev): -37.4201 -37.4201 -37.4201 -37.4201 -16.6712 -16.6712 -16.6701 -16.6701 -15.0239 -15.0239 -14.9683 -14.9683 -14.8362 -14.8362 -14.7802 -14.7802 5.1178 5.1178 5.1239 5.1239 9.2729 9.2729 9.2888 9.2888 9.9894 9.9894 10.0006 10.0006 11.0881 11.0881 11.0991 11.0991 12.9935 12.9935 13.0092 13.0092 13.7162 13.7162 k = 0.0789 0.2574 0.6684 ( 2804 PWs) bands (ev): -37.4208 -37.4208 -37.4208 -37.4208 -16.6695 -16.6695 -16.6685 -16.6685 -15.0223 -15.0223 -14.9703 -14.9703 -14.8285 -14.8285 -14.7762 -14.7762 5.0873 5.0873 5.0932 5.0932 9.2309 9.2309 9.2444 9.2444 10.0000 10.0000 10.0086 10.0086 11.1670 11.1670 11.1779 11.1779 12.9687 12.9687 12.9846 12.9846 13.7084 13.7084 k = 0.0736 0.2402 0.6684 ( 2800 PWs) bands (ev): -37.4215 -37.4215 -37.4215 -37.4215 -16.6680 -16.6680 -16.6670 -16.6670 -15.0207 -15.0207 -14.9723 -14.9723 -14.8210 -14.8210 -14.7723 -14.7723 5.0584 5.0584 5.0641 5.0641 9.1886 9.1886 9.1999 9.1999 10.0122 10.0122 10.0188 10.0188 11.2445 11.2445 11.2552 11.2552 12.9441 12.9441 12.9600 12.9600 13.7023 13.7023 k = 0.0684 0.2230 0.6684 ( 2792 PWs) bands (ev): -37.4222 -37.4222 -37.4222 -37.4222 -16.6665 -16.6665 -16.6656 -16.6656 -15.0191 -15.0191 -14.9744 -14.9744 -14.8137 -14.8137 -14.7687 -14.7687 5.0313 5.0313 5.0368 5.0368 9.1468 9.1468 9.1562 9.1562 10.0254 10.0254 10.0303 10.0303 11.3200 11.3200 11.3306 11.3306 12.9197 12.9197 12.9356 12.9356 13.6979 13.6979 k = 0.0631 0.2059 0.6684 ( 2792 PWs) bands (ev): -37.4228 -37.4228 -37.4228 -37.4228 -16.6652 -16.6652 -16.6642 -16.6642 -15.0175 -15.0175 -14.9764 -14.9764 -14.8067 -14.8067 -14.7653 -14.7653 5.0060 5.0060 5.0112 5.0112 9.1061 9.1061 9.1141 9.1141 10.0389 10.0389 10.0426 10.0426 11.3932 11.3932 11.4037 11.4037 12.8960 12.8960 12.9118 12.9118 13.6951 13.6951 k = 0.0579 0.1887 0.6684 ( 2790 PWs) bands (ev): -37.4234 -37.4234 -37.4234 -37.4234 -16.6639 -16.6639 -16.6630 -16.6630 -15.0159 -15.0159 -14.9783 -14.9783 -14.8000 -14.8000 -14.7622 -14.7622 4.9825 4.9825 4.9874 4.9874 9.0673 9.0673 9.0739 9.0739 10.0525 10.0525 10.0551 10.0551 11.4635 11.4635 11.4739 11.4739 12.8730 12.8730 12.8885 12.8885 13.6936 13.6936 k = 0.0526 0.1716 0.6684 ( 2790 PWs) bands (ev): -37.4240 -37.4240 -37.4240 -37.4240 -16.6627 -16.6627 -16.6619 -16.6619 -15.0143 -15.0143 -14.9803 -14.9803 -14.7937 -14.7937 -14.7594 -14.7594 4.9610 4.9610 4.9655 4.9655 9.0307 9.0307 9.0363 9.0363 10.0657 10.0657 10.0674 10.0674 11.5305 11.5305 11.5407 11.5407 12.8509 12.8509 12.8661 12.8661 13.6933 13.6933 k = 0.0473 0.1544 0.6684 ( 2794 PWs) bands (ev): -37.4245 -37.4245 -37.4245 -37.4245 -16.6616 -16.6616 -16.6609 -16.6609 -15.0128 -15.0128 -14.9822 -14.9822 -14.7877 -14.7877 -14.7569 -14.7569 4.9414 4.9414 4.9456 4.9456 8.9968 8.9968 9.0014 9.0014 10.0782 10.0782 10.0793 10.0793 11.5937 11.5937 11.6037 11.6037 12.8300 12.8300 12.8447 12.8447 13.6941 13.6941 k = 0.0421 0.1373 0.6684 ( 2802 PWs) bands (ev): -37.4250 -37.4250 -37.4250 -37.4250 -16.6607 -16.6607 -16.6600 -16.6600 -15.0112 -15.0112 -14.9841 -14.9841 -14.7821 -14.7821 -14.7548 -14.7548 4.9237 4.9237 4.9275 4.9275 8.9658 8.9658 8.9696 8.9696 10.0899 10.0899 10.0905 10.0905 11.6526 11.6526 11.6622 11.6622 12.8104 12.8104 12.8244 12.8244 13.6958 13.6958 k = 0.0368 0.1201 0.6684 ( 2798 PWs) bands (ev): -37.4254 -37.4254 -37.4254 -37.4254 -16.6598 -16.6598 -16.6592 -16.6592 -15.0096 -15.0096 -14.9860 -14.9860 -14.7769 -14.7769 -14.7531 -14.7531 4.9081 4.9081 4.9115 4.9115 8.9380 8.9380 8.9411 8.9411 10.1005 10.1005 10.1008 10.1008 11.7066 11.7066 11.7158 11.7158 12.7924 12.7924 12.8055 12.8055 13.6981 13.6981 k = 0.0316 0.1029 0.6684 ( 2802 PWs) bands (ev): -37.4258 -37.4258 -37.4258 -37.4258 -16.6591 -16.6591 -16.6586 -16.6586 -15.0081 -15.0081 -14.9879 -14.9879 -14.7721 -14.7721 -14.7518 -14.7518 4.8946 4.8946 4.8975 4.8975 8.9135 8.9135 8.9161 8.9161 10.1100 10.1100 10.1101 10.1101 11.7553 11.7553 11.7638 11.7638 12.7761 12.7761 12.7881 12.7881 13.7008 13.7008 k = 0.0263 0.0858 0.6684 ( 2798 PWs) bands (ev): -37.4260 -37.4260 -37.4260 -37.4260 -16.6584 -16.6584 -16.6580 -16.6580 -15.0065 -15.0065 -14.9897 -14.9897 -14.7678 -14.7678 -14.7509 -14.7509 4.8831 4.8831 4.8856 4.8856 8.8926 8.8926 8.8946 8.8946 10.1181 10.1181 10.1181 10.1181 11.7980 11.7980 11.8056 11.8056 12.7618 12.7618 12.7725 12.7725 13.7037 13.7037 k = 0.0210 0.0686 0.6684 ( 2802 PWs) bands (ev): -37.4263 -37.4263 -37.4263 -37.4263 -16.6579 -16.6579 -16.6575 -16.6575 -15.0049 -15.0049 -14.9915 -14.9915 -14.7640 -14.7640 -14.7505 -14.7505 4.8737 4.8737 4.8757 4.8757 8.8754 8.8754 8.8769 8.8769 10.1248 10.1248 10.1249 10.1249 11.8342 11.8342 11.8407 11.8407 12.7499 12.7499 12.7588 12.7588 13.7067 13.7067 k = 0.0158 0.0515 0.6684 ( 2810 PWs) bands (ev): -37.4266 -37.4266 -37.4266 -37.4266 -16.6574 -16.6574 -16.6572 -16.6572 -15.0033 -15.0033 -14.9932 -14.9932 -14.7606 -14.7606 -14.7505 -14.7505 4.8665 4.8665 4.8680 4.8680 8.8619 8.8619 8.8631 8.8631 10.1301 10.1301 10.1302 10.1302 11.8633 11.8633 11.8685 11.8685 12.7404 12.7404 12.7475 12.7475 13.7096 13.7096 k = 0.0105 0.0343 0.6684 ( 2814 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6571 -16.6571 -16.6570 -16.6570 -15.0017 -15.0017 -14.9950 -14.9950 -14.7577 -14.7577 -14.7509 -14.7509 4.8614 4.8614 4.8624 4.8624 8.8523 8.8523 8.8530 8.8530 10.1340 10.1340 10.1341 10.1341 11.8849 11.8849 11.8884 11.8884 12.7339 12.7339 12.7387 12.7387 13.7121 13.7121 k = 0.0053 0.0172 0.6684 ( 2822 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6569 -16.6569 -16.6568 -16.6568 -15.0000 -15.0000 -14.9967 -14.9967 -14.7553 -14.7553 -14.7519 -14.7519 4.8584 4.8584 4.8589 4.8589 8.8466 8.8466 8.8469 8.8469 10.1363 10.1363 10.1364 10.1364 11.8984 11.8984 11.9002 11.9002 12.7304 12.7304 12.7328 12.7328 13.7141 13.7141 k = 0.0000 0.0000 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6568 -16.6568 -16.6568 -16.6568 -14.9984 -14.9984 -14.9984 -14.9984 -14.7533 -14.7533 -14.7533 -14.7533 4.8576 4.8576 4.8576 4.8576 8.8448 8.8448 8.8448 8.8448 10.1371 10.1371 10.1371 10.1371 11.9035 11.9035 11.9035 11.9035 12.7300 12.7300 12.7300 12.7300 13.7156 13.7156 k = 0.0000 0.0000 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6568 -16.6568 -16.6568 -16.6568 -14.9984 -14.9984 -14.9984 -14.9984 -14.7533 -14.7533 -14.7533 -14.7533 4.8576 4.8576 4.8576 4.8576 8.8448 8.8448 8.8448 8.8448 10.1371 10.1371 10.1371 10.1371 11.9035 11.9035 11.9035 11.9035 12.7300 12.7300 12.7300 12.7300 13.7156 13.7156 k = 0.0000 0.0000 0.6503 ( 2822 PWs) bands (ev): -37.4281 -37.4281 -37.4257 -37.4257 -16.6604 -16.6604 -16.6532 -16.6532 -15.0026 -15.0026 -14.9940 -14.9940 -14.7558 -14.7558 -14.7509 -14.7509 4.7630 4.7630 4.9529 4.9529 8.7959 8.7959 8.8930 8.8930 10.1304 10.1304 10.1438 10.1438 11.8876 11.8876 11.9218 11.9218 12.6814 12.6814 12.7778 12.7778 13.6994 13.6994 k = 0.0000 0.0000 0.6323 ( 2810 PWs) bands (ev): -37.4292 -37.4292 -37.4245 -37.4245 -16.6639 -16.6639 -16.6495 -16.6495 -15.0068 -15.0068 -14.9896 -14.9896 -14.7583 -14.7583 -14.7484 -14.7484 4.6695 4.6695 5.0489 5.0489 8.7469 8.7469 8.9402 8.9402 10.1241 10.1241 10.1501 10.1501 11.8741 11.8741 11.9424 11.9424 12.6323 12.6323 12.8244 12.8244 13.6858 13.6858 k = 0.0000 0.0000 0.6142 ( 2806 PWs) bands (ev): -37.4304 -37.4304 -37.4232 -37.4232 -16.6674 -16.6674 -16.6458 -16.6458 -15.0110 -15.0110 -14.9852 -14.9852 -14.7609 -14.7609 -14.7460 -14.7460 4.5772 4.5772 5.1453 5.1453 8.6982 8.6982 8.9857 8.9857 10.1184 10.1184 10.1558 10.1558 11.8630 11.8630 11.9653 11.9653 12.5831 12.5831 12.8692 12.8692 13.6751 13.6751 k = 0.0000 0.0000 0.5961 ( 2802 PWs) bands (ev): -37.4316 -37.4316 -37.4221 -37.4221 -16.6708 -16.6708 -16.6420 -16.6420 -15.0150 -15.0150 -14.9807 -14.9807 -14.7634 -14.7634 -14.7436 -14.7436 4.4861 4.4861 5.2418 5.2418 8.6501 8.6501 9.0291 9.0291 10.1140 10.1140 10.1607 10.1607 11.8543 11.8543 11.9905 11.9905 12.5344 12.5344 12.9119 12.9119 13.6675 13.6675 k = 0.0000 0.0000 0.5781 ( 2800 PWs) bands (ev): -37.4327 -37.4327 -37.4209 -37.4209 -16.6741 -16.6741 -16.6382 -16.6382 -15.0189 -15.0189 -14.9762 -14.9762 -14.7659 -14.7659 -14.7412 -14.7412 4.3965 4.3965 5.3382 5.3382 8.6032 8.6032 9.0697 9.0697 10.1113 10.1113 10.1648 10.1648 11.8480 11.8480 12.0179 12.0179 12.4863 12.4863 12.9520 12.9520 13.6632 13.6632 k = 0.0000 0.0000 0.5600 ( 2802 PWs) bands (ev): -37.4339 -37.4339 -37.4197 -37.4197 -16.6773 -16.6773 -16.6344 -16.6344 -15.0228 -15.0228 -14.9716 -14.9716 -14.7684 -14.7684 -14.7389 -14.7389 4.3086 4.3086 5.4342 5.4342 8.5577 8.5577 9.1069 9.1069 10.1111 10.1111 10.1678 10.1678 11.8441 11.8441 12.0474 12.0474 12.4394 12.4394 12.9889 12.9889 13.6625 13.6625 k = 0.0000 0.0000 0.5419 ( 2798 PWs) bands (ev): -37.4351 -37.4351 -37.4186 -37.4186 -16.6804 -16.6804 -16.6306 -16.6306 -15.0266 -15.0266 -14.9670 -14.9670 -14.7710 -14.7710 -14.7365 -14.7365 4.2223 4.2223 5.5294 5.5294 8.5143 8.5143 9.1401 9.1401 10.1139 10.1139 10.1697 10.1697 11.8426 11.8426 12.0788 12.0788 12.3942 12.3942 13.0223 13.0223 13.6655 13.6655 k = 0.0000 0.0000 0.5239 ( 2796 PWs) bands (ev): -37.4362 -37.4362 -37.4175 -37.4175 -16.6835 -16.6835 -16.6268 -16.6268 -15.0302 -15.0302 -14.9624 -14.9624 -14.7735 -14.7735 -14.7343 -14.7343 4.1379 4.1379 5.6235 5.6235 8.4733 8.4733 9.1687 9.1687 10.1204 10.1204 10.1703 10.1703 11.8434 11.8434 12.1117 12.1117 12.3512 12.3512 13.0517 13.0517 13.6725 13.6725 k = 0.0000 0.0000 0.5058 ( 2794 PWs) bands (ev): -37.4374 -37.4374 -37.4164 -37.4164 -16.6864 -16.6864 -16.6229 -16.6229 -15.0338 -15.0338 -14.9578 -14.9578 -14.7760 -14.7760 -14.7320 -14.7320 4.0553 4.0553 5.7160 5.7160 8.4352 8.4352 9.1922 9.1922 10.1312 10.1312 10.1697 10.1697 11.8467 11.8467 12.1455 12.1455 12.3116 12.3116 13.0765 13.0765 13.6836 13.6836 k = 0.0000 0.0000 0.4878 ( 2804 PWs) bands (ev): -37.4385 -37.4385 -37.4154 -37.4154 -16.6893 -16.6893 -16.6191 -16.6191 -15.0373 -15.0373 -14.9532 -14.9532 -14.7786 -14.7786 -14.7299 -14.7299 3.9749 3.9749 5.8065 5.8065 8.4005 8.4005 9.2103 9.2103 10.1467 10.1467 10.1677 10.1677 11.8523 11.8523 12.1767 12.1767 12.2786 12.2786 13.0966 13.0966 13.6988 13.6988 k = 0.0000 0.0000 0.4697 ( 2808 PWs) bands (ev): -37.4396 -37.4396 -37.4144 -37.4144 -16.6921 -16.6921 -16.6154 -16.6154 -15.0406 -15.0406 -14.9486 -14.9486 -14.7811 -14.7811 -14.7277 -14.7277 3.8965 3.8965 5.8943 5.8943 8.3699 8.3699 9.2228 9.2228 10.1637 10.1637 10.1677 10.1677 11.8601 11.8601 12.1917 12.1917 12.2665 12.2665 13.1118 13.1118 13.7180 13.7180 k = 0.0000 0.0000 0.4516 ( 2804 PWs) bands (ev): -37.4407 -37.4407 -37.4133 -37.4133 -16.6947 -16.6947 -16.6116 -16.6116 -15.0438 -15.0438 -14.9439 -14.9439 -14.7836 -14.7836 -14.7256 -14.7256 3.8204 3.8204 5.9790 5.9790 8.3439 8.3439 9.2298 9.2298 10.1593 10.1593 10.1926 10.1926 11.8703 11.8703 12.1759 12.1759 12.2898 12.2898 13.1220 13.1220 13.7411 13.7411 k = 0.0000 0.0000 0.4336 ( 2812 PWs) bands (ev): -37.4418 -37.4418 -37.4124 -37.4124 -16.6973 -16.6973 -16.6079 -16.6079 -15.0470 -15.0470 -14.9394 -14.9394 -14.7861 -14.7861 -14.7236 -14.7236 3.7465 3.7465 6.0599 6.0599 8.3232 8.3232 9.2316 9.2316 10.1530 10.1530 10.2226 10.2226 11.8827 11.8827 12.1495 12.1495 12.3284 12.3284 13.1274 13.1274 13.7677 13.7677 k = 0.0000 0.0000 0.4155 ( 2820 PWs) bands (ev): -37.4429 -37.4429 -37.4115 -37.4115 -16.6998 -16.6998 -16.6043 -16.6043 -15.0500 -15.0500 -14.9348 -14.9348 -14.7886 -14.7886 -14.7216 -14.7216 3.6751 3.6751 6.1363 6.1363 8.3084 8.3084 9.2287 9.2287 10.1452 10.1452 10.2570 10.2570 11.8973 11.8973 12.1229 12.1229 12.3720 12.3720 13.1282 13.1282 13.7972 13.7972 k = 0.0000 0.0000 0.3974 ( 2820 PWs) bands (ev): -37.4439 -37.4439 -37.4106 -37.4106 -16.7021 -16.7021 -16.6007 -16.6007 -15.0529 -15.0529 -14.9303 -14.9303 -14.7911 -14.7911 -14.7197 -14.7197 3.6061 3.6061 6.2076 6.2076 8.3001 8.3001 9.2217 9.2217 10.1358 10.1358 10.2952 10.2952 11.9140 11.9140 12.0986 12.0986 12.4184 12.4184 13.1248 13.1248 13.8291 13.8291 k = 0.0000 0.0000 0.3794 ( 2814 PWs) bands (ev): -37.4449 -37.4449 -37.4096 -37.4096 -16.7044 -16.7044 -16.5972 -16.5972 -15.0556 -15.0556 -14.9258 -14.9258 -14.7936 -14.7936 -14.7179 -14.7179 3.5397 3.5397 6.2732 6.2732 8.2989 8.2989 9.2113 9.2113 10.1247 10.1247 10.3366 10.3366 11.9326 11.9326 12.0773 12.0773 12.4667 12.4667 13.1177 13.1177 13.8627 13.8627 k = 0.0000 0.0000 0.3613 ( 2810 PWs) bands (ev): -37.4458 -37.4458 -37.4087 -37.4087 -16.7065 -16.7065 -16.5938 -16.5938 -15.0583 -15.0583 -14.9213 -14.9213 -14.7960 -14.7960 -14.7161 -14.7161 3.4758 3.4758 6.3326 6.3326 8.3053 8.3053 9.1980 9.1980 10.1121 10.1121 10.3808 10.3808 11.9529 11.9529 12.0596 12.0596 12.5165 12.5165 13.1071 13.1071 13.8968 13.8968 k = 0.0000 0.0000 0.3432 ( 2810 PWs) bands (ev): -37.4467 -37.4467 -37.4079 -37.4079 -16.7086 -16.7086 -16.5905 -16.5905 -15.0608 -15.0608 -14.9169 -14.9169 -14.7985 -14.7985 -14.7143 -14.7143 3.4147 3.4147 6.3853 6.3853 8.3197 8.3197 9.1825 9.1825 10.0979 10.0979 10.4272 10.4272 11.9743 11.9743 12.0461 12.0461 12.5677 12.5677 13.0934 13.0934 13.9276 13.9276 k = 0.0000 0.0000 0.3252 ( 2809 PWs) bands (ev): -37.4476 -37.4476 -37.4071 -37.4071 -16.7105 -16.7105 -16.5872 -16.5872 -15.0632 -15.0632 -14.9126 -14.9126 -14.8009 -14.8009 -14.7127 -14.7127 3.3563 3.3563 6.4310 6.4310 8.3421 8.3421 9.1653 9.1653 10.0820 10.0820 10.4752 10.4752 11.9943 11.9943 12.0393 12.0393 12.6200 12.6200 13.0772 13.0772 13.9252 13.9252 k = 0.0000 0.0000 0.3071 ( 2809 PWs) bands (ev): -37.4484 -37.4484 -37.4063 -37.4063 -16.7123 -16.7123 -16.5841 -16.5841 -15.0655 -15.0655 -14.9083 -14.9083 -14.8034 -14.8034 -14.7111 -14.7111 3.3007 3.3007 6.4699 6.4699 8.3725 8.3725 9.1470 9.1470 10.0644 10.0644 10.5243 10.5243 12.0055 12.0055 12.0465 12.0465 12.6731 12.6731 13.0587 13.0587 13.8799 13.8799 k = 0.0000 0.0000 0.2890 ( 2811 PWs) bands (ev): -37.4492 -37.4492 -37.4056 -37.4056 -16.7140 -16.7140 -16.5811 -16.5811 -15.0676 -15.0676 -14.9041 -14.9041 -14.8058 -14.8058 -14.7096 -14.7096 3.2479 3.2479 6.5020 6.5020 8.4106 8.4106 9.1280 9.1280 10.0452 10.0452 10.5740 10.5740 12.0069 12.0069 12.0687 12.0687 12.7268 12.7268 13.0384 13.0384 13.8265 13.8265 k = 0.0000 0.0000 0.2710 ( 2815 PWs) bands (ev): -37.4500 -37.4500 -37.4049 -37.4049 -16.7156 -16.7156 -16.5783 -16.5783 -15.0696 -15.0696 -14.8999 -14.8999 -14.8083 -14.8083 -14.7081 -14.7081 3.1981 3.1981 6.5277 6.5277 8.4558 8.4558 9.1086 9.1086 10.0243 10.0243 10.6241 10.6241 12.0068 12.0068 12.0972 12.0972 12.7806 12.7806 13.0167 13.0167 13.7707 13.7707 k = 0.0000 0.0000 0.2529 ( 2819 PWs) bands (ev): -37.4508 -37.4508 -37.4043 -37.4043 -16.7171 -16.7171 -16.5755 -16.5755 -15.0715 -15.0715 -14.8959 -14.8959 -14.8107 -14.8107 -14.7067 -14.7067 3.1512 3.1512 6.5477 6.5477 8.5074 8.5074 9.0893 9.0893 10.0017 10.0017 10.6739 10.6739 12.0085 12.0085 12.1286 12.1286 12.8339 12.8339 12.9943 12.9943 13.7139 13.7139 k = 0.0000 0.0000 0.2348 ( 2817 PWs) bands (ev): -37.4514 -37.4514 -37.4037 -37.4037 -16.7185 -16.7185 -16.5730 -16.5730 -15.0733 -15.0733 -14.8919 -14.8919 -14.8132 -14.8132 -14.7055 -14.7055 3.1073 3.1073 6.5625 6.5625 8.5645 8.5645 9.0703 9.0703 9.9774 9.9774 10.7232 10.7232 12.0125 12.0125 12.1622 12.1622 12.8850 12.8850 12.9731 12.9731 13.6565 13.6565 k = 0.0000 0.0000 0.2168 ( 2819 PWs) bands (ev): -37.4521 -37.4521 -37.4032 -37.4032 -16.7198 -16.7198 -16.5705 -16.5705 -15.0749 -15.0749 -14.8880 -14.8880 -14.8156 -14.8156 -14.7043 -14.7043 3.0665 3.0665 6.5730 6.5730 8.6261 8.6261 9.0520 9.0520 9.9513 9.9513 10.7715 10.7715 12.0188 12.0188 12.1973 12.1973 12.9196 12.9196 12.9673 12.9673 13.5990 13.5990 k = 0.0000 0.0000 0.1987 ( 2827 PWs) bands (ev): -37.4526 -37.4526 -37.4027 -37.4027 -16.7210 -16.7210 -16.5683 -16.5683 -15.0764 -15.0764 -14.8842 -14.8842 -14.8181 -14.8181 -14.7031 -14.7031 3.0288 3.0288 6.5798 6.5798 8.6913 8.6913 9.0345 9.0345 9.9234 9.9234 10.8184 10.8184 12.0274 12.0274 12.2339 12.2339 12.9094 12.9094 13.0050 13.0050 13.5417 13.5417 k = 0.0000 0.0000 0.1806 ( 2823 PWs) bands (ev): -37.4532 -37.4532 -37.4022 -37.4022 -16.7221 -16.7221 -16.5662 -16.5662 -15.0778 -15.0778 -14.8804 -14.8804 -14.8206 -14.8206 -14.7021 -14.7021 2.9943 2.9943 6.5837 6.5837 8.7589 8.7589 9.0181 9.0181 9.8936 9.8936 10.8635 10.8635 12.0378 12.0378 12.2716 12.2716 12.8871 12.8871 13.0538 13.0538 13.4849 13.4849 k = 0.0000 0.0000 0.1626 ( 2819 PWs) bands (ev): -37.4536 -37.4536 -37.4018 -37.4018 -16.7231 -16.7231 -16.5643 -16.5643 -15.0791 -15.0791 -14.8768 -14.8768 -14.8231 -14.8231 -14.7012 -14.7012 2.9629 2.9629 6.5854 6.5854 8.8278 8.8278 9.0034 9.0034 9.8619 9.8619 10.9063 10.9063 12.0499 12.0499 12.3101 12.3101 12.8635 12.8635 13.1024 13.1024 13.4292 13.4292 k = 0.0000 0.0000 0.1445 ( 2821 PWs) bands (ev): -37.4541 -37.4541 -37.4014 -37.4014 -16.7239 -16.7239 -16.5626 -16.5626 -15.0802 -15.0802 -14.8732 -14.8732 -14.8256 -14.8256 -14.7003 -14.7003 2.9348 2.9348 6.5853 6.5853 8.8960 8.8960 8.9915 8.9915 9.8283 9.8283 10.9464 10.9464 12.0631 12.0631 12.3491 12.3491 12.8404 12.8404 13.1488 13.1488 13.3750 13.3750 k = 0.0000 0.0000 0.1265 ( 2819 PWs) bands (ev): -37.4545 -37.4545 -37.4011 -37.4011 -16.7247 -16.7247 -16.5610 -16.5610 -15.0812 -15.0812 -14.8697 -14.8697 -14.8281 -14.8281 -14.6996 -14.6996 2.9098 2.9098 6.5842 6.5842 8.9511 8.9511 8.9940 8.9940 9.7926 9.7926 10.9834 10.9834 12.0770 12.0770 12.3882 12.3882 12.8185 12.8185 13.1912 13.1912 13.3238 13.3238 k = 0.0000 0.0000 0.1084 ( 2817 PWs) bands (ev): -37.4548 -37.4548 -37.4008 -37.4008 -16.7254 -16.7254 -16.5597 -16.5597 -15.0820 -15.0820 -14.8664 -14.8664 -14.8307 -14.8307 -14.6989 -14.6989 2.8882 2.8882 6.5823 6.5823 8.9566 8.9566 9.0467 9.0467 9.7550 9.7550 11.0167 11.0167 12.0911 12.0911 12.4268 12.4268 12.7983 12.7983 13.2226 13.2226 13.2824 13.2824 k = 0.0000 0.0000 0.0903 ( 2797 PWs) bands (ev): -37.4550 -37.4550 -37.4004 -37.4004 -16.7259 -16.7259 -16.5586 -16.5586 -15.0827 -15.0827 -14.8630 -14.8630 -14.8333 -14.8333 -14.6984 -14.6984 2.8699 2.8699 6.5801 6.5801 8.9494 8.9494 9.1122 9.1122 9.7154 9.7154 11.0460 11.0460 12.1046 12.1046 12.4639 12.4639 12.7805 12.7805 13.2088 13.2088 13.2851 13.2851 k = 0.0000 0.0000 0.0723 ( 2801 PWs) bands (ev): -37.4553 -37.4553 -37.4002 -37.4002 -16.7264 -16.7264 -16.5576 -16.5576 -15.0833 -15.0833 -14.8598 -14.8598 -14.8360 -14.8360 -14.6979 -14.6979 2.8548 2.8548 6.5780 6.5780 8.9421 8.9421 9.1766 9.1766 9.6743 9.6743 11.0706 11.0706 12.1170 12.1170 12.4985 12.4985 12.7654 12.7654 13.1703 13.1703 13.3118 13.3118 k = 0.0000 0.0000 0.0542 ( 2801 PWs) bands (ev): -37.4555 -37.4555 -37.4000 -37.4000 -16.7267 -16.7267 -16.5569 -16.5569 -15.0838 -15.0838 -14.8567 -14.8567 -14.8386 -14.8386 -14.6975 -14.6975 2.8431 2.8431 6.5760 6.5760 8.9362 8.9362 9.2374 9.2374 9.6324 9.6324 11.0903 11.0903 12.1275 12.1275 12.5288 12.5288 12.7535 12.7535 13.1338 13.1338 13.3362 13.3362 k = 0.0000 0.0000 0.0361 ( 2801 PWs) bands (ev): -37.4556 -37.4556 -37.3999 -37.3999 -16.7270 -16.7270 -16.5564 -16.5564 -15.0841 -15.0841 -14.8538 -14.8538 -14.8413 -14.8413 -14.6973 -14.6973 2.8347 2.8347 6.5745 6.5745 8.9318 8.9318 9.2919 9.2919 9.5919 9.5919 11.1047 11.1047 12.1356 12.1356 12.5530 12.5530 12.7451 12.7451 13.1045 13.1045 13.3549 13.3549 k = 0.0000 0.0000 0.0181 ( 2801 PWs) bands (ev): -37.4557 -37.4557 -37.3999 -37.3999 -16.7271 -16.7271 -16.5560 -16.5560 -15.0843 -15.0843 -14.8510 -14.8510 -14.8438 -14.8438 -14.6971 -14.6971 2.8297 2.8297 6.5736 6.5736 8.9292 8.9292 9.3341 9.3341 9.5582 9.5582 11.1134 11.1134 12.1407 12.1407 12.5687 12.5687 12.7403 12.7403 13.0853 13.0853 13.3665 13.3665 k = 0.0000 0.0000 0.0000 ( 2801 PWs) bands (ev): -37.4557 -37.4557 -37.3998 -37.3998 -16.7272 -16.7272 -16.5559 -16.5559 -15.0844 -15.0844 -14.8495 -14.8495 -14.8453 -14.8453 -14.6971 -14.6971 2.8280 2.8280 6.5732 6.5732 8.9283 8.9283 9.3516 9.3516 9.5436 9.5436 11.1163 11.1163 12.1424 12.1424 12.5742 12.5742 12.7387 12.7387 13.0786 13.0786 13.3704 13.3704 k = 0.0000 0.0000 0.0000 ( 2801 PWs) bands (ev): -37.4557 -37.4557 -37.3998 -37.3998 -16.7272 -16.7272 -16.5559 -16.5559 -15.0844 -15.0844 -14.8495 -14.8495 -14.8453 -14.8453 -14.6971 -14.6971 2.8280 2.8280 6.5732 6.5732 8.9283 8.9283 9.3516 9.3516 9.5436 9.5436 11.1163 11.1163 12.1424 12.1424 12.5742 12.5742 12.7387 12.7387 13.0786 13.0786 13.3704 13.3704 k =-0.0172 0.0053-0.0000 ( 2805 PWs) bands (ev): -37.4557 -37.4557 -37.3999 -37.3999 -16.7272 -16.7272 -16.5560 -16.5560 -15.0843 -15.0843 -14.8496 -14.8496 -14.8453 -14.8453 -14.6971 -14.6971 2.8295 2.8295 6.5711 6.5711 8.9225 8.9225 9.3571 9.3571 9.5431 9.5431 11.1150 11.1150 12.1388 12.1388 12.5743 12.5743 12.7447 12.7447 13.0779 13.0779 13.3722 13.3722 k =-0.0345 0.0106-0.0000 ( 2809 PWs) bands (ev): -37.4558 -37.4558 -37.3999 -37.3999 -16.7270 -16.7270 -16.5561 -16.5561 -15.0841 -15.0841 -14.8497 -14.8497 -14.8454 -14.8454 -14.6971 -14.6971 2.8340 2.8340 6.5647 6.5647 8.9061 8.9061 9.3727 9.3727 9.5415 9.5415 11.1111 11.1111 12.1285 12.1285 12.5745 12.5745 12.7623 12.7623 13.0759 13.0759 13.3776 13.3776 k =-0.0517 0.0159-0.0000 ( 2805 PWs) bands (ev): -37.4557 -37.4557 -37.3999 -37.3999 -16.7269 -16.7269 -16.5563 -16.5563 -15.0838 -15.0838 -14.8499 -14.8499 -14.8455 -14.8455 -14.6972 -14.6972 2.8416 2.8416 6.5539 6.5539 8.8818 8.8818 9.3958 9.3958 9.5389 9.5389 11.1047 11.1047 12.1127 12.1127 12.5744 12.5744 12.7905 12.7905 13.0725 13.0725 13.3866 13.3866 k =-0.0690 0.0211-0.0000 ( 2807 PWs) bands (ev): -37.4557 -37.4557 -37.3999 -37.3999 -16.7266 -16.7266 -16.5566 -16.5566 -15.0834 -15.0834 -14.8502 -14.8502 -14.8456 -14.8456 -14.6973 -14.6973 2.8521 2.8521 6.5388 6.5388 8.8528 8.8528 9.4233 9.4233 9.5354 9.5354 11.0959 11.0959 12.0930 12.0930 12.5738 12.5738 12.8283 12.8283 13.0679 13.0679 13.3989 13.3989 k =-0.0862 0.0264-0.0000 ( 2801 PWs) bands (ev): -37.4556 -37.4556 -37.3999 -37.3999 -16.7263 -16.7263 -16.5569 -16.5569 -15.0829 -15.0829 -14.8507 -14.8507 -14.8457 -14.8457 -14.6974 -14.6974 2.8655 2.8655 6.5192 6.5192 8.8216 8.8216 9.4529 9.4529 9.5311 9.5311 11.0847 11.0847 12.0707 12.0707 12.5725 12.5725 12.8739 12.8739 13.0622 13.0622 13.4143 13.4143 k =-0.1034 0.0317-0.0000 ( 2801 PWs) bands (ev): -37.4556 -37.4556 -37.4000 -37.4000 -16.7260 -16.7260 -16.5573 -16.5573 -15.0822 -15.0822 -14.8512 -14.8512 -14.8458 -14.8458 -14.6976 -14.6976 2.8819 2.8819 6.4950 6.4950 8.7903 8.7903 9.4823 9.4823 9.5264 9.5264 11.0713 11.0713 12.0472 12.0472 12.5707 12.5707 12.9263 12.9263 13.0553 13.0553 13.4303 13.4303 k =-0.1207 0.0370-0.0000 ( 2797 PWs) bands (ev): -37.4555 -37.4555 -37.4000 -37.4000 -16.7256 -16.7256 -16.5578 -16.5578 -15.0814 -15.0814 -14.8519 -14.8519 -14.8458 -14.8458 -14.6978 -14.6978 2.9010 2.9010 6.4662 6.4662 8.7603 8.7603 9.5068 9.5068 9.5249 9.5249 11.0556 11.0556 12.0232 12.0232 12.5685 12.5685 12.9841 12.9841 13.0475 13.0475 13.4273 13.4273 k =-0.1379 0.0423-0.0000 ( 2795 PWs) bands (ev): -37.4554 -37.4554 -37.4001 -37.4001 -16.7251 -16.7251 -16.5583 -16.5583 -15.0806 -15.0806 -14.8527 -14.8527 -14.8459 -14.8459 -14.6980 -14.6980 2.9228 2.9228 6.4329 6.4329 8.7329 8.7329 9.5087 9.5087 9.5436 9.5436 11.0378 11.0378 11.9995 11.9995 12.5660 12.5660 13.0384 13.0384 13.0471 13.0471 13.4010 13.4010 k =-0.1552 0.0476-0.0000 ( 2797 PWs) bands (ev): -37.4553 -37.4553 -37.4002 -37.4002 -16.7246 -16.7246 -16.5589 -16.5589 -15.0796 -15.0796 -14.8537 -14.8537 -14.8459 -14.8459 -14.6982 -14.6982 2.9473 2.9473 6.3950 6.3950 8.7090 8.7090 9.5022 9.5022 9.5678 9.5678 11.0178 11.0178 11.9765 11.9765 12.5633 12.5633 13.0295 13.0295 13.1129 13.1129 13.3667 13.3667 k =-0.1724 0.0529-0.0000 ( 2797 PWs) bands (ev): -37.4552 -37.4552 -37.4003 -37.4003 -16.7240 -16.7240 -16.5596 -16.5596 -15.0786 -15.0786 -14.8547 -14.8547 -14.8459 -14.8459 -14.6984 -14.6984 2.9742 2.9742 6.3528 6.3528 8.6890 8.6890 9.4943 9.4943 9.5902 9.5902 10.9954 10.9954 11.9546 11.9546 12.5604 12.5604 13.0196 13.0196 13.1822 13.1822 13.3278 13.3278 k =-0.1897 0.0581-0.0000 ( 2790 PWs) bands (ev): -37.4551 -37.4551 -37.4003 -37.4003 -16.7234 -16.7234 -16.5602 -16.5602 -15.0775 -15.0775 -14.8558 -14.8558 -14.8458 -14.8458 -14.6986 -14.6986 3.0035 3.0035 6.3064 6.3064 8.6734 8.6734 9.4858 9.4858 9.6101 9.6101 10.9705 10.9705 11.9338 11.9338 12.5576 12.5576 13.0094 13.0094 13.2523 13.2523 13.2882 13.2882 k =-0.2069 0.0634-0.0000 ( 2794 PWs) bands (ev): -37.4551 -37.4551 -37.4004 -37.4004 -16.7227 -16.7227 -16.5610 -16.5610 -15.0763 -15.0763 -14.8570 -14.8570 -14.8458 -14.8458 -14.6989 -14.6989 3.0350 3.0350 6.2562 6.2562 8.6625 8.6625 9.4769 9.4769 9.6274 9.6274 10.9429 10.9429 11.9144 11.9144 12.5547 12.5547 12.9988 12.9988 13.2419 13.2419 13.3308 13.3308 k =-0.2241 0.0687-0.0000 ( 2794 PWs) bands (ev): -37.4549 -37.4549 -37.4005 -37.4005 -16.7221 -16.7221 -16.5617 -16.5617 -15.0751 -15.0751 -14.8583 -14.8583 -14.8457 -14.8457 -14.6992 -14.6992 3.0685 3.0685 6.2026 6.2026 8.6562 8.6562 9.4677 9.4677 9.6420 9.6420 10.9126 10.9126 11.8963 11.8963 12.5520 12.5520 12.9882 12.9882 13.2012 13.2012 13.4064 13.4064 k =-0.2414 0.0740-0.0000 ( 2794 PWs) bands (ev): -37.4548 -37.4548 -37.4006 -37.4006 -16.7214 -16.7214 -16.5625 -16.5625 -15.0738 -15.0738 -14.8597 -14.8597 -14.8457 -14.8457 -14.6994 -14.6994 3.1037 3.1037 6.1461 6.1461 8.6544 8.6544 9.4585 9.4585 9.6543 9.6543 10.8794 10.8794 11.8797 11.8797 12.5494 12.5494 12.9775 12.9775 13.1624 13.1624 13.4836 13.4836 k =-0.2586 0.0793-0.0000 ( 2790 PWs) bands (ev): -37.4547 -37.4547 -37.4007 -37.4007 -16.7207 -16.7207 -16.5633 -16.5633 -15.0726 -15.0726 -14.8610 -14.8610 -14.8456 -14.8456 -14.6997 -14.6997 3.1405 3.1405 6.0873 6.0873 8.6571 8.6571 9.4492 9.4492 9.6644 9.6644 10.8434 10.8434 11.8645 11.8645 12.5469 12.5469 12.9669 12.9669 13.1266 13.1266 13.5616 13.5616 k =-0.2759 0.0846-0.0000 ( 2786 PWs) bands (ev): -37.4546 -37.4546 -37.4008 -37.4008 -16.7200 -16.7200 -16.5640 -16.5640 -15.0713 -15.0713 -14.8624 -14.8624 -14.8455 -14.8455 -14.6999 -14.6999 3.1784 3.1784 6.0268 6.0268 8.6637 8.6637 9.4401 9.4401 9.6726 9.6726 10.8046 10.8046 11.8506 11.8506 12.5447 12.5447 12.9565 12.9565 13.0947 13.0947 13.6396 13.6396 k =-0.2931 0.0898-0.0000 ( 2794 PWs) bands (ev): -37.4546 -37.4546 -37.4009 -37.4009 -16.7193 -16.7193 -16.5648 -16.5648 -15.0700 -15.0700 -14.8638 -14.8638 -14.8454 -14.8454 -14.7002 -14.7002 3.2173 3.2173 5.9654 5.9654 8.6740 8.6740 9.4311 9.4311 9.6793 9.6793 10.7634 10.7634 11.8381 11.8381 12.5426 12.5426 12.9463 12.9463 13.0669 13.0669 13.7169 13.7169 k =-0.3103 0.0951-0.0000 ( 2802 PWs) bands (ev): -37.4545 -37.4545 -37.4010 -37.4010 -16.7186 -16.7186 -16.5656 -16.5656 -15.0687 -15.0687 -14.8651 -14.8651 -14.8453 -14.8453 -14.7004 -14.7004 3.2565 3.2565 5.9039 5.9039 8.6874 8.6874 9.4225 9.4225 9.6848 9.6848 10.7202 10.7202 11.8269 11.8269 12.5407 12.5407 12.9366 12.9366 13.0433 13.0433 13.7924 13.7924 k =-0.3276 0.1004-0.0000 ( 2802 PWs) bands (ev): -37.4544 -37.4544 -37.4011 -37.4011 -16.7180 -16.7180 -16.5663 -16.5663 -15.0675 -15.0675 -14.8664 -14.8664 -14.8453 -14.8453 -14.7007 -14.7007 3.2958 3.2958 5.8429 5.8429 8.7034 8.7034 9.4144 9.4144 9.6895 9.6895 10.6756 10.6756 11.8169 11.8169 12.5390 12.5390 12.9273 12.9273 13.0237 13.0237 13.8646 13.8646 k =-0.3448 0.1057-0.0000 ( 2802 PWs) bands (ev): -37.4543 -37.4543 -37.4012 -37.4012 -16.7174 -16.7174 -16.5670 -16.5670 -15.0663 -15.0663 -14.8677 -14.8677 -14.8452 -14.8452 -14.7009 -14.7009 3.3346 3.3346 5.7835 5.7835 8.7212 8.7212 9.4067 9.4067 9.6935 9.6935 10.6302 10.6302 11.8081 11.8081 12.5375 12.5375 12.9187 12.9187 13.0079 13.0079 13.9311 13.9311 k =-0.3621 0.1110-0.0000 ( 2802 PWs) bands (ev): -37.4542 -37.4542 -37.4013 -37.4013 -16.7168 -16.7168 -16.5676 -16.5676 -15.0652 -15.0652 -14.8689 -14.8689 -14.8451 -14.8451 -14.7011 -14.7011 3.3723 3.3723 5.7265 5.7265 8.7403 8.7403 9.3996 9.3996 9.6972 9.6972 10.5850 10.5850 11.8004 11.8004 12.5362 12.5362 12.9107 12.9107 12.9953 12.9953 13.9897 13.9897 k =-0.3793 0.1163-0.0000 ( 2802 PWs) bands (ev): -37.4542 -37.4542 -37.4014 -37.4014 -16.7162 -16.7162 -16.5682 -16.5682 -15.0642 -15.0642 -14.8700 -14.8700 -14.8450 -14.8450 -14.7013 -14.7013 3.4082 3.4082 5.6728 5.6728 8.7598 8.7598 9.3932 9.3932 9.7008 9.7008 10.5409 10.5409 11.7937 11.7937 12.5351 12.5351 12.9036 12.9036 12.9856 12.9856 14.0408 14.0408 k =-0.3966 0.1216-0.0000 ( 2798 PWs) bands (ev): -37.4541 -37.4541 -37.4014 -37.4014 -16.7158 -16.7158 -16.5688 -16.5688 -15.0633 -15.0633 -14.8710 -14.8710 -14.8450 -14.8450 -14.7015 -14.7015 3.4416 3.4416 5.6235 5.6235 8.7790 8.7790 9.3875 9.3875 9.7044 9.7044 10.4990 10.4990 11.7881 11.7881 12.5342 12.5342 12.8974 12.8974 12.9783 12.9783 14.0862 14.0862 k =-0.4138 0.1268-0.0000 ( 2796 PWs) bands (ev): -37.4540 -37.4540 -37.4015 -37.4015 -16.7153 -16.7153 -16.5693 -16.5693 -15.0625 -15.0625 -14.8718 -14.8718 -14.8449 -14.8449 -14.7016 -14.7016 3.4717 3.4717 5.5795 5.5795 8.7970 8.7970 9.3825 9.3825 9.7079 9.7079 10.4604 10.4604 11.7834 11.7834 12.5335 12.5335 12.8921 12.8921 12.9729 12.9729 14.1267 14.1267 k =-0.4310 0.1321-0.0000 ( 2800 PWs) bands (ev): -37.4540 -37.4540 -37.4015 -37.4015 -16.7150 -16.7150 -16.5696 -16.5696 -15.0618 -15.0618 -14.8725 -14.8725 -14.8449 -14.8449 -14.7017 -14.7017 3.4978 3.4978 5.5418 5.5418 8.8132 8.8132 9.3784 9.3784 9.7114 9.7114 10.4265 10.4265 11.7796 11.7796 12.5329 12.5329 12.8878 12.8878 12.9690 12.9690 14.1619 14.1619 k =-0.4483 0.1374-0.0000 ( 2798 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7147 -16.7147 -16.5700 -16.5700 -15.0612 -15.0612 -14.8731 -14.8731 -14.8448 -14.8448 -14.7018 -14.7018 3.5191 3.5191 5.5114 5.5114 8.8266 8.8266 9.3752 9.3752 9.7145 9.7145 10.3984 10.3984 11.7767 11.7767 12.5325 12.5325 12.8844 12.8844 12.9663 12.9663 14.1909 14.1909 k =-0.4655 0.1427-0.0000 ( 2800 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7145 -16.7145 -16.5702 -16.5702 -15.0608 -15.0608 -14.8735 -14.8735 -14.8448 -14.8448 -14.7019 -14.7019 3.5349 3.5349 5.4890 5.4890 8.8368 8.8368 9.3729 9.3729 9.7171 9.7171 10.3773 10.3773 11.7747 11.7747 12.5322 12.5322 12.8820 12.8820 12.9646 12.9646 14.2126 14.2126 k =-0.4828 0.1480-0.0000 ( 2798 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7144 -16.7144 -16.5703 -16.5703 -15.0606 -15.0606 -14.8738 -14.8738 -14.8448 -14.8448 -14.7019 -14.7019 3.5446 3.5446 5.4753 5.4753 8.8431 8.8431 9.3715 9.3715 9.7188 9.7188 10.3641 10.3641 11.7735 11.7735 12.5320 12.5320 12.8805 12.8805 12.9637 12.9637 14.2261 14.2261 k =-0.5000 0.1533-0.0000 ( 2800 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7143 -16.7143 -16.5704 -16.5704 -15.0605 -15.0605 -14.8739 -14.8739 -14.8448 -14.8448 -14.7020 -14.7020 3.5479 3.5479 5.4706 5.4706 8.8452 8.8452 9.3710 9.3710 9.7194 9.7194 10.3597 10.3597 11.7730 11.7730 12.5319 12.5319 12.8800 12.8800 12.9634 12.9634 14.2307 14.2307 k =-0.5000 0.1533-0.0000 ( 2800 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7143 -16.7143 -16.5704 -16.5704 -15.0605 -15.0605 -14.8739 -14.8739 -14.8448 -14.8448 -14.7020 -14.7020 3.5479 3.5479 5.4706 5.4706 8.8452 8.8452 9.3710 9.3710 9.7194 9.7194 10.3597 10.3597 11.7730 11.7730 12.5319 12.5319 12.8800 12.8800 12.9634 12.9634 14.2307 14.2307 k =-0.4947 0.1705-0.0000 ( 2792 PWs) bands (ev): -37.4538 -37.4538 -37.4016 -37.4016 -16.7143 -16.7143 -16.5705 -16.5705 -15.0604 -15.0604 -14.8741 -14.8741 -14.8448 -14.8448 -14.7022 -14.7022 3.5491 3.5491 5.4725 5.4725 8.8464 8.8464 9.3708 9.3708 9.7203 9.7203 10.3610 10.3610 11.7722 11.7722 12.5278 12.5278 12.8794 12.8794 12.9640 12.9640 14.2156 14.2156 k =-0.4895 0.1876-0.0000 ( 2794 PWs) bands (ev): -37.4537 -37.4537 -37.4015 -37.4015 -16.7144 -16.7144 -16.5708 -16.5708 -15.0602 -15.0602 -14.8749 -14.8749 -14.8448 -14.8448 -14.7031 -14.7031 3.5527 3.5527 5.4780 5.4780 8.8500 8.8500 9.3701 9.3701 9.7228 9.7228 10.3650 10.3650 11.7695 11.7695 12.5155 12.5155 12.8775 12.8775 12.9657 12.9657 14.1586 14.1586 k =-0.4842 0.2048-0.0000 ( 2790 PWs) bands (ev): -37.4535 -37.4535 -37.4014 -37.4014 -16.7145 -16.7145 -16.5714 -16.5714 -15.0598 -15.0598 -14.8761 -14.8761 -14.8448 -14.8448 -14.7046 -14.7046 3.5586 3.5586 5.4871 5.4871 8.8559 8.8559 9.3689 9.3689 9.7269 9.7269 10.3715 10.3715 11.7649 11.7649 12.4952 12.4952 12.8743 12.8743 12.9686 12.9686 14.0627 14.0627 k =-0.4789 0.2220-0.0000 ( 2800 PWs) bands (ev): -37.4532 -37.4532 -37.4014 -37.4014 -16.7147 -16.7147 -16.5721 -16.5721 -15.0592 -15.0592 -14.8778 -14.8778 -14.8448 -14.8448 -14.7067 -14.7067 3.5670 3.5670 5.4999 5.4999 8.8643 8.8643 9.3673 9.3673 9.7325 9.7325 10.3805 10.3805 11.7583 11.7583 12.4671 12.4671 12.8699 12.8699 12.9725 12.9725 13.9605 13.9605 k =-0.4737 0.2392-0.0000 ( 2804 PWs) bands (ev): -37.4528 -37.4528 -37.4013 -37.4013 -16.7149 -16.7149 -16.5731 -16.5731 -15.0584 -15.0584 -14.8799 -14.8799 -14.8448 -14.8448 -14.7093 -14.7093 3.5776 3.5776 5.5162 5.5162 8.8750 8.8750 9.3652 9.3652 9.7392 9.7392 10.3919 10.3919 11.7495 11.7495 12.4315 12.4315 12.8644 12.8644 12.9775 12.9775 13.8603 13.8603 k =-0.4684 0.2564-0.0000 ( 2804 PWs) bands (ev): -37.4524 -37.4524 -37.4011 -37.4011 -16.7151 -16.7151 -16.5743 -16.5743 -15.0575 -15.0575 -14.8825 -14.8825 -14.8448 -14.8448 -14.7125 -14.7125 3.5907 3.5907 5.5362 5.5362 8.8881 8.8881 9.3625 9.3625 9.7469 9.7469 10.4056 10.4056 11.7382 11.7382 12.3890 12.3890 12.8580 12.8580 12.9833 12.9833 13.7642 13.7642 k =-0.4631 0.2736-0.0000 ( 2802 PWs) bands (ev): -37.4518 -37.4518 -37.4009 -37.4009 -16.7154 -16.7154 -16.5758 -16.5758 -15.0564 -15.0564 -14.8855 -14.8855 -14.8448 -14.8448 -14.7163 -14.7163 3.6060 3.6060 5.5597 5.5597 8.9036 8.9036 9.3594 9.3594 9.7551 9.7551 10.4213 10.4213 11.7242 11.7242 12.3401 12.3401 12.8507 12.8507 12.9895 12.9895 13.6731 13.6731 k =-0.4579 0.2907-0.0000 ( 2798 PWs) bands (ev): -37.4512 -37.4512 -37.4007 -37.4007 -16.7157 -16.7157 -16.5774 -16.5774 -15.0552 -15.0552 -14.8889 -14.8889 -14.8449 -14.8449 -14.7205 -14.7205 3.6237 3.6237 5.5867 5.5867 8.9214 8.9214 9.3557 9.3557 9.7634 9.7634 10.4389 10.4389 11.7072 11.7072 12.2856 12.2856 12.8429 12.8429 12.9957 12.9957 13.5878 13.5878 k =-0.4526 0.3079-0.0000 ( 2794 PWs) bands (ev): -37.4504 -37.4504 -37.4005 -37.4005 -16.7161 -16.7161 -16.5792 -16.5792 -15.0538 -15.0538 -14.8926 -14.8926 -14.8450 -14.8450 -14.7252 -14.7252 3.6436 3.6436 5.6172 5.6172 8.9416 8.9416 9.3515 9.3515 9.7713 9.7713 10.4581 10.4581 11.6869 11.6869 12.2262 12.2262 12.8347 12.8347 13.0010 13.0010 13.5089 13.5089 k =-0.4473 0.3251-0.0000 ( 2794 PWs) bands (ev): -37.4496 -37.4496 -37.4002 -37.4002 -16.7165 -16.7165 -16.5813 -16.5813 -15.0523 -15.0523 -14.8967 -14.8967 -14.8451 -14.8451 -14.7304 -14.7304 3.6658 3.6658 5.6512 5.6512 8.9641 8.9641 9.3468 9.3468 9.7781 9.7781 10.4785 10.4785 11.6629 11.6629 12.1628 12.1628 12.8263 12.8263 13.0041 13.0041 13.4367 13.4367 k =-0.4421 0.3423-0.0000 ( 2786 PWs) bands (ev): -37.4488 -37.4488 -37.3999 -37.3999 -16.7169 -16.7169 -16.5835 -16.5835 -15.0506 -15.0506 -14.9012 -14.9012 -14.8453 -14.8453 -14.7361 -14.7361 3.6903 3.6903 5.6885 5.6885 8.9890 8.9890 9.3415 9.3415 9.7833 9.7833 10.4997 10.4997 11.6350 11.6350 12.0963 12.0963 12.8179 12.8179 13.0034 13.0034 13.3718 13.3718 k =-0.4368 0.3595-0.0000 ( 2786 PWs) bands (ev): -37.4478 -37.4478 -37.3997 -37.3997 -16.7174 -16.7174 -16.5860 -16.5860 -15.0489 -15.0489 -14.9059 -14.9059 -14.8455 -14.8455 -14.7421 -14.7421 3.7169 3.7169 5.7291 5.7291 9.0162 9.0162 9.3356 9.3356 9.7858 9.7858 10.5215 10.5215 11.6032 11.6032 12.0279 12.0279 12.8098 12.8098 12.9966 12.9966 13.3146 13.3146 k =-0.4315 0.3767-0.0000 ( 2786 PWs) bands (ev): -37.4468 -37.4468 -37.3994 -37.3994 -16.7179 -16.7179 -16.5886 -16.5886 -15.0470 -15.0470 -14.9109 -14.9109 -14.8457 -14.8457 -14.7485 -14.7485 3.7456 3.7456 5.7730 5.7730 9.0458 9.0458 9.3292 9.3292 9.7849 9.7849 10.5431 10.5431 11.5672 11.5672 11.9585 11.9585 12.8021 12.8021 12.9811 12.9811 13.2653 13.2653 k =-0.4263 0.3938-0.0000 ( 2791 PWs) bands (ev): -37.4458 -37.4458 -37.3991 -37.3991 -16.7184 -16.7184 -16.5914 -16.5914 -15.0450 -15.0450 -14.9161 -14.9161 -14.8460 -14.8460 -14.7553 -14.7553 3.7765 3.7765 5.8201 5.8201 9.0776 9.0776 9.3221 9.3221 9.7797 9.7797 10.5642 10.5642 11.5272 11.5272 11.8893 11.8893 12.7951 12.7951 12.9556 12.9556 13.2239 13.2239 k =-0.4210 0.4110-0.0000 ( 2787 PWs) bands (ev): -37.4446 -37.4446 -37.3988 -37.3988 -16.7190 -16.7190 -16.5944 -16.5944 -15.0429 -15.0429 -14.9215 -14.9215 -14.8464 -14.8464 -14.7623 -14.7623 3.8094 3.8094 5.8703 5.8703 9.1118 9.1118 9.3146 9.3146 9.7690 9.7690 10.5840 10.5840 11.4833 11.4833 11.8214 11.8214 12.7890 12.7890 12.9209 12.9209 13.1900 13.1900 k =-0.4157 0.4282-0.0000 ( 2787 PWs) bands (ev): -37.4434 -37.4434 -37.3985 -37.3985 -16.7196 -16.7196 -16.5976 -16.5976 -15.0408 -15.0408 -14.9270 -14.9270 -14.8468 -14.8468 -14.7696 -14.7696 3.8444 3.8444 5.9236 5.9236 9.1481 9.1481 9.3065 9.3065 9.7520 9.7520 10.6019 10.6019 11.4357 11.4357 11.7558 11.7558 12.7838 12.7838 12.8796 12.8796 13.1634 13.1634 k =-0.4105 0.4454-0.0000 ( 2789 PWs) bands (ev): -37.4422 -37.4422 -37.3982 -37.3982 -16.7202 -16.7202 -16.6009 -16.6009 -15.0386 -15.0386 -14.9327 -14.9327 -14.8472 -14.8472 -14.7771 -14.7771 3.8813 3.8813 5.9798 5.9798 9.1867 9.1867 9.2980 9.2980 9.7277 9.7277 10.6172 10.6172 11.3850 11.3850 11.6934 11.6934 12.7793 12.7793 12.8352 12.8352 13.1436 13.1436 k =-0.4052 0.4626-0.0000 ( 2797 PWs) bands (ev): -37.4410 -37.4410 -37.3979 -37.3979 -16.7208 -16.7208 -16.6044 -16.6044 -15.0364 -15.0364 -14.9385 -14.9385 -14.8478 -14.8478 -14.7847 -14.7847 3.9202 3.9202 6.0390 6.0390 9.2271 9.2271 9.2893 9.2893 9.6955 9.6955 10.6291 10.6291 11.3315 11.3315 11.6350 11.6350 12.7730 12.7730 12.7936 12.7936 13.1303 13.1303 k =-0.3999 0.4798-0.0000 ( 2799 PWs) bands (ev): -37.4397 -37.4397 -37.3976 -37.3976 -16.7214 -16.7214 -16.6080 -16.6080 -15.0342 -15.0342 -14.9444 -14.9444 -14.8483 -14.8483 -14.7925 -14.7925 3.9610 3.9610 6.1010 6.1010 9.2664 9.2664 9.2834 9.2834 9.6547 9.6547 10.6370 10.6370 11.2757 11.2757 11.5812 11.5812 12.7421 12.7421 12.7794 12.7794 13.1231 13.1231 k =-0.3946 0.4970-0.0000 ( 2807 PWs) bands (ev): -37.4383 -37.4383 -37.3974 -37.3974 -16.7221 -16.7221 -16.6118 -16.6118 -15.0320 -15.0320 -14.9502 -14.9502 -14.8490 -14.8490 -14.8003 -14.8003 4.0035 4.0035 6.1657 6.1657 9.2676 9.2676 9.3172 9.3172 9.6053 9.6053 10.6401 10.6401 11.2182 11.2182 11.5321 11.5321 12.7023 12.7023 12.7783 12.7783 13.1215 13.1215 k =-0.3894 0.5141-0.0000 ( 2813 PWs) bands (ev): -37.4369 -37.4369 -37.3971 -37.3971 -16.7228 -16.7228 -16.6157 -16.6157 -15.0299 -15.0299 -14.9560 -14.9560 -14.8497 -14.8497 -14.8081 -14.8081 4.0478 4.0478 6.2331 6.2331 9.2579 9.2579 9.3629 9.3629 9.5477 9.5477 10.6380 10.6380 11.1594 11.1594 11.4878 11.4878 12.6650 12.6650 12.7795 12.7795 13.1252 13.1252 k =-0.3841 0.5313-0.0000 ( 2809 PWs) bands (ev): -37.4354 -37.4354 -37.3968 -37.3968 -16.7234 -16.7234 -16.6197 -16.6197 -15.0278 -15.0278 -14.9617 -14.9617 -14.8506 -14.8506 -14.8159 -14.8159 4.0938 4.0938 6.3031 6.3031 9.2476 9.2476 9.4058 9.4058 9.4868 9.4868 10.6301 10.6301 11.0998 11.0998 11.4480 11.4480 12.6311 12.6311 12.7820 12.7820 13.1336 13.1336 k =-0.3788 0.5485-0.0000 ( 2809 PWs) bands (ev): -37.4339 -37.4339 -37.3966 -37.3966 -16.7240 -16.7240 -16.6238 -16.6238 -15.0260 -15.0260 -14.9673 -14.9673 -14.8515 -14.8515 -14.8235 -14.8235 4.1414 4.1414 6.3756 6.3756 9.2369 9.2369 9.3895 9.3895 9.4792 9.4792 10.6162 10.6162 11.0399 11.0399 11.4121 11.4121 12.6001 12.6001 12.7858 12.7858 13.1464 13.1464 k =-0.3736 0.5657-0.0000 ( 2825 PWs) bands (ev): -37.4325 -37.4325 -37.3964 -37.3964 -16.7247 -16.7247 -16.6280 -16.6280 -15.0243 -15.0243 -14.9727 -14.9727 -14.8527 -14.8527 -14.8309 -14.8309 4.1905 4.1905 6.4506 6.4506 9.2261 9.2261 9.3121 9.3121 9.5275 9.5275 10.5962 10.5962 10.9801 10.9801 11.3795 11.3795 12.5713 12.5713 12.7905 12.7905 13.1631 13.1631 k =-0.3683 0.5829-0.0000 ( 2823 PWs) bands (ev): -37.4310 -37.4310 -37.3961 -37.3961 -16.7253 -16.7253 -16.6323 -16.6323 -15.0229 -15.0229 -14.9778 -14.9778 -14.8541 -14.8541 -14.8378 -14.8378 4.2411 4.2411 6.5278 6.5278 9.2141 9.2141 9.2245 9.2245 9.5826 9.5826 10.5702 10.5702 10.9207 10.9207 11.3495 11.3495 12.5435 12.5435 12.7958 12.7958 13.1834 13.1834 k =-0.3630 0.6001-0.0000 ( 2819 PWs) bands (ev): -37.4295 -37.4295 -37.3959 -37.3959 -16.7258 -16.7258 -16.6367 -16.6367 -15.0218 -15.0218 -14.9826 -14.9826 -14.8560 -14.8560 -14.8441 -14.8441 4.2931 4.2931 6.6073 6.6073 9.1275 9.1275 9.2050 9.2050 9.6407 9.6407 10.5384 10.5384 10.8621 10.8621 11.3215 11.3215 12.5153 12.5153 12.8015 12.8015 13.2069 13.2069 k =-0.3578 0.6172-0.0000 ( 2817 PWs) bands (ev): -37.4279 -37.4279 -37.3957 -37.3957 -16.7263 -16.7263 -16.6411 -16.6411 -15.0212 -15.0212 -14.9870 -14.9870 -14.8588 -14.8588 -14.8492 -14.8492 4.3463 4.3463 6.6890 6.6890 9.0268 9.0268 9.1945 9.1945 9.7012 9.7012 10.5011 10.5011 10.8046 10.8046 11.2948 11.2948 12.4854 12.4854 12.8070 12.8070 13.2334 13.2334 k =-0.3525 0.6344-0.0000 ( 2817 PWs) bands (ev): -37.4264 -37.4264 -37.3955 -37.3955 -16.7268 -16.7268 -16.6455 -16.6455 -15.0213 -15.0213 -14.9908 -14.9908 -14.8629 -14.8629 -14.8526 -14.8526 4.4006 4.4006 6.7727 6.7727 8.9219 8.9219 9.1844 9.1844 9.7639 9.7639 10.4589 10.4589 10.7485 10.7485 11.2688 11.2688 12.4525 12.4525 12.8120 12.8120 13.2625 13.2625 k =-0.3472 0.6516-0.0000 ( 2821 PWs) bands (ev): -37.4249 -37.4249 -37.3954 -37.3954 -16.7272 -16.7272 -16.6500 -16.6500 -15.0219 -15.0219 -14.9941 -14.9941 -14.8677 -14.8677 -14.8550 -14.8550 4.4559 4.4559 6.8584 6.8584 8.8136 8.8136 9.1747 9.1747 9.8288 9.8288 10.4121 10.4121 10.6939 10.6939 11.2432 11.2432 12.4156 12.4156 12.8157 12.8157 13.2940 13.2940 k =-0.3420 0.6688-0.0000 ( 2813 PWs) bands (ev): -37.4232 -37.4232 -37.3954 -37.3954 -16.7275 -16.7275 -16.6544 -16.6544 -15.0233 -15.0233 -14.9968 -14.9968 -14.8726 -14.8726 -14.8568 -14.8568 4.5122 4.5122 6.9460 6.9460 8.7029 8.7029 9.1656 9.1656 9.8957 9.8957 10.3613 10.3613 10.6412 10.6412 11.2178 11.2178 12.3743 12.3743 12.8175 12.8175 13.3276 13.3276 k =-0.3367 0.6860-0.0000 ( 2809 PWs) bands (ev): -37.4217 -37.4217 -37.3953 -37.3953 -16.7277 -16.7277 -16.6589 -16.6589 -15.0252 -15.0252 -14.9990 -14.9990 -14.8770 -14.8770 -14.8586 -14.8586 4.5691 4.5691 7.0354 7.0354 8.5904 8.5904 9.1571 9.1571 9.9647 9.9647 10.3068 10.3068 10.5904 10.5904 11.1922 11.1922 12.3284 12.3284 12.8167 12.8167 13.3632 13.3632 k =-0.3314 0.7032-0.0000 ( 2811 PWs) bands (ev): -37.4202 -37.4202 -37.3953 -37.3953 -16.7279 -16.7279 -16.6634 -16.6634 -15.0275 -15.0275 -15.0010 -15.0010 -14.8810 -14.8810 -14.8602 -14.8602 4.6265 4.6265 7.1265 7.1265 8.4769 8.4769 9.1495 9.1495 10.0356 10.0356 10.2492 10.2492 10.5417 10.5417 11.1665 11.1665 12.2781 12.2781 12.8124 12.8124 13.4006 13.4006 k =-0.3262 0.7203-0.0000 ( 2809 PWs) bands (ev): -37.4186 -37.4186 -37.3954 -37.3954 -16.7279 -16.7279 -16.6678 -16.6678 -15.0300 -15.0300 -15.0030 -15.0030 -14.8842 -14.8842 -14.8620 -14.8620 4.6843 4.6843 7.2191 7.2191 8.3630 8.3630 9.1427 9.1427 10.1082 10.1082 10.1888 10.1888 10.4953 10.4953 11.1405 11.1405 12.2241 12.2241 12.8040 12.8040 13.4395 13.4395 k =-0.3209 0.7375-0.0000 ( 2807 PWs) bands (ev): -37.4171 -37.4171 -37.3955 -37.3955 -16.7279 -16.7279 -16.6721 -16.6721 -15.0326 -15.0326 -15.0049 -15.0049 -14.8869 -14.8869 -14.8637 -14.8637 4.7421 4.7421 7.3132 7.3132 8.2494 8.2494 9.1370 9.1370 10.1251 10.1251 10.1836 10.1836 10.4514 10.4514 11.1143 11.1143 12.1671 12.1671 12.7906 12.7906 13.4798 13.4798 k =-0.3156 0.7547-0.0000 ( 2811 PWs) bands (ev): -37.4157 -37.4157 -37.3956 -37.3956 -16.7277 -16.7277 -16.6764 -16.6764 -15.0351 -15.0351 -15.0071 -15.0071 -14.8888 -14.8888 -14.8655 -14.8655 4.7996 4.7996 7.4086 7.4086 8.1367 8.1367 9.1324 9.1324 10.0600 10.0600 10.2596 10.2596 10.4101 10.4101 11.0880 11.0880 12.1079 12.1079 12.7715 12.7715 13.5213 13.5213 k =-0.3104 0.7719-0.0000 ( 2807 PWs) bands (ev): -37.4142 -37.4142 -37.3958 -37.3958 -16.7273 -16.7273 -16.6806 -16.6806 -15.0375 -15.0375 -15.0094 -15.0094 -14.8901 -14.8901 -14.8673 -14.8673 4.8565 4.8565 7.5052 7.5052 8.0256 8.0256 9.1291 9.1291 9.9927 9.9927 10.3358 10.3358 10.3733 10.3733 11.0616 11.0616 12.0474 12.0474 12.7464 12.7464 13.5640 13.5640 k =-0.3051 0.7891-0.0000 ( 2809 PWs) bands (ev): -37.4128 -37.4128 -37.3961 -37.3961 -16.7269 -16.7269 -16.6848 -16.6848 -15.0396 -15.0396 -15.0119 -15.0119 -14.8908 -14.8908 -14.8692 -14.8692 4.9125 4.9125 7.6027 7.6027 7.9170 7.9170 9.1270 9.1270 9.9235 9.9235 10.3329 10.3329 10.4201 10.4201 11.0352 11.0352 11.9865 11.9865 12.7147 12.7147 13.6076 13.6076 k =-0.2998 0.8063-0.0000 ( 2811 PWs) bands (ev): -37.4114 -37.4114 -37.3964 -37.3964 -16.7262 -16.7262 -16.6888 -16.6888 -15.0415 -15.0415 -15.0146 -15.0146 -14.8910 -14.8910 -14.8712 -14.8712 4.9669 4.9669 7.6996 7.6996 7.8129 7.8129 9.1264 9.1264 9.8526 9.8526 10.3000 10.3000 10.5013 10.5013 11.0090 11.0090 11.9259 11.9259 12.6766 12.6766 13.6519 13.6519 k =-0.2946 0.8234-0.0000 ( 2815 PWs) bands (ev): -37.4101 -37.4101 -37.3968 -37.3968 -16.7255 -16.7255 -16.6927 -16.6927 -15.0431 -15.0431 -15.0174 -15.0174 -14.8907 -14.8907 -14.8732 -14.8732 5.0192 5.0192 7.7035 7.7035 7.8063 7.8063 9.1274 9.1274 9.7803 9.7803 10.2695 10.2695 10.5846 10.5846 10.9830 10.9830 11.8663 11.8663 12.6321 12.6321 13.6969 13.6969 k =-0.2893 0.8406-0.0000 ( 2815 PWs) bands (ev): -37.4088 -37.4088 -37.3972 -37.3972 -16.7245 -16.7245 -16.6964 -16.6964 -15.0443 -15.0443 -15.0203 -15.0203 -14.8900 -14.8900 -14.8751 -14.8751 5.0688 5.0688 7.6079 7.6079 7.9044 7.9044 9.1299 9.1299 9.7066 9.7066 10.2417 10.2417 10.6697 10.6697 10.9573 10.9573 11.8083 11.8083 12.5816 12.5816 13.7424 13.7424 k =-0.2840 0.8578-0.0000 ( 2813 PWs) bands (ev): -37.4075 -37.4075 -37.3977 -37.3977 -16.7234 -16.7234 -16.7001 -16.7001 -15.0453 -15.0453 -15.0231 -15.0231 -14.8891 -14.8891 -14.8770 -14.8770 5.1147 5.1147 7.5158 7.5158 8.0049 8.0049 9.1341 9.1341 9.6318 9.6318 10.2168 10.2168 10.7562 10.7562 10.9321 10.9321 11.7524 11.7524 12.5256 12.5256 13.7882 13.7882 k =-0.2788 0.8750-0.0000 ( 2817 PWs) bands (ev): -37.4063 -37.4063 -37.3983 -37.3983 -16.7221 -16.7221 -16.7035 -16.7035 -15.0459 -15.0459 -15.0259 -15.0259 -14.8881 -14.8881 -14.8787 -14.8787 5.1560 5.1560 7.4301 7.4301 8.1060 8.1060 9.1401 9.1401 9.5561 9.5561 10.1949 10.1949 10.8441 10.8441 10.9074 10.9074 11.6991 11.6991 12.4648 12.4648 13.8342 13.8342 k =-0.2735 0.8922-0.0000 ( 2823 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0462 -15.0462 -15.0285 -15.0285 -14.8874 -14.8874 -14.8799 -14.8799 5.1916 5.1916 7.3520 7.3520 8.2072 8.2072 9.1479 9.1479 9.4797 9.4797 10.1759 10.1759 10.8825 10.8825 10.9341 10.9341 11.6485 11.6485 12.3998 12.3998 13.8802 13.8802 k =-0.2735 0.8922-0.0000 ( 2823 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0462 -15.0462 -15.0285 -15.0285 -14.8874 -14.8874 -14.8799 -14.8799 5.1916 5.1916 7.3520 7.3520 8.2072 8.2072 9.1479 9.1479 9.4797 9.4797 10.1759 10.1759 10.8825 10.8825 10.9341 10.9341 11.6485 11.6485 12.3998 12.3998 13.8802 13.8802 k =-0.2735 0.8922 0.0181 ( 2823 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0466 -15.0466 -15.0280 -15.0280 -14.8883 -14.8883 -14.8791 -14.8791 5.1927 5.1927 7.3531 7.3531 8.2051 8.2051 9.1457 9.1457 9.4833 9.4833 10.1719 10.1719 10.8816 10.8816 10.9395 10.9395 11.6381 11.6381 12.4104 12.4104 13.8837 13.8837 k =-0.2735 0.8922 0.0361 ( 2825 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7069 -16.7069 -15.0477 -15.0477 -15.0268 -15.0268 -14.8903 -14.8903 -14.8774 -14.8774 5.1957 5.1957 7.3565 7.3565 8.1989 8.1989 9.1400 9.1400 9.4934 9.4934 10.1602 10.1602 10.8789 10.8789 10.9555 10.9555 11.6086 11.6086 12.4404 12.4404 13.8942 13.8942 k =-0.2735 0.8922 0.0542 ( 2829 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7206 -16.7206 -16.7070 -16.7070 -15.0492 -15.0492 -15.0250 -15.0250 -14.8928 -14.8928 -14.8754 -14.8754 5.2008 5.2008 7.3622 7.3622 8.1883 8.1883 9.1323 9.1323 9.5086 9.5086 10.1418 10.1418 10.8743 10.8743 10.9811 10.9811 11.5640 11.5640 12.4859 12.4859 13.9114 13.9114 k =-0.2735 0.8922 0.0723 ( 2831 PWs) bands (ev): -37.4052 -37.4052 -37.3989 -37.3989 -16.7207 -16.7207 -16.7071 -16.7071 -15.0510 -15.0510 -15.0228 -15.0228 -14.8956 -14.8956 -14.8734 -14.8734 5.2079 5.2079 7.3702 7.3702 8.1732 8.1732 9.1246 9.1246 9.5268 9.5268 10.1179 10.1179 10.8681 10.8681 11.0150 11.0150 11.5086 11.5086 12.5424 12.5424 13.9354 13.9354 k =-0.2735 0.8922 0.0903 ( 2827 PWs) bands (ev): -37.4051 -37.4051 -37.3989 -37.3989 -16.7207 -16.7207 -16.7073 -16.7073 -15.0530 -15.0530 -15.0204 -15.0204 -14.8985 -14.8985 -14.8715 -14.8715 5.2170 5.2170 7.3803 7.3803 8.1533 8.1533 9.1189 9.1189 9.5463 9.5463 10.0900 10.0900 10.8605 10.8605 11.0559 11.0559 11.4461 11.4461 12.6062 12.6062 13.9657 13.9657 k =-0.2735 0.8922 0.1084 ( 2827 PWs) bands (ev): -37.4050 -37.4050 -37.3989 -37.3989 -16.7208 -16.7208 -16.7075 -16.7075 -15.0549 -15.0549 -15.0179 -15.0179 -14.9015 -14.9015 -14.8697 -14.8697 5.2282 5.2282 7.3927 7.3927 8.1285 8.1285 9.1166 9.1166 9.5656 9.5656 10.0591 10.0591 10.8516 10.8516 11.1023 11.1023 11.3793 11.3793 12.6745 12.6745 14.0020 14.0020 k =-0.2735 0.8922 0.1265 ( 2819 PWs) bands (ev): -37.4049 -37.4049 -37.3989 -37.3989 -16.7209 -16.7209 -16.7077 -16.7077 -15.0569 -15.0569 -15.0153 -15.0153 -14.9045 -14.9045 -14.8680 -14.8680 5.2413 5.2413 7.4072 7.4072 8.0987 8.0987 9.1189 9.1189 9.5834 9.5834 10.0264 10.0264 10.8417 10.8417 11.1523 11.1523 11.3109 11.3109 12.7454 12.7454 14.0436 14.0436 k =-0.2735 0.8922 0.1445 ( 2819 PWs) bands (ev): -37.4049 -37.4049 -37.3989 -37.3989 -16.7210 -16.7210 -16.7079 -16.7079 -15.0588 -15.0588 -15.0127 -15.0127 -14.9075 -14.9075 -14.8664 -14.8664 5.2563 5.2563 7.4238 7.4238 8.0641 8.0641 9.1265 9.1265 9.5988 9.5988 9.9926 9.9926 10.8311 10.8311 11.1951 11.1951 11.2521 11.2521 12.8172 12.8172 14.0856 14.0856 k =-0.2735 0.8922 0.1626 ( 2814 PWs) bands (ev): -37.4048 -37.4048 -37.3989 -37.3989 -16.7211 -16.7211 -16.7082 -16.7082 -15.0606 -15.0606 -15.0101 -15.0101 -14.9105 -14.9105 -14.8649 -14.8649 5.2733 5.2733 7.4425 7.4425 8.0248 8.0248 9.1396 9.1396 9.6109 9.6109 9.9583 9.9583 10.8201 10.8201 11.1557 11.1557 11.2782 11.2782 12.8888 12.8888 14.0709 14.0709 k =-0.2735 0.8922 0.1806 ( 2812 PWs) bands (ev): -37.4047 -37.4047 -37.3990 -37.3990 -16.7212 -16.7212 -16.7085 -16.7085 -15.0624 -15.0624 -15.0077 -15.0077 -14.9135 -14.9135 -14.8637 -14.8637 5.2922 5.2922 7.4632 7.4632 7.9814 7.9814 9.1584 9.1584 9.6192 9.6192 9.9242 9.9242 10.8090 10.8090 11.0863 11.0863 11.3373 11.3373 12.9593 12.9593 14.0259 14.0259 k =-0.2735 0.8922 0.1987 ( 2806 PWs) bands (ev): -37.4045 -37.4045 -37.3990 -37.3990 -16.7213 -16.7213 -16.7088 -16.7088 -15.0640 -15.0640 -15.0053 -15.0053 -14.9164 -14.9164 -14.8625 -14.8625 5.3130 5.3130 7.4859 7.4859 7.9341 7.9341 9.1827 9.1827 9.6233 9.6233 9.8907 9.8907 10.7981 10.7981 11.0151 11.0151 11.4010 11.4010 13.0278 13.0278 13.9863 13.9863 k =-0.2735 0.8922 0.2168 ( 2808 PWs) bands (ev): -37.4045 -37.4045 -37.3990 -37.3990 -16.7214 -16.7214 -16.7092 -16.7092 -15.0655 -15.0655 -15.0030 -15.0030 -14.9192 -14.9192 -14.8616 -14.8616 5.3357 5.3357 7.5104 7.5104 7.8836 7.8836 9.2120 9.2120 9.6231 9.6231 9.8579 9.8579 10.7876 10.7876 10.9444 10.9444 11.4672 11.4672 13.0935 13.0935 13.9539 13.9539 k =-0.2735 0.8922 0.2348 ( 2804 PWs) bands (ev): -37.4043 -37.4043 -37.3990 -37.3990 -16.7215 -16.7215 -16.7096 -16.7096 -15.0669 -15.0669 -15.0010 -15.0010 -14.9218 -14.9218 -14.8607 -14.8607 5.3601 5.3601 7.5367 7.5367 7.8304 7.8304 9.2458 9.2458 9.6184 9.6184 9.8262 9.8262 10.7776 10.7776 10.8748 10.8748 11.5356 11.5356 13.1557 13.1557 13.9288 13.9288 k =-0.2735 0.8922 0.2529 ( 2802 PWs) bands (ev): -37.4042 -37.4042 -37.3991 -37.3991 -16.7217 -16.7217 -16.7100 -16.7100 -15.0682 -15.0682 -14.9992 -14.9992 -14.9242 -14.9242 -14.8601 -14.8601 5.3864 5.3864 7.5647 7.5647 7.7748 7.7748 9.2834 9.2834 9.6097 9.6097 9.7959 9.7959 10.7675 10.7675 10.8076 10.8076 11.6056 11.6056 13.2139 13.2139 13.9108 13.9108 k =-0.2735 0.8922 0.2710 ( 2804 PWs) bands (ev): -37.4041 -37.4041 -37.3991 -37.3991 -16.7218 -16.7218 -16.7104 -16.7104 -15.0693 -15.0693 -14.9977 -14.9977 -14.9264 -14.9264 -14.8596 -14.8596 5.4144 5.4144 7.5943 7.5943 7.7174 7.7174 9.3235 9.3235 9.5977 9.5977 9.7670 9.7670 10.7351 10.7351 10.7655 10.7655 11.6771 11.6771 13.2675 13.2675 13.8993 13.8993 k =-0.2735 0.8922 0.2890 ( 2804 PWs) bands (ev): -37.4040 -37.4040 -37.3992 -37.3992 -16.7219 -16.7219 -16.7108 -16.7108 -15.0703 -15.0703 -14.9966 -14.9966 -14.9281 -14.9281 -14.8592 -14.8592 5.4441 5.4441 7.6240 7.6240 7.6599 7.6599 9.3640 9.3640 9.5842 9.5842 9.7398 9.7398 10.6723 10.6723 10.7572 10.7572 11.7499 11.7499 13.3162 13.3162 13.8936 13.8936 k =-0.2735 0.8922 0.3071 ( 2802 PWs) bands (ev): -37.4038 -37.4038 -37.3992 -37.3992 -16.7220 -16.7220 -16.7113 -16.7113 -15.0711 -15.0711 -14.9958 -14.9958 -14.9295 -14.9295 -14.8590 -14.8590 5.4754 5.4754 7.5961 7.5961 7.6604 7.6604 9.4000 9.4000 9.5736 9.5736 9.7144 9.7144 10.6099 10.6099 10.7522 10.7522 11.8238 11.8238 13.3596 13.3596 13.8929 13.8929 k =-0.2735 0.8922 0.3252 ( 2800 PWs) bands (ev): -37.4037 -37.4037 -37.3992 -37.3992 -16.7221 -16.7221 -16.7118 -16.7118 -15.0717 -15.0717 -14.9956 -14.9956 -14.9305 -14.9305 -14.8589 -14.8589 5.5084 5.5084 7.5356 7.5356 7.6940 7.6940 9.4217 9.4217 9.5750 9.5750 9.6913 9.6913 10.5498 10.5498 10.7490 10.7490 11.8987 11.8987 13.3976 13.3976 13.8959 13.8959 k =-0.2735 0.8922 0.3432 ( 2804 PWs) bands (ev): -37.4036 -37.4036 -37.3993 -37.3993 -16.7222 -16.7222 -16.7123 -16.7123 -15.0723 -15.0723 -14.9958 -14.9958 -14.9310 -14.9310 -14.8590 -14.8590 5.5430 5.5430 7.4738 7.4738 7.7296 7.7296 9.4197 9.4197 9.5963 9.5963 9.6720 9.6720 10.4928 10.4928 10.7475 10.7475 11.9744 11.9744 13.4303 13.4303 13.9013 13.9013 k =-0.2735 0.8922 0.3613 ( 2808 PWs) bands (ev): -37.4035 -37.4035 -37.3994 -37.3994 -16.7223 -16.7223 -16.7128 -16.7128 -15.0726 -15.0726 -14.9964 -14.9964 -14.9311 -14.9311 -14.8593 -14.8593 5.5791 5.5791 7.4114 7.4114 7.7665 7.7665 9.3980 9.3980 9.6221 9.6221 9.6668 9.6668 10.4394 10.4394 10.7478 10.7478 12.0509 12.0509 13.4578 13.4578 13.9078 13.9078 k =-0.2735 0.8922 0.3794 ( 2809 PWs) bands (ev): -37.4033 -37.4033 -37.3994 -37.3994 -16.7224 -16.7224 -16.7133 -16.7133 -15.0728 -15.0728 -14.9975 -14.9975 -14.9307 -14.9307 -14.8596 -14.8596 5.6167 5.6167 7.3487 7.3487 7.8047 7.8047 9.3655 9.3655 9.6190 9.6190 9.6998 9.6998 10.3908 10.3908 10.7497 10.7497 12.1279 12.1279 13.4801 13.4801 13.9141 13.9141 k =-0.2735 0.8922 0.3974 ( 2807 PWs) bands (ev): -37.4032 -37.4032 -37.3995 -37.3995 -16.7224 -16.7224 -16.7138 -16.7138 -15.0729 -15.0729 -14.9990 -14.9990 -14.9299 -14.9299 -14.8601 -14.8601 5.6557 5.6557 7.2859 7.2859 7.8442 7.8442 9.3266 9.3266 9.6056 9.6056 9.7463 9.7463 10.3484 10.3484 10.7533 10.7533 12.2054 12.2054 13.4975 13.4975 13.9189 13.9189 k =-0.2735 0.8922 0.4155 ( 2808 PWs) bands (ev): -37.4030 -37.4030 -37.3996 -37.3996 -16.7225 -16.7225 -16.7143 -16.7143 -15.0728 -15.0728 -15.0009 -15.0009 -14.9288 -14.9288 -14.8607 -14.8607 5.6961 5.6961 7.2231 7.2231 7.8847 7.8847 9.2835 9.2835 9.5922 9.5922 9.7915 9.7915 10.3146 10.3146 10.7583 10.7583 12.2832 12.2832 13.5101 13.5101 13.9213 13.9213 k =-0.2735 0.8922 0.4336 ( 2812 PWs) bands (ev): -37.4029 -37.4029 -37.3997 -37.3997 -16.7225 -16.7225 -16.7148 -16.7148 -15.0725 -15.0725 -15.0030 -15.0030 -14.9273 -14.9273 -14.8614 -14.8614 5.7379 5.7379 7.1603 7.1603 7.9263 7.9263 9.2373 9.2373 9.5803 9.5803 9.8295 9.8295 10.2927 10.2927 10.7645 10.7645 12.3611 12.3611 13.5183 13.5183 13.9205 13.9205 k =-0.2735 0.8922 0.4516 ( 2810 PWs) bands (ev): -37.4027 -37.4027 -37.3998 -37.3998 -16.7225 -16.7225 -16.7153 -16.7153 -15.0721 -15.0721 -15.0053 -15.0053 -14.9257 -14.9257 -14.8623 -14.8623 5.7810 5.7810 7.0978 7.0978 7.9689 7.9689 9.1888 9.1888 9.5704 9.5704 9.8554 9.8554 10.2865 10.2865 10.7717 10.7717 12.4391 12.4391 13.5223 13.5223 13.9160 13.9160 k =-0.2735 0.8922 0.4697 ( 2808 PWs) bands (ev): -37.4026 -37.4026 -37.3998 -37.3998 -16.7225 -16.7225 -16.7158 -16.7158 -15.0716 -15.0716 -15.0077 -15.0077 -14.9240 -14.9240 -14.8632 -14.8632 5.8253 5.8253 7.0355 7.0355 8.0125 8.0125 9.1384 9.1384 9.5626 9.5626 9.8658 9.8658 10.2983 10.2983 10.7796 10.7796 12.5169 12.5169 13.5227 13.5227 13.9075 13.9075 k =-0.2735 0.8922 0.4878 ( 2810 PWs) bands (ev): -37.4024 -37.4024 -37.3999 -37.3999 -16.7224 -16.7224 -16.7163 -16.7163 -15.0710 -15.0710 -15.0102 -15.0102 -14.9221 -14.9221 -14.8642 -14.8642 5.8708 5.8708 6.9736 6.9736 8.0570 8.0570 9.0866 9.0866 9.5569 9.5569 9.8617 9.8617 10.3267 10.3267 10.7877 10.7877 12.5944 12.5944 13.5198 13.5198 13.8953 13.8953 k =-0.2735 0.8922 0.5058 ( 2810 PWs) bands (ev): -37.4023 -37.4023 -37.4000 -37.4000 -16.7224 -16.7224 -16.7168 -16.7168 -15.0702 -15.0702 -15.0128 -15.0128 -14.9201 -14.9201 -14.8652 -14.8652 5.9175 5.9175 6.9120 6.9120 8.1024 8.1024 9.0338 9.0338 9.5534 9.5534 9.8466 9.8466 10.3673 10.3673 10.7956 10.7956 12.6713 12.6713 13.5141 13.5141 13.8796 13.8796 k =-0.2735 0.8922 0.5239 ( 2802 PWs) bands (ev): -37.4021 -37.4021 -37.4001 -37.4001 -16.7223 -16.7223 -16.7173 -16.7173 -15.0694 -15.0694 -15.0153 -15.0153 -14.9182 -14.9182 -14.8663 -14.8663 5.9653 5.9653 6.8510 6.8510 8.1487 8.1487 8.9802 8.9802 9.5521 9.5521 9.8248 9.8248 10.4152 10.4152 10.8027 10.8027 12.7475 12.7475 13.5060 13.5060 13.8613 13.8613 k =-0.2735 0.8922 0.5419 ( 2800 PWs) bands (ev): -37.4019 -37.4019 -37.4002 -37.4002 -16.7222 -16.7222 -16.7178 -16.7178 -15.0685 -15.0685 -15.0177 -15.0177 -14.9163 -14.9163 -14.8674 -14.8674 6.0142 6.0142 6.7904 6.7904 8.1958 8.1958 8.9260 8.9260 9.5531 9.5531 9.7995 9.7995 10.4664 10.4664 10.8086 10.8086 12.8226 12.8226 13.4955 13.4955 13.8416 13.8416 k =-0.2735 0.8922 0.5600 ( 2805 PWs) bands (ev): -37.4018 -37.4018 -37.4003 -37.4003 -16.7220 -16.7220 -16.7182 -16.7182 -15.0676 -15.0676 -15.0200 -15.0200 -14.9145 -14.9145 -14.8685 -14.8685 6.0641 6.0641 6.7304 6.7304 8.2438 8.2438 8.8716 8.8716 9.5564 9.5564 9.7728 9.7728 10.5182 10.5182 10.8124 10.8124 12.8964 12.8964 13.4823 13.4823 13.8224 13.8224 k =-0.2735 0.8922 0.5781 ( 2811 PWs) bands (ev): -37.4017 -37.4017 -37.4004 -37.4004 -16.7219 -16.7219 -16.7186 -16.7186 -15.0667 -15.0667 -15.0221 -15.0221 -14.9129 -14.9129 -14.8695 -14.8695 6.1150 6.1150 6.6709 6.6709 8.2926 8.2926 8.8171 8.8171 9.5618 9.5618 9.7462 9.7462 10.5684 10.5684 10.8136 10.8136 12.9685 12.9685 13.4655 13.4655 13.8061 13.8061 k =-0.2735 0.8922 0.5961 ( 2810 PWs) bands (ev): -37.4015 -37.4015 -37.4005 -37.4005 -16.7217 -16.7217 -16.7190 -16.7190 -15.0659 -15.0659 -15.0240 -15.0240 -14.9114 -14.9114 -14.8704 -14.8704 6.1669 6.1669 6.6121 6.6121 8.3421 8.3421 8.7626 8.7626 9.5694 9.5694 9.7205 9.7205 10.6155 10.6155 10.8114 10.8114 13.0385 13.0385 13.4437 13.4437 13.7956 13.7956 k =-0.2735 0.8922 0.6142 ( 2812 PWs) bands (ev): -37.4014 -37.4014 -37.4006 -37.4006 -16.7215 -16.7215 -16.7194 -16.7194 -15.0651 -15.0651 -15.0255 -15.0255 -14.9102 -14.9102 -14.8712 -14.8712 6.2196 6.2196 6.5540 6.5540 8.3924 8.3924 8.7084 8.7084 9.5790 9.5790 9.6964 9.6964 10.6586 10.6586 10.8052 10.8052 13.1060 13.1060 13.4153 13.4153 13.7938 13.7938 k =-0.2735 0.8922 0.6323 ( 2806 PWs) bands (ev): -37.4013 -37.4013 -37.4007 -37.4007 -16.7213 -16.7213 -16.7197 -16.7197 -15.0645 -15.0645 -15.0267 -15.0267 -14.9093 -14.9093 -14.8719 -14.8719 6.2731 6.2731 6.4966 6.4966 8.4434 8.4434 8.6545 8.6545 9.5901 9.5901 9.6748 9.6748 10.6968 10.6968 10.7944 10.7944 13.1702 13.1702 13.3795 13.3795 13.8026 13.8026 k =-0.2735 0.8922 0.6503 ( 2806 PWs) bands (ev): -37.4011 -37.4011 -37.4008 -37.4008 -16.7211 -16.7211 -16.7200 -16.7200 -15.0641 -15.0641 -15.0274 -15.0274 -14.9087 -14.9087 -14.8722 -14.8722 6.3272 6.3272 6.4402 6.4402 8.4950 8.4950 8.6012 8.6012 9.6011 9.6011 9.6573 9.6573 10.7295 10.7295 10.7786 10.7786 13.2306 13.2306 13.3362 13.3362 13.8221 13.8221 k =-0.2735 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4010 -37.4010 -37.4010 -37.4010 -16.7210 -16.7210 -16.7201 -16.7201 -15.0640 -15.0640 -15.0277 -15.0277 -14.9085 -14.9085 -14.8724 -14.8724 6.3739 6.3739 6.3927 6.3927 8.5412 8.5412 8.5543 8.5543 9.6069 9.6069 9.6494 9.6494 10.7533 10.7533 10.7605 10.7605 13.2853 13.2853 13.2872 13.2872 13.8418 13.8418 k =-0.2735 0.8922 0.6684 ( 2806 PWs) bands (ev): -37.4010 -37.4010 -37.4010 -37.4010 -16.7210 -16.7210 -16.7201 -16.7201 -15.0640 -15.0640 -15.0277 -15.0277 -14.9085 -14.9085 -14.8724 -14.8724 6.3739 6.3739 6.3927 6.3927 8.5412 8.5412 8.5543 8.5543 9.6069 9.6069 9.6494 9.6494 10.7533 10.7533 10.7605 10.7605 13.2853 13.2853 13.2872 13.2872 13.8418 13.8418 k =-0.2788 0.8750 0.6684 ( 2806 PWs) bands (ev): -37.4013 -37.4013 -37.4013 -37.4013 -16.7203 -16.7203 -16.7193 -16.7193 -15.0651 -15.0651 -15.0234 -15.0234 -14.9109 -14.9109 -14.8695 -14.8695 6.3686 6.3686 6.3885 6.3885 8.5264 8.5264 8.5387 8.5387 9.6329 9.6329 9.6753 9.6753 10.7336 10.7336 10.7407 10.7407 13.2567 13.2567 13.2594 13.2594 13.8566 13.8566 k =-0.2840 0.8578 0.6684 ( 2808 PWs) bands (ev): -37.4016 -37.4016 -37.4016 -37.4016 -16.7194 -16.7194 -16.7183 -16.7183 -15.0660 -15.0660 -15.0189 -15.0189 -14.9134 -14.9134 -14.8665 -14.8665 6.3591 6.3591 6.3800 6.3800 8.5143 8.5143 8.5258 8.5258 9.6616 9.6616 9.7039 9.7039 10.7148 10.7148 10.7218 10.7218 13.2257 13.2257 13.2290 13.2290 13.8687 13.8687 k =-0.2893 0.8406 0.6684 ( 2808 PWs) bands (ev): -37.4020 -37.4020 -37.4020 -37.4020 -16.7183 -16.7183 -16.7171 -16.7171 -15.0666 -15.0666 -15.0140 -15.0140 -14.9158 -14.9158 -14.8634 -14.8634 6.3454 6.3454 6.3673 6.3673 8.5046 8.5046 8.5151 8.5151 9.6930 9.6930 9.7350 9.7350 10.6976 10.6976 10.7042 10.7042 13.1924 13.1924 13.1965 13.1965 13.8775 13.8775 k =-0.2946 0.8234 0.6684 ( 2798 PWs) bands (ev): -37.4024 -37.4024 -37.4024 -37.4024 -16.7171 -16.7171 -16.7159 -16.7159 -15.0669 -15.0669 -15.0088 -15.0088 -14.9182 -14.9182 -14.8603 -14.8603 6.3279 6.3279 6.3507 6.3507 8.4968 8.4968 8.5062 8.5062 9.7269 9.7269 9.7685 9.7685 10.6824 10.6824 10.6885 10.6885 13.1573 13.1573 13.1620 13.1620 13.8823 13.8823 k =-0.2998 0.8063 0.6684 ( 2794 PWs) bands (ev): -37.4029 -37.4029 -37.4029 -37.4029 -16.7158 -16.7158 -16.7144 -16.7144 -15.0670 -15.0670 -15.0033 -15.0033 -14.9205 -14.9205 -14.8570 -14.8570 6.3068 6.3068 6.3304 6.3304 8.4905 8.4905 8.4987 8.4987 9.7632 9.7632 9.8044 9.8044 10.6697 10.6697 10.6751 10.6751 13.1204 13.1204 13.1258 13.1258 13.8828 13.8828 k =-0.3051 0.7891 0.6684 ( 2794 PWs) bands (ev): -37.4034 -37.4034 -37.4034 -37.4034 -16.7143 -16.7143 -16.7129 -16.7129 -15.0668 -15.0668 -14.9975 -14.9975 -14.9229 -14.9229 -14.8537 -14.8537 6.2823 6.2823 6.3067 6.3067 8.4851 8.4851 8.4921 8.4921 9.8018 9.8018 9.8423 9.8423 10.6598 10.6598 10.6644 10.6644 13.0820 13.0820 13.0880 13.0880 13.8786 13.8786 k =-0.3104 0.7719 0.6684 ( 2798 PWs) bands (ev): -37.4040 -37.4040 -37.4040 -37.4040 -16.7127 -16.7127 -16.7113 -16.7113 -15.0664 -15.0664 -14.9915 -14.9915 -14.9252 -14.9252 -14.8504 -14.8504 6.2549 6.2549 6.2799 6.2799 8.4802 8.4802 8.4857 8.4857 9.8423 9.8423 9.8821 9.8821 10.6534 10.6534 10.6570 10.6570 13.0422 13.0422 13.0488 13.0488 13.8698 13.8698 k =-0.3156 0.7547 0.6684 ( 2798 PWs) bands (ev): -37.4046 -37.4046 -37.4046 -37.4046 -16.7111 -16.7111 -16.7095 -16.7095 -15.0658 -15.0658 -14.9851 -14.9851 -14.9275 -14.9275 -14.8469 -14.8469 6.2249 6.2249 6.2504 6.2504 8.4752 8.4752 8.4792 8.4792 9.8847 9.8847 9.9236 9.9236 10.6508 10.6508 10.6534 10.6534 13.0013 13.0013 13.0084 13.0084 13.8563 13.8563 k =-0.3209 0.7375 0.6684 ( 2790 PWs) bands (ev): -37.4052 -37.4052 -37.4052 -37.4052 -16.7093 -16.7093 -16.7077 -16.7077 -15.0650 -15.0650 -14.9786 -14.9786 -14.9297 -14.9297 -14.8433 -14.8433 6.1926 6.1926 6.2186 6.2186 8.4697 8.4697 8.4721 8.4721 9.9285 9.9285 9.9664 9.9664 10.6525 10.6525 10.6541 10.6541 12.9593 12.9593 12.9669 12.9669 13.8383 13.8383 k =-0.3262 0.7203 0.6684 ( 2790 PWs) bands (ev): -37.4059 -37.4059 -37.4059 -37.4059 -16.7074 -16.7074 -16.7058 -16.7058 -15.0641 -15.0641 -14.9718 -14.9718 -14.9318 -14.9318 -14.8396 -14.8396 6.1584 6.1584 6.1847 6.1847 8.4631 8.4631 8.4639 8.4639 9.9736 9.9736 10.0101 10.0101 10.6589 10.6589 10.6595 10.6595 12.9166 12.9166 12.9246 12.9246 13.8161 13.8161 k =-0.3314 0.7032 0.6684 ( 2790 PWs) bands (ev): -37.4067 -37.4067 -37.4067 -37.4067 -16.7055 -16.7055 -16.7038 -16.7038 -15.0630 -15.0630 -14.9650 -14.9650 -14.9338 -14.9338 -14.8358 -14.8358 6.1225 6.1225 6.1491 6.1491 8.4543 8.4543 8.4551 8.4551 10.0194 10.0194 10.0545 10.0545 10.6700 10.6700 10.6704 10.6704 12.8734 12.8734 12.8818 12.8818 13.7902 13.7902 k =-0.3367 0.6860 0.6684 ( 2792 PWs) bands (ev): -37.4074 -37.4074 -37.4074 -37.4074 -16.7035 -16.7035 -16.7018 -16.7018 -15.0617 -15.0617 -14.9584 -14.9584 -14.9353 -14.9353 -14.8320 -14.8320 6.0853 6.0853 6.1120 6.1120 8.4429 8.4429 8.4454 8.4454 10.0658 10.0658 10.0990 10.0990 10.6862 10.6862 10.6873 10.6873 12.8298 12.8298 12.8385 12.8385 13.7611 13.7611 k =-0.3420 0.6688 0.6684 ( 2800 PWs) bands (ev): -37.4083 -37.4083 -37.4083 -37.4083 -16.7015 -16.7015 -16.6997 -16.6997 -15.0603 -15.0603 -14.9526 -14.9526 -14.9357 -14.9357 -14.8280 -14.8280 6.0471 6.0471 6.0739 6.0739 8.4296 8.4296 8.4338 8.4338 10.1121 10.1121 10.1432 10.1432 10.7084 10.7084 10.7101 10.7101 12.7862 12.7862 12.7951 12.7951 13.7293 13.7293 k =-0.3472 0.6516 0.6684 ( 2804 PWs) bands (ev): -37.4091 -37.4091 -37.4091 -37.4091 -16.6995 -16.6995 -16.6976 -16.6976 -15.0588 -15.0588 -14.9492 -14.9492 -14.9335 -14.9335 -14.8239 -14.8239 6.0080 6.0080 6.0349 6.0349 8.4143 8.4143 8.4200 8.4200 10.1581 10.1581 10.1868 10.1868 10.7368 10.7368 10.7388 10.7388 12.7429 12.7429 12.7519 12.7519 13.6953 13.6953 k =-0.3525 0.6344 0.6684 ( 2804 PWs) bands (ev): -37.4099 -37.4099 -37.4099 -37.4099 -16.6974 -16.6974 -16.6955 -16.6955 -15.0572 -15.0572 -14.9488 -14.9488 -14.9282 -14.9282 -14.8198 -14.8198 5.9685 5.9685 5.9953 5.9953 8.3967 8.3967 8.4040 8.4040 10.2035 10.2035 10.2295 10.2295 10.7716 10.7716 10.7735 10.7735 12.7001 12.7001 12.7091 12.7091 13.6599 13.6599 k =-0.3578 0.6172 0.6684 ( 2812 PWs) bands (ev): -37.4108 -37.4108 -37.4108 -37.4108 -16.6953 -16.6953 -16.6934 -16.6934 -15.0555 -15.0555 -14.9500 -14.9500 -14.9211 -14.9211 -14.8156 -14.8156 5.9287 5.9287 5.9553 5.9553 8.3771 8.3771 8.3857 8.3857 10.2479 10.2479 10.2709 10.2709 10.8125 10.8125 10.8142 10.8142 12.6582 12.6582 12.6672 12.6672 13.6233 13.6233 k =-0.3630 0.6001 0.6684 ( 2812 PWs) bands (ev): -37.4117 -37.4117 -37.4117 -37.4117 -16.6932 -16.6932 -16.6913 -16.6913 -15.0538 -15.0538 -14.9517 -14.9517 -14.9133 -14.9133 -14.8113 -14.8113 5.8888 5.8888 5.9152 5.9152 8.3554 8.3554 8.3653 8.3653 10.2911 10.2911 10.3111 10.3111 10.8595 10.8595 10.8608 10.8608 12.6176 12.6176 12.6264 12.6264 13.5863 13.5863 k =-0.3683 0.5829 0.6684 ( 2812 PWs) bands (ev): -37.4125 -37.4125 -37.4125 -37.4125 -16.6911 -16.6911 -16.6892 -16.6892 -15.0520 -15.0520 -14.9537 -14.9537 -14.9051 -14.9051 -14.8069 -14.8069 5.8491 5.8491 5.8752 5.8752 8.3318 8.3318 8.3428 8.3428 10.3331 10.3331 10.3500 10.3500 10.9121 10.9121 10.9127 10.9127 12.5785 12.5785 12.5871 12.5871 13.5492 13.5492 k =-0.3736 0.5657 0.6684 ( 2812 PWs) bands (ev): -37.4134 -37.4134 -37.4134 -37.4134 -16.6890 -16.6890 -16.6871 -16.6871 -15.0501 -15.0501 -14.9559 -14.9559 -14.8968 -14.8968 -14.8025 -14.8025 5.8097 5.8097 5.8354 5.8354 8.3064 8.3064 8.3184 8.3184 10.3737 10.3737 10.3875 10.3875 10.9697 10.9697 10.9699 10.9699 12.5414 12.5414 12.5496 12.5496 13.5119 13.5119 k =-0.3788 0.5485 0.6684 ( 2810 PWs) bands (ev): -37.4143 -37.4143 -37.4143 -37.4143 -16.6869 -16.6869 -16.6851 -16.6851 -15.0482 -15.0482 -14.9580 -14.9580 -14.8883 -14.8883 -14.7981 -14.7981 5.7707 5.7707 5.7960 5.7960 8.2795 8.2795 8.2923 8.2923 10.4129 10.4129 10.4238 10.4238 11.0312 11.0312 11.0322 11.0322 12.5065 12.5065 12.5143 12.5143 13.4747 13.4747 k =-0.3841 0.5313 0.6684 ( 2814 PWs) bands (ev): -37.4151 -37.4151 -37.4151 -37.4151 -16.6849 -16.6849 -16.6830 -16.6830 -15.0463 -15.0463 -14.9603 -14.9603 -14.8797 -14.8797 -14.7936 -14.7936 5.7324 5.7324 5.7572 5.7572 8.2513 8.2513 8.2648 8.2648 10.4506 10.4506 10.4587 10.4587 11.0967 11.0967 11.0985 11.0985 12.4743 12.4743 12.4815 12.4815 13.4386 13.4386 k =-0.3894 0.5141 0.6684 ( 2810 PWs) bands (ev): -37.4160 -37.4160 -37.4160 -37.4160 -16.6829 -16.6829 -16.6811 -16.6811 -15.0444 -15.0444 -14.9625 -14.9625 -14.8711 -14.8711 -14.7892 -14.7892 5.6949 5.6949 5.7191 5.7191 8.2220 8.2220 8.2361 8.2361 10.4868 10.4868 10.4924 10.4924 11.1656 11.1656 11.1682 11.1682 12.4450 12.4450 12.4515 12.4515 13.4037 13.4037 k =-0.3946 0.4970 0.6684 ( 2818 PWs) bands (ev): -37.4169 -37.4169 -37.4169 -37.4169 -16.6810 -16.6810 -16.6792 -16.6792 -15.0424 -15.0424 -14.9647 -14.9647 -14.8625 -14.8625 -14.7848 -14.7848 5.6584 5.6584 5.6818 5.6818 8.1920 8.1920 8.2064 8.2064 10.5213 10.5213 10.5246 10.5246 11.2373 11.2373 11.2408 11.2408 12.4189 12.4189 12.4246 12.4246 13.3703 13.3703 k =-0.3999 0.4798 0.6684 ( 2822 PWs) bands (ev): -37.4177 -37.4177 -37.4177 -37.4177 -16.6791 -16.6791 -16.6774 -16.6774 -15.0405 -15.0405 -14.9669 -14.9669 -14.8540 -14.8540 -14.7804 -14.7804 5.6229 5.6229 5.6456 5.6456 8.1616 8.1616 8.1762 8.1762 10.5541 10.5541 10.5554 10.5554 11.3114 11.3114 11.3158 11.3158 12.3963 12.3963 12.4010 12.4010 13.3386 13.3386 k =-0.4052 0.4626 0.6684 ( 2822 PWs) bands (ev): -37.4186 -37.4186 -37.4186 -37.4186 -16.6773 -16.6773 -16.6756 -16.6756 -15.0386 -15.0386 -14.9691 -14.9691 -14.8456 -14.8456 -14.7762 -14.7762 5.5885 5.5885 5.6105 5.6105 8.1309 8.1309 8.1455 8.1455 10.5845 10.5845 10.5849 10.5849 11.3873 11.3873 11.3927 11.3927 12.3774 12.3774 12.3809 12.3809 13.3088 13.3088 k =-0.4105 0.4454 0.6684 ( 2822 PWs) bands (ev): -37.4194 -37.4194 -37.4194 -37.4194 -16.6756 -16.6756 -16.6739 -16.6739 -15.0366 -15.0366 -14.9713 -14.9713 -14.8373 -14.8373 -14.7720 -14.7720 5.5555 5.5555 5.5766 5.5766 8.1003 8.1003 8.1149 8.1149 10.6117 10.6117 10.6137 10.6137 11.4646 11.4646 11.4710 11.4710 12.3624 12.3624 12.3644 12.3644 13.2810 13.2810 k =-0.4157 0.4282 0.6684 ( 2818 PWs) bands (ev): -37.4201 -37.4201 -37.4201 -37.4201 -16.6739 -16.6739 -16.6723 -16.6723 -15.0347 -15.0347 -14.9735 -14.9735 -14.8292 -14.8292 -14.7680 -14.7680 5.5238 5.5238 5.5440 5.5440 8.0701 8.0701 8.0844 8.0844 10.6370 10.6370 10.6402 10.6402 11.5426 11.5426 11.5504 11.5504 12.3512 12.3512 12.3515 12.3515 13.2553 13.2553 k =-0.4210 0.4110 0.6684 ( 2830 PWs) bands (ev): -37.4209 -37.4209 -37.4209 -37.4209 -16.6723 -16.6723 -16.6708 -16.6708 -15.0328 -15.0328 -14.9757 -14.9757 -14.8213 -14.8213 -14.7641 -14.7641 5.4936 5.4936 5.5129 5.5129 8.0404 8.0404 8.0544 8.0544 10.6602 10.6602 10.6643 10.6643 11.6210 11.6210 11.6302 11.6302 12.3423 12.3423 12.3440 12.3440 13.2321 13.2321 k =-0.4263 0.3938 0.6684 ( 2824 PWs) bands (ev): -37.4216 -37.4216 -37.4216 -37.4216 -16.6708 -16.6708 -16.6694 -16.6694 -15.0309 -15.0309 -14.9778 -14.9778 -14.8136 -14.8136 -14.7604 -14.7604 5.4650 5.4650 5.4832 5.4832 8.0116 8.0116 8.0251 8.0251 10.6812 10.6812 10.6861 10.6861 11.6992 11.6992 11.7101 11.7101 12.3367 12.3367 12.3406 12.3406 13.2114 13.2114 k =-0.4315 0.3767 0.6684 ( 2824 PWs) bands (ev): -37.4223 -37.4223 -37.4223 -37.4223 -16.6694 -16.6694 -16.6680 -16.6680 -15.0291 -15.0291 -14.9800 -14.9800 -14.8061 -14.8061 -14.7569 -14.7569 5.4380 5.4380 5.4552 5.4552 7.9839 7.9839 7.9968 7.9968 10.6999 10.6999 10.7053 10.7053 11.7765 11.7765 11.7894 11.7894 12.3343 12.3343 12.3408 12.3408 13.1936 13.1936 k =-0.4368 0.3595 0.6684 ( 2824 PWs) bands (ev): -37.4229 -37.4229 -37.4229 -37.4229 -16.6681 -16.6681 -16.6668 -16.6668 -15.0272 -15.0272 -14.9821 -14.9821 -14.7989 -14.7989 -14.7537 -14.7537 5.4128 5.4128 5.4289 5.4289 7.9574 7.9574 7.9697 7.9697 10.7165 10.7165 10.7222 10.7222 11.8524 11.8524 11.8676 11.8676 12.3350 12.3350 12.3444 12.3444 13.1789 13.1789 k =-0.4421 0.3423 0.6684 ( 2824 PWs) bands (ev): -37.4235 -37.4235 -37.4235 -37.4235 -16.6669 -16.6669 -16.6656 -16.6656 -15.0254 -15.0254 -14.9842 -14.9842 -14.7921 -14.7921 -14.7508 -14.7508 5.3894 5.3894 5.4043 5.4043 7.9323 7.9323 7.9439 7.9439 10.7309 10.7309 10.7367 10.7367 11.9261 11.9261 11.9441 11.9441 12.3383 12.3383 12.3510 12.3510 13.1677 13.1677 k =-0.4473 0.3251 0.6684 ( 2824 PWs) bands (ev): -37.4241 -37.4241 -37.4241 -37.4241 -16.6657 -16.6657 -16.6646 -16.6646 -15.0236 -15.0236 -14.9862 -14.9862 -14.7856 -14.7856 -14.7482 -14.7482 5.3679 5.3679 5.3815 5.3815 7.9090 7.9090 7.9197 7.9197 10.7432 10.7432 10.7490 10.7490 11.9968 11.9968 12.0181 12.0181 12.3439 12.3439 12.3602 12.3602 13.1604 13.1604 k =-0.4526 0.3079 0.6684 ( 2820 PWs) bands (ev): -37.4246 -37.4246 -37.4246 -37.4246 -16.6647 -16.6647 -16.6637 -16.6637 -15.0218 -15.0218 -14.9882 -14.9882 -14.7794 -14.7794 -14.7459 -14.7459 5.3482 5.3482 5.3607 5.3607 7.8874 7.8874 7.8973 7.8973 10.7537 10.7537 10.7592 10.7592 12.0635 12.0635 12.0886 12.0886 12.3513 12.3513 12.3715 12.3715 13.1576 13.1576 k =-0.4579 0.2907 0.6684 ( 2828 PWs) bands (ev): -37.4251 -37.4251 -37.4251 -37.4251 -16.6638 -16.6638 -16.6628 -16.6628 -15.0200 -15.0200 -14.9903 -14.9903 -14.7737 -14.7737 -14.7439 -14.7439 5.3306 5.3306 5.3418 5.3418 7.8678 7.8678 7.8767 7.8767 10.7624 10.7624 10.7675 10.7675 12.1254 12.1254 12.1546 12.1546 12.3599 12.3599 12.3845 12.3845 13.1598 13.1598 k =-0.4631 0.2736 0.6684 ( 2828 PWs) bands (ev): -37.4255 -37.4255 -37.4255 -37.4255 -16.6629 -16.6629 -16.6621 -16.6621 -15.0182 -15.0182 -14.9922 -14.9922 -14.7683 -14.7683 -14.7424 -14.7424 5.3151 5.3151 5.3249 5.3249 7.8502 7.8502 7.8581 7.8581 10.7695 10.7695 10.7742 10.7742 12.1814 12.1814 12.2151 12.2151 12.3693 12.3693 12.3984 12.3984 13.1676 13.1676 k =-0.4684 0.2564 0.6684 ( 2828 PWs) bands (ev): -37.4258 -37.4258 -37.4258 -37.4258 -16.6622 -16.6622 -16.6615 -16.6615 -15.0164 -15.0164 -14.9942 -14.9942 -14.7634 -14.7634 -14.7412 -14.7412 5.3016 5.3016 5.3101 5.3101 7.8349 7.8349 7.8417 7.8417 10.7753 10.7753 10.7795 10.7795 12.2306 12.2306 12.2687 12.2687 12.3793 12.3793 12.4127 12.4127 13.1813 13.1813 k =-0.4737 0.2392 0.6684 ( 2836 PWs) bands (ev): -37.4262 -37.4262 -37.4262 -37.4262 -16.6616 -16.6616 -16.6610 -16.6610 -15.0146 -15.0146 -14.9961 -14.9961 -14.7590 -14.7590 -14.7405 -14.7405 5.2902 5.2902 5.2973 5.2973 7.8218 7.8218 7.8276 7.8276 10.7799 10.7799 10.7835 10.7835 12.2726 12.2726 12.3138 12.3138 12.3899 12.3899 12.4266 12.4266 13.2011 13.2011 k =-0.4789 0.2220 0.6684 ( 2832 PWs) bands (ev): -37.4264 -37.4264 -37.4264 -37.4264 -16.6610 -16.6610 -16.6605 -16.6605 -15.0128 -15.0128 -14.9981 -14.9981 -14.7550 -14.7550 -14.7402 -14.7402 5.2810 5.2810 5.2867 5.2867 7.8111 7.8111 7.8158 7.8158 10.7835 10.7835 10.7864 10.7864 12.3070 12.3070 12.3482 12.3482 12.4022 12.4022 12.4391 12.4391 13.2264 13.2264 k =-0.4842 0.2048 0.6684 ( 2836 PWs) bands (ev): -37.4266 -37.4266 -37.4266 -37.4266 -16.6606 -16.6606 -16.6602 -16.6602 -15.0110 -15.0110 -15.0000 -15.0000 -14.7514 -14.7514 -14.7404 -14.7404 5.2740 5.2740 5.2783 5.2783 7.8029 7.8029 7.8064 7.8064 10.7862 10.7862 10.7884 10.7884 12.3341 12.3341 12.3694 12.3694 12.4175 12.4175 12.4492 12.4492 13.2559 13.2559 k =-0.4895 0.1876 0.6684 ( 2832 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6603 -16.6603 -16.6600 -16.6600 -15.0092 -15.0092 -15.0018 -15.0018 -14.7484 -14.7484 -14.7410 -14.7410 5.2691 5.2691 5.2720 5.2720 7.7972 7.7972 7.7995 7.7995 10.7882 10.7882 10.7897 10.7897 12.3545 12.3545 12.3791 12.3791 12.4340 12.4340 12.4559 12.4559 13.2865 13.2865 k =-0.4947 0.1705 0.6684 ( 2836 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6601 -16.6601 -16.6599 -16.6599 -15.0074 -15.0074 -15.0037 -15.0037 -14.7458 -14.7458 -14.7421 -14.7421 5.2665 5.2665 5.2680 5.2680 7.7939 7.7939 7.7951 7.7951 10.7895 10.7895 10.7902 10.7902 12.3688 12.3688 12.3811 12.3811 12.4473 12.4473 12.4582 12.4582 13.3126 13.3126 k =-0.5000 0.1533 0.6684 ( 2844 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6599 -16.6599 -16.6599 -16.6599 -15.0055 -15.0055 -15.0055 -15.0055 -14.7437 -14.7437 -14.7437 -14.7437 5.2661 5.2661 5.2661 5.2661 7.7932 7.7932 7.7932 7.7932 10.7901 10.7901 10.7901 10.7901 12.3776 12.3776 12.3776 12.3776 12.4554 12.4554 12.4554 12.4554 13.3266 13.3266 k =-0.5000 0.1533 0.6684 ( 2844 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6599 -16.6599 -16.6599 -16.6599 -15.0055 -15.0055 -15.0055 -15.0055 -14.7437 -14.7437 -14.7437 -14.7437 5.2661 5.2661 5.2661 5.2661 7.7932 7.7932 7.7932 7.7932 10.7901 10.7901 10.7901 10.7901 12.3776 12.3776 12.3776 12.3776 12.4554 12.4554 12.4554 12.4554 13.3266 13.3266 k =-0.5000 0.1533 0.6503 ( 2832 PWs) bands (ev): -37.4281 -37.4281 -37.4257 -37.4257 -16.6629 -16.6629 -16.6569 -16.6569 -15.0086 -15.0086 -15.0024 -15.0024 -14.7459 -14.7459 -14.7416 -14.7416 5.1785 5.1785 5.3556 5.3556 7.6979 7.6979 7.8882 7.8882 10.7193 10.7193 10.8619 10.8619 12.3571 12.3571 12.3858 12.3858 12.4457 12.4457 12.4783 12.4783 13.2991 13.2991 k =-0.5000 0.1533 0.6323 ( 2828 PWs) bands (ev): -37.4292 -37.4292 -37.4246 -37.4246 -16.6659 -16.6659 -16.6538 -16.6538 -15.0116 -15.0116 -14.9991 -14.9991 -14.7481 -14.7481 -14.7395 -14.7395 5.0928 5.0928 5.4469 5.4469 7.6025 7.6025 7.9822 7.9822 10.6496 10.6496 10.9343 10.9343 12.3288 12.3288 12.3814 12.3814 12.4538 12.4538 12.5056 12.5056 13.2738 13.2738 k =-0.5000 0.1533 0.6142 ( 2828 PWs) bands (ev): -37.4303 -37.4303 -37.4235 -37.4235 -16.6687 -16.6687 -16.6506 -16.6506 -15.0145 -15.0145 -14.9958 -14.9958 -14.7504 -14.7504 -14.7375 -14.7375 5.0091 5.0091 5.5398 5.5398 7.5075 7.5075 8.0750 8.0750 10.5812 10.5812 11.0072 11.0072 12.2957 12.2957 12.3730 12.3730 12.4717 12.4717 12.5332 12.5332 13.2511 13.2511 k =-0.5000 0.1533 0.5961 ( 2824 PWs) bands (ev): -37.4314 -37.4314 -37.4224 -37.4224 -16.6715 -16.6715 -16.6474 -16.6474 -15.0173 -15.0173 -14.9924 -14.9924 -14.7527 -14.7527 -14.7356 -14.7356 4.9274 4.9274 5.6341 5.6341 7.4133 7.4133 8.1659 8.1659 10.5143 10.5143 11.0803 11.0803 12.2602 12.2602 12.3657 12.3657 12.4940 12.4940 12.5591 12.5591 13.2310 13.2310 k =-0.5000 0.1533 0.5781 ( 2824 PWs) bands (ev): -37.4325 -37.4325 -37.4213 -37.4213 -16.6742 -16.6742 -16.6441 -16.6441 -15.0201 -15.0201 -14.9889 -14.9889 -14.7551 -14.7551 -14.7336 -14.7336 4.8478 4.8478 5.7297 5.7297 7.3206 7.3206 8.2546 8.2546 10.4491 10.4491 11.1534 11.1534 12.2236 12.2236 12.3605 12.3605 12.5188 12.5188 12.5823 12.5823 13.2139 13.2139 k =-0.5000 0.1533 0.5600 ( 2824 PWs) bands (ev): -37.4336 -37.4336 -37.4202 -37.4202 -16.6768 -16.6768 -16.6408 -16.6408 -15.0227 -15.0227 -14.9854 -14.9854 -14.7576 -14.7576 -14.7318 -14.7318 4.7704 4.7704 5.8261 5.8261 7.2297 7.2297 8.3405 8.3405 10.3859 10.3859 11.2262 11.2262 12.1870 12.1870 12.3575 12.3575 12.5454 12.5454 12.6020 12.6020 13.2001 13.2001 k =-0.5000 0.1533 0.5419 ( 2820 PWs) bands (ev): -37.4347 -37.4347 -37.4191 -37.4191 -16.6794 -16.6794 -16.6375 -16.6375 -15.0253 -15.0253 -14.9818 -14.9818 -14.7600 -14.7600 -14.7300 -14.7300 4.6950 4.6950 5.9229 5.9229 7.1416 7.1416 8.4231 8.4231 10.3247 10.3247 11.2983 11.2983 12.1507 12.1507 12.3570 12.3570 12.5729 12.5729 12.6181 12.6181 13.1898 13.1898 k =-0.5000 0.1533 0.5239 ( 2820 PWs) bands (ev): -37.4358 -37.4358 -37.4181 -37.4181 -16.6818 -16.6818 -16.6342 -16.6342 -15.0277 -15.0277 -14.9781 -14.9781 -14.7626 -14.7626 -14.7282 -14.7282 4.6219 4.6219 6.0190 6.0190 7.0573 7.0573 8.5018 8.5018 10.2659 10.2659 11.3693 11.3693 12.1152 12.1152 12.3588 12.3588 12.5996 12.5996 12.6315 12.6315 13.1832 13.1832 k =-0.5000 0.1533 0.5058 ( 2812 PWs) bands (ev): -37.4368 -37.4368 -37.4171 -37.4171 -16.6842 -16.6842 -16.6308 -16.6308 -15.0301 -15.0301 -14.9744 -14.9744 -14.7652 -14.7652 -14.7265 -14.7265 4.5510 4.5510 6.1130 6.1130 6.9787 6.9787 8.5761 8.5761 10.2096 10.2096 11.4387 11.4387 12.0809 12.0809 12.3628 12.3628 12.6187 12.6187 12.6479 12.6479 13.1804 13.1804 k =-0.5000 0.1533 0.4878 ( 2812 PWs) bands (ev): -37.4378 -37.4378 -37.4161 -37.4161 -16.6864 -16.6864 -16.6275 -16.6275 -15.0323 -15.0323 -14.9706 -14.9706 -14.7678 -14.7678 -14.7249 -14.7249 4.4824 4.4824 6.2016 6.2016 6.9089 6.9089 8.6455 8.6455 10.1562 10.1562 11.5060 11.5060 12.0479 12.0479 12.3692 12.3692 12.6243 12.6243 12.6728 12.6728 13.1811 13.1811 k =-0.5000 0.1533 0.4697 ( 2808 PWs) bands (ev): -37.4388 -37.4388 -37.4151 -37.4151 -16.6886 -16.6886 -16.6241 -16.6241 -15.0345 -15.0345 -14.9668 -14.9668 -14.7705 -14.7705 -14.7233 -14.7233 4.4160 4.4160 6.2790 6.2790 6.8542 6.8542 8.7094 8.7094 10.1059 10.1059 11.5704 11.5704 12.0167 12.0167 12.3777 12.3777 12.6215 12.6215 12.7001 12.7001 13.1849 13.1849 k =-0.5000 0.1533 0.4516 ( 2806 PWs) bands (ev): -37.4398 -37.4398 -37.4142 -37.4142 -16.6907 -16.6907 -16.6208 -16.6208 -15.0366 -15.0366 -14.9629 -14.9629 -14.7732 -14.7732 -14.7218 -14.7218 4.3518 4.3518 6.3343 6.3343 6.8254 6.8254 8.7672 8.7672 10.0588 10.0588 11.6310 11.6310 11.9874 11.9874 12.3884 12.3884 12.6134 12.6134 12.7260 12.7260 13.1910 13.1910 k =-0.5000 0.1533 0.4336 ( 2808 PWs) bands (ev): -37.4408 -37.4408 -37.4133 -37.4133 -16.6927 -16.6927 -16.6175 -16.6175 -15.0386 -15.0386 -14.9590 -14.9590 -14.7760 -14.7760 -14.7203 -14.7203 4.2901 4.2901 6.3548 6.3548 6.8353 6.8353 8.8186 8.8186 10.0154 10.0154 11.6864 11.6864 11.9601 11.9601 12.4012 12.4012 12.6018 12.6018 12.7481 12.7481 13.1990 13.1990 k =-0.5000 0.1533 0.4155 ( 2806 PWs) bands (ev): -37.4417 -37.4417 -37.4124 -37.4124 -16.6945 -16.6945 -16.6143 -16.6143 -15.0404 -15.0404 -14.9550 -14.9550 -14.7788 -14.7788 -14.7189 -14.7189 4.2306 4.2306 6.3387 6.3387 6.8858 6.8858 8.8632 8.8632 9.9758 9.9758 11.7351 11.7351 11.9350 11.9350 12.4160 12.4160 12.5880 12.5880 12.7647 12.7647 13.2104 13.2104 k =-0.5000 0.1533 0.3974 ( 2804 PWs) bands (ev): -37.4427 -37.4427 -37.4115 -37.4115 -16.6963 -16.6963 -16.6111 -16.6111 -15.0422 -15.0422 -14.9510 -14.9510 -14.7817 -14.7817 -14.7175 -14.7175 4.1735 4.1735 6.2979 6.2979 6.9653 6.9653 8.9006 8.9006 9.9401 9.9401 11.7752 11.7752 11.9121 11.9121 12.4328 12.4328 12.5741 12.5741 12.7746 12.7746 13.2280 13.2280 k =-0.5000 0.1533 0.3794 ( 2796 PWs) bands (ev): -37.4436 -37.4436 -37.4107 -37.4107 -16.6980 -16.6980 -16.6080 -16.6080 -15.0439 -15.0439 -14.9470 -14.9470 -14.7846 -14.7846 -14.7162 -14.7162 4.1188 4.1188 6.2444 6.2444 7.0617 7.0617 8.9308 8.9308 9.9085 9.9085 11.8040 11.8040 11.8915 11.8915 12.4516 12.4516 12.5624 12.5624 12.7775 12.7775 13.2539 13.2539 k =-0.5000 0.1533 0.3613 ( 2796 PWs) bands (ev): -37.4444 -37.4444 -37.4099 -37.4099 -16.6996 -16.6996 -16.6049 -16.6049 -15.0456 -15.0456 -14.9430 -14.9430 -14.7876 -14.7876 -14.7149 -14.7149 4.0665 4.0665 6.1854 6.1854 7.1679 7.1679 8.9539 8.9539 9.8808 9.8808 11.8194 11.8194 11.8730 11.8730 12.4721 12.4721 12.5551 12.5551 12.7741 12.7741 13.2885 13.2885 k =-0.5000 0.1533 0.3432 ( 2798 PWs) bands (ev): -37.4453 -37.4453 -37.4091 -37.4091 -16.7011 -16.7011 -16.6019 -16.6019 -15.0471 -15.0471 -14.9390 -14.9390 -14.7906 -14.7906 -14.7137 -14.7137 4.0166 4.0166 6.1246 6.1246 7.2803 7.2803 8.9702 8.9702 9.8571 9.8571 11.8194 11.8194 11.8563 11.8563 12.4945 12.4945 12.5545 12.5545 12.7659 12.7659 13.3311 13.3311 k =-0.5000 0.1533 0.3252 ( 2794 PWs) bands (ev): -37.4461 -37.4461 -37.4083 -37.4083 -16.7026 -16.7026 -16.5990 -16.5990 -15.0485 -15.0485 -14.9349 -14.9349 -14.7936 -14.7936 -14.7125 -14.7125 3.9691 3.9691 6.0639 6.0639 7.3968 7.3968 8.9802 8.9802 9.8368 9.8368 11.8032 11.8032 11.8411 11.8411 12.5181 12.5181 12.5615 12.5615 12.7544 12.7544 13.3806 13.3806 k =-0.5000 0.1533 0.3071 ( 2790 PWs) bands (ev): -37.4469 -37.4469 -37.4076 -37.4076 -16.7039 -16.7039 -16.5961 -16.5961 -15.0499 -15.0499 -14.9308 -14.9308 -14.7967 -14.7967 -14.7114 -14.7114 3.9241 3.9241 6.0045 6.0045 7.5165 7.5165 8.9845 8.9845 9.8198 9.8198 11.7704 11.7704 11.8282 11.8282 12.5423 12.5423 12.5765 12.5765 12.7413 12.7413 13.4358 13.4358 k =-0.5000 0.1533 0.2890 ( 2790 PWs) bands (ev): -37.4477 -37.4477 -37.4069 -37.4069 -16.7051 -16.7051 -16.5934 -16.5934 -15.0511 -15.0511 -14.9268 -14.9268 -14.7998 -14.7998 -14.7104 -14.7104 3.8815 3.8815 5.9471 5.9471 7.6385 7.6385 8.9839 8.9839 9.8054 9.8054 11.7222 11.7222 11.8174 11.8174 12.5658 12.5658 12.5981 12.5981 12.7282 12.7282 13.4959 13.4959 k =-0.5000 0.1533 0.2710 ( 2794 PWs) bands (ev): -37.4484 -37.4484 -37.4063 -37.4063 -16.7063 -16.7063 -16.5908 -16.5908 -15.0523 -15.0523 -14.9227 -14.9227 -14.8030 -14.8030 -14.7094 -14.7094 3.8415 3.8415 5.8921 5.8921 7.7623 7.7623 8.9793 8.9793 9.7933 9.7933 11.6610 11.6610 11.8084 11.8084 12.5879 12.5879 12.6233 12.6233 12.7178 12.7178 13.5598 13.5598 k =-0.5000 0.1533 0.2529 ( 2794 PWs) bands (ev): -37.4491 -37.4491 -37.4057 -37.4057 -16.7074 -16.7074 -16.5883 -16.5883 -15.0534 -15.0534 -14.9186 -14.9186 -14.8062 -14.8062 -14.7085 -14.7085 3.8039 3.8039 5.8398 5.8398 7.8877 7.8877 8.9716 8.9716 9.7829 9.7829 11.5888 11.5888 11.8009 11.8009 12.6072 12.6072 12.6469 12.6469 12.7151 12.7151 13.6270 13.6270 k =-0.5000 0.1533 0.2348 ( 2790 PWs) bands (ev): -37.4497 -37.4497 -37.4051 -37.4051 -16.7084 -16.7084 -16.5860 -16.5860 -15.0544 -15.0544 -14.9146 -14.9146 -14.8094 -14.8094 -14.7076 -14.7076 3.7689 3.7689 5.7905 5.7905 8.0141 8.0141 8.9615 8.9615 9.7739 9.7739 11.5076 11.5076 11.7947 11.7947 12.6189 12.6189 12.6657 12.6657 12.7270 12.7270 13.6968 13.6968 k =-0.5000 0.1533 0.2168 ( 2790 PWs) bands (ev): -37.4503 -37.4503 -37.4046 -37.4046 -16.7093 -16.7093 -16.5838 -16.5838 -15.0553 -15.0553 -14.9106 -14.9106 -14.8127 -14.8127 -14.7068 -14.7068 3.7364 3.7364 5.7444 5.7444 8.1414 8.1414 8.9498 8.9498 9.7660 9.7660 11.4189 11.4189 11.7896 11.7896 12.6186 12.6186 12.6851 12.6851 12.7511 12.7511 13.7683 13.7683 k =-0.5000 0.1533 0.1987 ( 2786 PWs) bands (ev): -37.4508 -37.4508 -37.4041 -37.4041 -16.7101 -16.7101 -16.5817 -16.5817 -15.0562 -15.0562 -14.9066 -14.9066 -14.8160 -14.8160 -14.7060 -14.7060 3.7064 3.7064 5.7016 5.7016 8.2691 8.2691 8.9372 8.9372 9.7589 9.7589 11.3241 11.3241 11.7855 11.7855 12.6106 12.6106 12.7075 12.7075 12.7795 12.7795 13.8409 13.8409 k =-0.5000 0.1533 0.1806 ( 2784 PWs) bands (ev): -37.4513 -37.4513 -37.4037 -37.4037 -16.7108 -16.7108 -16.5798 -16.5798 -15.0569 -15.0569 -14.9026 -14.9026 -14.8193 -14.8193 -14.7053 -14.7053 3.6790 3.6790 5.6621 5.6621 8.3969 8.3969 8.9242 8.9242 9.7524 9.7524 11.2242 11.2242 11.7823 11.7823 12.5999 12.5999 12.7312 12.7312 12.8084 12.8084 13.9135 13.9135 k =-0.5000 0.1533 0.1626 ( 2788 PWs) bands (ev): -37.4518 -37.4518 -37.4033 -37.4033 -16.7115 -16.7115 -16.5781 -16.5781 -15.0576 -15.0576 -14.8988 -14.8988 -14.8225 -14.8225 -14.7047 -14.7047 3.6542 3.6542 5.6262 5.6262 8.5242 8.5242 8.9113 8.9113 9.7465 9.7465 11.1206 11.1206 11.7797 11.7797 12.5885 12.5885 12.7549 12.7549 12.8361 12.8361 13.9847 13.9847 k =-0.5000 0.1533 0.1445 ( 2790 PWs) bands (ev): -37.4523 -37.4523 -37.4029 -37.4029 -16.7121 -16.7121 -16.5765 -16.5765 -15.0582 -15.0582 -14.8949 -14.8949 -14.8258 -14.8258 -14.7041 -14.7041 3.6319 3.6319 5.5939 5.5939 8.6504 8.6504 8.8989 8.8989 9.7412 9.7412 11.0144 11.0144 11.7778 11.7778 12.5775 12.5775 12.7779 12.7779 12.8618 12.8618 14.0530 14.0530 k =-0.5000 0.1533 0.1265 ( 2786 PWs) bands (ev): -37.4526 -37.4526 -37.4026 -37.4026 -16.7126 -16.7126 -16.5751 -16.5751 -15.0588 -15.0588 -14.8912 -14.8912 -14.8291 -14.8291 -14.7036 -14.7036 3.6123 3.6123 5.5652 5.5652 8.7746 8.7746 8.8875 8.8875 9.7363 9.7363 10.9068 10.9068 11.7763 11.7763 12.5673 12.5673 12.7995 12.7995 12.8850 12.8850 14.1163 14.1163 k =-0.5000 0.1533 0.1084 ( 2790 PWs) bands (ev): -37.4529 -37.4529 -37.4023 -37.4023 -16.7131 -16.7131 -16.5738 -16.5738 -15.0592 -15.0592 -14.8876 -14.8876 -14.8322 -14.8322 -14.7032 -14.7032 3.5952 3.5952 5.5402 5.5402 8.8746 8.8746 8.8982 8.8982 9.7320 9.7320 10.7994 10.7994 11.7752 11.7752 12.5582 12.5582 12.8194 12.8194 12.9054 12.9054 14.1730 14.1730 k =-0.5000 0.1533 0.0903 ( 2790 PWs) bands (ev): -37.4532 -37.4532 -37.4021 -37.4021 -16.7135 -16.7135 -16.5728 -16.5728 -15.0596 -15.0596 -14.8842 -14.8842 -14.8353 -14.8353 -14.7028 -14.7028 3.5808 3.5808 5.5191 5.5191 8.8671 8.8671 9.0128 9.0128 9.7283 9.7283 10.6942 10.6942 11.7744 11.7744 12.5503 12.5503 12.8370 12.8370 12.9229 12.9229 14.2214 14.2214 k =-0.5000 0.1533 0.0723 ( 2798 PWs) bands (ev): -37.4534 -37.4534 -37.4020 -37.4020 -16.7138 -16.7138 -16.5719 -16.5719 -15.0600 -15.0600 -14.8810 -14.8810 -14.8382 -14.8382 -14.7025 -14.7025 3.5689 3.5689 5.5017 5.5017 8.8594 8.8594 9.1216 9.1216 9.7252 9.7252 10.5942 10.5942 11.7738 11.7738 12.5438 12.5438 12.8520 12.8520 12.9374 12.9374 14.2420 14.2420 k =-0.5000 0.1533 0.0542 ( 2794 PWs) bands (ev): -37.4536 -37.4536 -37.4018 -37.4018 -16.7140 -16.7140 -16.5712 -16.5712 -15.0602 -15.0602 -14.8782 -14.8782 -14.8408 -14.8408 -14.7023 -14.7023 3.5597 3.5597 5.4881 5.4881 8.8533 8.8533 9.2188 9.2188 9.7227 9.7227 10.5036 10.5036 11.7735 11.7735 12.5386 12.5386 12.8641 12.8641 12.9487 12.9487 14.2383 14.2383 k =-0.5000 0.1533 0.0361 ( 2794 PWs) bands (ev): -37.4537 -37.4537 -37.4017 -37.4017 -16.7142 -16.7142 -16.5708 -16.5708 -15.0604 -15.0604 -14.8759 -14.8759 -14.8429 -14.8429 -14.7021 -14.7021 3.5532 3.5532 5.4784 5.4784 8.8488 8.8488 9.2983 9.2983 9.7209 9.7209 10.4287 10.4287 11.7732 11.7732 12.5349 12.5349 12.8729 12.8729 12.9569 12.9569 14.2343 14.2343 k =-0.5000 0.1533 0.0181 ( 2788 PWs) bands (ev): -37.4538 -37.4538 -37.4016 -37.4016 -16.7143 -16.7143 -16.5705 -16.5705 -15.0605 -15.0605 -14.8744 -14.8744 -14.8443 -14.8443 -14.7020 -14.7020 3.5492 3.5492 5.4726 5.4726 8.8461 8.8461 9.3519 9.3519 9.7198 9.7198 10.3779 10.3779 11.7731 11.7731 12.5327 12.5327 12.8783 12.8783 12.9618 12.9618 14.2316 14.2316 k =-0.5000 0.1533-0.0000 ( 2800 PWs) bands (ev): -37.4539 -37.4539 -37.4016 -37.4016 -16.7143 -16.7143 -16.5704 -16.5704 -15.0605 -15.0605 -14.8739 -14.8739 -14.8448 -14.8448 -14.7020 -14.7020 3.5479 3.5479 5.4706 5.4706 8.8452 8.8452 9.3710 9.3710 9.7194 9.7194 10.3597 10.3597 11.7730 11.7730 12.5319 12.5319 12.8800 12.8800 12.9634 12.9634 14.2307 14.2307 k = 0.0000 0.0000 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6568 -16.6568 -16.6568 -16.6568 -14.9984 -14.9984 -14.9984 -14.9984 -14.7533 -14.7533 -14.7533 -14.7533 4.8576 4.8576 4.8576 4.8576 8.8448 8.8448 8.8448 8.8448 10.1371 10.1371 10.1371 10.1371 11.9035 11.9035 11.9035 11.9035 12.7300 12.7300 12.7300 12.7300 13.7156 13.7156 k =-0.0172 0.0053 0.6684 ( 2816 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6568 -16.6568 -16.6568 -16.6568 -14.9984 -14.9984 -14.9984 -14.9984 -14.7533 -14.7533 -14.7533 -14.7533 4.8585 4.8585 4.8585 4.8585 8.8408 8.8408 8.8408 8.8408 10.1401 10.1401 10.1401 10.1401 11.9045 11.9045 11.9045 11.9045 12.7298 12.7298 12.7298 12.7298 13.7131 13.7131 k =-0.0345 0.0106 0.6684 ( 2804 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6569 -16.6569 -16.6569 -16.6569 -14.9985 -14.9985 -14.9985 -14.9985 -14.7532 -14.7532 -14.7532 -14.7532 4.8615 4.8615 4.8615 4.8615 8.8289 8.8289 8.8289 8.8289 10.1489 10.1489 10.1489 10.1489 11.9076 11.9076 11.9076 11.9076 12.7290 12.7290 12.7290 12.7290 13.7054 13.7054 k =-0.0517 0.0159 0.6684 ( 2800 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6569 -16.6569 -16.6569 -16.6569 -14.9986 -14.9986 -14.9986 -14.9986 -14.7531 -14.7531 -14.7531 -14.7531 4.8664 4.8664 4.8664 4.8664 8.8096 8.8096 8.8096 8.8096 10.1632 10.1632 10.1632 10.1632 11.9128 11.9128 11.9128 11.9128 12.7277 12.7277 12.7278 12.7278 13.6929 13.6929 k =-0.0690 0.0211 0.6684 ( 2792 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6570 -16.6570 -16.6570 -16.6570 -14.9987 -14.9987 -14.9987 -14.9987 -14.7529 -14.7529 -14.7529 -14.7529 4.8731 4.8731 4.8731 4.8731 8.7834 8.7834 8.7834 8.7834 10.1823 10.1823 10.1823 10.1823 11.9199 11.9199 11.9199 11.9199 12.7259 12.7259 12.7259 12.7259 13.6761 13.6761 k =-0.0862 0.0264 0.6684 ( 2792 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6570 -16.6570 -16.6570 -16.6570 -14.9989 -14.9989 -14.9989 -14.9989 -14.7526 -14.7526 -14.7526 -14.7526 4.8818 4.8818 4.8818 4.8818 8.7510 8.7510 8.7510 8.7510 10.2057 10.2057 10.2057 10.2057 11.9291 11.9291 11.9291 11.9291 12.7233 12.7233 12.7233 12.7233 13.6554 13.6554 k =-0.1034 0.0317 0.6684 ( 2796 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6571 -16.6571 -16.6571 -16.6571 -14.9991 -14.9991 -14.9991 -14.9991 -14.7523 -14.7523 -14.7523 -14.7523 4.8922 4.8922 4.8922 4.8922 8.7133 8.7133 8.7133 8.7133 10.2325 10.2325 10.2325 10.2325 11.9402 11.9402 11.9402 11.9402 12.7199 12.7199 12.7199 12.7199 13.6316 13.6316 k =-0.1207 0.0370 0.6684 ( 2792 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6572 -16.6572 -16.6572 -16.6572 -14.9994 -14.9994 -14.9994 -14.9994 -14.7520 -14.7520 -14.7520 -14.7520 4.9044 4.9044 4.9044 4.9044 8.6711 8.6711 8.6711 8.6711 10.2621 10.2621 10.2621 10.2621 11.9532 11.9532 11.9532 11.9532 12.7157 12.7157 12.7157 12.7157 13.6054 13.6054 k =-0.1379 0.0423 0.6684 ( 2796 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6574 -16.6574 -16.6574 -16.6574 -14.9997 -14.9997 -14.9997 -14.9997 -14.7516 -14.7516 -14.7516 -14.7516 4.9182 4.9182 4.9182 4.9182 8.6251 8.6251 8.6251 8.6251 10.2938 10.2938 10.2938 10.2938 11.9681 11.9681 11.9681 11.9681 12.7103 12.7103 12.7103 12.7103 13.5776 13.5776 k =-0.1552 0.0476 0.6684 ( 2796 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6575 -16.6575 -16.6575 -16.6575 -15.0000 -15.0000 -15.0000 -15.0000 -14.7512 -14.7512 -14.7512 -14.7512 4.9336 4.9336 4.9336 4.9336 8.5762 8.5762 8.5762 8.5762 10.3270 10.3270 10.3270 10.3270 11.9848 11.9848 11.9848 11.9848 12.7037 12.7037 12.7037 12.7037 13.5489 13.5489 k =-0.1724 0.0529 0.6684 ( 2790 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6576 -16.6576 -16.6576 -16.6576 -15.0003 -15.0003 -15.0003 -15.0003 -14.7507 -14.7507 -14.7507 -14.7507 4.9504 4.9504 4.9504 4.9504 8.5249 8.5249 8.5249 8.5249 10.3611 10.3611 10.3611 10.3611 12.0032 12.0032 12.0032 12.0032 12.6957 12.6957 12.6957 12.6957 13.5203 13.5203 k =-0.1897 0.0581 0.6684 ( 2790 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6578 -16.6578 -16.6578 -16.6578 -15.0007 -15.0007 -15.0007 -15.0007 -14.7502 -14.7502 -14.7502 -14.7502 4.9686 4.9686 4.9686 4.9686 8.4719 8.4719 8.4719 8.4719 10.3957 10.3957 10.3957 10.3957 12.0233 12.0233 12.0233 12.0233 12.6861 12.6861 12.6861 12.6861 13.4923 13.4923 k =-0.2069 0.0634 0.6684 ( 2790 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6580 -16.6580 -16.6580 -16.6580 -15.0011 -15.0011 -15.0011 -15.0011 -14.7497 -14.7497 -14.7497 -14.7497 4.9879 4.9879 4.9879 4.9879 8.4178 8.4178 8.4178 8.4178 10.4304 10.4304 10.4304 10.4304 12.0449 12.0449 12.0449 12.0449 12.6749 12.6749 12.6749 12.6749 13.4657 13.4657 k =-0.2241 0.0687 0.6684 ( 2790 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6581 -16.6581 -16.6581 -16.6581 -15.0014 -15.0014 -15.0014 -15.0014 -14.7492 -14.7492 -14.7492 -14.7492 5.0081 5.0081 5.0081 5.0081 8.3631 8.3631 8.3631 8.3631 10.4647 10.4647 10.4647 10.4647 12.0680 12.0680 12.0680 12.0680 12.6619 12.6619 12.6619 12.6619 13.4410 13.4410 k =-0.2414 0.0740 0.6684 ( 2790 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6583 -16.6583 -16.6583 -16.6583 -15.0018 -15.0018 -15.0018 -15.0018 -14.7487 -14.7487 -14.7487 -14.7487 5.0292 5.0292 5.0292 5.0292 8.3084 8.3084 8.3084 8.3084 10.4985 10.4985 10.4985 10.4985 12.0922 12.0922 12.0922 12.0922 12.6472 12.6472 12.6472 12.6472 13.4187 13.4187 k =-0.2586 0.0793 0.6684 ( 2798 PWs) bands (ev): -37.4267 -37.4267 -37.4267 -37.4267 -16.6585 -16.6585 -16.6585 -16.6585 -15.0022 -15.0022 -15.0022 -15.0022 -14.7482 -14.7482 -14.7482 -14.7482 5.0509 5.0509 5.0509 5.0509 8.2542 8.2542 8.2542 8.2542 10.5313 10.5313 10.5313 10.5313 12.1176 12.1176 12.1176 12.1176 12.6308 12.6308 12.6308 12.6308 13.3990 13.3990 k =-0.2759 0.0846 0.6684 ( 2806 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6586 -16.6586 -16.6586 -16.6586 -15.0026 -15.0026 -15.0026 -15.0026 -14.7477 -14.7477 -14.7477 -14.7477 5.0730 5.0730 5.0730 5.0730 8.2009 8.2009 8.2009 8.2009 10.5631 10.5631 10.5631 10.5631 12.1438 12.1438 12.1438 12.1438 12.6130 12.6130 12.6130 12.6130 13.3821 13.3821 k =-0.2931 0.0898 0.6684 ( 2812 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6588 -16.6588 -16.6588 -16.6588 -15.0030 -15.0030 -15.0030 -15.0030 -14.7472 -14.7472 -14.7472 -14.7472 5.0952 5.0952 5.0952 5.0952 8.1490 8.1490 8.1490 8.1490 10.5934 10.5934 10.5934 10.5934 12.1707 12.1707 12.1707 12.1707 12.5941 12.5941 12.5941 12.5941 13.3680 13.3680 k =-0.3103 0.0951 0.6684 ( 2818 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6590 -16.6590 -16.6590 -16.6590 -15.0033 -15.0033 -15.0033 -15.0033 -14.7467 -14.7467 -14.7467 -14.7467 5.1172 5.1172 5.1172 5.1172 8.0990 8.0990 8.0990 8.0990 10.6223 10.6223 10.6223 10.6223 12.1979 12.1979 12.1979 12.1979 12.5745 12.5745 12.5745 12.5745 13.3565 13.3565 k =-0.3276 0.1004 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6591 -16.6591 -16.6591 -16.6591 -15.0037 -15.0037 -15.0037 -15.0037 -14.7462 -14.7462 -14.7462 -14.7462 5.1389 5.1389 5.1389 5.1389 8.0513 8.0513 8.0513 8.0513 10.6494 10.6494 10.6494 10.6494 12.2251 12.2251 12.2251 12.2251 12.5547 12.5547 12.5547 12.5547 13.3474 13.3474 k =-0.3448 0.1057 0.6684 ( 2830 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6593 -16.6593 -16.6593 -16.6593 -15.0040 -15.0040 -15.0040 -15.0040 -14.7458 -14.7458 -14.7458 -14.7458 5.1598 5.1598 5.1598 5.1598 8.0064 8.0064 8.0064 8.0064 10.6746 10.6746 10.6746 10.6746 12.2519 12.2519 12.2519 12.2519 12.5351 12.5351 12.5351 12.5351 13.3405 13.3405 k =-0.3621 0.1110 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6594 -16.6594 -16.6594 -16.6594 -15.0043 -15.0043 -15.0043 -15.0043 -14.7454 -14.7454 -14.7454 -14.7454 5.1797 5.1797 5.1797 5.1797 7.9647 7.9647 7.9647 7.9647 10.6977 10.6977 10.6977 10.6977 12.2778 12.2778 12.2778 12.2778 12.5163 12.5163 12.5163 12.5163 13.3355 13.3355 k =-0.3793 0.1163 0.6684 ( 2820 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6595 -16.6595 -16.6595 -16.6595 -15.0046 -15.0046 -15.0046 -15.0046 -14.7450 -14.7450 -14.7450 -14.7450 5.1982 5.1982 5.1982 5.1982 7.9266 7.9266 7.9266 7.9266 10.7186 10.7186 10.7186 10.7186 12.3021 12.3021 12.3021 12.3021 12.4991 12.4991 12.4991 12.4991 13.3320 13.3320 k =-0.3966 0.1216 0.6684 ( 2820 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6596 -16.6596 -16.6596 -16.6596 -15.0048 -15.0048 -15.0048 -15.0048 -14.7447 -14.7447 -14.7447 -14.7447 5.2151 5.2151 5.2151 5.2151 7.8926 7.8926 7.8926 7.8926 10.7370 10.7370 10.7370 10.7370 12.3242 12.3242 12.3242 12.3242 12.4839 12.4839 12.4839 12.4839 13.3296 13.3296 k =-0.4138 0.1268 0.6684 ( 2822 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6597 -16.6597 -16.6597 -16.6597 -15.0050 -15.0050 -15.0050 -15.0050 -14.7444 -14.7444 -14.7444 -14.7444 5.2300 5.2300 5.2300 5.2300 7.8631 7.8631 7.8631 7.8631 10.7529 10.7529 10.7529 10.7529 12.3432 12.3432 12.3432 12.3432 12.4715 12.4715 12.4715 12.4715 13.3282 13.3282 k =-0.4310 0.1321 0.6684 ( 2826 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6598 -16.6598 -16.6598 -16.6598 -15.0052 -15.0052 -15.0052 -15.0052 -14.7442 -14.7442 -14.7442 -14.7442 5.2426 5.2426 5.2426 5.2426 7.8384 7.8384 7.8384 7.8384 10.7662 10.7662 10.7662 10.7662 12.3581 12.3581 12.3581 12.3581 12.4625 12.4625 12.4625 12.4625 13.3273 13.3273 k =-0.4483 0.1374 0.6684 ( 2822 PWs) bands (ev): -37.4268 -37.4268 -37.4268 -37.4268 -16.6599 -16.6599 -16.6599 -16.6599 -15.0053 -15.0053 -15.0053 -15.0053 -14.7440 -14.7440 -14.7440 -14.7440 5.2527 5.2527 5.2527 5.2527 7.8189 7.8189 7.8189 7.8189 10.7766 10.7766 10.7766 10.7766 12.3684 12.3684 12.3684 12.3684 12.4574 12.4574 12.4574 12.4574 13.3269 13.3269 k =-0.4655 0.1427 0.6684 ( 2830 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6599 -16.6599 -16.6599 -16.6599 -15.0054 -15.0054 -15.0054 -15.0054 -14.7438 -14.7438 -14.7438 -14.7438 5.2601 5.2601 5.2601 5.2601 7.8047 7.8047 7.8047 7.8047 10.7841 10.7841 10.7841 10.7841 12.3743 12.3743 12.3743 12.3743 12.4554 12.4554 12.4554 12.4554 13.3267 13.3267 k =-0.4828 0.1480 0.6684 ( 2840 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6599 -16.6599 -16.6599 -16.6599 -15.0055 -15.0055 -15.0055 -15.0055 -14.7438 -14.7438 -14.7438 -14.7438 5.2646 5.2646 5.2646 5.2646 7.7961 7.7961 7.7961 7.7961 10.7886 10.7886 10.7886 10.7886 12.3769 12.3769 12.3769 12.3769 12.4553 12.4553 12.4553 12.4553 13.3266 13.3266 k =-0.5000 0.1533 0.6684 ( 2844 PWs) bands (ev): -37.4269 -37.4269 -37.4269 -37.4269 -16.6599 -16.6599 -16.6599 -16.6599 -15.0055 -15.0055 -15.0055 -15.0055 -14.7437 -14.7437 -14.7437 -14.7437 5.2661 5.2661 5.2661 5.2661 7.7932 7.7932 7.7932 7.7932 10.7901 10.7901 10.7901 10.7901 12.3776 12.3776 12.3776 12.3776 12.4554 12.4554 12.4554 12.4554 13.3266 13.3266 Writing output data file ZrAl.save init_run : 2.57s CPU 13.09s WALL ( 1 calls) electrons : 405.65s CPU 411.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.33s CPU 1.45s WALL ( 1 calls) Called by electrons: c_bands : 405.63s CPU 411.34s WALL ( 1 calls) v_of_rho : 0.18s CPU 0.89s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.16s CPU 0.51s WALL ( 1 calls) newd : 0.33s CPU 0.49s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.06s WALL ( 438 calls) cegterg : 350.20s CPU 352.97s WALL ( 822 calls) Called by sum_band: Called by *egterg: h_psi : 187.34s CPU 194.19s WALL ( 12865 calls) s_psi : 15.23s CPU 15.78s WALL ( 12865 calls) g_psi : 0.36s CPU 0.42s WALL ( 11605 calls) cdiaghg : 113.78s CPU 111.42s WALL ( 12043 calls) cegterg:over : 29.10s CPU 25.95s WALL ( 11605 calls) cegterg:upda : 3.61s CPU 6.51s WALL ( 11605 calls) cegterg:last : 4.07s CPU 4.94s WALL ( 2347 calls) Called by h_psi: h_psi:vloc : 156.67s CPU 162.66s WALL ( 12865 calls) h_psi:vnl : 30.50s CPU 31.15s WALL ( 12865 calls) add_vuspsi : 8.19s CPU 11.94s WALL ( 12865 calls) General routines calbec : 22.25s CPU 19.14s WALL ( 12865 calls) fft : 0.27s CPU 1.35s WALL ( 19 calls) ffts : 0.01s CPU 0.07s WALL ( 4 calls) fftw : 148.95s CPU 153.79s WALL ( 1095100 calls) interpolate : 0.04s CPU 0.12s WALL ( 4 calls) davcio : 0.03s CPU 1.50s WALL ( 876 calls) Parallel routines fft_scatter : 92.68s CPU 96.26s WALL ( 1095123 calls) PWSCF : 7m38.35s CPU 9m37.20s WALL This run was terminated on: 6:16:14 21Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=