Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19: 7:37 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./YGe3.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 85 51 15 2163 1013 165 Max 87 52 16 2164 1022 168 Sum 3095 1865 563 77899 36649 6015 bravais-lattice index = 14 lattice parameter (alat) = 20.0026 a.u. unit-cell volume = 1112.3660 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 39.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 20.002579 celldm(2)= 1.000000 celldm(3)= 0.370187 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.926837 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.926837 0.375464 0.000000 ) a(3) = ( 0.000000 0.000000 0.370187 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 2.468512 -0.000000 ) b(2) = ( 0.000000 2.663372 -0.000000 ) b(3) = ( 0.000000 0.000000 2.701335 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Y 11.00 88.90590 Y( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.1850937 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.1850937 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 382 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 2) = ( 0.0063291 0.0324802 -0.0000000), wk = 0.0026178 k( 3) = ( 0.0126582 0.0649603 -0.0000000), wk = 0.0026178 k( 4) = ( 0.0189873 0.0974405 -0.0000000), wk = 0.0026178 k( 5) = ( 0.0253164 0.1299206 -0.0000000), wk = 0.0026178 k( 6) = ( 0.0316454 0.1624007 -0.0000000), wk = 0.0026178 k( 7) = ( 0.0379745 0.1948809 -0.0000000), wk = 0.0026178 k( 8) = ( 0.0443036 0.2273611 -0.0000000), wk = 0.0026178 k( 9) = ( 0.0506327 0.2598412 -0.0000000), wk = 0.0026178 k( 10) = ( 0.0569618 0.2923214 -0.0000000), wk = 0.0026178 k( 11) = ( 0.0632909 0.3248015 -0.0000000), wk = 0.0026178 k( 12) = ( 0.0696200 0.3572816 -0.0000000), wk = 0.0026178 k( 13) = ( 0.0759491 0.3897618 -0.0000000), wk = 0.0026178 k( 14) = ( 0.0822781 0.4222420 -0.0000000), wk = 0.0026178 k( 15) = ( 0.0886072 0.4547221 -0.0000000), wk = 0.0026178 k( 16) = ( 0.0949363 0.4872023 -0.0000000), wk = 0.0026178 k( 17) = ( 0.1012654 0.5196824 -0.0000000), wk = 0.0026178 k( 18) = ( 0.1075945 0.5521625 -0.0000000), wk = 0.0026178 k( 19) = ( 0.1139236 0.5846427 -0.0000000), wk = 0.0026178 k( 20) = ( 0.1202527 0.6171229 -0.0000000), wk = 0.0026178 k( 21) = ( 0.1265818 0.6496030 -0.0000000), wk = 0.0026178 k( 22) = ( 0.1329109 0.6820832 -0.0000000), wk = 0.0026178 k( 23) = ( 0.1392399 0.7145633 -0.0000000), wk = 0.0026178 k( 24) = ( 0.1455690 0.7470434 -0.0000000), wk = 0.0026178 k( 25) = ( 0.1518981 0.7795236 -0.0000000), wk = 0.0026178 k( 26) = ( 0.1582272 0.8120038 -0.0000000), wk = 0.0026178 k( 27) = ( 0.1645563 0.8444839 -0.0000000), wk = 0.0026178 k( 28) = ( 0.1708854 0.8769641 -0.0000000), wk = 0.0026178 k( 29) = ( 0.1772145 0.9094442 -0.0000000), wk = 0.0026178 k( 30) = ( 0.1835436 0.9419243 -0.0000000), wk = 0.0026178 k( 31) = ( 0.1898727 0.9744045 -0.0000000), wk = 0.0026178 k( 32) = ( 0.1962017 1.0068847 -0.0000000), wk = 0.0026178 k( 33) = ( 0.2025308 1.0393648 -0.0000000), wk = 0.0026178 k( 34) = ( 0.2088599 1.0718450 -0.0000000), wk = 0.0026178 k( 35) = ( 0.2151890 1.1043251 -0.0000000), wk = 0.0026178 k( 36) = ( 0.2215181 1.1368052 -0.0000000), wk = 0.0026178 k( 37) = ( 0.2278472 1.1692854 -0.0000000), wk = 0.0026178 k( 38) = ( 0.2341763 1.2017656 -0.0000000), wk = 0.0026178 k( 39) = ( 0.2405054 1.2342457 -0.0000000), wk = 0.0026178 k( 40) = ( 0.2468345 1.2667259 -0.0000000), wk = 0.0026178 k( 41) = ( 0.2531635 1.2992060 -0.0000000), wk = 0.0026178 k( 42) = ( 0.2594926 1.3316861 -0.0000000), wk = 0.0026178 k( 43) = ( 0.2594926 1.3316861 -0.0000000), wk = 0.0026178 k( 44) = ( 0.2270561 1.3316862 -0.0000000), wk = 0.0026178 k( 45) = ( 0.1946195 1.3316862 -0.0000000), wk = 0.0026178 k( 46) = ( 0.1621829 1.3316862 -0.0000000), wk = 0.0026178 k( 47) = ( 0.1297463 1.3316861 -0.0000000), wk = 0.0026178 k( 48) = ( 0.0973097 1.3316861 -0.0000000), wk = 0.0026178 k( 49) = ( 0.0648732 1.3316862 -0.0000000), wk = 0.0026178 k( 50) = ( 0.0324366 1.3316862 -0.0000000), wk = 0.0026178 k( 51) = ( 0.0000000 1.3316862 -0.0000000), wk = 0.0026178 k( 52) = ( 0.0000000 1.3316862 -0.0000000), wk = 0.0026178 k( 53) = ( 0.0000000 1.3316862 0.0329431), wk = 0.0026178 k( 54) = ( 0.0000000 1.3316862 0.0658862), wk = 0.0026178 k( 55) = ( 0.0000000 1.3316862 0.0988293), wk = 0.0026178 k( 56) = ( 0.0000000 1.3316862 0.1317724), wk = 0.0026178 k( 57) = ( 0.0000000 1.3316862 0.1647155), wk = 0.0026178 k( 58) = ( 0.0000000 1.3316862 0.1976586), wk = 0.0026178 k( 59) = ( 0.0000000 1.3316862 0.2306017), wk = 0.0026178 k( 60) = ( 0.0000000 1.3316862 0.2635449), wk = 0.0026178 k( 61) = ( 0.0000000 1.3316862 0.2964880), wk = 0.0026178 k( 62) = ( 0.0000000 1.3316862 0.3294311), wk = 0.0026178 k( 63) = ( 0.0000000 1.3316862 0.3623742), wk = 0.0026178 k( 64) = ( 0.0000000 1.3316862 0.3953173), wk = 0.0026178 k( 65) = ( 0.0000000 1.3316862 0.4282604), wk = 0.0026178 k( 66) = ( 0.0000000 1.3316862 0.4612035), wk = 0.0026178 k( 67) = ( 0.0000000 1.3316862 0.4941466), wk = 0.0026178 k( 68) = ( 0.0000000 1.3316862 0.5270897), wk = 0.0026178 k( 69) = ( 0.0000000 1.3316862 0.5600328), wk = 0.0026178 k( 70) = ( 0.0000000 1.3316862 0.5929759), wk = 0.0026178 k( 71) = ( 0.0000000 1.3316862 0.6259190), wk = 0.0026178 k( 72) = ( 0.0000000 1.3316862 0.6588621), wk = 0.0026178 k( 73) = ( 0.0000000 1.3316862 0.6918052), wk = 0.0026178 k( 74) = ( 0.0000000 1.3316862 0.7247483), wk = 0.0026178 k( 75) = ( 0.0000000 1.3316862 0.7576914), wk = 0.0026178 k( 76) = ( 0.0000000 1.3316862 0.7906345), wk = 0.0026178 k( 77) = ( 0.0000000 1.3316862 0.8235776), wk = 0.0026178 k( 78) = ( 0.0000000 1.3316862 0.8565207), wk = 0.0026178 k( 79) = ( 0.0000000 1.3316862 0.8894638), wk = 0.0026178 k( 80) = ( 0.0000000 1.3316862 0.9224069), wk = 0.0026178 k( 81) = ( 0.0000000 1.3316862 0.9553501), wk = 0.0026178 k( 82) = ( 0.0000000 1.3316862 0.9882932), wk = 0.0026178 k( 83) = ( 0.0000000 1.3316862 1.0212363), wk = 0.0026178 k( 84) = ( 0.0000000 1.3316862 1.0541794), wk = 0.0026178 k( 85) = ( 0.0000000 1.3316862 1.0871225), wk = 0.0026178 k( 86) = ( 0.0000000 1.3316862 1.1200656), wk = 0.0026178 k( 87) = ( 0.0000000 1.3316862 1.1530087), wk = 0.0026178 k( 88) = ( 0.0000000 1.3316862 1.1859518), wk = 0.0026178 k( 89) = ( 0.0000000 1.3316862 1.2188949), wk = 0.0026178 k( 90) = ( 0.0000000 1.3316862 1.2518380), wk = 0.0026178 k( 91) = ( 0.0000000 1.3316862 1.2847811), wk = 0.0026178 k( 92) = ( 0.0000000 1.3316862 1.3177242), wk = 0.0026178 k( 93) = ( 0.0000000 1.3316862 1.3506673), wk = 0.0026178 k( 94) = ( 0.0000000 1.3316862 1.3506673), wk = 0.0026178 k( 95) = ( 0.0324366 1.3316862 1.3506673), wk = 0.0026178 k( 96) = ( 0.0648732 1.3316862 1.3506673), wk = 0.0026178 k( 97) = ( 0.0973097 1.3316861 1.3506673), wk = 0.0026178 k( 98) = ( 0.1297463 1.3316861 1.3506673), wk = 0.0026178 k( 99) = ( 0.1621829 1.3316862 1.3506673), wk = 0.0026178 k( 100) = ( 0.1946195 1.3316862 1.3506673), wk = 0.0026178 k( 101) = ( 0.2270561 1.3316862 1.3506673), wk = 0.0026178 k( 102) = ( 0.2594926 1.3316861 1.3506673), wk = 0.0026178 k( 103) = ( 0.2594926 1.3316861 1.3506673), wk = 0.0026178 k( 104) = ( 0.2531635 1.2992060 1.3506673), wk = 0.0026178 k( 105) = ( 0.2468345 1.2667259 1.3506673), wk = 0.0026178 k( 106) = ( 0.2405054 1.2342457 1.3506673), wk = 0.0026178 k( 107) = ( 0.2341763 1.2017656 1.3506673), wk = 0.0026178 k( 108) = ( 0.2278472 1.1692854 1.3506673), wk = 0.0026178 k( 109) = ( 0.2215181 1.1368052 1.3506673), wk = 0.0026178 k( 110) = ( 0.2151890 1.1043251 1.3506673), wk = 0.0026178 k( 111) = ( 0.2088599 1.0718450 1.3506673), wk = 0.0026178 k( 112) = ( 0.2025308 1.0393648 1.3506673), wk = 0.0026178 k( 113) = ( 0.1962017 1.0068847 1.3506673), wk = 0.0026178 k( 114) = ( 0.1898727 0.9744045 1.3506673), wk = 0.0026178 k( 115) = ( 0.1835436 0.9419243 1.3506673), wk = 0.0026178 k( 116) = ( 0.1772145 0.9094442 1.3506673), wk = 0.0026178 k( 117) = ( 0.1708854 0.8769641 1.3506673), wk = 0.0026178 k( 118) = ( 0.1645563 0.8444839 1.3506673), wk = 0.0026178 k( 119) = ( 0.1582272 0.8120038 1.3506673), wk = 0.0026178 k( 120) = ( 0.1518981 0.7795236 1.3506673), wk = 0.0026178 k( 121) = ( 0.1455690 0.7470434 1.3506673), wk = 0.0026178 k( 122) = ( 0.1392399 0.7145633 1.3506673), wk = 0.0026178 k( 123) = ( 0.1329109 0.6820832 1.3506673), wk = 0.0026178 k( 124) = ( 0.1265818 0.6496030 1.3506673), wk = 0.0026178 k( 125) = ( 0.1202527 0.6171229 1.3506673), wk = 0.0026178 k( 126) = ( 0.1139236 0.5846427 1.3506673), wk = 0.0026178 k( 127) = ( 0.1075945 0.5521625 1.3506673), wk = 0.0026178 k( 128) = ( 0.1012654 0.5196824 1.3506673), wk = 0.0026178 k( 129) = ( 0.0949363 0.4872023 1.3506673), wk = 0.0026178 k( 130) = ( 0.0886072 0.4547221 1.3506673), wk = 0.0026178 k( 131) = ( 0.0822781 0.4222420 1.3506673), wk = 0.0026178 k( 132) = ( 0.0759491 0.3897618 1.3506673), wk = 0.0026178 k( 133) = ( 0.0696200 0.3572816 1.3506673), wk = 0.0026178 k( 134) = ( 0.0632909 0.3248015 1.3506673), wk = 0.0026178 k( 135) = ( 0.0569618 0.2923214 1.3506673), wk = 0.0026178 k( 136) = ( 0.0506327 0.2598412 1.3506673), wk = 0.0026178 k( 137) = ( 0.0443036 0.2273611 1.3506673), wk = 0.0026178 k( 138) = ( 0.0379745 0.1948809 1.3506673), wk = 0.0026178 k( 139) = ( 0.0316454 0.1624007 1.3506673), wk = 0.0026178 k( 140) = ( 0.0253164 0.1299206 1.3506673), wk = 0.0026178 k( 141) = ( 0.0189873 0.0974405 1.3506673), wk = 0.0026178 k( 142) = ( 0.0126582 0.0649603 1.3506673), wk = 0.0026178 k( 143) = ( 0.0063291 0.0324802 1.3506673), wk = 0.0026178 k( 144) = ( 0.0000000 0.0000000 1.3506673), wk = 0.0026178 k( 145) = ( 0.0000000 0.0000000 1.3506673), wk = 0.0026178 k( 146) = ( 0.0000000 0.0000000 1.3177242), wk = 0.0026178 k( 147) = ( 0.0000000 0.0000000 1.2847811), wk = 0.0026178 k( 148) = ( 0.0000000 0.0000000 1.2518380), wk = 0.0026178 k( 149) = ( 0.0000000 0.0000000 1.2188949), wk = 0.0026178 k( 150) = ( 0.0000000 0.0000000 1.1859518), wk = 0.0026178 k( 151) = ( 0.0000000 0.0000000 1.1530087), wk = 0.0026178 k( 152) = ( 0.0000000 0.0000000 1.1200656), wk = 0.0026178 k( 153) = ( 0.0000000 0.0000000 1.0871225), wk = 0.0026178 k( 154) = ( 0.0000000 0.0000000 1.0541794), wk = 0.0026178 k( 155) = ( 0.0000000 0.0000000 1.0212363), wk = 0.0026178 k( 156) = ( 0.0000000 0.0000000 0.9882932), wk = 0.0026178 k( 157) = ( 0.0000000 0.0000000 0.9553501), wk = 0.0026178 k( 158) = ( 0.0000000 0.0000000 0.9224069), wk = 0.0026178 k( 159) = ( 0.0000000 0.0000000 0.8894638), wk = 0.0026178 k( 160) = ( 0.0000000 0.0000000 0.8565207), wk = 0.0026178 k( 161) = ( 0.0000000 0.0000000 0.8235776), wk = 0.0026178 k( 162) = ( 0.0000000 0.0000000 0.7906345), wk = 0.0026178 k( 163) = ( 0.0000000 0.0000000 0.7576914), wk = 0.0026178 k( 164) = ( 0.0000000 0.0000000 0.7247483), wk = 0.0026178 k( 165) = ( 0.0000000 0.0000000 0.6918052), wk = 0.0026178 k( 166) = ( 0.0000000 0.0000000 0.6588621), wk = 0.0026178 k( 167) = ( 0.0000000 0.0000000 0.6259190), wk = 0.0026178 k( 168) = ( 0.0000000 0.0000000 0.5929759), wk = 0.0026178 k( 169) = ( 0.0000000 0.0000000 0.5600328), wk = 0.0026178 k( 170) = ( 0.0000000 0.0000000 0.5270897), wk = 0.0026178 k( 171) = ( 0.0000000 0.0000000 0.4941466), wk = 0.0026178 k( 172) = ( 0.0000000 0.0000000 0.4612035), wk = 0.0026178 k( 173) = ( 0.0000000 0.0000000 0.4282604), wk = 0.0026178 k( 174) = ( 0.0000000 0.0000000 0.3953173), wk = 0.0026178 k( 175) = ( 0.0000000 0.0000000 0.3623742), wk = 0.0026178 k( 176) = ( 0.0000000 0.0000000 0.3294311), wk = 0.0026178 k( 177) = ( 0.0000000 0.0000000 0.2964880), wk = 0.0026178 k( 178) = ( 0.0000000 0.0000000 0.2635449), wk = 0.0026178 k( 179) = ( 0.0000000 0.0000000 0.2306017), wk = 0.0026178 k( 180) = ( 0.0000000 0.0000000 0.1976586), wk = 0.0026178 k( 181) = ( 0.0000000 0.0000000 0.1647155), wk = 0.0026178 k( 182) = ( 0.0000000 0.0000000 0.1317724), wk = 0.0026178 k( 183) = ( 0.0000000 0.0000000 0.0988293), wk = 0.0026178 k( 184) = ( 0.0000000 0.0000000 0.0658862), wk = 0.0026178 k( 185) = ( 0.0000000 0.0000000 0.0329431), wk = 0.0026178 k( 186) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 187) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 188) = ( -0.0312500 0.0060894 -0.0000000), wk = 0.0026178 k( 189) = ( -0.0625000 0.0121788 -0.0000000), wk = 0.0026178 k( 190) = ( -0.0937500 0.0182681 -0.0000000), wk = 0.0026178 k( 191) = ( -0.1250000 0.0243575 -0.0000000), wk = 0.0026178 k( 192) = ( -0.1562500 0.0304469 -0.0000000), wk = 0.0026178 k( 193) = ( -0.1875000 0.0365363 -0.0000000), wk = 0.0026178 k( 194) = ( -0.2187500 0.0426257 -0.0000000), wk = 0.0026178 k( 195) = ( -0.2500000 0.0487150 -0.0000000), wk = 0.0026178 k( 196) = ( -0.2812500 0.0548044 -0.0000000), wk = 0.0026178 k( 197) = ( -0.3125000 0.0608938 -0.0000000), wk = 0.0026178 k( 198) = ( -0.3437500 0.0669832 -0.0000000), wk = 0.0026178 k( 199) = ( -0.3750000 0.0730726 -0.0000000), wk = 0.0026178 k( 200) = ( -0.4062500 0.0791620 -0.0000000), wk = 0.0026178 k( 201) = ( -0.4375000 0.0852513 -0.0000000), wk = 0.0026178 k( 202) = ( -0.4687500 0.0913407 -0.0000000), wk = 0.0026178 k( 203) = ( -0.5000000 0.0974301 -0.0000000), wk = 0.0026178 k( 204) = ( -0.5000000 0.0974301 -0.0000000), wk = 0.0026178 k( 205) = ( -0.4936709 0.1299105 -0.0000000), wk = 0.0026178 k( 206) = ( -0.4873417 0.1623909 -0.0000000), wk = 0.0026178 k( 207) = ( -0.4810126 0.1948713 -0.0000000), wk = 0.0026178 k( 208) = ( -0.4746834 0.2273518 -0.0000000), wk = 0.0026178 k( 209) = ( -0.4683543 0.2598322 -0.0000000), wk = 0.0026178 k( 210) = ( -0.4620251 0.2923126 -0.0000000), wk = 0.0026178 k( 211) = ( -0.4556960 0.3247931 -0.0000000), wk = 0.0026178 k( 212) = ( -0.4493669 0.3572735 -0.0000000), wk = 0.0026178 k( 213) = ( -0.4430377 0.3897539 -0.0000000), wk = 0.0026178 k( 214) = ( -0.4367086 0.4222343 -0.0000000), wk = 0.0026178 k( 215) = ( -0.4303794 0.4547148 -0.0000000), wk = 0.0026178 k( 216) = ( -0.4240503 0.4871952 -0.0000000), wk = 0.0026178 k( 217) = ( -0.4177212 0.5196756 -0.0000000), wk = 0.0026178 k( 218) = ( -0.4113920 0.5521560 -0.0000000), wk = 0.0026178 k( 219) = ( -0.4050629 0.5846364 -0.0000000), wk = 0.0026178 k( 220) = ( -0.3987337 0.6171168 -0.0000000), wk = 0.0026178 k( 221) = ( -0.3924046 0.6495973 -0.0000000), wk = 0.0026178 k( 222) = ( -0.3860754 0.6820777 -0.0000000), wk = 0.0026178 k( 223) = ( -0.3797463 0.7145581 -0.0000000), wk = 0.0026178 k( 224) = ( -0.3734172 0.7470386 -0.0000000), wk = 0.0026178 k( 225) = ( -0.3670880 0.7795190 -0.0000000), wk = 0.0026178 k( 226) = ( -0.3607589 0.8119994 -0.0000000), wk = 0.0026178 k( 227) = ( -0.3544297 0.8444798 -0.0000000), wk = 0.0026178 k( 228) = ( -0.3481006 0.8769603 -0.0000000), wk = 0.0026178 k( 229) = ( -0.3417715 0.9094407 -0.0000000), wk = 0.0026178 k( 230) = ( -0.3354423 0.9419211 -0.0000000), wk = 0.0026178 k( 231) = ( -0.3291132 0.9744015 -0.0000000), wk = 0.0026178 k( 232) = ( -0.3227840 1.0068819 -0.0000000), wk = 0.0026178 k( 233) = ( -0.3164549 1.0393623 -0.0000000), wk = 0.0026178 k( 234) = ( -0.3101258 1.0718428 -0.0000000), wk = 0.0026178 k( 235) = ( -0.3037966 1.1043232 -0.0000000), wk = 0.0026178 k( 236) = ( -0.2974675 1.1368036 -0.0000000), wk = 0.0026178 k( 237) = ( -0.2911383 1.1692840 -0.0000000), wk = 0.0026178 k( 238) = ( -0.2848092 1.2017645 -0.0000000), wk = 0.0026178 k( 239) = ( -0.2784800 1.2342449 -0.0000000), wk = 0.0026178 k( 240) = ( -0.2721509 1.2667253 -0.0000000), wk = 0.0026178 k( 241) = ( -0.2658218 1.2992057 -0.0000000), wk = 0.0026178 k( 242) = ( -0.2594926 1.3316862 -0.0000000), wk = 0.0026178 k( 243) = ( -0.2594926 1.3316862 -0.0000000), wk = 0.0026178 k( 244) = ( -0.2594926 1.3316862 0.0329431), wk = 0.0026178 k( 245) = ( -0.2594926 1.3316862 0.0658862), wk = 0.0026178 k( 246) = ( -0.2594926 1.3316862 0.0988293), wk = 0.0026178 k( 247) = ( -0.2594926 1.3316862 0.1317724), wk = 0.0026178 k( 248) = ( -0.2594926 1.3316862 0.1647155), wk = 0.0026178 k( 249) = ( -0.2594926 1.3316862 0.1976586), wk = 0.0026178 k( 250) = ( -0.2594926 1.3316862 0.2306017), wk = 0.0026178 k( 251) = ( -0.2594926 1.3316862 0.2635449), wk = 0.0026178 k( 252) = ( -0.2594926 1.3316862 0.2964880), wk = 0.0026178 k( 253) = ( -0.2594926 1.3316862 0.3294311), wk = 0.0026178 k( 254) = ( -0.2594926 1.3316862 0.3623742), wk = 0.0026178 k( 255) = ( -0.2594926 1.3316862 0.3953173), wk = 0.0026178 k( 256) = ( -0.2594926 1.3316862 0.4282604), wk = 0.0026178 k( 257) = ( -0.2594926 1.3316862 0.4612035), wk = 0.0026178 k( 258) = ( -0.2594926 1.3316862 0.4941466), wk = 0.0026178 k( 259) = ( -0.2594926 1.3316862 0.5270897), wk = 0.0026178 k( 260) = ( -0.2594926 1.3316862 0.5600328), wk = 0.0026178 k( 261) = ( -0.2594926 1.3316862 0.5929759), wk = 0.0026178 k( 262) = ( -0.2594926 1.3316862 0.6259190), wk = 0.0026178 k( 263) = ( -0.2594926 1.3316862 0.6588621), wk = 0.0026178 k( 264) = ( -0.2594926 1.3316862 0.6918052), wk = 0.0026178 k( 265) = ( -0.2594926 1.3316862 0.7247483), wk = 0.0026178 k( 266) = ( -0.2594926 1.3316862 0.7576914), wk = 0.0026178 k( 267) = ( -0.2594926 1.3316862 0.7906345), wk = 0.0026178 k( 268) = ( -0.2594926 1.3316862 0.8235776), wk = 0.0026178 k( 269) = ( -0.2594926 1.3316862 0.8565207), wk = 0.0026178 k( 270) = ( -0.2594926 1.3316862 0.8894638), wk = 0.0026178 k( 271) = ( -0.2594926 1.3316862 0.9224069), wk = 0.0026178 k( 272) = ( -0.2594926 1.3316862 0.9553501), wk = 0.0026178 k( 273) = ( -0.2594926 1.3316862 0.9882932), wk = 0.0026178 k( 274) = ( -0.2594926 1.3316862 1.0212363), wk = 0.0026178 k( 275) = ( -0.2594926 1.3316862 1.0541794), wk = 0.0026178 k( 276) = ( -0.2594926 1.3316862 1.0871225), wk = 0.0026178 k( 277) = ( -0.2594926 1.3316862 1.1200656), wk = 0.0026178 k( 278) = ( -0.2594926 1.3316862 1.1530087), wk = 0.0026178 k( 279) = ( -0.2594926 1.3316862 1.1859518), wk = 0.0026178 k( 280) = ( -0.2594926 1.3316862 1.2188949), wk = 0.0026178 k( 281) = ( -0.2594926 1.3316862 1.2518380), wk = 0.0026178 k( 282) = ( -0.2594926 1.3316862 1.2847811), wk = 0.0026178 k( 283) = ( -0.2594926 1.3316862 1.3177242), wk = 0.0026178 k( 284) = ( -0.2594926 1.3316862 1.3506673), wk = 0.0026178 k( 285) = ( -0.2594926 1.3316862 1.3506673), wk = 0.0026178 k( 286) = ( -0.2658218 1.2992057 1.3506673), wk = 0.0026178 k( 287) = ( -0.2721509 1.2667253 1.3506673), wk = 0.0026178 k( 288) = ( -0.2784800 1.2342449 1.3506673), wk = 0.0026178 k( 289) = ( -0.2848092 1.2017645 1.3506673), wk = 0.0026178 k( 290) = ( -0.2911383 1.1692840 1.3506673), wk = 0.0026178 k( 291) = ( -0.2974675 1.1368036 1.3506673), wk = 0.0026178 k( 292) = ( -0.3037966 1.1043232 1.3506673), wk = 0.0026178 k( 293) = ( -0.3101258 1.0718428 1.3506673), wk = 0.0026178 k( 294) = ( -0.3164549 1.0393623 1.3506673), wk = 0.0026178 k( 295) = ( -0.3227840 1.0068819 1.3506673), wk = 0.0026178 k( 296) = ( -0.3291132 0.9744015 1.3506673), wk = 0.0026178 k( 297) = ( -0.3354423 0.9419211 1.3506673), wk = 0.0026178 k( 298) = ( -0.3417715 0.9094407 1.3506673), wk = 0.0026178 k( 299) = ( -0.3481006 0.8769603 1.3506673), wk = 0.0026178 k( 300) = ( -0.3544297 0.8444798 1.3506673), wk = 0.0026178 k( 301) = ( -0.3607589 0.8119994 1.3506673), wk = 0.0026178 k( 302) = ( -0.3670880 0.7795190 1.3506673), wk = 0.0026178 k( 303) = ( -0.3734172 0.7470386 1.3506673), wk = 0.0026178 k( 304) = ( -0.3797463 0.7145581 1.3506673), wk = 0.0026178 k( 305) = ( -0.3860754 0.6820777 1.3506673), wk = 0.0026178 k( 306) = ( -0.3924046 0.6495973 1.3506673), wk = 0.0026178 k( 307) = ( -0.3987337 0.6171168 1.3506673), wk = 0.0026178 k( 308) = ( -0.4050629 0.5846364 1.3506673), wk = 0.0026178 k( 309) = ( -0.4113920 0.5521560 1.3506673), wk = 0.0026178 k( 310) = ( -0.4177212 0.5196756 1.3506673), wk = 0.0026178 k( 311) = ( -0.4240503 0.4871952 1.3506673), wk = 0.0026178 k( 312) = ( -0.4303794 0.4547148 1.3506673), wk = 0.0026178 k( 313) = ( -0.4367086 0.4222343 1.3506673), wk = 0.0026178 k( 314) = ( -0.4430377 0.3897539 1.3506673), wk = 0.0026178 k( 315) = ( -0.4493669 0.3572735 1.3506673), wk = 0.0026178 k( 316) = ( -0.4556960 0.3247931 1.3506673), wk = 0.0026178 k( 317) = ( -0.4620251 0.2923126 1.3506673), wk = 0.0026178 k( 318) = ( -0.4683543 0.2598322 1.3506673), wk = 0.0026178 k( 319) = ( -0.4746834 0.2273518 1.3506673), wk = 0.0026178 k( 320) = ( -0.4810126 0.1948713 1.3506673), wk = 0.0026178 k( 321) = ( -0.4873417 0.1623909 1.3506673), wk = 0.0026178 k( 322) = ( -0.4936709 0.1299105 1.3506673), wk = 0.0026178 k( 323) = ( -0.5000000 0.0974301 1.3506673), wk = 0.0026178 k( 324) = ( -0.5000000 0.0974301 1.3506673), wk = 0.0026178 k( 325) = ( -0.5000000 0.0974301 1.3177242), wk = 0.0026178 k( 326) = ( -0.5000000 0.0974301 1.2847811), wk = 0.0026178 k( 327) = ( -0.5000000 0.0974301 1.2518380), wk = 0.0026178 k( 328) = ( -0.5000000 0.0974301 1.2188949), wk = 0.0026178 k( 329) = ( -0.5000000 0.0974301 1.1859518), wk = 0.0026178 k( 330) = ( -0.5000000 0.0974301 1.1530087), wk = 0.0026178 k( 331) = ( -0.5000000 0.0974301 1.1200656), wk = 0.0026178 k( 332) = ( -0.5000000 0.0974301 1.0871225), wk = 0.0026178 k( 333) = ( -0.5000000 0.0974301 1.0541794), wk = 0.0026178 k( 334) = ( -0.5000000 0.0974301 1.0212363), wk = 0.0026178 k( 335) = ( -0.5000000 0.0974301 0.9882932), wk = 0.0026178 k( 336) = ( -0.5000000 0.0974301 0.9553501), wk = 0.0026178 k( 337) = ( -0.5000000 0.0974301 0.9224069), wk = 0.0026178 k( 338) = ( -0.5000000 0.0974301 0.8894638), wk = 0.0026178 k( 339) = ( -0.5000000 0.0974301 0.8565207), wk = 0.0026178 k( 340) = ( -0.5000000 0.0974301 0.8235776), wk = 0.0026178 k( 341) = ( -0.5000000 0.0974301 0.7906345), wk = 0.0026178 k( 342) = ( -0.5000000 0.0974301 0.7576914), wk = 0.0026178 k( 343) = ( -0.5000000 0.0974301 0.7247483), wk = 0.0026178 k( 344) = ( -0.5000000 0.0974301 0.6918052), wk = 0.0026178 k( 345) = ( -0.5000000 0.0974301 0.6588621), wk = 0.0026178 k( 346) = ( -0.5000000 0.0974301 0.6259190), wk = 0.0026178 k( 347) = ( -0.5000000 0.0974301 0.5929759), wk = 0.0026178 k( 348) = ( -0.5000000 0.0974301 0.5600328), wk = 0.0026178 k( 349) = ( -0.5000000 0.0974301 0.5270897), wk = 0.0026178 k( 350) = ( -0.5000000 0.0974301 0.4941466), wk = 0.0026178 k( 351) = ( -0.5000000 0.0974301 0.4612035), wk = 0.0026178 k( 352) = ( -0.5000000 0.0974301 0.4282604), wk = 0.0026178 k( 353) = ( -0.5000000 0.0974301 0.3953173), wk = 0.0026178 k( 354) = ( -0.5000000 0.0974301 0.3623742), wk = 0.0026178 k( 355) = ( -0.5000000 0.0974301 0.3294311), wk = 0.0026178 k( 356) = ( -0.5000000 0.0974301 0.2964880), wk = 0.0026178 k( 357) = ( -0.5000000 0.0974301 0.2635449), wk = 0.0026178 k( 358) = ( -0.5000000 0.0974301 0.2306017), wk = 0.0026178 k( 359) = ( -0.5000000 0.0974301 0.1976586), wk = 0.0026178 k( 360) = ( -0.5000000 0.0974301 0.1647155), wk = 0.0026178 k( 361) = ( -0.5000000 0.0974301 0.1317724), wk = 0.0026178 k( 362) = ( -0.5000000 0.0974301 0.0988293), wk = 0.0026178 k( 363) = ( -0.5000000 0.0974301 0.0658862), wk = 0.0026178 k( 364) = ( -0.5000000 0.0974301 0.0329431), wk = 0.0026178 k( 365) = ( -0.5000000 0.0974301 -0.0000000), wk = 0.0026178 k( 366) = ( 0.0000000 0.0000000 1.3506673), wk = 0.0026178 k( 367) = ( -0.0312500 0.0060894 1.3506673), wk = 0.0026178 k( 368) = ( -0.0625000 0.0121788 1.3506673), wk = 0.0026178 k( 369) = ( -0.0937500 0.0182681 1.3506673), wk = 0.0026178 k( 370) = ( -0.1250000 0.0243575 1.3506673), wk = 0.0026178 k( 371) = ( -0.1562500 0.0304469 1.3506673), wk = 0.0026178 k( 372) = ( -0.1875000 0.0365363 1.3506673), wk = 0.0026178 k( 373) = ( -0.2187500 0.0426257 1.3506673), wk = 0.0026178 k( 374) = ( -0.2500000 0.0487150 1.3506673), wk = 0.0026178 k( 375) = ( -0.2812500 0.0548044 1.3506673), wk = 0.0026178 k( 376) = ( -0.3125000 0.0608938 1.3506673), wk = 0.0026178 k( 377) = ( -0.3437500 0.0669832 1.3506673), wk = 0.0026178 k( 378) = ( -0.3750000 0.0730726 1.3506673), wk = 0.0026178 k( 379) = ( -0.4062500 0.0791620 1.3506673), wk = 0.0026178 k( 380) = ( -0.4375000 0.0852513 1.3506673), wk = 0.0026178 k( 381) = ( -0.4687500 0.0913407 1.3506673), wk = 0.0026178 k( 382) = ( -0.5000000 0.0974301 1.3506673), wk = 0.0026178 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 2) = ( 0.0063291 0.0063291 0.0000000), wk = 0.0026178 k( 3) = ( 0.0126582 0.0126582 0.0000000), wk = 0.0026178 k( 4) = ( 0.0189873 0.0189873 -0.0000000), wk = 0.0026178 k( 5) = ( 0.0253164 0.0253164 0.0000000), wk = 0.0026178 k( 6) = ( 0.0316454 0.0316454 -0.0000000), wk = 0.0026178 k( 7) = ( 0.0379745 0.0379745 -0.0000000), wk = 0.0026178 k( 8) = ( 0.0443036 0.0443036 -0.0000000), wk = 0.0026178 k( 9) = ( 0.0506327 0.0506327 0.0000000), wk = 0.0026178 k( 10) = ( 0.0569618 0.0569618 -0.0000000), wk = 0.0026178 k( 11) = ( 0.0632909 0.0632909 -0.0000000), wk = 0.0026178 k( 12) = ( 0.0696200 0.0696200 -0.0000000), wk = 0.0026178 k( 13) = ( 0.0759491 0.0759491 -0.0000000), wk = 0.0026178 k( 14) = ( 0.0822781 0.0822782 -0.0000000), wk = 0.0026178 k( 15) = ( 0.0886072 0.0886072 -0.0000000), wk = 0.0026178 k( 16) = ( 0.0949363 0.0949363 -0.0000000), wk = 0.0026178 k( 17) = ( 0.1012654 0.1012654 0.0000000), wk = 0.0026178 k( 18) = ( 0.1075945 0.1075945 0.0000000), wk = 0.0026178 k( 19) = ( 0.1139236 0.1139236 -0.0000000), wk = 0.0026178 k( 20) = ( 0.1202527 0.1202527 -0.0000000), wk = 0.0026178 k( 21) = ( 0.1265818 0.1265818 -0.0000000), wk = 0.0026178 k( 22) = ( 0.1329109 0.1329109 -0.0000000), wk = 0.0026178 k( 23) = ( 0.1392399 0.1392399 -0.0000000), wk = 0.0026178 k( 24) = ( 0.1455690 0.1455690 -0.0000000), wk = 0.0026178 k( 25) = ( 0.1518981 0.1518981 -0.0000000), wk = 0.0026178 k( 26) = ( 0.1582272 0.1582272 0.0000000), wk = 0.0026178 k( 27) = ( 0.1645563 0.1645563 -0.0000000), wk = 0.0026178 k( 28) = ( 0.1708854 0.1708854 0.0000000), wk = 0.0026178 k( 29) = ( 0.1772145 0.1772145 0.0000000), wk = 0.0026178 k( 30) = ( 0.1835436 0.1835436 -0.0000000), wk = 0.0026178 k( 31) = ( 0.1898727 0.1898727 0.0000000), wk = 0.0026178 k( 32) = ( 0.1962017 0.1962017 0.0000000), wk = 0.0026178 k( 33) = ( 0.2025308 0.2025308 0.0000000), wk = 0.0026178 k( 34) = ( 0.2088599 0.2088599 0.0000000), wk = 0.0026178 k( 35) = ( 0.2151890 0.2151890 0.0000000), wk = 0.0026178 k( 36) = ( 0.2215181 0.2215181 0.0000000), wk = 0.0026178 k( 37) = ( 0.2278472 0.2278472 -0.0000000), wk = 0.0026178 k( 38) = ( 0.2341763 0.2341763 0.0000000), wk = 0.0026178 k( 39) = ( 0.2405054 0.2405054 -0.0000000), wk = 0.0026178 k( 40) = ( 0.2468345 0.2468345 0.0000000), wk = 0.0026178 k( 41) = ( 0.2531635 0.2531635 -0.0000000), wk = 0.0026178 k( 42) = ( 0.2594926 0.2594926 0.0000000), wk = 0.0026178 k( 43) = ( 0.2594926 0.2594926 0.0000000), wk = 0.0026178 k( 44) = ( 0.2270561 0.2895560 -0.0000000), wk = 0.0026178 k( 45) = ( 0.1946195 0.3196195 0.0000000), wk = 0.0026178 k( 46) = ( 0.1621829 0.3496829 0.0000000), wk = 0.0026178 k( 47) = ( 0.1297463 0.3797463 -0.0000000), wk = 0.0026178 k( 48) = ( 0.0973097 0.4098097 0.0000000), wk = 0.0026178 k( 49) = ( 0.0648732 0.4398732 -0.0000000), wk = 0.0026178 k( 50) = ( 0.0324366 0.4699366 -0.0000000), wk = 0.0026178 k( 51) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026178 k( 52) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0026178 k( 53) = ( 0.0000000 0.5000000 0.0121951), wk = 0.0026178 k( 54) = ( 0.0000000 0.5000000 0.0243902), wk = 0.0026178 k( 55) = ( 0.0000000 0.5000000 0.0365854), wk = 0.0026178 k( 56) = ( 0.0000000 0.5000000 0.0487805), wk = 0.0026178 k( 57) = ( 0.0000000 0.5000000 0.0609756), wk = 0.0026178 k( 58) = ( 0.0000000 0.5000000 0.0731707), wk = 0.0026178 k( 59) = ( 0.0000000 0.5000000 0.0853659), wk = 0.0026178 k( 60) = ( 0.0000000 0.5000000 0.0975610), wk = 0.0026178 k( 61) = ( 0.0000000 0.5000000 0.1097561), wk = 0.0026178 k( 62) = ( 0.0000000 0.5000000 0.1219512), wk = 0.0026178 k( 63) = ( 0.0000000 0.5000000 0.1341463), wk = 0.0026178 k( 64) = ( 0.0000000 0.5000000 0.1463415), wk = 0.0026178 k( 65) = ( 0.0000000 0.5000000 0.1585366), wk = 0.0026178 k( 66) = ( 0.0000000 0.5000000 0.1707317), wk = 0.0026178 k( 67) = ( 0.0000000 0.5000000 0.1829268), wk = 0.0026178 k( 68) = ( 0.0000000 0.5000000 0.1951220), wk = 0.0026178 k( 69) = ( 0.0000000 0.5000000 0.2073171), wk = 0.0026178 k( 70) = ( 0.0000000 0.5000000 0.2195122), wk = 0.0026178 k( 71) = ( 0.0000000 0.5000000 0.2317073), wk = 0.0026178 k( 72) = ( 0.0000000 0.5000000 0.2439024), wk = 0.0026178 k( 73) = ( 0.0000000 0.5000000 0.2560976), wk = 0.0026178 k( 74) = ( 0.0000000 0.5000000 0.2682927), wk = 0.0026178 k( 75) = ( 0.0000000 0.5000000 0.2804878), wk = 0.0026178 k( 76) = ( 0.0000000 0.5000000 0.2926829), wk = 0.0026178 k( 77) = ( 0.0000000 0.5000000 0.3048781), wk = 0.0026178 k( 78) = ( 0.0000000 0.5000000 0.3170732), wk = 0.0026178 k( 79) = ( 0.0000000 0.5000000 0.3292683), wk = 0.0026178 k( 80) = ( 0.0000000 0.5000000 0.3414634), wk = 0.0026178 k( 81) = ( 0.0000000 0.5000000 0.3536585), wk = 0.0026178 k( 82) = ( 0.0000000 0.5000000 0.3658537), wk = 0.0026178 k( 83) = ( 0.0000000 0.5000000 0.3780488), wk = 0.0026178 k( 84) = ( 0.0000000 0.5000000 0.3902439), wk = 0.0026178 k( 85) = ( 0.0000000 0.5000000 0.4024390), wk = 0.0026178 k( 86) = ( 0.0000000 0.5000000 0.4146342), wk = 0.0026178 k( 87) = ( 0.0000000 0.5000000 0.4268293), wk = 0.0026178 k( 88) = ( 0.0000000 0.5000000 0.4390244), wk = 0.0026178 k( 89) = ( 0.0000000 0.5000000 0.4512195), wk = 0.0026178 k( 90) = ( 0.0000000 0.5000000 0.4634146), wk = 0.0026178 k( 91) = ( 0.0000000 0.5000000 0.4756098), wk = 0.0026178 k( 92) = ( 0.0000000 0.5000000 0.4878049), wk = 0.0026178 k( 93) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026178 k( 94) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0026178 k( 95) = ( 0.0324366 0.4699366 0.5000000), wk = 0.0026178 k( 96) = ( 0.0648732 0.4398732 0.5000000), wk = 0.0026178 k( 97) = ( 0.0973097 0.4098097 0.5000000), wk = 0.0026178 k( 98) = ( 0.1297463 0.3797463 0.5000000), wk = 0.0026178 k( 99) = ( 0.1621829 0.3496829 0.5000000), wk = 0.0026178 k( 100) = ( 0.1946195 0.3196195 0.5000000), wk = 0.0026178 k( 101) = ( 0.2270561 0.2895560 0.5000000), wk = 0.0026178 k( 102) = ( 0.2594926 0.2594926 0.5000000), wk = 0.0026178 k( 103) = ( 0.2594926 0.2594926 0.5000000), wk = 0.0026178 k( 104) = ( 0.2531635 0.2531635 0.5000000), wk = 0.0026178 k( 105) = ( 0.2468345 0.2468345 0.5000000), wk = 0.0026178 k( 106) = ( 0.2405054 0.2405054 0.5000000), wk = 0.0026178 k( 107) = ( 0.2341763 0.2341763 0.5000000), wk = 0.0026178 k( 108) = ( 0.2278472 0.2278472 0.5000000), wk = 0.0026178 k( 109) = ( 0.2215181 0.2215181 0.5000000), wk = 0.0026178 k( 110) = ( 0.2151890 0.2151890 0.5000000), wk = 0.0026178 k( 111) = ( 0.2088599 0.2088599 0.5000000), wk = 0.0026178 k( 112) = ( 0.2025308 0.2025308 0.5000000), wk = 0.0026178 k( 113) = ( 0.1962017 0.1962017 0.5000000), wk = 0.0026178 k( 114) = ( 0.1898727 0.1898727 0.5000000), wk = 0.0026178 k( 115) = ( 0.1835436 0.1835436 0.5000000), wk = 0.0026178 k( 116) = ( 0.1772145 0.1772145 0.5000000), wk = 0.0026178 k( 117) = ( 0.1708854 0.1708854 0.5000000), wk = 0.0026178 k( 118) = ( 0.1645563 0.1645563 0.5000000), wk = 0.0026178 k( 119) = ( 0.1582272 0.1582272 0.5000000), wk = 0.0026178 k( 120) = ( 0.1518981 0.1518981 0.5000000), wk = 0.0026178 k( 121) = ( 0.1455690 0.1455690 0.5000000), wk = 0.0026178 k( 122) = ( 0.1392399 0.1392399 0.5000000), wk = 0.0026178 k( 123) = ( 0.1329109 0.1329109 0.5000000), wk = 0.0026178 k( 124) = ( 0.1265818 0.1265818 0.5000000), wk = 0.0026178 k( 125) = ( 0.1202527 0.1202527 0.5000000), wk = 0.0026178 k( 126) = ( 0.1139236 0.1139236 0.5000000), wk = 0.0026178 k( 127) = ( 0.1075945 0.1075945 0.5000000), wk = 0.0026178 k( 128) = ( 0.1012654 0.1012654 0.5000000), wk = 0.0026178 k( 129) = ( 0.0949363 0.0949363 0.5000000), wk = 0.0026178 k( 130) = ( 0.0886072 0.0886072 0.5000000), wk = 0.0026178 k( 131) = ( 0.0822781 0.0822782 0.5000000), wk = 0.0026178 k( 132) = ( 0.0759491 0.0759491 0.5000000), wk = 0.0026178 k( 133) = ( 0.0696200 0.0696200 0.5000000), wk = 0.0026178 k( 134) = ( 0.0632909 0.0632909 0.5000000), wk = 0.0026178 k( 135) = ( 0.0569618 0.0569618 0.5000000), wk = 0.0026178 k( 136) = ( 0.0506327 0.0506327 0.5000000), wk = 0.0026178 k( 137) = ( 0.0443036 0.0443036 0.5000000), wk = 0.0026178 k( 138) = ( 0.0379745 0.0379745 0.5000000), wk = 0.0026178 k( 139) = ( 0.0316454 0.0316454 0.5000000), wk = 0.0026178 k( 140) = ( 0.0253164 0.0253164 0.5000000), wk = 0.0026178 k( 141) = ( 0.0189873 0.0189873 0.5000000), wk = 0.0026178 k( 142) = ( 0.0126582 0.0126582 0.5000000), wk = 0.0026178 k( 143) = ( 0.0063291 0.0063291 0.5000000), wk = 0.0026178 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026178 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026178 k( 146) = ( 0.0000000 0.0000000 0.4878049), wk = 0.0026178 k( 147) = ( 0.0000000 0.0000000 0.4756098), wk = 0.0026178 k( 148) = ( 0.0000000 0.0000000 0.4634146), wk = 0.0026178 k( 149) = ( 0.0000000 0.0000000 0.4512195), wk = 0.0026178 k( 150) = ( 0.0000000 0.0000000 0.4390244), wk = 0.0026178 k( 151) = ( 0.0000000 0.0000000 0.4268293), wk = 0.0026178 k( 152) = ( 0.0000000 0.0000000 0.4146342), wk = 0.0026178 k( 153) = ( 0.0000000 0.0000000 0.4024390), wk = 0.0026178 k( 154) = ( 0.0000000 0.0000000 0.3902439), wk = 0.0026178 k( 155) = ( 0.0000000 0.0000000 0.3780488), wk = 0.0026178 k( 156) = ( 0.0000000 0.0000000 0.3658537), wk = 0.0026178 k( 157) = ( 0.0000000 0.0000000 0.3536585), wk = 0.0026178 k( 158) = ( 0.0000000 0.0000000 0.3414634), wk = 0.0026178 k( 159) = ( 0.0000000 0.0000000 0.3292683), wk = 0.0026178 k( 160) = ( 0.0000000 0.0000000 0.3170732), wk = 0.0026178 k( 161) = ( 0.0000000 0.0000000 0.3048781), wk = 0.0026178 k( 162) = ( 0.0000000 0.0000000 0.2926829), wk = 0.0026178 k( 163) = ( 0.0000000 0.0000000 0.2804878), wk = 0.0026178 k( 164) = ( 0.0000000 0.0000000 0.2682927), wk = 0.0026178 k( 165) = ( 0.0000000 0.0000000 0.2560976), wk = 0.0026178 k( 166) = ( 0.0000000 0.0000000 0.2439024), wk = 0.0026178 k( 167) = ( 0.0000000 0.0000000 0.2317073), wk = 0.0026178 k( 168) = ( 0.0000000 0.0000000 0.2195122), wk = 0.0026178 k( 169) = ( 0.0000000 0.0000000 0.2073171), wk = 0.0026178 k( 170) = ( 0.0000000 0.0000000 0.1951220), wk = 0.0026178 k( 171) = ( 0.0000000 0.0000000 0.1829268), wk = 0.0026178 k( 172) = ( 0.0000000 0.0000000 0.1707317), wk = 0.0026178 k( 173) = ( 0.0000000 0.0000000 0.1585366), wk = 0.0026178 k( 174) = ( 0.0000000 0.0000000 0.1463415), wk = 0.0026178 k( 175) = ( 0.0000000 0.0000000 0.1341463), wk = 0.0026178 k( 176) = ( 0.0000000 0.0000000 0.1219512), wk = 0.0026178 k( 177) = ( 0.0000000 0.0000000 0.1097561), wk = 0.0026178 k( 178) = ( 0.0000000 0.0000000 0.0975610), wk = 0.0026178 k( 179) = ( 0.0000000 0.0000000 0.0853659), wk = 0.0026178 k( 180) = ( 0.0000000 0.0000000 0.0731707), wk = 0.0026178 k( 181) = ( 0.0000000 0.0000000 0.0609756), wk = 0.0026178 k( 182) = ( 0.0000000 0.0000000 0.0487805), wk = 0.0026178 k( 183) = ( 0.0000000 0.0000000 0.0365854), wk = 0.0026178 k( 184) = ( 0.0000000 0.0000000 0.0243902), wk = 0.0026178 k( 185) = ( 0.0000000 0.0000000 0.0121951), wk = 0.0026178 k( 186) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 187) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026178 k( 188) = ( -0.0312500 0.0312500 -0.0000000), wk = 0.0026178 k( 189) = ( -0.0625000 0.0625000 -0.0000000), wk = 0.0026178 k( 190) = ( -0.0937500 0.0937500 -0.0000000), wk = 0.0026178 k( 191) = ( -0.1250000 0.1250000 -0.0000000), wk = 0.0026178 k( 192) = ( -0.1562500 0.1562500 -0.0000000), wk = 0.0026178 k( 193) = ( -0.1875000 0.1875000 -0.0000000), wk = 0.0026178 k( 194) = ( -0.2187500 0.2187500 0.0000000), wk = 0.0026178 k( 195) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0026178 k( 196) = ( -0.2812500 0.2812500 -0.0000000), wk = 0.0026178 k( 197) = ( -0.3125000 0.3125000 -0.0000000), wk = 0.0026178 k( 198) = ( -0.3437500 0.3437500 -0.0000000), wk = 0.0026178 k( 199) = ( -0.3750000 0.3750000 -0.0000000), wk = 0.0026178 k( 200) = ( -0.4062500 0.4062500 0.0000000), wk = 0.0026178 k( 201) = ( -0.4375000 0.4375000 0.0000000), wk = 0.0026178 k( 202) = ( -0.4687500 0.4687500 -0.0000000), wk = 0.0026178 k( 203) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0026178 k( 204) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0026178 k( 205) = ( -0.4936709 0.5063291 -0.0000000), wk = 0.0026178 k( 206) = ( -0.4873417 0.5126583 0.0000000), wk = 0.0026178 k( 207) = ( -0.4810126 0.5189874 -0.0000000), wk = 0.0026178 k( 208) = ( -0.4746834 0.5253166 0.0000000), wk = 0.0026178 k( 209) = ( -0.4683543 0.5316457 -0.0000000), wk = 0.0026178 k( 210) = ( -0.4620251 0.5379749 0.0000000), wk = 0.0026178 k( 211) = ( -0.4556960 0.5443040 -0.0000000), wk = 0.0026178 k( 212) = ( -0.4493669 0.5506331 0.0000000), wk = 0.0026178 k( 213) = ( -0.4430377 0.5569623 -0.0000000), wk = 0.0026178 k( 214) = ( -0.4367086 0.5632914 -0.0000000), wk = 0.0026178 k( 215) = ( -0.4303794 0.5696206 -0.0000000), wk = 0.0026178 k( 216) = ( -0.4240503 0.5759497 -0.0000000), wk = 0.0026178 k( 217) = ( -0.4177212 0.5822788 -0.0000000), wk = 0.0026178 k( 218) = ( -0.4113920 0.5886080 -0.0000000), wk = 0.0026178 k( 219) = ( -0.4050629 0.5949371 0.0000000), wk = 0.0026178 k( 220) = ( -0.3987337 0.6012663 -0.0000000), wk = 0.0026178 k( 221) = ( -0.3924046 0.6075954 -0.0000000), wk = 0.0026178 k( 222) = ( -0.3860754 0.6139246 -0.0000000), wk = 0.0026178 k( 223) = ( -0.3797463 0.6202537 -0.0000000), wk = 0.0026178 k( 224) = ( -0.3734172 0.6265828 0.0000000), wk = 0.0026178 k( 225) = ( -0.3670880 0.6329120 -0.0000000), wk = 0.0026178 k( 226) = ( -0.3607589 0.6392411 0.0000000), wk = 0.0026178 k( 227) = ( -0.3544297 0.6455703 -0.0000000), wk = 0.0026178 k( 228) = ( -0.3481006 0.6518994 -0.0000000), wk = 0.0026178 k( 229) = ( -0.3417715 0.6582285 -0.0000000), wk = 0.0026178 k( 230) = ( -0.3354423 0.6645577 -0.0000000), wk = 0.0026178 k( 231) = ( -0.3291132 0.6708868 0.0000000), wk = 0.0026178 k( 232) = ( -0.3227840 0.6772160 0.0000000), wk = 0.0026178 k( 233) = ( -0.3164549 0.6835451 0.0000000), wk = 0.0026178 k( 234) = ( -0.3101258 0.6898742 -0.0000000), wk = 0.0026178 k( 235) = ( -0.3037966 0.6962034 -0.0000000), wk = 0.0026178 k( 236) = ( -0.2974675 0.7025325 -0.0000000), wk = 0.0026178 k( 237) = ( -0.2911383 0.7088617 0.0000000), wk = 0.0026178 k( 238) = ( -0.2848092 0.7151908 0.0000000), wk = 0.0026178 k( 239) = ( -0.2784800 0.7215200 -0.0000000), wk = 0.0026178 k( 240) = ( -0.2721509 0.7278491 0.0000000), wk = 0.0026178 k( 241) = ( -0.2658218 0.7341782 -0.0000000), wk = 0.0026178 k( 242) = ( -0.2594926 0.7405074 0.0000000), wk = 0.0026178 k( 243) = ( -0.2594926 0.7405074 0.0000000), wk = 0.0026178 k( 244) = ( -0.2594926 0.7405074 0.0121951), wk = 0.0026178 k( 245) = ( -0.2594926 0.7405074 0.0243902), wk = 0.0026178 k( 246) = ( -0.2594926 0.7405074 0.0365854), wk = 0.0026178 k( 247) = ( -0.2594926 0.7405074 0.0487805), wk = 0.0026178 k( 248) = ( -0.2594926 0.7405074 0.0609756), wk = 0.0026178 k( 249) = ( -0.2594926 0.7405074 0.0731707), wk = 0.0026178 k( 250) = ( -0.2594926 0.7405074 0.0853659), wk = 0.0026178 k( 251) = ( -0.2594926 0.7405074 0.0975610), wk = 0.0026178 k( 252) = ( -0.2594926 0.7405074 0.1097561), wk = 0.0026178 k( 253) = ( -0.2594926 0.7405074 0.1219512), wk = 0.0026178 k( 254) = ( -0.2594926 0.7405074 0.1341463), wk = 0.0026178 k( 255) = ( -0.2594926 0.7405074 0.1463415), wk = 0.0026178 k( 256) = ( -0.2594926 0.7405074 0.1585366), wk = 0.0026178 k( 257) = ( -0.2594926 0.7405074 0.1707317), wk = 0.0026178 k( 258) = ( -0.2594926 0.7405074 0.1829268), wk = 0.0026178 k( 259) = ( -0.2594926 0.7405074 0.1951220), wk = 0.0026178 k( 260) = ( -0.2594926 0.7405074 0.2073171), wk = 0.0026178 k( 261) = ( -0.2594926 0.7405074 0.2195122), wk = 0.0026178 k( 262) = ( -0.2594926 0.7405074 0.2317073), wk = 0.0026178 k( 263) = ( -0.2594926 0.7405074 0.2439024), wk = 0.0026178 k( 264) = ( -0.2594926 0.7405074 0.2560976), wk = 0.0026178 k( 265) = ( -0.2594926 0.7405074 0.2682927), wk = 0.0026178 k( 266) = ( -0.2594926 0.7405074 0.2804878), wk = 0.0026178 k( 267) = ( -0.2594926 0.7405074 0.2926829), wk = 0.0026178 k( 268) = ( -0.2594926 0.7405074 0.3048781), wk = 0.0026178 k( 269) = ( -0.2594926 0.7405074 0.3170732), wk = 0.0026178 k( 270) = ( -0.2594926 0.7405074 0.3292683), wk = 0.0026178 k( 271) = ( -0.2594926 0.7405074 0.3414634), wk = 0.0026178 k( 272) = ( -0.2594926 0.7405074 0.3536585), wk = 0.0026178 k( 273) = ( -0.2594926 0.7405074 0.3658537), wk = 0.0026178 k( 274) = ( -0.2594926 0.7405074 0.3780488), wk = 0.0026178 k( 275) = ( -0.2594926 0.7405074 0.3902439), wk = 0.0026178 k( 276) = ( -0.2594926 0.7405074 0.4024390), wk = 0.0026178 k( 277) = ( -0.2594926 0.7405074 0.4146342), wk = 0.0026178 k( 278) = ( -0.2594926 0.7405074 0.4268293), wk = 0.0026178 k( 279) = ( -0.2594926 0.7405074 0.4390244), wk = 0.0026178 k( 280) = ( -0.2594926 0.7405074 0.4512195), wk = 0.0026178 k( 281) = ( -0.2594926 0.7405074 0.4634146), wk = 0.0026178 k( 282) = ( -0.2594926 0.7405074 0.4756098), wk = 0.0026178 k( 283) = ( -0.2594926 0.7405074 0.4878049), wk = 0.0026178 k( 284) = ( -0.2594926 0.7405074 0.5000000), wk = 0.0026178 k( 285) = ( -0.2594926 0.7405074 0.5000000), wk = 0.0026178 k( 286) = ( -0.2658218 0.7341782 0.5000000), wk = 0.0026178 k( 287) = ( -0.2721509 0.7278491 0.5000000), wk = 0.0026178 k( 288) = ( -0.2784800 0.7215200 0.5000000), wk = 0.0026178 k( 289) = ( -0.2848092 0.7151908 0.5000000), wk = 0.0026178 k( 290) = ( -0.2911383 0.7088617 0.5000000), wk = 0.0026178 k( 291) = ( -0.2974675 0.7025325 0.5000000), wk = 0.0026178 k( 292) = ( -0.3037966 0.6962034 0.5000000), wk = 0.0026178 k( 293) = ( -0.3101258 0.6898742 0.5000000), wk = 0.0026178 k( 294) = ( -0.3164549 0.6835451 0.5000000), wk = 0.0026178 k( 295) = ( -0.3227840 0.6772160 0.5000000), wk = 0.0026178 k( 296) = ( -0.3291132 0.6708868 0.5000000), wk = 0.0026178 k( 297) = ( -0.3354423 0.6645577 0.5000000), wk = 0.0026178 k( 298) = ( -0.3417715 0.6582285 0.5000000), wk = 0.0026178 k( 299) = ( -0.3481006 0.6518994 0.5000000), wk = 0.0026178 k( 300) = ( -0.3544297 0.6455703 0.5000000), wk = 0.0026178 k( 301) = ( -0.3607589 0.6392411 0.5000000), wk = 0.0026178 k( 302) = ( -0.3670880 0.6329120 0.5000000), wk = 0.0026178 k( 303) = ( -0.3734172 0.6265828 0.5000000), wk = 0.0026178 k( 304) = ( -0.3797463 0.6202537 0.5000000), wk = 0.0026178 k( 305) = ( -0.3860754 0.6139246 0.5000000), wk = 0.0026178 k( 306) = ( -0.3924046 0.6075954 0.5000000), wk = 0.0026178 k( 307) = ( -0.3987337 0.6012663 0.5000000), wk = 0.0026178 k( 308) = ( -0.4050629 0.5949371 0.5000000), wk = 0.0026178 k( 309) = ( -0.4113920 0.5886080 0.5000000), wk = 0.0026178 k( 310) = ( -0.4177212 0.5822788 0.5000000), wk = 0.0026178 k( 311) = ( -0.4240503 0.5759497 0.5000000), wk = 0.0026178 k( 312) = ( -0.4303794 0.5696206 0.5000000), wk = 0.0026178 k( 313) = ( -0.4367086 0.5632914 0.5000000), wk = 0.0026178 k( 314) = ( -0.4430377 0.5569623 0.5000000), wk = 0.0026178 k( 315) = ( -0.4493669 0.5506331 0.5000000), wk = 0.0026178 k( 316) = ( -0.4556960 0.5443040 0.5000000), wk = 0.0026178 k( 317) = ( -0.4620251 0.5379749 0.5000000), wk = 0.0026178 k( 318) = ( -0.4683543 0.5316457 0.5000000), wk = 0.0026178 k( 319) = ( -0.4746834 0.5253166 0.5000000), wk = 0.0026178 k( 320) = ( -0.4810126 0.5189874 0.5000000), wk = 0.0026178 k( 321) = ( -0.4873417 0.5126583 0.5000000), wk = 0.0026178 k( 322) = ( -0.4936709 0.5063291 0.5000000), wk = 0.0026178 k( 323) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026178 k( 324) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026178 k( 325) = ( -0.5000000 0.5000000 0.4878049), wk = 0.0026178 k( 326) = ( -0.5000000 0.5000000 0.4756098), wk = 0.0026178 k( 327) = ( -0.5000000 0.5000000 0.4634146), wk = 0.0026178 k( 328) = ( -0.5000000 0.5000000 0.4512195), wk = 0.0026178 k( 329) = ( -0.5000000 0.5000000 0.4390244), wk = 0.0026178 k( 330) = ( -0.5000000 0.5000000 0.4268293), wk = 0.0026178 k( 331) = ( -0.5000000 0.5000000 0.4146342), wk = 0.0026178 k( 332) = ( -0.5000000 0.5000000 0.4024390), wk = 0.0026178 k( 333) = ( -0.5000000 0.5000000 0.3902439), wk = 0.0026178 k( 334) = ( -0.5000000 0.5000000 0.3780488), wk = 0.0026178 k( 335) = ( -0.5000000 0.5000000 0.3658537), wk = 0.0026178 k( 336) = ( -0.5000000 0.5000000 0.3536585), wk = 0.0026178 k( 337) = ( -0.5000000 0.5000000 0.3414634), wk = 0.0026178 k( 338) = ( -0.5000000 0.5000000 0.3292683), wk = 0.0026178 k( 339) = ( -0.5000000 0.5000000 0.3170732), wk = 0.0026178 k( 340) = ( -0.5000000 0.5000000 0.3048781), wk = 0.0026178 k( 341) = ( -0.5000000 0.5000000 0.2926829), wk = 0.0026178 k( 342) = ( -0.5000000 0.5000000 0.2804878), wk = 0.0026178 k( 343) = ( -0.5000000 0.5000000 0.2682927), wk = 0.0026178 k( 344) = ( -0.5000000 0.5000000 0.2560976), wk = 0.0026178 k( 345) = ( -0.5000000 0.5000000 0.2439024), wk = 0.0026178 k( 346) = ( -0.5000000 0.5000000 0.2317073), wk = 0.0026178 k( 347) = ( -0.5000000 0.5000000 0.2195122), wk = 0.0026178 k( 348) = ( -0.5000000 0.5000000 0.2073171), wk = 0.0026178 k( 349) = ( -0.5000000 0.5000000 0.1951220), wk = 0.0026178 k( 350) = ( -0.5000000 0.5000000 0.1829268), wk = 0.0026178 k( 351) = ( -0.5000000 0.5000000 0.1707317), wk = 0.0026178 k( 352) = ( -0.5000000 0.5000000 0.1585366), wk = 0.0026178 k( 353) = ( -0.5000000 0.5000000 0.1463415), wk = 0.0026178 k( 354) = ( -0.5000000 0.5000000 0.1341463), wk = 0.0026178 k( 355) = ( -0.5000000 0.5000000 0.1219512), wk = 0.0026178 k( 356) = ( -0.5000000 0.5000000 0.1097561), wk = 0.0026178 k( 357) = ( -0.5000000 0.5000000 0.0975610), wk = 0.0026178 k( 358) = ( -0.5000000 0.5000000 0.0853659), wk = 0.0026178 k( 359) = ( -0.5000000 0.5000000 0.0731707), wk = 0.0026178 k( 360) = ( -0.5000000 0.5000000 0.0609756), wk = 0.0026178 k( 361) = ( -0.5000000 0.5000000 0.0487805), wk = 0.0026178 k( 362) = ( -0.5000000 0.5000000 0.0365854), wk = 0.0026178 k( 363) = ( -0.5000000 0.5000000 0.0243902), wk = 0.0026178 k( 364) = ( -0.5000000 0.5000000 0.0121951), wk = 0.0026178 k( 365) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0026178 k( 366) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026178 k( 367) = ( -0.0312500 0.0312500 0.5000000), wk = 0.0026178 k( 368) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0026178 k( 369) = ( -0.0937500 0.0937500 0.5000000), wk = 0.0026178 k( 370) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0026178 k( 371) = ( -0.1562500 0.1562500 0.5000000), wk = 0.0026178 k( 372) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0026178 k( 373) = ( -0.2187500 0.2187500 0.5000000), wk = 0.0026178 k( 374) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0026178 k( 375) = ( -0.2812500 0.2812500 0.5000000), wk = 0.0026178 k( 376) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0026178 k( 377) = ( -0.3437500 0.3437500 0.5000000), wk = 0.0026178 k( 378) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0026178 k( 379) = ( -0.4062500 0.4062500 0.5000000), wk = 0.0026178 k( 380) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0026178 k( 381) = ( -0.4687500 0.4687500 0.5000000), wk = 0.0026178 k( 382) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026178 Dense grid: 77899 G-vectors FFT dimensions: ( 108, 108, 40) Smooth grid: 36649 G-vectors FFT dimensions: ( 80, 80, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 276, 56) NL pseudopotentials 0.32 Mb ( 138, 152) Each V/rho on FFT grid 0.36 Mb ( 23328) Each G-vector array 0.02 Mb ( 2164) G-vector shells 0.01 Mb ( 1065) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.94 Mb ( 276, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.26 Mb ( 152, 2, 56) The potential is recalculated from file : ./YGe3.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.9 secs Computing kpt #: 2 total cpu time spent up to now is 3.8 secs Computing kpt #: 3 total cpu time spent up to now is 4.7 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.4 secs Computing kpt #: 6 total cpu time spent up to now is 7.3 secs Computing kpt #: 7 total cpu time spent up to now is 8.1 secs Computing kpt #: 8 total cpu time spent up to now is 8.9 secs Computing kpt #: 9 total cpu time spent up to now is 9.8 secs Computing kpt #: 10 total cpu time spent up to now is 10.6 secs Computing kpt #: 11 total cpu time spent up to now is 11.4 secs Computing kpt #: 12 total cpu time spent up to now is 12.2 secs Computing kpt #: 13 total cpu time spent up to now is 13.0 secs Computing kpt #: 14 total cpu time spent up to now is 13.9 secs Computing kpt #: 15 total cpu time spent up to now is 14.7 secs Computing kpt #: 16 total cpu time spent up to now is 15.5 secs Computing kpt #: 17 total cpu time spent up to now is 16.3 secs Computing kpt #: 18 total cpu time spent up to now is 17.1 secs Computing kpt #: 19 total cpu time spent up to now is 17.9 secs Computing kpt #: 20 total cpu time spent up to now is 18.7 secs Computing kpt #: 21 total cpu time spent up to now is 19.5 secs Computing kpt #: 22 total cpu time spent up to now is 20.2 secs Computing kpt #: 23 total cpu time spent up to now is 21.1 secs Computing kpt #: 24 total cpu time spent up to now is 21.9 secs Computing kpt #: 25 total cpu time spent up to now is 22.7 secs Computing kpt #: 26 total cpu time spent up to now is 23.5 secs Computing kpt #: 27 total cpu time spent up to now is 24.3 secs Computing kpt #: 28 total cpu time spent up to now is 25.1 secs Computing kpt #: 29 total cpu time spent up to now is 25.8 secs Computing kpt #: 30 total cpu time spent up to now is 26.4 secs Computing kpt #: 31 total cpu time spent up to now is 27.1 secs Computing kpt #: 32 total cpu time spent up to now is 27.7 secs Computing kpt #: 33 total cpu time spent up to now is 28.5 secs Computing kpt #: 34 total cpu time spent up to now is 29.4 secs Computing kpt #: 35 total cpu time spent up to now is 30.2 secs Computing kpt #: 36 total cpu time spent up to now is 31.0 secs Computing kpt #: 37 total cpu time spent up to now is 31.8 secs Computing kpt #: 38 total cpu time spent up to now is 32.6 secs Computing kpt #: 39 total cpu time spent up to now is 33.4 secs Computing kpt #: 40 total cpu time spent up to now is 34.3 secs Computing kpt #: 41 total cpu time spent up to now is 35.1 secs Computing kpt #: 42 total cpu time spent up to now is 36.0 secs Computing kpt #: 43 total cpu time spent up to now is 36.8 secs Computing kpt #: 44 total cpu time spent up to now is 37.6 secs Computing kpt #: 45 total cpu time spent up to now is 38.5 secs Computing kpt #: 46 total cpu time spent up to now is 39.3 secs Computing kpt #: 47 total cpu time spent up to now is 40.2 secs Computing kpt #: 48 total cpu time spent up to now is 41.0 secs Computing kpt #: 49 total cpu time spent up to now is 41.8 secs Computing kpt #: 50 total cpu time spent up to now is 42.5 secs Computing kpt #: 51 total cpu time spent up to now is 43.2 secs Computing kpt #: 52 total cpu time spent up to now is 43.9 secs Computing kpt #: 53 total cpu time spent up to now is 44.6 secs Computing kpt #: 54 total cpu time spent up to now is 45.2 secs Computing kpt #: 55 total cpu time spent up to now is 46.0 secs Computing kpt #: 56 total cpu time spent up to now is 46.8 secs Computing kpt #: 57 total cpu time spent up to now is 47.5 secs Computing kpt #: 58 total cpu time spent up to now is 48.3 secs Computing kpt #: 59 total cpu time spent up to now is 49.1 secs Computing kpt #: 60 total cpu time spent up to now is 49.8 secs Computing kpt #: 61 total cpu time spent up to now is 50.6 secs Computing kpt #: 62 total cpu time spent up to now is 51.4 secs Computing kpt #: 63 total cpu time spent up to now is 52.3 secs Computing kpt #: 64 total cpu time spent up to now is 53.1 secs Computing kpt #: 65 total cpu time spent up to now is 53.8 secs Computing kpt #: 66 total cpu time spent up to now is 54.6 secs Computing kpt #: 67 total cpu time spent up to now is 55.3 secs Computing kpt #: 68 total cpu time spent up to now is 56.1 secs Computing kpt #: 69 total cpu time spent up to now is 56.8 secs Computing kpt #: 70 total cpu time spent up to now is 57.6 secs Computing kpt #: 71 total cpu time spent up to now is 58.3 secs Computing kpt #: 72 total cpu time spent up to now is 59.1 secs Computing kpt #: 73 total cpu time spent up to now is 59.8 secs Computing kpt #: 74 total cpu time spent up to now is 60.6 secs Computing kpt #: 75 total cpu time spent up to now is 61.3 secs Computing kpt #: 76 total cpu time spent up to now is 62.1 secs Computing kpt #: 77 total cpu time spent up to now is 62.9 secs Computing kpt #: 78 total cpu time spent up to now is 64.1 secs Computing kpt #: 79 total cpu time spent up to now is 64.9 secs Computing kpt #: 80 total cpu time spent up to now is 65.8 secs Computing kpt #: 81 total cpu time spent up to now is 66.6 secs Computing kpt #: 82 total cpu time spent up to now is 67.4 secs Computing kpt #: 83 total cpu time spent up to now is 68.2 secs Computing kpt #: 84 total cpu time spent up to now is 69.0 secs Computing kpt #: 85 total cpu time spent up to now is 69.8 secs Computing kpt #: 86 total cpu time spent up to now is 70.5 secs Computing kpt #: 87 total cpu time spent up to now is 71.1 secs Computing kpt #: 88 total cpu time spent up to now is 71.7 secs Computing kpt #: 89 total cpu time spent up to now is 72.4 secs Computing kpt #: 90 total cpu time spent up to now is 73.0 secs Computing kpt #: 91 total cpu time spent up to now is 73.6 secs Computing kpt #: 92 total cpu time spent up to now is 74.2 secs Computing kpt #: 93 total cpu time spent up to now is 74.9 secs Computing kpt #: 94 total cpu time spent up to now is 75.5 secs Computing kpt #: 95 total cpu time spent up to now is 76.1 secs Computing kpt #: 96 total cpu time spent up to now is 76.8 secs Computing kpt #: 97 total cpu time spent up to now is 77.4 secs Computing kpt #: 98 total cpu time spent up to now is 78.0 secs Computing kpt #: 99 total cpu time spent up to now is 78.6 secs Computing kpt #: 100 total cpu time spent up to now is 79.3 secs Computing kpt #: 101 total cpu time spent up to now is 79.9 secs Computing kpt #: 102 total cpu time spent up to now is 80.5 secs Computing kpt #: 103 total cpu time spent up to now is 81.1 secs Computing kpt #: 104 total cpu time spent up to now is 81.8 secs Computing kpt #: 105 total cpu time spent up to now is 82.4 secs Computing kpt #: 106 total cpu time spent up to now is 83.0 secs Computing kpt #: 107 total cpu time spent up to now is 83.7 secs Computing kpt #: 108 total cpu time spent up to now is 84.3 secs Computing kpt #: 109 total cpu time spent up to now is 85.0 secs Computing kpt #: 110 total cpu time spent up to now is 85.7 secs Computing kpt #: 111 total cpu time spent up to now is 86.5 secs Computing kpt #: 112 total cpu time spent up to now is 87.1 secs Computing kpt #: 113 total cpu time spent up to now is 87.9 secs Computing kpt #: 114 total cpu time spent up to now is 88.7 secs Computing kpt #: 115 total cpu time spent up to now is 89.4 secs Computing kpt #: 116 total cpu time spent up to now is 90.1 secs Computing kpt #: 117 total cpu time spent up to now is 90.7 secs Computing kpt #: 118 total cpu time spent up to now is 91.4 secs Computing kpt #: 119 total cpu time spent up to now is 92.0 secs Computing kpt #: 120 total cpu time spent up to now is 92.7 secs Computing kpt #: 121 total cpu time spent up to now is 93.3 secs Computing kpt #: 122 total cpu time spent up to now is 93.9 secs Computing kpt #: 123 total cpu time spent up to now is 94.5 secs Computing kpt #: 124 total cpu time spent up to now is 95.1 secs Computing kpt #: 125 total cpu time spent up to now is 95.6 secs Computing kpt #: 126 total cpu time spent up to now is 96.2 secs Computing kpt #: 127 total cpu time spent up to now is 96.8 secs Computing kpt #: 128 total cpu time spent up to now is 97.4 secs Computing kpt #: 129 total cpu time spent up to now is 98.0 secs Computing kpt #: 130 total cpu time spent up to now is 98.7 secs Computing kpt #: 131 total cpu time spent up to now is 99.3 secs Computing kpt #: 132 total cpu time spent up to now is 100.1 secs Computing kpt #: 133 total cpu time spent up to now is 100.9 secs Computing kpt #: 134 total cpu time spent up to now is 101.6 secs Computing kpt #: 135 total cpu time spent up to now is 102.3 secs Computing kpt #: 136 total cpu time spent up to now is 102.9 secs Computing kpt #: 137 total cpu time spent up to now is 103.5 secs Computing kpt #: 138 total cpu time spent up to now is 104.1 secs Computing kpt #: 139 total cpu time spent up to now is 104.7 secs Computing kpt #: 140 total cpu time spent up to now is 105.3 secs Computing kpt #: 141 total cpu time spent up to now is 105.8 secs Computing kpt #: 142 total cpu time spent up to now is 106.4 secs Computing kpt #: 143 total cpu time spent up to now is 107.0 secs Computing kpt #: 144 total cpu time spent up to now is 107.5 secs Computing kpt #: 145 total cpu time spent up to now is 108.1 secs Computing kpt #: 146 total cpu time spent up to now is 108.7 secs Computing kpt #: 147 total cpu time spent up to now is 109.2 secs Computing kpt #: 148 total cpu time spent up to now is 109.9 secs Computing kpt #: 149 total cpu time spent up to now is 110.5 secs Computing kpt #: 150 total cpu time spent up to now is 111.1 secs Computing kpt #: 151 total cpu time spent up to now is 111.7 secs Computing kpt #: 152 total cpu time spent up to now is 112.3 secs Computing kpt #: 153 total cpu time spent up to now is 112.9 secs Computing kpt #: 154 total cpu time spent up to now is 113.6 secs Computing kpt #: 155 total cpu time spent up to now is 114.2 secs Computing kpt #: 156 total cpu time spent up to now is 115.0 secs Computing kpt #: 157 total cpu time spent up to now is 115.8 secs Computing kpt #: 158 total cpu time spent up to now is 116.6 secs Computing kpt #: 159 total cpu time spent up to now is 117.7 secs Computing kpt #: 160 total cpu time spent up to now is 119.0 secs Computing kpt #: 161 total cpu time spent up to now is 120.8 secs Computing kpt #: 162 total cpu time spent up to now is 121.9 secs Computing kpt #: 163 total cpu time spent up to now is 122.9 secs Computing kpt #: 164 total cpu time spent up to now is 124.0 secs Computing kpt #: 165 total cpu time spent up to now is 125.4 secs Computing kpt #: 166 total cpu time spent up to now is 126.5 secs Computing kpt #: 167 total cpu time spent up to now is 127.4 secs Computing kpt #: 168 total cpu time spent up to now is 128.3 secs Computing kpt #: 169 total cpu time spent up to now is 129.2 secs Computing kpt #: 170 total cpu time spent up to now is 130.0 secs Computing kpt #: 171 total cpu time spent up to now is 130.8 secs Computing kpt #: 172 total cpu time spent up to now is 131.5 secs Computing kpt #: 173 total cpu time spent up to now is 132.3 secs Computing kpt #: 174 total cpu time spent up to now is 133.0 secs Computing kpt #: 175 total cpu time spent up to now is 133.8 secs Computing kpt #: 176 total cpu time spent up to now is 134.6 secs Computing kpt #: 177 total cpu time spent up to now is 135.4 secs Computing kpt #: 178 total cpu time spent up to now is 136.1 secs Computing kpt #: 179 total cpu time spent up to now is 137.0 secs Computing kpt #: 180 total cpu time spent up to now is 137.7 secs Computing kpt #: 181 total cpu time spent up to now is 138.6 secs Computing kpt #: 182 total cpu time spent up to now is 139.5 secs Computing kpt #: 183 total cpu time spent up to now is 140.3 secs Computing kpt #: 184 total cpu time spent up to now is 141.3 secs Computing kpt #: 185 total cpu time spent up to now is 142.3 secs Computing kpt #: 186 total cpu time spent up to now is 143.2 secs Computing kpt #: 187 total cpu time spent up to now is 144.3 secs Computing kpt #: 188 total cpu time spent up to now is 145.3 secs Computing kpt #: 189 total cpu time spent up to now is 146.2 secs Computing kpt #: 190 total cpu time spent up to now is 147.1 secs Computing kpt #: 191 total cpu time spent up to now is 148.2 secs Computing kpt #: 192 total cpu time spent up to now is 149.4 secs Computing kpt #: 193 total cpu time spent up to now is 150.4 secs Computing kpt #: 194 total cpu time spent up to now is 151.8 secs Computing kpt #: 195 total cpu time spent up to now is 152.8 secs Computing kpt #: 196 total cpu time spent up to now is 153.6 secs Computing kpt #: 197 total cpu time spent up to now is 154.4 secs Computing kpt #: 198 total cpu time spent up to now is 155.2 secs Computing kpt #: 199 total cpu time spent up to now is 156.0 secs Computing kpt #: 200 total cpu time spent up to now is 156.9 secs Computing kpt #: 201 total cpu time spent up to now is 157.8 secs Computing kpt #: 202 total cpu time spent up to now is 158.6 secs Computing kpt #: 203 total cpu time spent up to now is 159.4 secs Computing kpt #: 204 total cpu time spent up to now is 160.2 secs Computing kpt #: 205 total cpu time spent up to now is 161.0 secs Computing kpt #: 206 total cpu time spent up to now is 161.8 secs Computing kpt #: 207 total cpu time spent up to now is 162.5 secs Computing kpt #: 208 total cpu time spent up to now is 163.2 secs Computing kpt #: 209 total cpu time spent up to now is 163.9 secs Computing kpt #: 210 total cpu time spent up to now is 164.6 secs Computing kpt #: 211 total cpu time spent up to now is 165.4 secs Computing kpt #: 212 total cpu time spent up to now is 166.2 secs Computing kpt #: 213 total cpu time spent up to now is 167.0 secs Computing kpt #: 214 total cpu time spent up to now is 167.8 secs Computing kpt #: 215 total cpu time spent up to now is 168.6 secs Computing kpt #: 216 total cpu time spent up to now is 169.4 secs Computing kpt #: 217 total cpu time spent up to now is 170.2 secs Computing kpt #: 218 total cpu time spent up to now is 171.1 secs Computing kpt #: 219 total cpu time spent up to now is 172.1 secs Computing kpt #: 220 total cpu time spent up to now is 173.4 secs Computing kpt #: 221 total cpu time spent up to now is 174.3 secs Computing kpt #: 222 total cpu time spent up to now is 175.1 secs Computing kpt #: 223 total cpu time spent up to now is 175.9 secs Computing kpt #: 224 total cpu time spent up to now is 176.8 secs Computing kpt #: 225 total cpu time spent up to now is 177.8 secs Computing kpt #: 226 total cpu time spent up to now is 178.7 secs Computing kpt #: 227 total cpu time spent up to now is 179.6 secs Computing kpt #: 228 total cpu time spent up to now is 180.4 secs Computing kpt #: 229 total cpu time spent up to now is 181.1 secs Computing kpt #: 230 total cpu time spent up to now is 181.9 secs Computing kpt #: 231 total cpu time spent up to now is 182.7 secs Computing kpt #: 232 total cpu time spent up to now is 183.6 secs Computing kpt #: 233 total cpu time spent up to now is 184.4 secs Computing kpt #: 234 total cpu time spent up to now is 185.2 secs Computing kpt #: 235 total cpu time spent up to now is 186.0 secs Computing kpt #: 236 total cpu time spent up to now is 186.8 secs Computing kpt #: 237 total cpu time spent up to now is 187.6 secs Computing kpt #: 238 total cpu time spent up to now is 188.3 secs Computing kpt #: 239 total cpu time spent up to now is 189.2 secs Computing kpt #: 240 total cpu time spent up to now is 189.9 secs Computing kpt #: 241 total cpu time spent up to now is 190.7 secs Computing kpt #: 242 total cpu time spent up to now is 191.6 secs Computing kpt #: 243 total cpu time spent up to now is 192.5 secs Computing kpt #: 244 total cpu time spent up to now is 193.3 secs Computing kpt #: 245 total cpu time spent up to now is 194.1 secs Computing kpt #: 246 total cpu time spent up to now is 195.0 secs Computing kpt #: 247 total cpu time spent up to now is 195.8 secs Computing kpt #: 248 total cpu time spent up to now is 196.6 secs Computing kpt #: 249 total cpu time spent up to now is 197.4 secs Computing kpt #: 250 total cpu time spent up to now is 198.1 secs Computing kpt #: 251 total cpu time spent up to now is 198.8 secs Computing kpt #: 252 total cpu time spent up to now is 199.5 secs Computing kpt #: 253 total cpu time spent up to now is 200.1 secs Computing kpt #: 254 total cpu time spent up to now is 200.7 secs Computing kpt #: 255 total cpu time spent up to now is 201.3 secs Computing kpt #: 256 total cpu time spent up to now is 201.9 secs Computing kpt #: 257 total cpu time spent up to now is 202.5 secs Computing kpt #: 258 total cpu time spent up to now is 203.1 secs Computing kpt #: 259 total cpu time spent up to now is 203.6 secs Computing kpt #: 260 total cpu time spent up to now is 204.2 secs Computing kpt #: 261 total cpu time spent up to now is 204.8 secs Computing kpt #: 262 total cpu time spent up to now is 205.4 secs Computing kpt #: 263 total cpu time spent up to now is 206.0 secs Computing kpt #: 264 total cpu time spent up to now is 206.5 secs Computing kpt #: 265 total cpu time spent up to now is 207.1 secs Computing kpt #: 266 total cpu time spent up to now is 207.7 secs Computing kpt #: 267 total cpu time spent up to now is 208.4 secs Computing kpt #: 268 total cpu time spent up to now is 209.0 secs Computing kpt #: 269 total cpu time spent up to now is 209.6 secs Computing kpt #: 270 total cpu time spent up to now is 210.2 secs Computing kpt #: 271 total cpu time spent up to now is 210.9 secs Computing kpt #: 272 total cpu time spent up to now is 211.5 secs Computing kpt #: 273 total cpu time spent up to now is 212.2 secs Computing kpt #: 274 total cpu time spent up to now is 212.9 secs Computing kpt #: 275 total cpu time spent up to now is 213.8 secs Computing kpt #: 276 total cpu time spent up to now is 214.6 secs Computing kpt #: 277 total cpu time spent up to now is 215.4 secs Computing kpt #: 278 total cpu time spent up to now is 216.2 secs Computing kpt #: 279 total cpu time spent up to now is 216.9 secs Computing kpt #: 280 total cpu time spent up to now is 217.7 secs Computing kpt #: 281 total cpu time spent up to now is 218.3 secs Computing kpt #: 282 total cpu time spent up to now is 218.9 secs Computing kpt #: 283 total cpu time spent up to now is 219.6 secs Computing kpt #: 284 total cpu time spent up to now is 220.2 secs Computing kpt #: 285 total cpu time spent up to now is 220.8 secs Computing kpt #: 286 total cpu time spent up to now is 221.5 secs Computing kpt #: 287 total cpu time spent up to now is 222.1 secs Computing kpt #: 288 total cpu time spent up to now is 222.7 secs Computing kpt #: 289 total cpu time spent up to now is 223.3 secs Computing kpt #: 290 total cpu time spent up to now is 224.0 secs Computing kpt #: 291 total cpu time spent up to now is 224.6 secs Computing kpt #: 292 total cpu time spent up to now is 225.2 secs Computing kpt #: 293 total cpu time spent up to now is 225.8 secs Computing kpt #: 294 total cpu time spent up to now is 226.4 secs Computing kpt #: 295 total cpu time spent up to now is 227.1 secs Computing kpt #: 296 total cpu time spent up to now is 227.8 secs Computing kpt #: 297 total cpu time spent up to now is 228.5 secs Computing kpt #: 298 total cpu time spent up to now is 229.3 secs Computing kpt #: 299 total cpu time spent up to now is 230.0 secs Computing kpt #: 300 total cpu time spent up to now is 230.9 secs Computing kpt #: 301 total cpu time spent up to now is 231.8 secs Computing kpt #: 302 total cpu time spent up to now is 232.7 secs Computing kpt #: 303 total cpu time spent up to now is 233.5 secs Computing kpt #: 304 total cpu time spent up to now is 234.3 secs Computing kpt #: 305 total cpu time spent up to now is 235.1 secs Computing kpt #: 306 total cpu time spent up to now is 235.9 secs Computing kpt #: 307 total cpu time spent up to now is 236.6 secs Computing kpt #: 308 total cpu time spent up to now is 237.3 secs Computing kpt #: 309 total cpu time spent up to now is 237.9 secs Computing kpt #: 310 total cpu time spent up to now is 238.5 secs Computing kpt #: 311 total cpu time spent up to now is 239.1 secs Computing kpt #: 312 total cpu time spent up to now is 239.7 secs Computing kpt #: 313 total cpu time spent up to now is 240.2 secs Computing kpt #: 314 total cpu time spent up to now is 240.8 secs Computing kpt #: 315 total cpu time spent up to now is 241.3 secs Computing kpt #: 316 total cpu time spent up to now is 241.9 secs Computing kpt #: 317 total cpu time spent up to now is 242.4 secs Computing kpt #: 318 total cpu time spent up to now is 243.0 secs Computing kpt #: 319 total cpu time spent up to now is 243.5 secs Computing kpt #: 320 total cpu time spent up to now is 244.1 secs Computing kpt #: 321 total cpu time spent up to now is 244.7 secs Computing kpt #: 322 total cpu time spent up to now is 245.2 secs Computing kpt #: 323 total cpu time spent up to now is 245.8 secs Computing kpt #: 324 total cpu time spent up to now is 246.3 secs Computing kpt #: 325 total cpu time spent up to now is 246.9 secs Computing kpt #: 326 total cpu time spent up to now is 247.5 secs Computing kpt #: 327 total cpu time spent up to now is 248.1 secs Computing kpt #: 328 total cpu time spent up to now is 248.7 secs Computing kpt #: 329 total cpu time spent up to now is 249.5 secs Computing kpt #: 330 total cpu time spent up to now is 250.2 secs Computing kpt #: 331 total cpu time spent up to now is 250.8 secs Computing kpt #: 332 total cpu time spent up to now is 251.3 secs Computing kpt #: 333 total cpu time spent up to now is 251.9 secs Computing kpt #: 334 total cpu time spent up to now is 252.5 secs Computing kpt #: 335 total cpu time spent up to now is 253.0 secs Computing kpt #: 336 total cpu time spent up to now is 253.6 secs Computing kpt #: 337 total cpu time spent up to now is 254.2 secs Computing kpt #: 338 total cpu time spent up to now is 254.8 secs Computing kpt #: 339 total cpu time spent up to now is 255.5 secs Computing kpt #: 340 total cpu time spent up to now is 256.3 secs Computing kpt #: 341 total cpu time spent up to now is 257.1 secs Computing kpt #: 342 total cpu time spent up to now is 257.9 secs Computing kpt #: 343 total cpu time spent up to now is 258.6 secs Computing kpt #: 344 total cpu time spent up to now is 259.3 secs Computing kpt #: 345 total cpu time spent up to now is 260.2 secs Computing kpt #: 346 total cpu time spent up to now is 261.0 secs Computing kpt #: 347 total cpu time spent up to now is 261.6 secs Computing kpt #: 348 total cpu time spent up to now is 262.3 secs Computing kpt #: 349 total cpu time spent up to now is 262.9 secs Computing kpt #: 350 total cpu time spent up to now is 263.5 secs Computing kpt #: 351 total cpu time spent up to now is 264.2 secs Computing kpt #: 352 total cpu time spent up to now is 264.8 secs Computing kpt #: 353 total cpu time spent up to now is 265.5 secs Computing kpt #: 354 total cpu time spent up to now is 266.2 secs Computing kpt #: 355 total cpu time spent up to now is 266.8 secs Computing kpt #: 356 total cpu time spent up to now is 267.6 secs Computing kpt #: 357 total cpu time spent up to now is 268.4 secs Computing kpt #: 358 total cpu time spent up to now is 269.2 secs Computing kpt #: 359 total cpu time spent up to now is 270.2 secs Computing kpt #: 360 total cpu time spent up to now is 271.5 secs Computing kpt #: 361 total cpu time spent up to now is 272.5 secs Computing kpt #: 362 total cpu time spent up to now is 273.5 secs Computing kpt #: 363 total cpu time spent up to now is 274.4 secs Computing kpt #: 364 total cpu time spent up to now is 275.3 secs Computing kpt #: 365 total cpu time spent up to now is 276.2 secs Computing kpt #: 366 total cpu time spent up to now is 276.7 secs Computing kpt #: 367 total cpu time spent up to now is 277.3 secs Computing kpt #: 368 total cpu time spent up to now is 277.9 secs Computing kpt #: 369 total cpu time spent up to now is 278.4 secs Computing kpt #: 370 total cpu time spent up to now is 279.0 secs Computing kpt #: 371 total cpu time spent up to now is 279.6 secs Computing kpt #: 372 total cpu time spent up to now is 280.1 secs Computing kpt #: 373 total cpu time spent up to now is 280.7 secs Computing kpt #: 374 total cpu time spent up to now is 281.3 secs Computing kpt #: 375 total cpu time spent up to now is 281.8 secs Computing kpt #: 376 total cpu time spent up to now is 282.4 secs Computing kpt #: 377 total cpu time spent up to now is 282.9 secs Computing kpt #: 378 total cpu time spent up to now is 283.5 secs Computing kpt #: 379 total cpu time spent up to now is 284.0 secs Computing kpt #: 380 total cpu time spent up to now is 284.6 secs Computing kpt #: 381 total cpu time spent up to now is 285.2 secs Computing kpt #: 382 total cpu time spent up to now is 285.7 secs ethr = 2.17E-08, avg # of iterations = 24.1 total cpu time spent up to now is 285.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4575 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3110 -14.3110 -14.2752 -14.2752 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2098 -3.2098 -1.3390 -1.3390 -0.8394 -0.8394 2.0765 2.0765 3.1567 3.1567 4.6470 4.6470 5.7778 5.7778 6.1704 6.1704 6.6414 6.6414 7.6402 7.6402 7.7957 7.7957 7.8599 7.8599 7.8986 7.8986 8.1457 8.1457 8.3612 8.3612 9.5429 9.5429 10.0770 10.0770 11.2761 11.2761 11.5403 11.5403 11.6968 11.6968 k = 0.0063 0.0325-0.0000 ( 4589 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9397 -12.9397 -12.8783 -12.8783 -12.8288 -12.8288 -12.8084 -12.8084 -3.2084 -3.2084 -1.3380 -1.3380 -0.8379 -0.8379 2.0778 2.0778 3.1488 3.1488 4.6471 4.6471 5.7682 5.7682 6.1764 6.1764 6.6430 6.6430 7.6373 7.6373 7.7948 7.7948 7.8595 7.8595 7.8969 7.8969 8.1521 8.1521 8.3627 8.3627 9.5505 9.5505 10.0740 10.0740 11.2584 11.2584 11.5536 11.5536 11.6662 11.6662 k = 0.0127 0.0650-0.0000 ( 4591 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3111 -14.3111 -14.2755 -14.2755 -12.9398 -12.9398 -12.8787 -12.8787 -12.8290 -12.8290 -12.8085 -12.8085 -3.2042 -3.2042 -1.3351 -1.3351 -0.8336 -0.8336 2.0816 2.0816 3.1252 3.1252 4.6474 4.6474 5.7396 5.7396 6.1942 6.1942 6.6476 6.6476 7.6287 7.6287 7.7912 7.7912 7.8578 7.8578 7.8921 7.8921 8.1719 8.1719 8.3673 8.3673 9.5729 9.5729 10.0653 10.0653 11.2116 11.2116 11.5865 11.5865 11.5918 11.5918 k = 0.0190 0.0974-0.0000 ( 4595 PWs) bands (ev): -33.2649 -33.2649 -33.2574 -33.2574 -14.3113 -14.3113 -14.2758 -14.2758 -12.9400 -12.9400 -12.8793 -12.8793 -12.8294 -12.8294 -12.8086 -12.8086 -3.1972 -3.1972 -1.3302 -1.3302 -0.8264 -0.8264 2.0880 2.0880 3.0867 3.0867 4.6478 4.6478 5.6934 5.6934 6.2233 6.2233 6.6553 6.6553 7.6150 7.6150 7.7830 7.7830 7.8544 7.8544 7.8850 7.8850 8.2058 8.2058 8.3753 8.3753 9.6092 9.6092 10.0507 10.0507 11.1460 11.1460 11.4968 11.4968 11.6198 11.6198 k = 0.0253 0.1299-0.0000 ( 4603 PWs) bands (ev): -33.2649 -33.2649 -33.2574 -33.2574 -14.3116 -14.3116 -14.2762 -14.2762 -12.9402 -12.9402 -12.8801 -12.8801 -12.8298 -12.8298 -12.8087 -12.8087 -3.1874 -3.1874 -1.3235 -1.3235 -0.8164 -0.8164 2.0969 2.0969 3.0343 3.0343 4.6483 4.6483 5.6314 5.6314 6.2626 6.2626 6.6662 6.6662 7.5949 7.5949 7.7704 7.7704 7.8490 7.8490 7.8768 7.8768 8.2522 8.2522 8.3877 8.3877 9.6577 9.6577 10.0304 10.0304 11.0680 11.0680 11.3939 11.3939 11.5801 11.5801 k = 0.0316 0.1624-0.0000 ( 4615 PWs) bands (ev): -33.2648 -33.2648 -33.2573 -33.2573 -14.3120 -14.3120 -14.2767 -14.2767 -12.9406 -12.9406 -12.8812 -12.8812 -12.8304 -12.8304 -12.8088 -12.8088 -3.1748 -3.1748 -1.3149 -1.3149 -0.8035 -0.8035 2.1082 2.1082 2.9693 2.9693 4.6487 4.6487 5.5555 5.5555 6.3109 6.3109 6.6802 6.6802 7.5657 7.5657 7.7572 7.7572 7.8416 7.8416 7.8685 7.8685 8.3063 8.3063 8.4075 8.4075 9.7170 9.7170 10.0043 10.0043 10.9817 10.9817 11.2879 11.2879 11.5253 11.5253 k = 0.0380 0.1949-0.0000 ( 4619 PWs) bands (ev): -33.2647 -33.2647 -33.2572 -33.2572 -14.3124 -14.3124 -14.2773 -14.2773 -12.9411 -12.9411 -12.8826 -12.8826 -12.8311 -12.8311 -12.8089 -12.8089 -3.1594 -3.1594 -1.3044 -1.3044 -0.7878 -0.7878 2.1219 2.1219 2.8931 2.8931 4.6488 4.6488 5.4681 5.4681 6.3669 6.3669 6.6975 6.6975 7.5249 7.5249 7.7479 7.7479 7.8319 7.8319 7.8601 7.8601 8.3566 8.3566 8.4432 8.4432 9.7854 9.7854 9.9729 9.9729 10.8902 10.8902 11.1813 11.1813 11.4757 11.4757 k = 0.0443 0.2274-0.0000 ( 4607 PWs) bands (ev): -33.2646 -33.2646 -33.2571 -33.2571 -14.3129 -14.3129 -14.2780 -14.2780 -12.9416 -12.9416 -12.8841 -12.8841 -12.8319 -12.8319 -12.8090 -12.8090 -3.1412 -3.1412 -1.2922 -1.2922 -0.7692 -0.7692 2.1379 2.1379 2.8072 2.8072 4.6484 4.6484 5.3715 5.3715 6.4291 6.4291 6.7183 6.7183 7.4726 7.4726 7.7443 7.7443 7.8202 7.8202 7.8514 7.8514 8.3921 8.3921 8.5036 8.5036 9.8615 9.8615 9.9363 9.9363 10.7962 10.7962 11.0753 11.0753 11.4320 11.4320 k = 0.0506 0.2598-0.0000 ( 4613 PWs) bands (ev): -33.2645 -33.2645 -33.2570 -33.2570 -14.3134 -14.3134 -14.2788 -14.2788 -12.9422 -12.9422 -12.8859 -12.8859 -12.8328 -12.8328 -12.8091 -12.8091 -3.1203 -3.1203 -1.2782 -1.2782 -0.7478 -0.7478 2.1559 2.1559 2.7132 2.7132 4.6469 4.6469 5.2678 5.2678 6.4960 6.4960 6.7427 6.7427 7.4110 7.4110 7.7452 7.7452 7.8076 7.8076 7.8417 7.8417 8.4182 8.4182 8.5808 8.5808 9.8950 9.8950 9.9441 9.9441 10.7018 10.7018 10.9708 10.9708 11.3944 11.3944 k = 0.0570 0.2923-0.0000 ( 4609 PWs) bands (ev): -33.2643 -33.2643 -33.2569 -33.2569 -14.3140 -14.3140 -14.2797 -14.2797 -12.9430 -12.9430 -12.8880 -12.8880 -12.8337 -12.8337 -12.8092 -12.8092 -3.0965 -3.0965 -1.2625 -1.2625 -0.7236 -0.7236 2.1754 2.1754 2.6127 2.6127 4.6434 4.6434 5.1595 5.1595 6.5660 6.5660 6.7713 6.7713 7.3428 7.3428 7.7458 7.7458 7.7969 7.7969 7.8315 7.8315 8.4423 8.4423 8.6658 8.6658 9.8498 9.8498 10.0318 10.0318 10.6089 10.6089 10.8682 10.8682 11.3625 11.3625 k = 0.0633 0.3248-0.0000 ( 4613 PWs) bands (ev): -33.2642 -33.2642 -33.2567 -33.2567 -14.3147 -14.3147 -14.2808 -14.2808 -12.9438 -12.9438 -12.8902 -12.8902 -12.8347 -12.8347 -12.8092 -12.8092 -3.0700 -3.0700 -1.2452 -1.2452 -0.6966 -0.6966 2.1953 2.1953 2.5081 2.5081 4.6360 4.6360 5.0498 5.0498 6.6371 6.6371 6.8050 6.8050 7.2703 7.2703 7.7389 7.7389 7.7895 7.7895 7.8249 7.8249 8.4668 8.4668 8.7549 8.7549 9.8011 9.8011 10.1239 10.1239 10.5194 10.5194 10.7682 10.7682 11.3360 11.3360 k = 0.0696 0.3573-0.0000 ( 4617 PWs) bands (ev): -33.2640 -33.2640 -33.2566 -33.2566 -14.3155 -14.3155 -14.2819 -14.2819 -12.9448 -12.9448 -12.8927 -12.8927 -12.8357 -12.8357 -12.8092 -12.8092 -3.0408 -3.0408 -1.2264 -1.2264 -0.6667 -0.6667 2.2110 2.2110 2.4048 2.4048 4.6204 4.6204 4.9439 4.9439 6.7068 6.7068 6.8454 6.8454 7.1953 7.1953 7.7228 7.7228 7.7764 7.7764 7.8314 7.8314 8.4926 8.4926 8.8459 8.8459 9.7494 9.7494 10.2196 10.2196 10.4348 10.4348 10.6709 10.6709 11.3145 11.3145 k = 0.0759 0.3898-0.0000 ( 4617 PWs) bands (ev): -33.2638 -33.2638 -33.2564 -33.2564 -14.3163 -14.3163 -14.2830 -14.2830 -12.9459 -12.9459 -12.8953 -12.8953 -12.8368 -12.8368 -12.8092 -12.8092 -3.0088 -3.0088 -1.2062 -1.2062 -0.6342 -0.6342 2.1986 2.1986 2.3274 2.3274 4.5873 4.5873 4.8519 4.8519 6.7718 6.7718 6.8949 6.8949 7.1192 7.1192 7.7009 7.7009 7.7543 7.7543 7.8501 7.8501 8.5200 8.5200 8.9377 8.9377 9.6952 9.6952 10.3166 10.3166 10.3579 10.3579 10.5772 10.5772 11.2976 11.2976 k = 0.0823 0.4222-0.0000 ( 4615 PWs) bands (ev): -33.2636 -33.2636 -33.2562 -33.2562 -14.3171 -14.3171 -14.2843 -14.2843 -12.9470 -12.9470 -12.8982 -12.8982 -12.8378 -12.8378 -12.8091 -12.8091 -2.9740 -2.9740 -1.1846 -1.1846 -0.5988 -0.5988 2.1171 2.1171 2.3179 2.3179 4.5235 4.5235 4.7879 4.7879 6.8297 6.8297 6.9551 6.9551 7.0432 7.0432 7.6749 7.6749 7.7262 7.7262 7.8757 7.8757 8.5490 8.5490 9.0295 9.0295 9.6385 9.6385 10.2860 10.2860 10.4140 10.4140 10.4917 10.4917 11.2846 11.2846 k = 0.0886 0.4547-0.0000 ( 4617 PWs) bands (ev): -33.2634 -33.2634 -33.2560 -33.2560 -14.3180 -14.3180 -14.2856 -14.2856 -12.9484 -12.9484 -12.9012 -12.9012 -12.8387 -12.8387 -12.8090 -12.8090 -2.9365 -2.9365 -1.1618 -1.1618 -0.5607 -0.5607 2.0032 2.0032 2.3399 2.3399 4.4278 4.4278 4.7534 4.7534 6.8813 6.8813 6.9682 6.9682 7.0242 7.0242 7.6446 7.6446 7.6944 7.6944 7.9060 7.9060 8.5795 8.5795 9.1205 9.1205 9.5794 9.5794 10.2257 10.2257 10.3920 10.3920 10.5289 10.5289 11.2753 11.2753 k = 0.0949 0.4872-0.0000 ( 4617 PWs) bands (ev): -33.2632 -33.2632 -33.2558 -33.2558 -14.3190 -14.3190 -14.2870 -14.2870 -12.9498 -12.9498 -12.9043 -12.9043 -12.8397 -12.8397 -12.8088 -12.8088 -2.8964 -2.8964 -1.1378 -1.1378 -0.5199 -0.5199 1.8808 1.8808 2.3702 2.3702 4.3128 4.3128 4.7362 4.7362 6.8930 6.8930 6.9320 6.9320 7.0980 7.0980 7.6085 7.6085 7.6619 7.6619 7.9400 7.9400 8.6115 8.6115 9.2100 9.2100 9.5180 9.5180 10.1756 10.1756 10.3113 10.3113 10.6304 10.6304 11.2691 11.2691 k = 0.1013 0.5197-0.0000 ( 4597 PWs) bands (ev): -33.2629 -33.2629 -33.2556 -33.2556 -14.3200 -14.3200 -14.2885 -14.2885 -12.9513 -12.9513 -12.9076 -12.9076 -12.8406 -12.8406 -12.8086 -12.8086 -2.8535 -2.8535 -1.1129 -1.1129 -0.4764 -0.4764 1.7547 1.7547 2.4043 2.4043 4.1885 4.1885 4.7270 4.7270 6.8228 6.8228 6.9790 6.9790 7.1726 7.1726 7.5659 7.5659 7.6311 7.6311 7.9773 7.9773 8.6447 8.6447 9.2974 9.2974 9.4545 9.4545 10.1350 10.1350 10.2352 10.2352 10.7338 10.7338 11.2654 11.2654 k = 0.1076 0.5522-0.0000 ( 4593 PWs) bands (ev): -33.2627 -33.2627 -33.2554 -33.2554 -14.3210 -14.3210 -14.2899 -14.2899 -12.9529 -12.9529 -12.9110 -12.9110 -12.8414 -12.8414 -12.8084 -12.8084 -2.8079 -2.8079 -1.0871 -1.0871 -0.4302 -0.4302 1.6265 1.6265 2.4409 2.4409 4.0594 4.0594 4.7212 4.7212 6.7548 6.7548 7.0270 7.0270 7.2427 7.2427 7.5203 7.5203 7.6029 7.6029 8.0177 8.0177 8.6788 8.6788 9.3750 9.3750 9.3960 9.3960 10.0979 10.0979 10.1718 10.1718 10.8367 10.8367 11.2640 11.2640 k = 0.1139 0.5846-0.0000 ( 4581 PWs) bands (ev): -33.2625 -33.2625 -33.2551 -33.2551 -14.3220 -14.3220 -14.2915 -14.2915 -12.9547 -12.9547 -12.9144 -12.9144 -12.8422 -12.8422 -12.8081 -12.8081 -2.7597 -2.7597 -1.0606 -1.0606 -0.3813 -0.3813 1.4972 1.4972 2.4793 2.4793 3.9279 3.9279 4.7169 4.7169 6.6902 6.6902 7.0754 7.0754 7.2946 7.2946 7.4856 7.4856 7.5774 7.5774 8.0609 8.0609 8.7135 8.7135 9.3201 9.3201 9.4652 9.4652 10.0494 10.0494 10.1364 10.1364 10.9374 10.9374 11.2642 11.2642 k = 0.1203 0.6171-0.0000 ( 4585 PWs) bands (ev): -33.2622 -33.2622 -33.2549 -33.2549 -14.3231 -14.3231 -14.2930 -14.2930 -12.9565 -12.9565 -12.9179 -12.9179 -12.8429 -12.8429 -12.8078 -12.8078 -2.7088 -2.7088 -1.0335 -1.0335 -0.3299 -0.3299 1.3671 1.3671 2.5193 2.5193 3.7952 3.7952 4.7130 4.7130 6.6295 6.6295 7.1237 7.1237 7.2961 7.2961 7.4943 7.4943 7.5551 7.5551 8.1068 8.1068 8.7485 8.7485 9.2531 9.2531 9.5417 9.5417 9.9895 9.9895 10.1287 10.1287 11.0339 11.0339 11.2657 11.2657 k = 0.1266 0.6496-0.0000 ( 4597 PWs) bands (ev): -33.2620 -33.2620 -33.2547 -33.2547 -14.3242 -14.3242 -14.2946 -14.2946 -12.9584 -12.9584 -12.9214 -12.9214 -12.8435 -12.8435 -12.8075 -12.8075 -2.6553 -2.6553 -1.0060 -1.0060 -0.2758 -0.2758 1.2368 1.2368 2.5606 2.5606 3.6619 3.6619 4.7091 4.7091 6.5732 6.5732 7.1705 7.1705 7.2474 7.2474 7.5367 7.5367 7.5471 7.5471 8.1554 8.1554 8.7831 8.7831 9.1870 9.1870 9.6124 9.6124 9.9291 9.9291 10.1375 10.1375 11.1222 11.1222 11.2681 11.2681 k = 0.1329 0.6821-0.0000 ( 4589 PWs) bands (ev): -33.2618 -33.2618 -33.2545 -33.2545 -14.3253 -14.3253 -14.2962 -14.2962 -12.9603 -12.9603 -12.9249 -12.9249 -12.8440 -12.8440 -12.8071 -12.8071 -2.5991 -2.5991 -0.9782 -0.9782 -0.2192 -0.2192 1.1066 1.1066 2.6028 2.6028 3.5286 3.5286 4.7048 4.7048 6.5215 6.5215 7.1782 7.1782 7.2133 7.2133 7.5264 7.5264 7.6129 7.6129 8.2064 8.2064 8.8166 8.8166 9.1235 9.1235 9.6748 9.6748 9.8731 9.8731 10.1582 10.1582 11.1949 11.1949 11.2709 11.2709 k = 0.1392 0.7146-0.0000 ( 4597 PWs) bands (ev): -33.2616 -33.2616 -33.2543 -33.2543 -14.3263 -14.3263 -14.2977 -14.2977 -12.9623 -12.9623 -12.9284 -12.9284 -12.8445 -12.8445 -12.8067 -12.8067 -2.5403 -2.5403 -0.9504 -0.9504 -0.1600 -0.1600 0.9767 0.9767 2.6458 2.6458 3.3957 3.3957 4.6999 4.6999 6.4749 6.4749 7.1008 7.1008 7.2479 7.2479 7.5272 7.5272 7.6806 7.6806 8.2599 8.2599 8.8479 8.8479 9.0647 9.0647 9.7232 9.7232 9.8270 9.8270 10.1885 10.1885 11.2374 11.2374 11.2741 11.2741 k = 0.1456 0.7470-0.0000 ( 4603 PWs) bands (ev): -33.2613 -33.2613 -33.2541 -33.2541 -14.3274 -14.3274 -14.2993 -14.2993 -12.9643 -12.9643 -12.9318 -12.9318 -12.8448 -12.8448 -12.8063 -12.8063 -2.4790 -2.4790 -0.9226 -0.9226 -0.0984 -0.0984 0.8475 0.8475 2.6892 2.6892 3.2635 3.2635 4.6945 4.6945 6.4334 6.4334 7.0193 7.0193 7.2697 7.2697 7.5442 7.5442 7.7453 7.7453 8.3156 8.3156 8.8755 8.8755 9.0133 9.0133 9.7354 9.7354 9.8119 9.8119 10.2269 10.2269 11.2360 11.2360 11.2801 11.2801 k = 0.1519 0.7795-0.0000 ( 4585 PWs) bands (ev): -33.2611 -33.2611 -33.2538 -33.2538 -14.3285 -14.3285 -14.3008 -14.3008 -12.9664 -12.9664 -12.9352 -12.9352 -12.8451 -12.8451 -12.8059 -12.8059 -2.4150 -2.4150 -0.8951 -0.8951 -0.0345 -0.0345 0.7192 0.7192 2.7327 2.7327 3.1322 3.1322 4.6884 4.6884 6.3972 6.3972 6.9356 6.9356 7.2771 7.2771 7.5790 7.5790 7.8037 7.8037 8.3735 8.3735 8.8953 8.8953 8.9747 8.9747 9.7074 9.7074 9.8302 9.8302 10.2722 10.2722 11.2036 11.2036 11.2850 11.2850 k = 0.1582 0.8120-0.0000 ( 4569 PWs) bands (ev): -33.2608 -33.2608 -33.2536 -33.2536 -14.3295 -14.3295 -14.3023 -14.3023 -12.9684 -12.9684 -12.9384 -12.9384 -12.8454 -12.8454 -12.8055 -12.8055 -2.3485 -2.3485 -0.8681 -0.8681 0.0315 0.0315 0.5922 0.5922 2.7759 2.7759 3.0021 3.0021 4.6819 4.6819 6.3665 6.3665 6.8512 6.8512 7.2734 7.2734 7.6285 7.6285 7.8532 7.8532 8.4334 8.4334 8.8989 8.8989 8.9592 8.9592 9.6742 9.6742 9.8456 9.8456 10.3234 10.3234 11.1584 11.1584 11.2869 11.2869 k = 0.1646 0.8445-0.0000 ( 4563 PWs) bands (ev): -33.2606 -33.2606 -33.2534 -33.2534 -14.3305 -14.3305 -14.3038 -14.3038 -12.9703 -12.9703 -12.9416 -12.9416 -12.8456 -12.8456 -12.8051 -12.8051 -2.2794 -2.2794 -0.8418 -0.8418 0.0988 0.0988 0.4675 0.4675 2.8183 2.8183 2.8736 2.8736 4.6751 4.6751 6.3412 6.3412 6.7671 6.7671 7.2629 7.2629 7.6885 7.6885 7.8908 7.8908 8.4953 8.4953 8.8915 8.8915 8.9634 8.9634 9.6448 9.6448 9.8480 9.8480 10.3793 10.3793 11.1084 11.1084 11.2710 11.2710 k = 0.1709 0.8770-0.0000 ( 4547 PWs) bands (ev): -33.2604 -33.2604 -33.2532 -33.2532 -14.3315 -14.3315 -14.3052 -14.3052 -12.9722 -12.9722 -12.9446 -12.9446 -12.8457 -12.8457 -12.8047 -12.8047 -2.2078 -2.2078 -0.8163 -0.8163 0.1636 0.1636 0.3490 0.3490 2.7455 2.7455 2.8607 2.8607 4.6683 4.6683 6.3213 6.3213 6.6843 6.6843 7.2489 7.2489 7.7553 7.7553 7.9147 7.9147 8.5589 8.5589 8.8920 8.8920 8.9701 8.9701 9.6203 9.6203 9.8356 9.8356 10.4387 10.4387 11.0559 11.0559 11.1917 11.1917 k = 0.1772 0.9094-0.0000 ( 4547 PWs) bands (ev): -33.2602 -33.2602 -33.2530 -33.2530 -14.3324 -14.3324 -14.3066 -14.3066 -12.9741 -12.9741 -12.9475 -12.9475 -12.8458 -12.8458 -12.8043 -12.8043 -2.1337 -2.1337 -0.7919 -0.7919 0.1787 0.1787 0.2840 0.2840 2.6199 2.6199 2.9008 2.9008 4.6616 4.6616 6.3065 6.3065 6.6037 6.6037 7.2334 7.2334 7.8255 7.8255 7.9250 7.9250 8.6240 8.6240 8.9077 8.9077 8.9729 8.9729 9.6002 9.6002 9.8088 9.8088 10.5004 10.5004 11.0004 11.0004 11.1031 11.1031 k = 0.1835 0.9419-0.0000 ( 4547 PWs) bands (ev): -33.2600 -33.2600 -33.2528 -33.2528 -14.3333 -14.3333 -14.3078 -14.3078 -12.9758 -12.9758 -12.9501 -12.9501 -12.8458 -12.8458 -12.8040 -12.8040 -2.0571 -2.0571 -0.7688 -0.7688 0.0785 0.0785 0.3381 0.3381 2.4959 2.4959 2.9392 2.9392 4.6555 4.6555 6.2968 6.2968 6.5262 6.5262 7.2176 7.2176 7.8838 7.8838 7.9366 7.9366 8.6903 8.6903 8.9378 8.9378 8.9723 8.9723 9.5827 9.5827 9.7691 9.7691 10.5630 10.5630 10.9418 10.9418 11.0234 11.0234 k = 0.1899 0.9744-0.0000 ( 4551 PWs) bands (ev): -33.2599 -33.2599 -33.2527 -33.2527 -14.3341 -14.3341 -14.3090 -14.3090 -12.9774 -12.9774 -12.9526 -12.9526 -12.8458 -12.8458 -12.8036 -12.8036 -1.9781 -1.9781 -0.7472 -0.7472 -0.0387 -0.0387 0.4132 0.4132 2.3739 2.3739 2.9751 2.9751 4.6502 4.6502 6.2917 6.2917 6.4525 6.4525 7.2022 7.2022 7.8824 7.8824 7.9984 7.9984 8.7574 8.7574 8.9534 8.9534 8.9957 8.9957 9.5659 9.5659 9.7185 9.7185 10.6250 10.6250 10.8817 10.8817 10.9545 10.9545 k = 0.1962 1.0069-0.0000 ( 4543 PWs) bands (ev): -33.2597 -33.2597 -33.2525 -33.2525 -14.3349 -14.3349 -14.3101 -14.3101 -12.9790 -12.9790 -12.9549 -12.9549 -12.8458 -12.8458 -12.8033 -12.8033 -1.8966 -1.8966 -0.7272 -0.7272 -0.1569 -0.1569 0.4932 0.4932 2.2538 2.2538 3.0081 3.0081 4.6463 4.6463 6.2909 6.2909 6.3837 6.3837 7.1877 7.1877 7.8545 7.8545 8.0798 8.0798 8.8246 8.8246 8.9416 8.9416 9.0545 9.0545 9.5472 9.5472 9.6593 9.6593 10.6846 10.6846 10.8212 10.8212 10.8982 10.8982 k = 0.2025 1.0394-0.0000 ( 4538 PWs) bands (ev): -33.2596 -33.2596 -33.2524 -33.2524 -14.3356 -14.3356 -14.3111 -14.3111 -12.9803 -12.9803 -12.9570 -12.9570 -12.8458 -12.8458 -12.8030 -12.8030 -1.8127 -1.8127 -0.7092 -0.7092 -0.2740 -0.2740 0.5763 0.5763 2.1360 2.1360 3.0377 3.0377 4.6440 4.6440 6.2914 6.2914 6.3230 6.3230 7.1744 7.1744 7.8170 7.8170 8.1662 8.1662 8.8897 8.8897 8.9243 8.9243 9.1258 9.1258 9.5248 9.5248 9.5939 9.5939 10.7395 10.7395 10.7592 10.7592 10.8589 10.8589 k = 0.2089 1.0718-0.0000 ( 4534 PWs) bands (ev): -33.2595 -33.2595 -33.2522 -33.2522 -14.3362 -14.3362 -14.3120 -14.3120 -12.9816 -12.9816 -12.9588 -12.9588 -12.8458 -12.8458 -12.8027 -12.8027 -1.7264 -1.7264 -0.6932 -0.6932 -0.3896 -0.3896 0.6619 0.6619 2.0204 2.0204 3.0632 3.0632 4.6438 4.6438 6.2566 6.2566 6.3073 6.3073 7.1625 7.1625 7.7739 7.7739 8.2557 8.2557 8.8960 8.8960 8.9593 8.9593 9.2057 9.2057 9.4977 9.4977 9.5243 9.5243 10.6949 10.6949 10.7868 10.7868 10.8408 10.8408 k = 0.2152 1.1043-0.0000 ( 4540 PWs) bands (ev): -33.2594 -33.2594 -33.2522 -33.2522 -14.3367 -14.3367 -14.3128 -14.3128 -12.9827 -12.9827 -12.9604 -12.9604 -12.8457 -12.8457 -12.8025 -12.8025 -1.6378 -1.6378 -0.6795 -0.6795 -0.5035 -0.5035 0.7500 0.7500 1.9072 1.9072 3.0843 3.0843 4.6460 4.6460 6.2060 6.2060 6.3175 6.3175 7.1522 7.1522 7.7277 7.7277 8.3478 8.3478 8.8680 8.8680 9.0206 9.0206 9.2917 9.2917 9.4532 9.4532 9.4662 9.4662 10.6310 10.6310 10.8171 10.8171 10.8503 10.8503 k = 0.2215 1.1368-0.0000 ( 4550 PWs) bands (ev): -33.2593 -33.2593 -33.2521 -33.2521 -14.3372 -14.3372 -14.3134 -14.3134 -12.9836 -12.9836 -12.9618 -12.9618 -12.8457 -12.8457 -12.8023 -12.8023 -1.5469 -1.5469 -0.6688 -0.6688 -0.6151 -0.6151 0.8403 0.8403 1.7966 1.7966 3.1003 3.1003 4.6509 4.6509 6.1610 6.1610 6.3321 6.3321 7.1436 7.1436 7.6798 7.6798 8.4421 8.4421 8.8345 8.8345 9.0761 9.0761 9.3682 9.3682 9.3981 9.3981 9.4315 9.4315 10.5696 10.5696 10.8376 10.8376 10.8448 10.8448 k = 0.2278 1.1693-0.0000 ( 4550 PWs) bands (ev): -33.2592 -33.2592 -33.2520 -33.2520 -14.3375 -14.3375 -14.3140 -14.3140 -12.9843 -12.9843 -12.9628 -12.9628 -12.8456 -12.8456 -12.8021 -12.8021 -1.4537 -1.4537 -0.7267 -0.7267 -0.6585 -0.6585 0.9329 0.9329 1.6886 1.6886 3.1109 3.1109 4.6590 4.6590 6.1229 6.1229 6.3500 6.3500 7.1369 7.1369 7.6318 7.6318 8.5380 8.5380 8.7956 8.7956 9.1176 9.1176 9.3169 9.3169 9.3960 9.3960 9.4827 9.4827 10.5134 10.5134 10.7680 10.7680 10.8665 10.8665 k = 0.2342 1.2018-0.0000 ( 4548 PWs) bands (ev): -33.2592 -33.2592 -33.2520 -33.2520 -14.3378 -14.3378 -14.3144 -14.3144 -12.9849 -12.9849 -12.9637 -12.9637 -12.8456 -12.8456 -12.8020 -12.8020 -1.3584 -1.3584 -0.8345 -0.8345 -0.6528 -0.6528 1.0275 1.0275 1.5834 1.5834 3.1159 3.1159 4.6704 4.6704 6.0918 6.0918 6.3706 6.3706 7.1320 7.1320 7.5847 7.5847 8.6353 8.6353 8.7508 8.7508 9.1254 9.1254 9.2801 9.2801 9.3627 9.3627 9.5815 9.5815 10.4651 10.4651 10.6888 10.6888 10.9021 10.9021 k = 0.2405 1.2342-0.0000 ( 4556 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3146 -14.3146 -12.9853 -12.9853 -12.9642 -12.9642 -12.8456 -12.8456 -12.8019 -12.8019 -1.2609 -1.2609 -0.9405 -0.9405 -0.6496 -0.6496 1.1241 1.1241 1.4811 1.4811 3.1150 3.1150 4.6854 4.6854 6.0679 6.0679 6.3936 6.3936 7.1290 7.1290 7.5394 7.5394 8.6992 8.6992 8.7336 8.7336 9.0856 9.0856 9.2783 9.2783 9.3359 9.3359 9.6835 9.6835 10.4275 10.4275 10.6104 10.6104 10.9286 10.9286 k = 0.2468 1.2667-0.0000 ( 4554 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1615 -1.1615 -1.0444 -1.0444 -0.6491 -0.6491 1.2225 1.2225 1.3818 1.3818 3.1083 3.1083 4.7043 4.7043 6.0508 6.0508 6.4187 6.4187 7.1281 7.1281 7.4968 7.4968 8.6421 8.6421 8.8310 8.8310 9.0225 9.0225 9.2792 9.2792 9.3235 9.3235 9.7877 9.7877 10.4034 10.4034 10.5348 10.5348 10.9400 10.9400 k = 0.2532 1.2992-0.0000 ( 4554 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1462 -1.1462 -1.0604 -1.0604 -0.6511 -0.6511 1.2855 1.2855 1.3228 1.3228 3.0959 3.0959 4.7272 4.7272 6.0401 6.0401 6.4454 6.4454 7.1290 7.1290 7.4577 7.4577 8.5788 8.5788 8.9231 8.9231 8.9575 8.9575 9.2682 9.2682 9.3216 9.3216 9.8933 9.8933 10.3924 10.3924 10.4668 10.4668 10.9435 10.9435 k = 0.2595 1.3317-0.0000 ( 4554 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9852 -12.9852 -12.9642 -12.9642 -12.8456 -12.8456 -12.8020 -12.8020 -1.2457 -1.2457 -0.9584 -0.9584 -0.6552 -0.6552 1.1926 1.1926 1.4245 1.4245 3.0781 3.0781 4.7542 4.7542 6.0349 6.0349 6.4735 6.4735 7.1320 7.1320 7.4231 7.4231 8.5104 8.5104 8.8800 8.8800 9.0237 9.0237 9.2566 9.2566 9.3136 9.3136 9.9995 9.9995 10.3723 10.3723 10.4323 10.4323 10.9408 10.9408 k = 0.2595 1.3317-0.0000 ( 4554 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9852 -12.9852 -12.9642 -12.9642 -12.8456 -12.8456 -12.8020 -12.8020 -1.2457 -1.2457 -0.9584 -0.9584 -0.6552 -0.6552 1.1926 1.1926 1.4245 1.4245 3.0781 3.0781 4.7542 4.7542 6.0349 6.0349 6.4735 6.4735 7.1320 7.1320 7.4231 7.4231 8.5104 8.5104 8.8800 8.8800 9.0237 9.0237 9.2566 9.2566 9.3136 9.3136 9.9995 9.9995 10.3723 10.3723 10.4323 10.4323 10.9408 10.9408 k = 0.2271 1.3317-0.0000 ( 4555 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9853 -12.9853 -12.9643 -12.9643 -12.8456 -12.8456 -12.8019 -12.8019 -1.2274 -1.2274 -0.9774 -0.9774 -0.6543 -0.6543 1.2084 1.2084 1.4067 1.4067 3.0815 3.0815 4.7512 4.7512 6.0169 6.0169 6.4909 6.4909 7.1312 7.1312 7.4215 7.4215 8.5240 8.5240 8.8974 8.8974 9.0075 9.0075 9.2560 9.2560 9.3136 9.3136 9.9800 9.9800 10.3801 10.3801 10.4334 10.4334 10.9426 10.9426 k = 0.1946 1.3317-0.0000 ( 4555 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9853 -12.9853 -12.9644 -12.9644 -12.8456 -12.8456 -12.8019 -12.8019 -1.2093 -1.2093 -0.9960 -0.9960 -0.6533 -0.6533 1.2214 1.2214 1.3920 1.3920 3.0841 3.0841 4.7530 4.7530 5.9712 5.9712 6.5444 6.5444 7.1304 7.1304 7.4051 7.4051 8.5381 8.5381 8.9227 8.9227 8.9935 8.9935 9.2510 9.2510 9.3083 9.3083 9.9614 9.9614 10.3791 10.3791 10.4466 10.4466 10.9455 10.9455 k = 0.1622 1.3317-0.0000 ( 4560 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9854 -12.9854 -12.9644 -12.9644 -12.8456 -12.8456 -12.8019 -12.8019 -1.1913 -1.1913 -1.0145 -1.0145 -0.6523 -0.6523 1.2311 1.2311 1.3809 1.3809 3.0859 3.0859 4.7592 4.7592 5.9139 5.9139 6.6183 6.6183 7.1296 7.1296 7.3748 7.3748 8.5520 8.5520 8.9519 8.9519 8.9846 8.9846 9.2425 9.2425 9.2981 9.2981 9.9439 9.9439 10.3657 10.3657 10.4772 10.4772 10.9487 10.9487 k = 0.1297 1.3317-0.0000 ( 4562 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1736 -1.1736 -1.0326 -1.0326 -0.6513 -0.6513 1.2374 1.2374 1.3735 1.3735 3.0868 3.0868 4.7685 4.7685 5.8564 5.8564 6.7018 6.7018 7.1287 7.1287 7.3318 7.3318 8.5649 8.5649 8.9627 8.9627 9.0016 9.0016 9.2319 9.2319 9.2833 9.2833 9.9276 9.9276 10.3478 10.3478 10.5191 10.5191 10.9512 10.9512 k = 0.0973 1.3317-0.0000 ( 4557 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1560 -1.1560 -1.0505 -1.0505 -0.6505 -0.6505 1.2409 1.2409 1.3692 1.3692 3.0872 3.0872 4.7792 4.7792 5.8053 5.8053 6.7892 6.7892 7.1276 7.1276 7.2783 7.2783 8.5761 8.5761 8.9573 8.9573 9.0399 9.0399 9.2203 9.2203 9.2647 9.2647 9.9131 9.9131 10.3305 10.3305 10.5679 10.5679 10.9476 10.9476 k = 0.0649 1.3317-0.0000 ( 4558 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1385 -1.1385 -1.0683 -1.0683 -0.6498 -0.6498 1.2423 1.2423 1.3673 1.3673 3.0873 3.0873 4.7892 4.7892 5.7654 5.7654 6.8766 6.8766 7.1252 7.1252 7.2173 7.2173 8.5848 8.5848 8.9522 8.9522 9.0808 9.0808 9.2075 9.2075 9.2443 9.2443 9.9013 9.9013 10.3167 10.3167 10.6200 10.6200 10.9071 10.9071 k = 0.0324 1.3317-0.0000 ( 4570 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9855 -12.9855 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1212 -1.1212 -1.0858 -1.0858 -0.6494 -0.6494 1.2427 1.2427 1.3666 1.3666 3.0872 3.0872 4.7963 4.7963 5.7400 5.7400 6.9595 6.9595 7.1136 7.1136 7.1604 7.1604 8.5903 8.5903 8.9490 8.9490 9.1197 9.1197 9.1898 9.1898 9.2280 9.2280 9.8935 9.8935 10.3079 10.3079 10.6690 10.6690 10.8566 10.8566 k = 0.0000 1.3317-0.0000 ( 4566 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9855 -12.9855 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1062 -1.1062 -1.1008 -1.1008 -0.6493 -0.6493 1.2428 1.2428 1.3664 1.3664 3.0872 3.0872 4.7988 4.7988 5.7312 5.7312 7.0136 7.0136 7.0814 7.0814 7.1434 7.1434 8.5922 8.5922 8.9480 8.9480 9.1455 9.1455 9.1713 9.1713 9.2225 9.2225 9.8908 9.8908 10.3049 10.3049 10.6940 10.6940 10.8309 10.8309 k = 0.0000 1.3317-0.0000 ( 4566 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9855 -12.9855 -12.9645 -12.9645 -12.8456 -12.8456 -12.8019 -12.8019 -1.1062 -1.1062 -1.1008 -1.1008 -0.6493 -0.6493 1.2428 1.2428 1.3664 1.3664 3.0872 3.0872 4.7988 4.7988 5.7312 5.7312 7.0136 7.0136 7.0814 7.0814 7.1434 7.1434 8.5922 8.5922 8.9480 8.9480 9.1455 9.1455 9.1713 9.1713 9.2225 9.2225 9.8908 9.8908 10.3049 10.3049 10.6940 10.6940 10.8309 10.8309 k = 0.0000 1.3317 0.0329 ( 4562 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9854 -12.9854 -12.9645 -12.9645 -12.8457 -12.8457 -12.8021 -12.8021 -1.1051 -1.1051 -1.0998 -1.0998 -0.6484 -0.6484 1.2438 1.2438 1.3676 1.3676 3.0854 3.0854 4.8003 4.8003 5.7325 5.7325 7.0120 7.0120 7.0747 7.0747 7.1488 7.1488 8.5692 8.5692 8.8625 8.8625 9.0771 9.0771 9.2523 9.2523 9.2735 9.2735 9.9194 9.9194 10.2820 10.2820 10.7100 10.7100 10.8176 10.8176 k = 0.0000 1.3317 0.0659 ( 4554 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3382 -14.3382 -14.3150 -14.3150 -12.9853 -12.9853 -12.9645 -12.9645 -12.8462 -12.8462 -12.8025 -12.8025 -1.1019 -1.1019 -1.0965 -1.0965 -0.6456 -0.6456 1.2471 1.2471 1.3710 1.3710 3.0800 3.0800 4.8048 4.8048 5.7361 5.7361 7.0063 7.0063 7.0600 7.0600 7.1604 7.1604 8.5047 8.5047 8.7099 8.7099 8.9757 8.9757 9.3307 9.3307 9.3857 9.3857 9.9936 9.9936 10.2263 10.2263 10.7471 10.7471 10.7855 10.7855 k = 0.0000 1.3317 0.0988 ( 4558 PWs) bands (ev): -33.2590 -33.2590 -33.2519 -33.2519 -14.3383 -14.3383 -14.3152 -14.3152 -12.9850 -12.9850 -12.9644 -12.9644 -12.8469 -12.8469 -12.8033 -12.8033 -1.0967 -1.0967 -1.0911 -1.0911 -0.6410 -0.6410 1.2524 1.2524 1.3768 1.3768 3.0711 3.0711 4.8123 4.8123 5.7422 5.7422 6.9937 6.9937 7.0452 7.0452 7.1729 7.1729 8.4086 8.4086 8.5431 8.5431 8.8646 8.8646 9.3935 9.3935 9.4947 9.4947 10.0871 10.0871 10.1631 10.1631 10.7491 10.7491 10.7955 10.7955 k = 0.0000 1.3317 0.1318 ( 4554 PWs) bands (ev): -33.2589 -33.2589 -33.2518 -33.2518 -14.3385 -14.3385 -14.3154 -14.3154 -12.9847 -12.9847 -12.9643 -12.9643 -12.8480 -12.8480 -12.8045 -12.8045 -1.0893 -1.0893 -1.0836 -1.0836 -0.6346 -0.6346 1.2599 1.2599 1.3848 1.3848 3.0586 3.0586 4.8227 4.8227 5.7507 5.7507 6.9726 6.9726 7.0336 7.0336 7.1843 7.1843 8.2910 8.2910 8.3714 8.3714 8.7503 8.7503 9.4476 9.4476 9.5618 9.5618 10.1195 10.1195 10.1706 10.1706 10.7426 10.7426 10.8423 10.8423 k = 0.0000 1.3317 0.1647 ( 4556 PWs) bands (ev): -33.2588 -33.2588 -33.2517 -33.2517 -14.3387 -14.3387 -14.3158 -14.3158 -12.9842 -12.9842 -12.9642 -12.9642 -12.8493 -12.8493 -12.8059 -12.8059 -1.0798 -1.0798 -1.0740 -1.0740 -0.6264 -0.6264 1.2695 1.2695 1.3951 1.3951 3.0426 3.0426 4.8361 4.8361 5.7613 5.7613 6.9448 6.9448 7.0237 7.0237 7.1936 7.1936 8.1604 8.1604 8.1981 8.1981 8.6358 8.6358 9.4876 9.4876 9.5622 9.5622 10.1237 10.1237 10.2163 10.2163 10.7889 10.7889 10.8917 10.8917 k = 0.0000 1.3317 0.1977 ( 4564 PWs) bands (ev): -33.2586 -33.2586 -33.2516 -33.2516 -14.3389 -14.3389 -14.3162 -14.3162 -12.9837 -12.9837 -12.9641 -12.9641 -12.8509 -12.8509 -12.8076 -12.8076 -1.0683 -1.0683 -1.0623 -1.0623 -0.6163 -0.6163 1.2811 1.2811 1.4077 1.4077 3.0231 3.0231 4.8524 4.8524 5.7739 5.7739 6.9129 6.9129 7.0122 7.0122 7.2001 7.2001 8.0227 8.0227 8.0262 8.0262 8.5221 8.5221 9.4892 9.4892 9.5163 9.5163 10.1689 10.1689 10.2287 10.2287 10.8904 10.8904 10.9452 10.9452 k = 0.0000 1.3317 0.2306 ( 4564 PWs) bands (ev): -33.2584 -33.2584 -33.2515 -33.2515 -14.3392 -14.3392 -14.3167 -14.3167 -12.9831 -12.9831 -12.9639 -12.9639 -12.8527 -12.8527 -12.8096 -12.8096 -1.0547 -1.0547 -1.0485 -1.0485 -0.6044 -0.6044 1.2947 1.2947 1.4225 1.4225 3.0000 3.0000 4.8716 4.8716 5.7883 5.7883 6.8783 6.8783 6.9961 6.9961 7.2028 7.2028 7.8543 7.8543 7.8870 7.8870 8.4096 8.4096 9.3905 9.3905 9.5048 9.5048 10.2044 10.2044 10.2581 10.2581 10.9973 10.9973 11.0320 11.0320 k = 0.0000 1.3317 0.2635 ( 4562 PWs) bands (ev): -33.2582 -33.2582 -33.2514 -33.2514 -14.3395 -14.3395 -14.3173 -14.3173 -12.9824 -12.9824 -12.9638 -12.9638 -12.8548 -12.8548 -12.8118 -12.8118 -1.0391 -1.0391 -1.0326 -1.0326 -0.5907 -0.5907 1.3103 1.3103 1.4395 1.4395 2.9736 2.9736 4.8937 4.8937 5.8042 5.8042 6.8420 6.8420 6.9720 6.9720 7.1993 7.1993 7.6891 7.6891 7.7555 7.7555 8.2982 8.2982 9.2669 9.2669 9.4687 9.4687 10.2116 10.2116 10.3236 10.3236 11.0595 11.0595 11.1807 11.1807 k = 0.0000 1.3317 0.2965 ( 4566 PWs) bands (ev): -33.2580 -33.2580 -33.2513 -33.2513 -14.3399 -14.3399 -14.3179 -14.3179 -12.9817 -12.9817 -12.9636 -12.9636 -12.8571 -12.8571 -12.8143 -12.8143 -1.0215 -1.0215 -1.0147 -1.0147 -0.5752 -0.5752 1.3278 1.3278 1.4587 1.4587 2.9437 2.9437 4.9185 4.9185 5.8212 5.8212 6.8045 6.8045 6.9356 6.9356 7.1834 7.1834 7.5362 7.5362 7.6357 7.6357 8.1881 8.1881 9.1321 9.1321 9.4066 9.4066 10.2253 10.2253 10.3887 10.3887 11.1217 11.1217 11.3291 11.3291 k = 0.0000 1.3317 0.3294 ( 4564 PWs) bands (ev): -33.2578 -33.2578 -33.2511 -33.2511 -14.3403 -14.3403 -14.3187 -14.3187 -12.9809 -12.9809 -12.9635 -12.9635 -12.8597 -12.8597 -12.8170 -12.8170 -1.0020 -1.0020 -0.9948 -0.9948 -0.5579 -0.5579 1.3471 1.3471 1.4800 1.4800 2.9106 2.9106 4.9460 4.9460 5.8386 5.8386 6.7662 6.7662 6.8823 6.8823 7.1385 7.1385 7.4128 7.4128 7.5335 7.5335 8.0796 8.0796 8.9912 8.9912 9.3245 9.3245 10.2469 10.2469 10.4469 10.4469 11.1835 11.1835 11.4494 11.4494 k = 0.0000 1.3317 0.3624 ( 4566 PWs) bands (ev): -33.2575 -33.2575 -33.2509 -33.2509 -14.3407 -14.3407 -14.3195 -14.3195 -12.9800 -12.9800 -12.9633 -12.9633 -12.8624 -12.8624 -12.8199 -12.8199 -0.9805 -0.9805 -0.9730 -0.9730 -0.5388 -0.5388 1.3681 1.3681 1.5034 1.5034 2.8743 2.8743 4.9761 4.9761 5.8556 5.8556 6.7268 6.7268 6.8094 6.8094 7.0431 7.0431 7.3410 7.3410 7.4529 7.4529 7.9733 7.9733 8.8469 8.8469 9.2291 9.2291 10.2725 10.2725 10.4981 10.4981 11.2428 11.2428 11.5131 11.5131 k = 0.0000 1.3317 0.3953 ( 4566 PWs) bands (ev): -33.2572 -33.2572 -33.2508 -33.2508 -14.3412 -14.3412 -14.3203 -14.3203 -12.9791 -12.9791 -12.9631 -12.9631 -12.8652 -12.8652 -12.8230 -12.8230 -0.9571 -0.9571 -0.9494 -0.9494 -0.5179 -0.5179 1.3907 1.3907 1.5289 1.5289 2.8351 2.8351 5.0086 5.0086 5.8709 5.8709 6.6837 6.6837 6.7208 6.7208 6.9095 6.9095 7.3096 7.3096 7.3932 7.3932 7.8699 7.8699 8.7010 8.7010 9.1253 9.1253 10.2984 10.2984 10.5429 10.5429 11.2981 11.2981 11.5614 11.5614 k = 0.0000 1.3317 0.4283 ( 4570 PWs) bands (ev): -33.2569 -33.2569 -33.2506 -33.2506 -14.3417 -14.3417 -14.3212 -14.3212 -12.9781 -12.9781 -12.9630 -12.9630 -12.8683 -12.8683 -12.8263 -12.8263 -0.9319 -0.9319 -0.9239 -0.9239 -0.4953 -0.4953 1.4147 1.4147 1.5564 1.5564 2.7930 2.7930 5.0432 5.0432 5.8822 5.8822 6.6070 6.6070 6.6495 6.6495 6.7657 6.7657 7.2940 7.2940 7.3499 7.3499 7.7711 7.7711 8.5545 8.5545 9.0168 9.0168 10.3218 10.3218 10.5829 10.5829 11.3477 11.3477 11.6050 11.6050 k = 0.0000 1.3317 0.4612 ( 4562 PWs) bands (ev): -33.2565 -33.2565 -33.2504 -33.2504 -14.3423 -14.3423 -14.3222 -14.3222 -12.9772 -12.9772 -12.9628 -12.9628 -12.8714 -12.8714 -12.8296 -12.8296 -0.9049 -0.9049 -0.8966 -0.8966 -0.4710 -0.4710 1.4399 1.4399 1.5859 1.5859 2.7484 2.7484 5.0797 5.0797 5.8858 5.8858 6.5024 6.5024 6.5696 6.5696 6.6520 6.6520 7.2810 7.2810 7.3181 7.3181 7.6792 7.6792 8.4086 8.4086 8.9059 8.9059 10.3414 10.3414 10.6191 10.6191 11.3908 11.3908 11.6462 11.6462 k = 0.0000 1.3317 0.4941 ( 4568 PWs) bands (ev): -33.2562 -33.2562 -33.2502 -33.2502 -14.3428 -14.3428 -14.3232 -14.3232 -12.9762 -12.9762 -12.9627 -12.9627 -12.8745 -12.8745 -12.8331 -12.8331 -0.8762 -0.8762 -0.8676 -0.8676 -0.4449 -0.4449 1.4662 1.4662 1.6172 1.6172 2.7016 2.7016 5.1175 5.1175 5.8753 5.8753 6.4033 6.4033 6.4325 6.4325 6.5992 6.5992 7.2576 7.2576 7.2989 7.2989 7.5980 7.5980 8.2639 8.2639 8.7942 8.7942 10.3567 10.3567 10.6526 10.6526 11.4263 11.4263 11.6868 11.6868 k = 0.0000 1.3317 0.5271 ( 4574 PWs) bands (ev): -33.2558 -33.2558 -33.2500 -33.2500 -14.3434 -14.3434 -14.3243 -14.3243 -12.9752 -12.9752 -12.9626 -12.9626 -12.8778 -12.8778 -12.8367 -12.8367 -0.8459 -0.8459 -0.8370 -0.8370 -0.4171 -0.4171 1.4933 1.4933 1.6503 1.6503 2.6529 2.6529 5.1560 5.1560 5.8417 5.8417 6.2846 6.2846 6.3235 6.3235 6.5610 6.5610 7.2169 7.2169 7.2902 7.2902 7.5319 7.5319 8.1212 8.1212 8.6829 8.6829 10.3681 10.3681 10.6844 10.6844 11.4538 11.4538 11.7280 11.7280 k = 0.0000 1.3317 0.5600 ( 4572 PWs) bands (ev): -33.2555 -33.2555 -33.2498 -33.2498 -14.3440 -14.3440 -14.3254 -14.3254 -12.9743 -12.9743 -12.9625 -12.9625 -12.8810 -12.8810 -12.8403 -12.8403 -0.8140 -0.8140 -0.8049 -0.8049 -0.3877 -0.3877 1.5207 1.5207 1.6852 1.6852 2.6028 2.6028 5.1939 5.1939 5.7782 5.7782 6.1396 6.1396 6.2710 6.2710 6.5263 6.5263 7.1609 7.1609 7.2850 7.2850 7.4836 7.4836 7.9812 7.9812 8.5729 8.5729 10.3763 10.3763 10.7151 10.7151 11.4734 11.4734 11.7707 11.7707 k = 0.0000 1.3317 0.5930 ( 4560 PWs) bands (ev): -33.2551 -33.2551 -33.2495 -33.2495 -14.3447 -14.3447 -14.3266 -14.3266 -12.9734 -12.9734 -12.9624 -12.9624 -12.8843 -12.8843 -12.8440 -12.8440 -0.7806 -0.7806 -0.7713 -0.7713 -0.3566 -0.3566 1.5479 1.5479 1.7216 1.7216 2.5519 2.5519 5.2292 5.2292 5.6871 5.6871 6.0012 6.0012 6.2444 6.2444 6.4934 6.4934 7.0932 7.0932 7.2806 7.2806 7.4512 7.4512 7.8447 7.8447 8.4647 8.4647 10.3823 10.3823 10.7454 10.7454 11.4853 11.4853 11.8152 11.8152 k = 0.0000 1.3317 0.6259 ( 4560 PWs) bands (ev): -33.2547 -33.2547 -33.2493 -33.2493 -14.3453 -14.3453 -14.3278 -14.3278 -12.9726 -12.9726 -12.9624 -12.9624 -12.8874 -12.8874 -12.8476 -12.8476 -0.7459 -0.7459 -0.7365 -0.7365 -0.3239 -0.3239 1.5745 1.5745 1.7596 1.7596 2.5009 2.5009 5.2576 5.2576 5.5777 5.5777 5.8743 5.8743 6.2344 6.2344 6.4615 6.4615 7.0194 7.0194 7.2760 7.2760 7.4295 7.4295 7.7127 7.7127 8.3588 8.3588 10.3873 10.3873 10.7758 10.7758 11.4902 11.4902 11.8617 11.8617 k = 0.0000 1.3317 0.6589 ( 4566 PWs) bands (ev): -33.2543 -33.2543 -33.2491 -33.2491 -14.3459 -14.3459 -14.3291 -14.3291 -12.9719 -12.9719 -12.9624 -12.9624 -12.8905 -12.8905 -12.8513 -12.8513 -0.7098 -0.7098 -0.7004 -0.7004 -0.2896 -0.2896 1.5995 1.5995 1.7990 1.7990 2.4507 2.4507 5.2707 5.2707 5.4585 5.4585 5.7676 5.7676 6.2313 6.2313 6.4302 6.4302 6.9452 6.9452 7.2706 7.2706 7.4129 7.4129 7.5870 7.5870 8.2558 8.2558 10.3924 10.3924 10.8067 10.8067 11.4889 11.4889 11.9101 11.9101 k = 0.0000 1.3317 0.6918 ( 4570 PWs) bands (ev): -33.2539 -33.2539 -33.2489 -33.2489 -14.3466 -14.3466 -14.3304 -14.3304 -12.9712 -12.9712 -12.9624 -12.9624 -12.8935 -12.8935 -12.8549 -12.8549 -0.6727 -0.6727 -0.6633 -0.6633 -0.2537 -0.2537 1.6217 1.6217 1.8397 1.8397 2.4025 2.4025 5.2546 5.2546 5.3352 5.3352 5.6951 5.6951 6.2279 6.2279 6.3988 6.3988 6.8757 6.8757 7.2636 7.2636 7.3941 7.3941 7.4736 7.4736 8.1558 8.1558 10.3988 10.3988 10.8383 10.8383 11.4823 11.4823 11.9605 11.9605 k = 0.0000 1.3317 0.7247 ( 4564 PWs) bands (ev): -33.2535 -33.2535 -33.2487 -33.2487 -14.3472 -14.3472 -14.3316 -14.3316 -12.9708 -12.9708 -12.9625 -12.9625 -12.8963 -12.8963 -12.8584 -12.8584 -0.6345 -0.6345 -0.6253 -0.6253 -0.2163 -0.2163 1.6398 1.6398 1.8814 1.8814 2.3579 2.3579 5.1985 5.1985 5.2113 5.2113 5.6674 5.6674 6.2185 6.2185 6.3666 6.3666 6.8156 6.8156 7.2510 7.2510 7.3388 7.3388 7.4093 7.4093 8.0592 8.0592 10.4074 10.4074 10.8710 10.8710 11.4711 11.4711 12.0126 12.0126 k = 0.0000 1.3317 0.7577 ( 4566 PWs) bands (ev): -33.2531 -33.2531 -33.2485 -33.2485 -14.3478 -14.3478 -14.3330 -14.3330 -12.9704 -12.9704 -12.9626 -12.9626 -12.8989 -12.8989 -12.8618 -12.8618 -0.5955 -0.5955 -0.5865 -0.5865 -0.1774 -0.1774 1.6518 1.6518 1.9242 1.9242 2.3189 2.3189 5.0871 5.0871 5.1118 5.1118 5.6766 5.6766 6.1986 6.1986 6.3328 6.3328 6.7687 6.7687 7.2057 7.2057 7.2780 7.2780 7.3898 7.3898 7.9663 7.9663 10.4188 10.4188 10.9048 10.9048 11.4562 11.4562 12.0663 12.0663 k = 0.0000 1.3317 0.7906 ( 4570 PWs) bands (ev): -33.2527 -33.2527 -33.2483 -33.2483 -14.3485 -14.3485 -14.3343 -14.3343 -12.9702 -12.9702 -12.9628 -12.9628 -12.9012 -12.9012 -12.8651 -12.8651 -0.5558 -0.5558 -0.5472 -0.5472 -0.1370 -0.1370 1.6557 1.6557 1.9676 1.9676 2.2874 2.2874 4.9660 4.9660 5.0076 5.0076 5.7074 5.7074 6.1657 6.1657 6.2963 6.2963 6.7374 6.7374 7.1211 7.1211 7.2597 7.2597 7.3746 7.3746 7.8775 7.8775 10.4337 10.4337 10.9399 10.9399 11.4384 11.4384 12.1216 12.1216 k = 0.0000 1.3317 0.8236 ( 4568 PWs) bands (ev): -33.2523 -33.2523 -33.2481 -33.2481 -14.3491 -14.3491 -14.3356 -14.3356 -12.9702 -12.9702 -12.9630 -12.9630 -12.9033 -12.9033 -12.8683 -12.8683 -0.5157 -0.5157 -0.5075 -0.5075 -0.0953 -0.0953 1.6495 1.6495 2.0117 2.0117 2.2655 2.2655 4.8481 4.8481 4.8974 4.8974 5.7490 5.7490 6.1198 6.1198 6.2561 6.2561 6.7215 6.7215 7.0377 7.0377 7.2494 7.2494 7.3579 7.3579 7.7931 7.7931 10.4524 10.4524 10.9763 10.9763 11.4183 11.4183 12.1780 12.1780 k = 0.0000 1.3317 0.8565 ( 4566 PWs) bands (ev): -33.2519 -33.2519 -33.2480 -33.2480 -14.3496 -14.3496 -14.3369 -14.3369 -12.9703 -12.9703 -12.9633 -12.9633 -12.9051 -12.9051 -12.8714 -12.8714 -0.4753 -0.4753 -0.4677 -0.4677 -0.0521 -0.0521 1.6321 1.6321 2.0560 2.0560 2.2543 2.2543 4.7340 4.7340 4.7863 4.7863 5.7956 5.7956 6.0635 6.0635 6.2119 6.2119 6.7185 6.7185 6.9649 6.9649 7.2399 7.2399 7.3381 7.3381 7.7136 7.7136 10.4751 10.4751 11.0138 11.0138 11.3968 11.3968 12.2243 12.2243 k = 0.0000 1.3317 0.8895 ( 4568 PWs) bands (ev): -33.2515 -33.2515 -33.2478 -33.2478 -14.3502 -14.3502 -14.3382 -14.3382 -12.9706 -12.9706 -12.9638 -12.9638 -12.9066 -12.9066 -12.8743 -12.8743 -0.4350 -0.4350 -0.4281 -0.4281 -0.0075 -0.0075 1.6034 1.6034 2.1003 2.1003 2.2538 2.2538 4.6243 4.6243 4.6770 4.6770 5.8428 5.8428 6.0003 6.0003 6.1647 6.1647 6.7245 6.7245 6.9053 6.9053 7.2301 7.2301 7.3145 7.3145 7.6395 7.6395 10.5017 10.5017 11.0523 11.0523 11.3745 11.3745 12.2337 12.2337 k = 0.0000 1.3317 0.9224 ( 4568 PWs) bands (ev): -33.2511 -33.2511 -33.2477 -33.2477 -14.3507 -14.3507 -14.3395 -14.3395 -12.9709 -12.9709 -12.9643 -12.9643 -12.9078 -12.9078 -12.8771 -12.8771 -0.3950 -0.3950 -0.3888 -0.3888 0.0384 0.0384 1.5647 1.5647 2.1444 2.1444 2.2626 2.2626 4.5196 4.5196 4.5713 4.5713 5.8843 5.8843 5.9338 5.9338 6.1190 6.1190 6.7359 6.7359 6.8602 6.8602 7.2189 7.2189 7.2867 7.2867 7.5713 7.5713 10.5320 10.5320 11.0911 11.0911 11.3526 11.3526 12.2285 12.2285 k = 0.0000 1.3317 0.9554 ( 4574 PWs) bands (ev): -33.2507 -33.2507 -33.2475 -33.2475 -14.3511 -14.3511 -14.3407 -14.3407 -12.9713 -12.9713 -12.9650 -12.9650 -12.9087 -12.9087 -12.8798 -12.8798 -0.3556 -0.3556 -0.3503 -0.3503 0.0856 0.0856 1.5178 1.5178 2.1879 2.1879 2.2788 2.2788 4.4203 4.4203 4.4700 4.4700 5.8633 5.8633 5.9097 5.9097 6.0888 6.0888 6.7483 6.7483 6.8312 6.8312 7.2050 7.2050 7.2556 7.2556 7.5095 7.5095 10.5658 10.5658 11.1293 11.1293 11.3324 11.3324 12.2111 12.2111 k = 0.0000 1.3317 0.9883 ( 4572 PWs) bands (ev): -33.2504 -33.2504 -33.2474 -33.2474 -14.3515 -14.3515 -14.3420 -14.3420 -12.9718 -12.9718 -12.9657 -12.9657 -12.9093 -12.9093 -12.8823 -12.8823 -0.3172 -0.3172 -0.3127 -0.3127 0.1342 0.1342 1.4645 1.4645 2.2305 2.2305 2.3004 2.3004 4.3270 4.3270 4.3739 4.3739 5.7963 5.7963 5.8931 5.8931 6.0950 6.0950 6.7561 6.7561 6.8212 6.8212 7.1834 7.1834 7.2260 7.2260 7.4538 7.4538 10.6025 10.6025 11.1638 11.1638 11.3171 11.3171 12.1842 12.1842 k = 0.0000 1.3317 1.0212 ( 4572 PWs) bands (ev): -33.2500 -33.2500 -33.2473 -33.2473 -14.3519 -14.3519 -14.3431 -14.3431 -12.9723 -12.9723 -12.9666 -12.9666 -12.9095 -12.9095 -12.8847 -12.8847 -0.2801 -0.2801 -0.2765 -0.2765 0.1841 0.1841 1.4067 1.4067 2.2716 2.2716 2.3253 2.3253 4.2399 4.2399 4.2837 4.2837 5.7311 5.7311 5.8455 5.8455 6.1314 6.1314 6.7576 6.7576 6.8292 6.8292 7.1482 7.1482 7.2047 7.2047 7.4037 7.4037 10.6416 10.6416 11.1883 11.1883 11.3131 11.3131 12.1503 12.1503 k = 0.0000 1.3317 1.0542 ( 4570 PWs) bands (ev): -33.2497 -33.2497 -33.2473 -33.2473 -14.3522 -14.3522 -14.3443 -14.3443 -12.9728 -12.9728 -12.9675 -12.9675 -12.9096 -12.9096 -12.8869 -12.8869 -0.2449 -0.2449 -0.2420 -0.2420 0.2353 0.2353 1.3455 1.3455 2.3110 2.3110 2.3521 2.3521 4.1597 4.1597 4.2000 4.2000 5.6694 5.6694 5.7862 5.7862 6.1795 6.1795 6.7593 6.7593 6.8466 6.8466 7.1034 7.1034 7.1889 7.1889 7.3577 7.3577 10.6823 10.6823 11.1947 11.1947 11.3286 11.3286 12.1118 12.1118 k = 0.0000 1.3317 1.0871 ( 4570 PWs) bands (ev): -33.2494 -33.2494 -33.2472 -33.2472 -14.3524 -14.3524 -14.3453 -14.3453 -12.9732 -12.9732 -12.9685 -12.9685 -12.9094 -12.9094 -12.8890 -12.8890 -0.2119 -0.2119 -0.2096 -0.2096 0.2879 0.2879 1.2820 1.2820 2.3481 2.3481 2.3795 2.3795 4.0867 4.0867 4.1231 4.1231 5.6122 5.6122 5.7244 5.7244 6.2314 6.2314 6.7654 6.7654 6.8669 6.8669 7.0549 7.0549 7.1745 7.1745 7.3147 7.3147 10.7240 10.7240 11.1856 11.1856 11.3610 11.3610 12.0705 12.0705 k = 0.0000 1.3317 1.1201 ( 4574 PWs) bands (ev): -33.2491 -33.2491 -33.2472 -33.2472 -14.3526 -14.3526 -14.3464 -14.3464 -12.9737 -12.9737 -12.9694 -12.9694 -12.9089 -12.9089 -12.8910 -12.8910 -0.1816 -0.1816 -0.1796 -0.1796 0.3419 0.3419 1.2171 1.2171 2.3825 2.3825 2.4062 2.4062 4.0214 4.0214 4.0537 4.0537 5.5605 5.5605 5.6640 5.6640 6.2844 6.2844 6.7770 6.7770 6.8865 6.8865 7.0067 7.0067 7.1602 7.1602 7.2734 7.2734 10.7657 10.7657 11.1691 11.1691 11.4016 11.4016 12.0277 12.0277 k = 0.0000 1.3317 1.1530 ( 4568 PWs) bands (ev): -33.2488 -33.2488 -33.2472 -33.2472 -14.3527 -14.3527 -14.3473 -14.3473 -12.9741 -12.9741 -12.9704 -12.9704 -12.9084 -12.9084 -12.8929 -12.8929 -0.1543 -0.1543 -0.1526 -0.1526 0.3973 0.3973 1.1512 1.1512 2.4136 2.4136 2.4314 2.4314 3.9641 3.9641 3.9921 3.9921 5.5150 5.5150 5.6073 5.6073 6.3371 6.3371 6.7937 6.7937 6.8972 6.8972 6.9672 6.9672 7.1451 7.1451 7.2332 7.2332 10.8067 10.8067 11.1497 11.1497 11.4460 11.4460 11.9844 11.9844 k = 0.0000 1.3317 1.1860 ( 4566 PWs) bands (ev): -33.2485 -33.2485 -33.2472 -33.2472 -14.3527 -14.3527 -14.3482 -14.3482 -12.9744 -12.9744 -12.9713 -12.9713 -12.9076 -12.9076 -12.8947 -12.8947 -0.1305 -0.1305 -0.1288 -0.1288 0.4540 0.4540 1.0848 1.0848 2.4411 2.4411 2.4542 2.4542 3.9152 3.9152 3.9387 3.9387 5.4766 5.4766 5.5557 5.5557 6.3891 6.3891 6.8149 6.8149 6.8769 6.8769 6.9594 6.9594 7.1286 7.1286 7.1940 7.1940 10.8465 10.8465 11.1290 11.1290 11.4919 11.4919 11.9409 11.9409 k = 0.0000 1.3317 1.2189 ( 4570 PWs) bands (ev): -33.2483 -33.2483 -33.2472 -33.2472 -14.3526 -14.3526 -14.3490 -14.3490 -12.9746 -12.9746 -12.9721 -12.9721 -12.9067 -12.9067 -12.8963 -12.8963 -0.1104 -0.1104 -0.1088 -0.1088 0.5121 0.5121 1.0184 1.0184 2.4644 2.4644 2.4738 2.4738 3.8751 3.8751 3.8941 3.8941 5.4457 5.4457 5.5104 5.5104 6.4402 6.4402 6.8259 6.8259 6.8484 6.8484 6.9743 6.9743 7.1097 7.1097 7.1567 7.1567 10.8843 10.8843 11.1076 11.1076 11.5385 11.5385 11.8974 11.8974 k = 0.0000 1.3317 1.2518 ( 4568 PWs) bands (ev): -33.2481 -33.2481 -33.2472 -33.2472 -14.3525 -14.3525 -14.3498 -14.3498 -12.9747 -12.9747 -12.9728 -12.9728 -12.9057 -12.9057 -12.8979 -12.8979 -0.0943 -0.0943 -0.0930 -0.0930 0.5716 0.5716 0.9522 0.9522 2.4831 2.4831 2.4896 2.4896 3.8441 3.8441 3.8584 3.8584 5.4231 5.4231 5.4724 5.4724 6.4904 6.4904 6.7823 6.7823 6.8738 6.8738 6.9938 6.9938 7.0857 7.0857 7.1240 7.1240 10.9198 10.9198 11.0853 11.0853 11.5851 11.5851 11.8540 11.8540 k = 0.0000 1.3317 1.2848 ( 4568 PWs) bands (ev): -33.2479 -33.2479 -33.2473 -33.2473 -14.3522 -14.3522 -14.3504 -14.3504 -12.9747 -12.9747 -12.9734 -12.9734 -12.9047 -12.9047 -12.8994 -12.8994 -0.0825 -0.0825 -0.0816 -0.0816 0.6323 0.6323 0.8866 0.8866 2.4970 2.4970 2.5011 2.5011 3.8225 3.8225 3.8320 3.8320 5.4090 5.4090 5.4423 5.4423 6.5397 6.5397 6.7340 6.7340 6.9064 6.9064 7.0133 7.0133 7.0549 7.0549 7.0981 7.0981 10.9529 10.9529 11.0622 11.0622 11.6314 11.6314 11.8104 11.8104 k = 0.0000 1.3317 1.3177 ( 4570 PWs) bands (ev): -33.2477 -33.2477 -33.2474 -33.2474 -14.3519 -14.3519 -14.3510 -14.3510 -12.9745 -12.9745 -12.9739 -12.9739 -12.9035 -12.9035 -12.9009 -12.9009 -0.0752 -0.0752 -0.0747 -0.0747 0.6943 0.6943 0.8216 0.8216 2.5058 2.5058 2.5078 2.5078 3.8104 3.8104 3.8152 3.8152 5.4038 5.4038 5.4206 5.4206 6.5885 6.5885 6.6855 6.6855 6.9417 6.9417 7.0136 7.0136 7.0387 7.0387 7.0766 7.0766 10.9834 10.9834 11.0377 11.0377 11.6771 11.6771 11.7665 11.7665 k = 0.0000 1.3317 1.3507 ( 4580 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9743 -12.9743 -12.9022 -12.9022 -12.9022 -12.9022 -0.0726 -0.0726 -0.0726 -0.0726 0.7574 0.7574 0.7574 0.7574 2.5094 2.5094 2.5094 2.5094 3.8079 3.8079 3.8079 3.8079 5.4077 5.4077 5.4077 5.4077 6.6370 6.6370 6.6370 6.6370 6.9783 6.9783 6.9783 6.9783 7.0566 7.0566 7.0566 7.0566 11.0116 11.0116 11.0116 11.0116 11.7221 11.7221 11.7221 11.7221 k = 0.0000 1.3317 1.3507 ( 4580 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9743 -12.9743 -12.9022 -12.9022 -12.9022 -12.9022 -0.0726 -0.0726 -0.0726 -0.0726 0.7574 0.7574 0.7574 0.7574 2.5094 2.5094 2.5094 2.5094 3.8079 3.8079 3.8079 3.8079 5.4077 5.4077 5.4077 5.4077 6.6370 6.6370 6.6370 6.6370 6.9783 6.9783 6.9783 6.9783 7.0566 7.0566 7.0566 7.0566 11.0116 11.0116 11.0116 11.0116 11.7221 11.7221 11.7221 11.7221 k = 0.0324 1.3317 1.3507 ( 4574 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9743 -12.9743 -12.9022 -12.9022 -12.9022 -12.9022 -0.0727 -0.0727 -0.0727 -0.0727 0.7574 0.7574 0.7575 0.7575 2.5092 2.5092 2.5094 2.5094 3.8074 3.8074 3.8085 3.8085 5.4065 5.4065 5.4103 5.4103 6.6366 6.6366 6.6375 6.6375 6.9687 6.9687 6.9767 6.9767 7.0562 7.0562 7.0674 7.0674 11.0041 11.0041 11.0107 11.0107 11.7276 11.7276 11.7312 11.7312 k = 0.0649 1.3317 1.3507 ( 4576 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9742 -12.9742 -12.9022 -12.9022 -12.9022 -12.9022 -0.0730 -0.0730 -0.0729 -0.0729 0.7575 0.7575 0.7577 0.7577 2.5088 2.5088 2.5093 2.5093 3.8069 3.8069 3.8090 3.8090 5.4067 5.4067 5.4142 5.4142 6.6362 6.6362 6.6381 6.6381 6.9534 6.9534 6.9649 6.9649 7.0655 7.0655 7.0833 7.0833 10.9894 10.9894 11.0020 11.0020 11.7466 11.7466 11.7533 11.7533 k = 0.0973 1.3317 1.3507 ( 4578 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9742 -12.9742 -12.9022 -12.9022 -12.9022 -12.9022 -0.0735 -0.0735 -0.0734 -0.0734 0.7576 0.7576 0.7579 0.7579 2.5082 2.5082 2.5089 2.5089 3.8065 3.8065 3.8095 3.8095 5.4083 5.4083 5.4191 5.4191 6.6357 6.6357 6.6384 6.6384 6.9367 6.9367 6.9490 6.9490 7.0787 7.0787 7.1000 7.1000 10.9700 10.9700 10.9876 10.9876 11.7761 11.7761 11.7851 11.7851 k = 0.1297 1.3317 1.3507 ( 4570 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3514 -14.3514 -12.9743 -12.9743 -12.9742 -12.9742 -12.9022 -12.9022 -12.9022 -12.9022 -0.0741 -0.0741 -0.0739 -0.0739 0.7577 0.7577 0.7581 0.7581 2.5075 2.5075 2.5083 2.5083 3.8062 3.8062 3.8100 3.8100 5.4111 5.4111 5.4249 5.4249 6.6349 6.6349 6.6382 6.6382 6.9210 6.9210 6.9330 6.9330 7.0919 7.0919 7.1156 7.1156 10.9487 10.9487 10.9703 10.9703 11.8116 11.8116 11.8221 11.8221 k = 0.1622 1.3317 1.3507 ( 4568 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3514 -14.3514 -12.9743 -12.9743 -12.9741 -12.9741 -12.9022 -12.9022 -12.9022 -12.9022 -0.0749 -0.0749 -0.0747 -0.0747 0.7579 0.7579 0.7584 0.7584 2.5065 2.5065 2.5076 2.5076 3.8062 3.8062 3.8107 3.8107 5.4148 5.4148 5.4311 5.4311 6.6336 6.6336 6.6372 6.6372 6.9078 6.9078 6.9191 6.9191 7.1037 7.1037 7.1289 7.1289 10.9281 10.9281 10.9526 10.9526 11.8482 11.8482 11.8597 11.8597 k = 0.1946 1.3317 1.3507 ( 4564 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3514 -14.3514 -12.9743 -12.9743 -12.9741 -12.9741 -12.9022 -12.9022 -12.9022 -12.9022 -0.0759 -0.0759 -0.0756 -0.0756 0.7581 0.7581 0.7587 0.7587 2.5054 2.5054 2.5067 2.5067 3.8066 3.8066 3.8115 3.8115 5.4193 5.4193 5.4374 5.4374 6.6315 6.6315 6.6351 6.6351 6.8982 6.8982 6.9088 6.9088 7.1130 7.1130 7.1394 7.1394 10.9102 10.9102 10.9368 10.9368 11.8808 11.8808 11.8930 11.8930 k = 0.2271 1.3317 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3514 -14.3514 -12.9742 -12.9742 -12.9740 -12.9740 -12.9023 -12.9023 -12.9022 -12.9022 -0.0770 -0.0770 -0.0766 -0.0766 0.7584 0.7584 0.7590 0.7590 2.5042 2.5042 2.5056 2.5056 3.8075 3.8075 3.8126 3.8126 5.4242 5.4242 5.4434 5.4434 6.6285 6.6285 6.6318 6.6318 6.8928 6.8928 6.9027 6.9027 7.1194 7.1194 7.1466 7.1466 10.8964 10.8964 10.9243 10.9243 11.9049 11.9049 11.9176 11.9176 k = 0.2595 1.3317 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3513 -14.3513 -12.9742 -12.9742 -12.9740 -12.9740 -12.9023 -12.9023 -12.9022 -12.9022 -0.0782 -0.0782 -0.0778 -0.0778 0.7586 0.7586 0.7592 0.7592 2.5028 2.5028 2.5044 2.5044 3.8089 3.8089 3.8141 3.8141 5.4292 5.4292 5.4486 5.4486 6.6249 6.6249 6.6274 6.6274 6.8921 6.8921 6.9014 6.9014 7.1225 7.1225 7.1501 7.1501 10.8875 10.8875 10.9160 10.9160 11.9172 11.9172 11.9303 11.9303 k = 0.2595 1.3317 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3513 -14.3513 -12.9742 -12.9742 -12.9740 -12.9740 -12.9023 -12.9023 -12.9022 -12.9022 -0.0782 -0.0782 -0.0778 -0.0778 0.7586 0.7586 0.7592 0.7592 2.5028 2.5028 2.5044 2.5044 3.8089 3.8089 3.8141 3.8141 5.4292 5.4292 5.4486 5.4486 6.6249 6.6249 6.6274 6.6274 6.8921 6.8921 6.9014 6.9014 7.1225 7.1225 7.1501 7.1501 10.8875 10.8875 10.9160 10.9160 11.9172 11.9172 11.9303 11.9303 k = 0.2532 1.2992 1.3507 ( 4568 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9742 -12.9742 -12.9022 -12.9022 -12.9022 -12.9022 -0.0734 -0.0734 -0.0733 -0.0733 0.7577 0.7577 0.7580 0.7580 2.5083 2.5083 2.5091 2.5091 3.8041 3.8041 3.8096 3.8096 5.4066 5.4066 5.4266 5.4266 6.6451 6.6451 6.6530 6.6530 6.8844 6.8844 6.8965 6.8965 7.1158 7.1158 7.1421 7.1421 10.9161 10.9161 10.9433 10.9433 11.8879 11.8879 11.8992 11.8992 k = 0.2468 1.2667 1.3507 ( 4568 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3515 -14.3515 -12.9743 -12.9743 -12.9742 -12.9742 -12.9022 -12.9022 -12.9022 -12.9022 -0.0731 -0.0731 -0.0729 -0.0729 0.7571 0.7571 0.7571 0.7571 2.5089 2.5089 2.5089 2.5089 3.8084 3.8084 3.8143 3.8143 5.3907 5.3907 5.4111 5.4111 6.6650 6.6650 6.6784 6.6784 6.8780 6.8780 6.8929 6.8929 7.1119 7.1119 7.1368 7.1368 10.9362 10.9362 10.9621 10.9621 11.8600 11.8600 11.8698 11.8698 k = 0.2405 1.2342 1.3507 ( 4564 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3513 -14.3513 -12.9742 -12.9742 -12.9739 -12.9739 -12.9023 -12.9023 -12.9022 -12.9022 -0.0773 -0.0773 -0.0768 -0.0768 0.7564 0.7564 0.7568 0.7568 2.5036 2.5036 2.5045 2.5045 3.8220 3.8220 3.8282 3.8282 5.3819 5.3819 5.4027 5.4027 6.6841 6.6841 6.7031 6.7031 6.8727 6.8727 6.8902 6.8902 7.1112 7.1112 7.1346 7.1346 10.9485 10.9485 10.9732 10.9732 11.8338 11.8338 11.8422 11.8422 k = 0.2342 1.2018 1.3507 ( 4564 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3514 -14.3514 -14.3511 -14.3511 -12.9740 -12.9740 -12.9735 -12.9735 -12.9024 -12.9024 -12.9022 -12.9022 -0.0859 -0.0859 -0.0850 -0.0850 0.7562 0.7562 0.7569 0.7569 2.4934 2.4934 2.4951 2.4951 3.8447 3.8447 3.8513 3.8513 5.3802 5.3802 5.4013 5.4013 6.7023 6.7023 6.7266 6.7266 6.8681 6.8681 6.8883 6.8883 7.1136 7.1136 7.1354 7.1354 10.9541 10.9541 10.9777 10.9777 11.8096 11.8096 11.8169 11.8169 k = 0.2278 1.1693 1.3507 ( 4576 PWs) bands (ev): -33.2477 -33.2477 -33.2477 -33.2477 -14.3512 -14.3512 -14.3508 -14.3508 -12.9735 -12.9735 -12.9728 -12.9728 -12.9025 -12.9025 -12.9022 -12.9022 -0.0985 -0.0985 -0.0973 -0.0973 0.7563 0.7563 0.7574 0.7574 2.4782 2.4782 2.4808 2.4808 3.8764 3.8764 3.8833 3.8833 5.3857 5.3857 5.4071 5.4071 6.7193 6.7193 6.7488 6.7488 6.8641 6.8641 6.8868 6.8868 7.1192 7.1192 7.1396 7.1396 10.9543 10.9543 10.9770 10.9770 11.7876 11.7876 11.7940 11.7940 k = 0.2215 1.1368 1.3507 ( 4560 PWs) bands (ev): -33.2477 -33.2477 -33.2477 -33.2477 -14.3509 -14.3509 -14.3505 -14.3505 -12.9729 -12.9729 -12.9720 -12.9720 -12.9026 -12.9026 -12.9022 -12.9022 -0.1152 -0.1152 -0.1137 -0.1137 0.7569 0.7569 0.7583 0.7583 2.4584 2.4584 2.4618 2.4618 3.9168 3.9168 3.9240 3.9240 5.3979 5.3979 5.4197 5.4197 6.7350 6.7350 6.7693 6.7693 6.8606 6.8606 6.8854 6.8854 7.1283 7.1283 7.1474 7.1474 10.9507 10.9507 10.9726 10.9726 11.7680 11.7680 11.7735 11.7735 k = 0.2152 1.1043 1.3507 ( 4574 PWs) bands (ev): -33.2478 -33.2478 -33.2478 -33.2478 -14.3506 -14.3506 -14.3501 -14.3501 -12.9721 -12.9721 -12.9711 -12.9711 -12.9027 -12.9027 -12.9022 -12.9022 -0.1355 -0.1355 -0.1337 -0.1337 0.7578 0.7578 0.7596 0.7596 2.4343 2.4343 2.4384 2.4384 3.9656 3.9656 3.9731 3.9731 5.4166 5.4166 5.4387 5.4387 6.7496 6.7496 6.7873 6.7873 6.8580 6.8580 6.8839 6.8839 7.1409 7.1409 7.1589 7.1589 10.9448 10.9448 10.9661 10.9661 11.7508 11.7508 11.7556 11.7556 k = 0.2089 1.0718 1.3507 ( 4574 PWs) bands (ev): -33.2479 -33.2479 -33.2479 -33.2479 -14.3502 -14.3502 -14.3496 -14.3496 -12.9712 -12.9712 -12.9700 -12.9700 -12.9028 -12.9028 -12.9022 -12.9022 -0.1591 -0.1591 -0.1570 -0.1570 0.7591 0.7591 0.7612 0.7612 2.4062 2.4062 2.4110 2.4110 4.0225 4.0225 4.0303 4.0303 5.4412 5.4412 5.4637 5.4637 6.7630 6.7630 6.8015 6.8015 6.8576 6.8576 6.8821 6.8821 7.1572 7.1572 7.1744 7.1744 10.9379 10.9379 10.9588 10.9588 11.7358 11.7358 11.7397 11.7397 k = 0.2025 1.0394 1.3507 ( 4564 PWs) bands (ev): -33.2480 -33.2480 -33.2480 -33.2480 -14.3497 -14.3497 -14.3490 -14.3490 -12.9701 -12.9701 -12.9687 -12.9687 -12.9028 -12.9028 -12.9022 -12.9022 -0.1857 -0.1857 -0.1834 -0.1834 0.7607 0.7607 0.7632 0.7632 2.3746 2.3746 2.3800 2.3800 4.0871 4.0871 4.0952 4.0952 5.4710 5.4710 5.4940 5.4940 6.7749 6.7749 6.8087 6.8087 6.8623 6.8623 6.8801 6.8801 7.1774 7.1774 7.1940 7.1940 10.9314 10.9314 10.9520 10.9520 11.7225 11.7225 11.7256 11.7256 k = 0.1962 1.0069 1.3507 ( 4568 PWs) bands (ev): -33.2482 -33.2482 -33.2482 -33.2482 -14.3491 -14.3491 -14.3484 -14.3484 -12.9689 -12.9689 -12.9674 -12.9674 -12.9029 -12.9029 -12.9022 -12.9022 -0.2149 -0.2149 -0.2123 -0.2123 0.7625 0.7625 0.7654 0.7654 2.3399 2.3399 2.3459 2.3459 4.1592 4.1592 4.1676 4.1676 5.5053 5.5053 5.5288 5.5288 6.7847 6.7847 6.8074 6.8074 6.8736 6.8736 6.8786 6.8786 7.2017 7.2017 7.2179 7.2179 10.9264 10.9264 10.9467 10.9467 11.7103 11.7103 11.7123 11.7123 k = 0.1899 0.9744 1.3507 ( 4572 PWs) bands (ev): -33.2483 -33.2483 -33.2483 -33.2483 -14.3485 -14.3485 -14.3477 -14.3477 -12.9676 -12.9676 -12.9660 -12.9660 -12.9029 -12.9029 -12.9022 -12.9022 -0.2462 -0.2462 -0.2435 -0.2435 0.7646 0.7646 0.7678 0.7678 2.3027 2.3027 2.3091 2.3091 4.2382 4.2382 4.2468 4.2468 5.5433 5.5433 5.5674 5.5674 6.7913 6.7913 6.8000 6.8000 6.8790 6.8790 6.8894 6.8894 7.2302 7.2302 7.2464 7.2464 10.9238 10.9238 10.9439 10.9439 11.6978 11.6978 11.6987 11.6987 k = 0.1835 0.9419 1.3507 ( 4572 PWs) bands (ev): -33.2485 -33.2485 -33.2485 -33.2485 -14.3479 -14.3479 -14.3470 -14.3470 -12.9662 -12.9662 -12.9645 -12.9645 -12.9028 -12.9028 -12.9020 -12.9020 -0.2794 -0.2794 -0.2765 -0.2765 0.7668 0.7668 0.7704 0.7704 2.2633 2.2633 2.2701 2.2701 4.3239 4.3239 4.3327 4.3327 5.5844 5.5844 5.6089 5.6089 6.7884 6.7884 6.7928 6.7928 6.8832 6.8832 6.9077 6.9077 7.2633 7.2633 7.2797 7.2797 10.9243 10.9243 10.9443 10.9443 11.6833 11.6833 11.6835 11.6835 k = 0.1772 0.9094 1.3507 ( 4568 PWs) bands (ev): -33.2486 -33.2486 -33.2486 -33.2486 -14.3472 -14.3472 -14.3462 -14.3462 -12.9648 -12.9648 -12.9629 -12.9629 -12.9027 -12.9027 -12.9019 -12.9019 -0.3140 -0.3140 -0.3110 -0.3110 0.7691 0.7691 0.7730 0.7730 2.2222 2.2222 2.2294 2.2294 4.4157 4.4157 4.4247 4.4247 5.6276 5.6276 5.6525 5.6525 6.7739 6.7739 6.7882 6.7882 6.8925 6.8925 6.9277 6.9277 7.3012 7.3012 7.3179 7.3179 10.9284 10.9284 10.9484 10.9484 11.6642 11.6642 11.6655 11.6655 k = 0.1709 0.8770 1.3507 ( 4568 PWs) bands (ev): -33.2488 -33.2488 -33.2488 -33.2488 -14.3464 -14.3464 -14.3454 -14.3454 -12.9633 -12.9633 -12.9613 -12.9613 -12.9025 -12.9025 -12.9016 -12.9016 -0.3497 -0.3497 -0.3465 -0.3465 0.7714 0.7714 0.7756 0.7756 2.1799 2.1799 2.1874 2.1874 4.5133 4.5133 4.5225 4.5225 5.6723 5.6723 5.6973 5.6973 6.7569 6.7569 6.7781 6.7781 6.9069 6.9069 6.9493 6.9493 7.3439 7.3439 7.3613 7.3613 10.9367 10.9367 10.9565 10.9565 11.6395 11.6395 11.6417 11.6417 k = 0.1646 0.8445 1.3507 ( 4560 PWs) bands (ev): -33.2490 -33.2490 -33.2490 -33.2490 -14.3456 -14.3456 -14.3445 -14.3445 -12.9619 -12.9619 -12.9598 -12.9598 -12.9021 -12.9021 -12.9012 -12.9012 -0.3861 -0.3861 -0.3829 -0.3829 0.7737 0.7737 0.7782 0.7782 2.1368 2.1368 2.1445 2.1445 4.6162 4.6162 4.6255 4.6255 5.7175 5.7175 5.7425 5.7425 6.7378 6.7378 6.7636 6.7636 6.9256 6.9256 6.9723 6.9723 7.3919 7.3919 7.4101 7.4101 10.9493 10.9493 10.9691 10.9691 11.6074 11.6074 11.6103 11.6103 k = 0.1582 0.8120 1.3507 ( 4576 PWs) bands (ev): -33.2492 -33.2492 -33.2492 -33.2492 -14.3448 -14.3448 -14.3437 -14.3437 -12.9604 -12.9604 -12.9583 -12.9583 -12.9016 -12.9016 -12.9007 -12.9007 -0.4230 -0.4230 -0.4197 -0.4197 0.7760 0.7760 0.7808 0.7808 2.0931 2.0931 2.1010 2.1010 4.7240 4.7240 4.7334 4.7334 5.7628 5.7628 5.7874 5.7874 6.7169 6.7169 6.7460 6.7460 6.9480 6.9480 6.9970 6.9970 7.4452 7.4452 7.4645 7.4645 10.9665 10.9665 10.9861 10.9861 11.5671 11.5671 11.5702 11.5702 k = 0.1519 0.7795 1.3507 ( 4564 PWs) bands (ev): -33.2494 -33.2494 -33.2494 -33.2494 -14.3439 -14.3439 -14.3428 -14.3428 -12.9591 -12.9591 -12.9569 -12.9569 -12.9010 -12.9010 -12.9001 -12.9001 -0.4601 -0.4601 -0.4567 -0.4567 0.7783 0.7783 0.7833 0.7833 2.0494 2.0494 2.0573 2.0573 4.8362 4.8362 4.8456 4.8456 5.8075 5.8075 5.8313 5.8313 6.6948 6.6948 6.7261 6.7261 6.9736 6.9736 7.0235 7.0235 7.5041 7.5041 7.5247 7.5247 10.9884 10.9884 11.0077 11.0077 11.5183 11.5183 11.5216 11.5216 k = 0.1456 0.7470 1.3507 ( 4568 PWs) bands (ev): -33.2496 -33.2496 -33.2496 -33.2496 -14.3430 -14.3430 -14.3419 -14.3419 -12.9578 -12.9578 -12.9556 -12.9556 -12.9002 -12.9002 -12.8993 -12.8993 -0.4971 -0.4971 -0.4937 -0.4937 0.7804 0.7804 0.7856 0.7856 2.0058 2.0058 2.0138 2.0138 4.9521 4.9521 4.9614 4.9614 5.8512 5.8512 5.8738 5.8738 6.6718 6.6718 6.7048 6.7048 7.0025 7.0025 7.0519 7.0519 7.5686 7.5686 7.5907 7.5907 11.0150 11.0150 11.0339 11.0339 11.4618 11.4618 11.4652 11.4652 k = 0.1392 0.7146 1.3507 ( 4568 PWs) bands (ev): -33.2498 -33.2498 -33.2498 -33.2498 -14.3422 -14.3422 -14.3410 -14.3410 -12.9565 -12.9565 -12.9544 -12.9544 -12.8992 -12.8992 -12.8983 -12.8983 -0.5338 -0.5338 -0.5304 -0.5304 0.7825 0.7825 0.7878 0.7878 1.9626 1.9626 1.9706 1.9706 5.0709 5.0709 5.0802 5.0802 5.8937 5.8937 5.9145 5.9145 6.6485 6.6485 6.6828 6.6828 7.0343 7.0343 7.0823 7.0823 7.6389 7.6389 7.6626 7.6626 11.0463 11.0463 11.0646 11.0646 11.3986 11.3986 11.4022 11.4022 k = 0.1329 0.6821 1.3507 ( 4572 PWs) bands (ev): -33.2501 -33.2501 -33.2501 -33.2501 -14.3413 -14.3413 -14.3401 -14.3401 -12.9555 -12.9555 -12.9533 -12.9533 -12.8980 -12.8980 -12.8972 -12.8972 -0.5699 -0.5699 -0.5665 -0.5665 0.7844 0.7844 0.7899 0.7899 1.9201 1.9201 1.9281 1.9281 5.1918 5.1918 5.2007 5.2007 5.9351 5.9351 5.9536 5.9536 6.6255 6.6255 6.6607 6.6607 7.0692 7.0692 7.1148 7.1148 7.7150 7.7150 7.7405 7.7405 11.0822 11.0822 11.0996 11.0996 11.3298 11.3298 11.3341 11.3341 k = 0.1266 0.6496 1.3507 ( 4576 PWs) bands (ev): -33.2503 -33.2503 -33.2503 -33.2503 -14.3404 -14.3404 -14.3392 -14.3392 -12.9545 -12.9545 -12.9524 -12.9524 -12.8966 -12.8966 -12.8959 -12.8959 -0.6053 -0.6053 -0.6020 -0.6020 0.7861 0.7861 0.7917 0.7917 1.8786 1.8786 1.8864 1.8864 5.3130 5.3130 5.3214 5.3214 5.9762 5.9762 5.9917 5.9917 6.6034 6.6034 6.6393 6.6393 7.1069 7.1069 7.1494 7.1494 7.7968 7.7968 7.8242 7.8242 11.1226 11.1226 11.1379 11.1379 11.2564 11.2564 11.2626 11.2626 k = 0.1203 0.6171 1.3507 ( 4576 PWs) bands (ev): -33.2505 -33.2505 -33.2505 -33.2505 -14.3395 -14.3395 -14.3383 -14.3383 -12.9537 -12.9537 -12.9517 -12.9517 -12.8951 -12.8951 -12.8944 -12.8944 -0.6398 -0.6398 -0.6366 -0.6366 0.7878 0.7878 0.7934 0.7934 1.8382 1.8382 1.8458 1.8458 5.4325 5.4325 5.4400 5.4400 6.0184 6.0184 6.0302 6.0302 6.5831 6.5831 6.6194 6.6194 7.1474 7.1474 7.1862 7.1862 7.8843 7.8843 7.9135 7.9135 11.1644 11.1644 11.1663 11.1663 11.1803 11.1803 11.2038 11.2038 k = 0.1139 0.5846 1.3507 ( 4588 PWs) bands (ev): -33.2508 -33.2508 -33.2508 -33.2508 -14.3386 -14.3386 -14.3374 -14.3374 -12.9530 -12.9530 -12.9511 -12.9511 -12.8933 -12.8933 -12.8928 -12.8928 -0.6733 -0.6733 -0.6701 -0.6701 0.7892 0.7892 0.7949 0.7949 1.7990 1.7990 1.8065 1.8065 5.5467 5.5467 5.5527 5.5527 6.0644 6.0644 6.0719 6.0719 6.5654 6.5654 6.6020 6.6020 7.1904 7.1904 7.2251 7.2251 7.9773 7.9773 8.0084 8.0084 11.0986 11.0986 11.1008 11.1008 11.2166 11.2166 11.2363 11.2363 k = 0.1076 0.5522 1.3507 ( 4592 PWs) bands (ev): -33.2510 -33.2510 -33.2510 -33.2510 -14.3377 -14.3377 -14.3365 -14.3365 -12.9525 -12.9525 -12.9507 -12.9507 -12.8915 -12.8915 -12.8910 -12.8910 -0.7056 -0.7056 -0.7025 -0.7025 0.7905 0.7905 0.7962 0.7962 1.7613 1.7613 1.7686 1.7686 5.6501 5.6501 5.6540 5.6540 6.1184 6.1184 6.1207 6.1207 6.5519 6.5519 6.5883 6.5883 7.2359 7.2359 7.2661 7.2661 8.0756 8.0756 8.1085 8.1085 11.0158 11.0158 11.0207 11.0207 11.2694 11.2694 11.2867 11.2867 k = 0.1013 0.5197 1.3507 ( 4584 PWs) bands (ev): -33.2512 -33.2512 -33.2512 -33.2512 -14.3368 -14.3368 -14.3357 -14.3357 -12.9521 -12.9521 -12.9504 -12.9504 -12.8895 -12.8895 -12.8891 -12.8891 -0.7366 -0.7366 -0.7336 -0.7336 0.7917 0.7917 0.7973 0.7973 1.7252 1.7252 1.7323 1.7323 5.7362 5.7362 5.7375 5.7375 6.1815 6.1815 6.1843 6.1843 6.5449 6.5449 6.5804 6.5804 7.2836 7.2836 7.3092 7.3092 8.1787 8.1787 8.2135 8.2135 10.9306 10.9306 10.9377 10.9377 11.3257 11.3257 11.3413 11.3413 k = 0.0949 0.4872 1.3507 ( 4584 PWs) bands (ev): -33.2514 -33.2514 -33.2514 -33.2514 -14.3360 -14.3360 -14.3349 -14.3349 -12.9518 -12.9518 -12.9503 -12.9503 -12.8875 -12.8875 -12.8872 -12.8872 -0.7662 -0.7662 -0.7633 -0.7633 0.7927 0.7927 0.7982 0.7982 1.6909 1.6909 1.6976 1.6976 5.7992 5.7992 5.8002 5.8002 6.2547 6.2547 6.2608 6.2608 6.5499 6.5499 6.5829 6.5829 7.3334 7.3334 7.3543 7.3543 8.2865 8.2865 8.3231 8.3231 10.8434 10.8434 10.8525 10.8525 11.3849 11.3849 11.3985 11.3985 k = 0.0886 0.4547 1.3507 ( 4580 PWs) bands (ev): -33.2516 -33.2516 -33.2516 -33.2516 -14.3352 -14.3352 -14.3341 -14.3341 -12.9516 -12.9516 -12.9502 -12.9502 -12.8854 -12.8854 -12.8852 -12.8852 -0.7943 -0.7943 -0.7915 -0.7915 0.7935 0.7935 0.7989 0.7989 1.6583 1.6583 1.6648 1.6648 5.8401 5.8401 5.8423 5.8423 6.3302 6.3302 6.3344 6.3344 6.5794 6.5794 6.6054 6.6054 7.3852 7.3852 7.4015 7.4015 8.3986 8.3986 8.4370 8.4370 10.7541 10.7541 10.7654 10.7654 11.4460 11.4460 11.4569 11.4569 k = 0.0823 0.4222 1.3507 ( 4572 PWs) bands (ev): -33.2518 -33.2518 -33.2518 -33.2518 -14.3344 -14.3344 -14.3334 -14.3334 -12.9516 -12.9516 -12.9502 -12.9502 -12.8833 -12.8833 -12.8831 -12.8831 -0.8207 -0.8207 -0.8181 -0.8181 0.7942 0.7942 0.7994 0.7994 1.6277 1.6277 1.6338 1.6338 5.8647 5.8647 5.8672 5.8672 6.3836 6.3836 6.3876 6.3876 6.6499 6.6499 6.6634 6.6634 7.4391 7.4391 7.4507 7.4507 8.5144 8.5144 8.5547 8.5547 10.6627 10.6627 10.6763 10.6763 11.5068 11.5068 11.5132 11.5132 k = 0.0759 0.3898 1.3507 ( 4564 PWs) bands (ev): -33.2519 -33.2519 -33.2519 -33.2519 -14.3337 -14.3337 -14.3327 -14.3327 -12.9515 -12.9515 -12.9503 -12.9503 -12.8812 -12.8812 -12.8811 -12.8811 -0.8455 -0.8455 -0.8430 -0.8430 0.7948 0.7948 0.7998 0.7998 1.5992 1.5992 1.6049 1.6049 5.8777 5.8777 5.8801 5.8801 6.4064 6.4064 6.4178 6.4178 6.7585 6.7585 6.7607 6.7607 7.4954 7.4954 7.5024 7.5024 8.6336 8.6336 8.6758 8.6758 10.5688 10.5688 10.5848 10.5848 11.5570 11.5570 11.5612 11.5612 k = 0.0696 0.3573 1.3507 ( 4564 PWs) bands (ev): -33.2521 -33.2521 -33.2521 -33.2521 -14.3330 -14.3330 -14.3321 -14.3321 -12.9516 -12.9516 -12.9505 -12.9505 -12.8792 -12.8792 -12.8792 -12.8792 -0.8685 -0.8685 -0.8662 -0.8662 0.7952 0.7952 0.8000 0.8000 1.5727 1.5727 1.5781 1.5781 5.8830 5.8830 5.8851 5.8851 6.4159 6.4159 6.4305 6.4305 6.8825 6.8825 6.8873 6.8873 7.5546 7.5546 7.5571 7.5571 8.7557 8.7557 8.8000 8.8000 10.4718 10.4718 10.4902 10.4902 11.5467 11.5467 11.5727 11.5727 k = 0.0633 0.3248 1.3507 ( 4568 PWs) bands (ev): -33.2523 -33.2523 -33.2523 -33.2523 -14.3324 -14.3324 -14.3315 -14.3315 -12.9517 -12.9517 -12.9507 -12.9507 -12.8773 -12.8773 -12.8772 -12.8772 -0.8897 -0.8897 -0.8875 -0.8875 0.7956 0.7956 0.8001 0.8001 1.5484 1.5484 1.5533 1.5533 5.8830 5.8830 5.8847 5.8847 6.4202 6.4202 6.4355 6.4355 7.0147 7.0147 7.0240 7.0240 7.6161 7.6161 7.6180 7.6180 8.8801 8.8801 8.9267 8.9267 10.3711 10.3711 10.3916 10.3916 11.4352 11.4352 11.4541 11.4541 k = 0.0570 0.2923 1.3507 ( 4568 PWs) bands (ev): -33.2524 -33.2524 -33.2524 -33.2524 -14.3318 -14.3318 -14.3310 -14.3310 -12.9518 -12.9518 -12.9509 -12.9509 -12.8754 -12.8754 -12.8754 -12.8754 -0.9090 -0.9090 -0.9070 -0.9070 0.7959 0.7959 0.8000 0.8000 1.5263 1.5263 1.5308 1.5308 5.8795 5.8795 5.8810 5.8810 6.4226 6.4226 6.4373 6.4373 7.1481 7.1481 7.1606 7.1606 7.6821 7.6821 7.6881 7.6881 9.0063 9.0063 9.0554 9.0554 10.2654 10.2654 10.2876 10.2876 11.2848 11.2848 11.2918 11.2918 k = 0.0506 0.2598 1.3507 ( 4576 PWs) bands (ev): -33.2526 -33.2526 -33.2526 -33.2526 -14.3312 -14.3312 -14.3305 -14.3305 -12.9519 -12.9519 -12.9512 -12.9512 -12.8737 -12.8737 -12.8737 -12.8737 -0.9264 -0.9264 -0.9246 -0.9246 0.7961 0.7961 0.7998 0.7998 1.5065 1.5065 1.5105 1.5105 5.8740 5.8740 5.8753 5.8753 6.4242 6.4242 6.4378 6.4378 7.2749 7.2749 7.2896 7.2896 7.7594 7.7594 7.7687 7.7687 9.1336 9.1336 9.1855 9.1855 10.1535 10.1535 10.1769 10.1769 11.1292 11.1292 11.1320 11.1320 k = 0.0443 0.2274 1.3507 ( 4572 PWs) bands (ev): -33.2527 -33.2527 -33.2527 -33.2527 -14.3307 -14.3307 -14.3301 -14.3301 -12.9520 -12.9520 -12.9514 -12.9514 -12.8722 -12.8722 -12.8721 -12.8721 -0.9418 -0.9418 -0.9402 -0.9402 0.7962 0.7962 0.7996 0.7996 1.4889 1.4889 1.4925 1.4925 5.8675 5.8675 5.8686 5.8686 6.4256 6.4256 6.4376 6.4376 7.3880 7.3880 7.4033 7.4033 7.8535 7.8535 7.8647 7.8647 9.2611 9.2611 9.3165 9.3165 10.0339 10.0339 10.0578 10.0578 10.9739 10.9739 10.9863 10.9863 k = 0.0380 0.1949 1.3507 ( 4568 PWs) bands (ev): -33.2528 -33.2528 -33.2528 -33.2528 -14.3303 -14.3303 -14.3297 -14.3297 -12.9522 -12.9522 -12.9516 -12.9516 -12.8708 -12.8708 -12.8707 -12.8707 -0.9552 -0.9552 -0.9539 -0.9539 0.7963 0.7963 0.7993 0.7993 1.4737 1.4737 1.4768 1.4768 5.8606 5.8606 5.8615 5.8615 6.4269 6.4269 6.4372 6.4372 7.4817 7.4817 7.4958 7.4958 7.9686 7.9686 7.9797 7.9797 9.3872 9.3872 9.4473 9.4473 9.9058 9.9058 9.9301 9.9301 10.8287 10.8287 10.8514 10.8514 k = 0.0316 0.1624 1.3507 ( 4568 PWs) bands (ev): -33.2529 -33.2529 -33.2529 -33.2529 -14.3299 -14.3299 -14.3294 -14.3294 -12.9523 -12.9523 -12.9518 -12.9518 -12.8696 -12.8696 -12.8695 -12.8695 -0.9666 -0.9666 -0.9655 -0.9655 0.7964 0.7964 0.7989 0.7989 1.4609 1.4609 1.4635 1.4635 5.8540 5.8540 5.8548 5.8548 6.4281 6.4281 6.4366 6.4366 7.5549 7.5549 7.5664 7.5664 8.1038 8.1038 8.1133 8.1133 9.5078 9.5078 9.5755 9.5755 9.7701 9.7701 9.7970 9.7970 10.6946 10.6946 10.7280 10.7280 k = 0.0253 0.1299 1.3507 ( 4572 PWs) bands (ev): -33.2530 -33.2530 -33.2530 -33.2530 -14.3295 -14.3295 -14.3292 -14.3292 -12.9524 -12.9524 -12.9520 -12.9520 -12.8686 -12.8686 -12.8685 -12.8685 -0.9759 -0.9759 -0.9750 -0.9750 0.7965 0.7965 0.7986 0.7986 1.4504 1.4504 1.4525 1.4525 5.8481 5.8481 5.8487 5.8487 6.4292 6.4292 6.4360 6.4360 7.6098 7.6098 7.6184 7.6184 8.2539 8.2539 8.2612 8.2612 9.5760 9.5760 9.6100 9.6100 9.7052 9.7052 9.7178 9.7178 10.5711 10.5711 10.6150 10.6150 k = 0.0190 0.0974 1.3507 ( 4572 PWs) bands (ev): -33.2530 -33.2530 -33.2530 -33.2530 -14.3293 -14.3293 -14.3290 -14.3290 -12.9525 -12.9525 -12.9522 -12.9522 -12.8678 -12.8678 -12.8677 -12.8677 -0.9832 -0.9832 -0.9825 -0.9825 0.7967 0.7967 0.7982 0.7982 1.4423 1.4423 1.4439 1.4439 5.8432 5.8432 5.8437 5.8437 6.4303 6.4303 6.4354 6.4354 7.6497 7.6497 7.6557 7.6557 8.4131 8.4131 8.4182 8.4182 9.4620 9.4620 9.4621 9.4621 9.7856 9.7856 9.8382 9.8382 10.4561 10.4561 10.5091 10.5091 k = 0.0127 0.0650 1.3507 ( 4560 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3291 -14.3291 -14.3289 -14.3289 -12.9525 -12.9525 -12.9523 -12.9523 -12.8672 -12.8672 -12.8671 -12.8671 -0.9883 -0.9883 -0.9879 -0.9879 0.7968 0.7968 0.7979 0.7979 1.4365 1.4365 1.4376 1.4376 5.8396 5.8396 5.8399 5.8399 6.4313 6.4313 6.4347 6.4347 7.6771 7.6771 7.6808 7.6808 8.5754 8.5754 8.5784 8.5784 9.3056 9.3056 9.3081 9.3081 9.8994 9.8994 9.9597 9.9597 10.3469 10.3469 10.4066 10.4066 k = 0.0063 0.0325 1.3507 ( 4562 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3288 -14.3288 -12.9525 -12.9525 -12.9524 -12.9524 -12.8668 -12.8668 -12.8668 -12.8668 -0.9914 -0.9914 -0.9911 -0.9911 0.7970 0.7970 0.7975 0.7975 1.4332 1.4332 1.4337 1.4337 5.8374 5.8374 5.8375 5.8375 6.4323 6.4323 6.4339 6.4339 7.6933 7.6933 7.6951 7.6951 8.7297 8.7297 8.7309 8.7309 9.1553 9.1553 9.1571 9.1571 10.0124 10.0124 10.0746 10.0746 10.2420 10.2420 10.3042 10.3042 k = 0.0000 0.0000 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9923 -0.9923 -0.9923 -0.9923 0.7973 0.7973 0.7973 0.7973 1.4323 1.4323 1.4323 1.4323 5.8367 5.8367 5.8367 5.8367 6.4331 6.4331 6.4331 6.4331 7.6993 7.6993 7.6993 7.6993 8.8190 8.8190 8.8190 8.8190 9.0684 9.0684 9.0684 9.0684 10.1153 10.1153 10.1153 10.1153 10.2052 10.2052 10.2052 10.2052 k = 0.0000 0.0000 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9923 -0.9923 -0.9923 -0.9923 0.7973 0.7973 0.7973 0.7973 1.4323 1.4323 1.4323 1.4323 5.8367 5.8367 5.8367 5.8367 6.4331 6.4331 6.4331 6.4331 7.6993 7.6993 7.6993 7.6993 8.8190 8.8190 8.8190 8.8190 9.0684 9.0684 9.0684 9.0684 10.1153 10.1153 10.1153 10.1153 10.2052 10.2052 10.2052 10.2052 k = 0.0000 0.0000 1.3177 ( 4568 PWs) bands (ev): -33.2532 -33.2532 -33.2530 -33.2530 -14.3295 -14.3295 -14.3281 -14.3281 -12.9534 -12.9534 -12.9513 -12.9513 -12.8673 -12.8673 -12.8661 -12.8661 -1.0948 -1.0948 -0.8878 -0.8878 0.7113 0.7113 0.8807 0.8807 1.3345 1.3345 1.5349 1.5349 5.7549 5.7549 5.9192 5.9192 6.3660 6.3660 6.5040 6.5040 7.6980 7.6980 7.6982 7.6982 8.7476 8.7476 8.8917 8.8917 9.0289 9.0289 9.0909 9.0909 10.0995 10.0995 10.1093 10.1093 10.1835 10.1835 10.2765 10.2765 k = 0.0000 0.0000 1.2848 ( 4566 PWs) bands (ev): -33.2534 -33.2534 -33.2529 -33.2529 -14.3299 -14.3299 -14.3273 -14.3273 -12.9540 -12.9540 -12.9499 -12.9499 -12.8679 -12.8679 -12.8656 -12.8656 -1.1952 -1.1952 -0.7813 -0.7813 0.6245 0.6245 0.9562 0.9562 1.2468 1.2468 1.6409 1.6409 5.6757 5.6757 5.9973 5.9973 6.3075 6.3075 6.5768 6.5768 7.6933 7.6933 7.6958 7.6958 8.6809 8.6809 8.9606 8.9606 8.9772 8.9772 9.0946 9.0946 10.0472 10.0472 10.1202 10.1202 10.2258 10.2258 10.3587 10.3587 k = 0.0000 0.0000 1.2518 ( 4572 PWs) bands (ev): -33.2536 -33.2536 -33.2528 -33.2528 -14.3303 -14.3303 -14.3264 -14.3264 -12.9543 -12.9543 -12.9482 -12.9482 -12.8685 -12.8685 -12.8651 -12.8651 -1.2935 -1.2935 -0.6729 -0.6729 0.5377 0.5377 1.0010 1.0010 1.1914 1.1914 1.7495 1.7495 5.6002 5.6002 6.0541 6.0541 6.2743 6.2743 6.6507 6.6507 7.6837 7.6837 7.6929 7.6929 8.6215 8.6215 8.9130 8.9130 9.0224 9.0224 9.0823 9.0823 10.0008 10.0008 10.1524 10.1524 10.2895 10.2895 10.4456 10.4456 k = 0.0000 0.0000 1.2189 ( 4572 PWs) bands (ev): -33.2539 -33.2539 -33.2527 -33.2527 -14.3305 -14.3305 -14.3253 -14.3253 -12.9544 -12.9544 -12.9463 -12.9463 -12.8691 -12.8691 -12.8647 -12.8647 -1.3896 -1.3896 -0.5626 -0.5626 0.4514 0.4514 0.9709 0.9709 1.2126 1.2126 1.8604 1.8604 5.5290 5.5290 6.0569 6.0569 6.2991 6.2991 6.7251 6.7251 7.6677 7.6677 7.6901 7.6901 8.5717 8.5717 8.8442 8.8442 9.0351 9.0351 9.0885 9.0885 9.9721 9.9721 10.2036 10.2036 10.3650 10.3650 10.5352 10.5352 k = 0.0000 0.0000 1.1860 ( 4568 PWs) bands (ev): -33.2541 -33.2541 -33.2527 -33.2527 -14.3307 -14.3307 -14.3242 -14.3242 -12.9543 -12.9543 -12.9441 -12.9441 -12.8697 -12.8697 -12.8642 -12.8642 -1.4836 -1.4836 -0.4506 -0.4506 0.3658 0.3658 0.8959 0.8959 1.2798 1.2798 1.9736 1.9736 5.4629 5.4629 6.0143 6.0143 6.3729 6.3729 6.7995 6.7995 7.6441 7.6441 7.6877 7.6877 8.5331 8.5331 8.7719 8.7719 8.9949 8.9949 9.1160 9.1160 9.9680 9.9680 10.2700 10.2700 10.4483 10.4483 10.6265 10.6265 k = 0.0000 0.0000 1.1530 ( 4572 PWs) bands (ev): -33.2544 -33.2544 -33.2527 -33.2527 -14.3307 -14.3307 -14.3229 -14.3229 -12.9539 -12.9539 -12.9416 -12.9416 -12.8703 -12.8703 -12.8638 -12.8638 -1.5753 -1.5753 -0.3368 -0.3368 0.2813 0.2813 0.8109 0.8109 1.3578 1.3578 2.0888 2.0888 5.4023 5.4023 5.9562 5.9562 6.4657 6.4657 6.8736 6.8736 7.6123 7.6123 7.6862 7.6862 8.5065 8.5065 8.6983 8.6983 8.9421 8.9421 9.1244 9.1244 9.9924 9.9924 10.3472 10.3472 10.5368 10.5368 10.7185 10.7185 k = 0.0000 0.0000 1.1201 ( 4572 PWs) bands (ev): -33.2546 -33.2546 -33.2527 -33.2527 -14.3306 -14.3306 -14.3215 -14.3215 -12.9534 -12.9534 -12.9389 -12.9389 -12.8709 -12.8709 -12.8635 -12.8635 -1.6648 -1.6648 -0.2214 -0.2214 0.1980 0.1980 0.7243 0.7243 1.4377 1.4377 2.2058 2.2058 5.3477 5.3477 5.8936 5.8936 6.5663 6.5663 6.9469 6.9469 7.5722 7.5722 7.6856 7.6856 8.4911 8.4911 8.6264 8.6264 8.8827 8.8827 9.1110 9.1110 10.0449 10.0449 10.4312 10.4312 10.6283 10.6283 10.8105 10.8105 k = 0.0000 0.0000 1.0871 ( 4568 PWs) bands (ev): -33.2549 -33.2549 -33.2528 -33.2528 -14.3304 -14.3304 -14.3201 -14.3201 -12.9526 -12.9526 -12.9360 -12.9360 -12.8714 -12.8714 -12.8631 -12.8631 -1.7519 -1.7519 -0.1045 -0.1045 0.1162 0.1162 0.6385 0.6385 1.5169 1.5169 2.3248 2.3248 5.2997 5.2997 5.8299 5.8299 6.6711 6.6711 7.0188 7.0188 7.5248 7.5248 7.6861 7.6861 8.4805 8.4805 8.5629 8.5629 8.8197 8.8197 9.0794 9.0794 10.1210 10.1210 10.5178 10.5178 10.7206 10.7206 10.9018 10.9018 k = 0.0000 0.0000 1.0542 ( 4572 PWs) bands (ev): -33.2553 -33.2553 -33.2528 -33.2528 -14.3301 -14.3301 -14.3186 -14.3186 -12.9517 -12.9517 -12.9329 -12.9329 -12.8718 -12.8718 -12.8628 -12.8628 -1.8368 -1.8368 0.0123 0.0123 0.0373 0.0373 0.5541 0.5541 1.5940 1.5940 2.4454 2.4454 5.2589 5.2589 5.7663 5.7663 6.7785 6.7785 7.0887 7.0887 7.4713 7.4713 7.6878 7.6878 8.4488 8.4488 8.5337 8.5337 8.7547 8.7547 9.0349 9.0349 10.2153 10.2153 10.6019 10.6019 10.8109 10.8109 10.9915 10.9915 k = 0.0000 0.0000 1.0212 ( 4578 PWs) bands (ev): -33.2556 -33.2556 -33.2529 -33.2529 -14.3297 -14.3297 -14.3169 -14.3169 -12.9506 -12.9506 -12.9295 -12.9295 -12.8722 -12.8722 -12.8625 -12.8625 -1.9193 -1.9193 -0.0436 -0.0436 0.1342 0.1342 0.4717 0.4717 1.6682 1.6682 2.5677 2.5677 5.2258 5.2258 5.7034 5.7034 6.8877 6.8877 7.1555 7.1555 7.4134 7.4134 7.6907 7.6907 8.3906 8.3906 8.5437 8.5437 8.6896 8.6896 8.9823 8.9823 10.3230 10.3230 10.6760 10.6760 10.8957 10.8957 11.0788 11.0788 k = 0.0000 0.0000 0.9883 ( 4578 PWs) bands (ev): -33.2560 -33.2560 -33.2530 -33.2530 -14.3293 -14.3293 -14.3153 -14.3153 -12.9494 -12.9494 -12.9260 -12.9260 -12.8725 -12.8725 -12.8623 -12.8623 -1.9994 -1.9994 -0.1206 -0.1206 0.2551 0.2551 0.3913 0.3913 1.7386 1.7386 2.6915 2.6915 5.2009 5.2009 5.6416 5.6416 6.9980 6.9980 7.2175 7.2175 7.3532 7.3532 7.6948 7.6948 8.3291 8.3291 8.5667 8.5667 8.6279 8.6279 8.9247 8.9247 10.4404 10.4404 10.7293 10.7293 10.9699 10.9699 11.1614 11.1614 k = 0.0000 0.0000 0.9554 ( 4591 PWs) bands (ev): -33.2564 -33.2564 -33.2531 -33.2531 -14.3288 -14.3288 -14.3135 -14.3135 -12.9481 -12.9481 -12.9223 -12.9223 -12.8726 -12.8726 -12.8620 -12.8620 -2.0771 -2.0771 -0.1958 -0.1958 0.3128 0.3128 0.3777 0.3777 1.8048 1.8048 2.8167 2.8167 5.1849 5.1849 5.5811 5.5811 7.1085 7.1085 7.2619 7.2619 7.3036 7.3036 7.7001 7.7001 8.2714 8.2714 8.5494 8.5494 8.6170 8.6170 8.8647 8.8647 10.5648 10.5648 10.7503 10.7503 11.0272 11.0272 11.2304 11.2304 k = 0.0000 0.0000 0.9224 ( 4589 PWs) bands (ev): -33.2568 -33.2568 -33.2532 -33.2532 -14.3282 -14.3282 -14.3117 -14.3117 -12.9468 -12.9468 -12.9185 -12.9185 -12.8726 -12.8726 -12.8617 -12.8617 -2.1524 -2.1524 -0.2692 -0.2692 0.2371 0.2371 0.5008 0.5008 1.8662 1.8662 2.9433 2.9433 5.1781 5.1781 5.5220 5.5220 7.2136 7.2136 7.2224 7.2224 7.3349 7.3349 7.7066 7.7066 8.2206 8.2206 8.4895 8.4895 8.6575 8.6575 8.8037 8.8037 10.6894 10.6894 10.7410 10.7410 11.0654 11.0654 11.2965 11.2965 k = 0.0000 0.0000 0.8895 ( 4585 PWs) bands (ev): -33.2571 -33.2571 -33.2534 -33.2534 -14.3275 -14.3275 -14.3099 -14.3099 -12.9454 -12.9454 -12.9146 -12.9146 -12.8725 -12.8725 -12.8614 -12.8614 -2.2252 -2.2252 -0.3406 -0.3406 0.1636 0.1636 0.6249 0.6249 1.9223 1.9223 3.0711 3.0711 5.1811 5.1811 5.4644 5.4644 7.1542 7.1542 7.3233 7.3233 7.3800 7.3800 7.7142 7.7142 8.1790 8.1790 8.4285 8.4285 8.7068 8.7068 8.7434 8.7434 10.6876 10.6876 10.8349 10.8349 11.0886 11.0886 11.3779 11.3779 k = 0.0000 0.0000 0.8565 ( 4583 PWs) bands (ev): -33.2575 -33.2575 -33.2535 -33.2535 -14.3268 -14.3268 -14.3080 -14.3080 -12.9440 -12.9440 -12.9106 -12.9106 -12.8721 -12.8721 -12.8611 -12.8611 -2.2956 -2.2956 -0.4099 -0.4099 0.0924 0.0924 0.7497 0.7497 1.9727 1.9727 3.1999 3.1999 5.1940 5.1940 5.4084 5.4084 7.0901 7.0901 7.3897 7.3897 7.4508 7.4508 7.7232 7.7232 8.1491 8.1491 8.3694 8.3694 8.6822 8.6822 8.7642 8.7642 10.6296 10.6296 10.9701 10.9701 11.1023 11.1023 11.4666 11.4666 k = 0.0000 0.0000 0.8236 ( 4579 PWs) bands (ev): -33.2579 -33.2579 -33.2537 -33.2537 -14.3260 -14.3260 -14.3061 -14.3061 -12.9427 -12.9427 -12.9066 -12.9066 -12.8715 -12.8715 -12.8607 -12.8607 -2.3635 -2.3635 -0.4771 -0.4771 0.0237 0.0237 0.8752 0.8752 2.0172 2.0172 3.3297 3.3297 5.2169 5.2169 5.3544 5.3544 7.0266 7.0266 7.4102 7.4102 7.5503 7.5503 7.7344 7.7344 8.1322 8.1322 8.3134 8.3134 8.6240 8.6240 8.8253 8.8253 10.5619 10.5619 11.0806 11.0806 11.1359 11.1359 11.5445 11.5445 k = 0.0000 0.0000 0.7906 ( 4583 PWs) bands (ev): -33.2584 -33.2584 -33.2539 -33.2539 -14.3252 -14.3252 -14.3042 -14.3042 -12.9415 -12.9415 -12.9027 -12.9027 -12.8707 -12.8707 -12.8601 -12.8601 -2.4289 -2.4289 -0.5421 -0.5421 -0.0425 -0.0425 1.0009 1.0009 2.0557 2.0557 3.4602 3.4602 5.2487 5.2487 5.3037 5.3037 6.9641 6.9641 7.4119 7.4119 7.6450 7.6450 7.7515 7.7515 8.1283 8.1283 8.2621 8.2621 8.5679 8.5679 8.8914 8.8914 10.4901 10.4901 11.0915 11.0915 11.2641 11.2641 11.6083 11.6083 k = 0.0000 0.0000 0.7577 ( 4579 PWs) bands (ev): -33.2588 -33.2588 -33.2540 -33.2540 -14.3244 -14.3244 -14.3023 -14.3023 -12.9404 -12.9404 -12.8989 -12.8989 -12.8696 -12.8696 -12.8595 -12.8595 -2.4918 -2.4918 -0.6049 -0.6049 -0.1063 -0.1063 1.1268 1.1268 2.0881 2.0881 3.5912 3.5912 5.2460 5.2460 5.2995 5.2995 6.9031 6.9031 7.3991 7.3991 7.7117 7.7117 7.7922 7.7922 8.1337 8.1337 8.2191 8.2191 8.5144 8.5144 8.9620 8.9620 10.4173 10.4173 11.0846 11.0846 11.4048 11.4048 11.6653 11.6653 k = 0.0000 0.0000 0.7247 ( 4581 PWs) bands (ev): -33.2592 -33.2592 -33.2542 -33.2542 -14.3235 -14.3235 -14.3004 -14.3004 -12.9394 -12.9394 -12.8953 -12.8953 -12.8682 -12.8682 -12.8586 -12.8586 -2.5521 -2.5521 -0.6654 -0.6654 -0.1675 -0.1675 1.2527 1.2527 2.1146 2.1146 3.7226 3.7226 5.1991 5.1991 5.3514 5.3514 6.8439 6.8439 7.3746 7.3746 7.7382 7.7382 7.8632 7.8632 8.1367 8.1367 8.1971 8.1971 8.4643 8.4643 9.0368 9.0368 10.3456 10.3456 11.0724 11.0724 11.5420 11.5420 11.7165 11.7165 k = 0.0000 0.0000 0.6918 ( 4579 PWs) bands (ev): -33.2596 -33.2596 -33.2544 -33.2544 -14.3227 -14.3227 -14.2985 -14.2985 -12.9385 -12.9385 -12.8919 -12.8919 -12.8666 -12.8666 -12.8575 -12.8575 -2.6099 -2.6099 -0.7235 -0.7235 -0.2262 -0.2262 1.3781 1.3781 2.1356 2.1356 3.8542 3.8542 5.1523 5.1523 5.4150 5.4150 6.7866 6.7866 7.3416 7.3416 7.7518 7.7518 7.9257 7.9257 8.1319 8.1319 8.2078 8.2078 8.4186 8.4186 9.1156 9.1156 10.2764 10.2764 11.0568 11.0568 11.6550 11.6550 11.7331 11.7331 k = 0.0000 0.0000 0.6589 ( 4579 PWs) bands (ev): -33.2600 -33.2600 -33.2547 -33.2547 -14.3218 -14.3218 -14.2967 -14.2967 -12.9379 -12.9379 -12.8889 -12.8889 -12.8648 -12.8648 -12.8560 -12.8560 -2.6651 -2.6651 -0.7793 -0.7793 -0.2824 -0.2824 1.5030 1.5030 2.1514 2.1514 3.9856 3.9856 5.1071 5.1071 5.4881 5.4881 6.7314 6.7314 7.3026 7.3026 7.7617 7.7617 7.9509 7.9509 8.1498 8.1498 8.2344 8.2344 8.3792 8.3792 9.1981 9.1981 10.2108 10.2108 11.0385 11.0385 11.6727 11.6727 11.7218 11.7218 k = 0.0000 0.0000 0.6259 ( 4583 PWs) bands (ev): -33.2604 -33.2604 -33.2549 -33.2549 -14.3209 -14.3209 -14.2948 -14.2948 -12.9373 -12.9373 -12.8864 -12.8864 -12.8627 -12.8627 -12.8541 -12.8541 -2.7177 -2.7177 -0.8326 -0.8326 -0.3359 -0.3359 1.6269 1.6269 2.1625 2.1625 4.1165 4.1165 5.0638 5.0638 5.5700 5.5700 6.6785 6.6785 7.2600 7.2600 7.7695 7.7695 7.9396 7.9396 8.1890 8.1890 8.2683 8.2683 8.3504 8.3504 9.2844 9.2844 10.1494 10.1494 11.0182 11.0182 11.6373 11.6373 11.6998 11.6998 k = 0.0000 0.0000 0.5930 ( 4583 PWs) bands (ev): -33.2608 -33.2608 -33.2551 -33.2551 -14.3201 -14.3201 -14.2930 -14.2930 -12.9369 -12.9369 -12.8842 -12.8842 -12.8605 -12.8605 -12.8518 -12.8518 -2.7677 -2.7677 -0.8834 -0.8834 -0.3869 -0.3869 1.7493 1.7493 2.1695 2.1695 4.2467 4.2467 5.0225 5.0225 5.6601 5.6601 6.6278 6.6278 7.2152 7.2152 7.7751 7.7751 7.9133 7.9133 8.2126 8.2126 8.3132 8.3132 8.3405 8.3405 9.3742 9.3742 10.0928 10.0928 10.9960 10.9960 11.5954 11.5954 11.6733 11.6734 k = 0.0000 0.0000 0.5600 ( 4589 PWs) bands (ev): -33.2612 -33.2612 -33.2553 -33.2553 -14.3192 -14.3192 -14.2913 -14.2913 -12.9367 -12.9367 -12.8825 -12.8825 -12.8583 -12.8583 -12.8490 -12.8490 -2.8151 -2.8151 -0.9317 -0.9317 -0.4352 -0.4352 1.8699 1.8699 2.1731 2.1731 4.3756 4.3756 4.9832 4.9832 5.7575 5.7575 6.5797 6.5797 7.1695 7.1695 7.7784 7.7784 7.8835 7.8835 8.2079 8.2079 8.3506 8.3506 8.3671 8.3671 9.4674 9.4674 10.0412 10.0412 10.9715 10.9715 11.5540 11.5540 11.6470 11.6470 k = 0.0000 0.0000 0.5271 ( 4589 PWs) bands (ev): -33.2616 -33.2616 -33.2555 -33.2555 -14.3184 -14.3184 -14.2896 -14.2896 -12.9366 -12.9366 -12.8811 -12.8811 -12.8559 -12.8559 -12.8459 -12.8459 -2.8599 -2.8599 -0.9774 -0.9774 -0.4809 -0.4809 1.9876 1.9876 2.1746 2.1746 4.5029 4.5029 4.9462 4.9462 5.8616 5.8616 6.5340 6.5340 7.1237 7.1237 7.7786 7.7786 7.8544 7.8544 8.1910 8.1910 8.3692 8.3692 8.4195 8.4195 9.5640 9.5640 9.9948 9.9948 10.9441 10.9441 11.5160 11.5160 11.6223 11.6223 k = 0.0000 0.0000 0.4941 ( 4589 PWs) bands (ev): -33.2620 -33.2620 -33.2557 -33.2557 -14.3176 -14.3176 -14.2880 -14.2880 -12.9366 -12.9366 -12.8801 -12.8801 -12.8535 -12.8535 -12.8426 -12.8426 -2.9020 -2.9020 -1.0206 -1.0206 -0.5239 -0.5239 2.0976 2.0976 2.1786 2.1786 4.6277 4.6277 4.9116 4.9116 5.9715 5.9715 6.4909 6.4909 7.0785 7.0785 7.7753 7.7753 7.8283 7.8283 8.1728 8.1728 8.3878 8.3878 8.4649 8.4649 9.6638 9.6638 9.9529 9.9529 10.9125 10.9125 11.4836 11.4836 11.6000 11.6001 k = 0.0000 0.0000 0.4612 ( 4589 PWs) bands (ev): -33.2623 -33.2623 -33.2559 -33.2559 -14.3168 -14.3168 -14.2865 -14.2865 -12.9367 -12.9367 -12.8794 -12.8794 -12.8510 -12.8510 -12.8391 -12.8391 -2.9414 -2.9414 -1.0611 -1.0611 -0.5643 -0.5643 2.1519 2.1519 2.2335 2.2335 4.7482 4.7482 4.8810 4.8810 6.0864 6.0864 6.4506 6.4506 7.0345 7.0345 7.7677 7.7677 7.8065 7.8065 8.1570 8.1570 8.4032 8.4032 8.5010 8.5010 9.7667 9.7667 9.9150 9.9150 10.8751 10.8751 11.4584 11.4584 11.5812 11.5812 k = 0.0000 0.0000 0.4283 ( 4581 PWs) bands (ev): -33.2626 -33.2626 -33.2561 -33.2561 -14.3161 -14.3161 -14.2850 -14.2850 -12.9368 -12.9368 -12.8789 -12.8789 -12.8486 -12.8486 -12.8356 -12.8356 -2.9782 -2.9782 -1.0990 -1.0990 -0.6019 -0.6019 2.1521 2.1521 2.3373 2.3373 4.8308 4.8308 4.8871 4.8871 6.2049 6.2049 6.4133 6.4133 6.9924 6.9924 7.7558 7.7558 7.7896 7.7896 8.1448 8.1448 8.4139 8.4139 8.5270 8.5270 9.8724 9.8724 9.8801 9.8801 10.8305 10.8305 11.4418 11.4418 11.5667 11.5667 k = 0.0000 0.0000 0.3953 ( 4575 PWs) bands (ev): -33.2629 -33.2629 -33.2563 -33.2563 -14.3153 -14.3153 -14.2836 -14.2836 -12.9371 -12.9371 -12.8785 -12.8785 -12.8461 -12.8461 -12.8322 -12.8322 -3.0124 -3.0124 -1.1341 -1.1341 -0.6368 -0.6368 2.1462 2.1462 2.4421 2.4421 4.8129 4.8129 4.9922 4.9922 6.3223 6.3223 6.3827 6.3827 6.9528 6.9528 7.7419 7.7419 7.7763 7.7763 8.1362 8.1362 8.4192 8.4192 8.5428 8.5428 9.8468 9.8468 9.9812 9.9812 10.7776 10.7776 11.4347 11.4347 11.5570 11.5570 k = 0.0000 0.0000 0.3624 ( 4587 PWs) bands (ev): -33.2633 -33.2633 -33.2565 -33.2565 -14.3147 -14.3147 -14.2823 -14.2823 -12.9373 -12.9373 -12.8783 -12.8783 -12.8437 -12.8437 -12.8288 -12.8288 -3.0438 -3.0438 -1.1666 -1.1666 -0.6690 -0.6690 2.1386 2.1386 2.5432 2.5432 4.7877 4.7877 5.1022 5.1022 6.3407 6.3407 6.4549 6.4549 6.9172 6.9172 7.7285 7.7285 7.7648 7.7648 8.1308 8.1308 8.4185 8.4185 8.5491 8.5491 9.8142 9.8142 10.0925 10.0925 10.7161 10.7161 11.4373 11.4373 11.5526 11.5526 k = 0.0000 0.0000 0.3294 ( 4583 PWs) bands (ev): -33.2635 -33.2635 -33.2567 -33.2567 -14.3141 -14.3141 -14.2811 -14.2811 -12.9376 -12.9376 -12.8781 -12.8781 -12.8414 -12.8414 -12.8256 -12.8256 -3.0725 -3.0725 -1.1963 -1.1963 -0.6984 -0.6984 2.1304 2.1304 2.6394 2.6394 4.7638 4.7638 5.2076 5.2076 6.3126 6.3126 6.5733 6.5733 6.8893 6.8893 7.7165 7.7165 7.7551 7.7551 8.1281 8.1281 8.4115 8.4115 8.5467 8.5467 9.7815 9.7815 10.2060 10.2060 10.6473 10.6473 11.4493 11.4493 11.5527 11.5527 k = 0.0000 0.0000 0.2965 ( 4585 PWs) bands (ev): -33.2638 -33.2638 -33.2568 -33.2568 -14.3135 -14.3135 -14.2800 -14.2800 -12.9379 -12.9379 -12.8781 -12.8781 -12.8392 -12.8392 -12.8225 -12.8225 -3.0986 -3.0986 -1.2233 -1.2233 -0.7251 -0.7251 2.1219 2.1219 2.7297 2.7297 4.7419 4.7419 5.3070 5.3070 6.2860 6.2860 6.6768 6.6768 6.8817 6.8817 7.7059 7.7059 7.7481 7.7481 8.1273 8.1273 8.3975 8.3975 8.5368 8.5368 9.7483 9.7483 10.3208 10.3208 10.5737 10.5737 11.4697 11.4697 11.5564 11.5564 k = 0.0000 0.0000 0.2635 ( 4587 PWs) bands (ev): -33.2640 -33.2640 -33.2570 -33.2570 -14.3130 -14.3130 -14.2791 -14.2791 -12.9382 -12.9382 -12.8780 -12.8780 -12.8371 -12.8371 -12.8197 -12.8197 -3.1219 -3.1219 -1.2475 -1.2475 -0.7490 -0.7490 2.1136 2.1136 2.8133 2.8133 4.7222 4.7222 5.3994 5.3994 6.2619 6.2619 6.7282 6.7282 6.9300 6.9300 7.6960 7.6960 7.7451 7.7451 8.1279 8.1279 8.3763 8.3763 8.5206 8.5206 9.7148 9.7148 10.4260 10.4260 10.5082 10.5082 11.4969 11.4969 11.5618 11.5618 k = 0.0000 0.0000 0.2306 ( 4595 PWs) bands (ev): -33.2643 -33.2643 -33.2571 -33.2571 -14.3125 -14.3125 -14.2782 -14.2782 -12.9385 -12.9385 -12.8780 -12.8780 -12.8353 -12.8353 -12.8172 -12.8172 -3.1425 -3.1425 -1.2688 -1.2688 -0.7702 -0.7702 2.1057 2.1057 2.8895 2.8895 4.7047 4.7047 5.4836 5.4836 6.2405 6.2405 6.7273 6.7273 7.0338 7.0338 7.6863 7.6863 7.7467 7.7467 8.1293 8.1293 8.3473 8.3473 8.4996 8.4996 9.6816 9.6816 10.4029 10.4029 10.5725 10.5725 11.5287 11.5287 11.5672 11.5672 k = 0.0000 0.0000 0.1977 ( 4593 PWs) bands (ev): -33.2645 -33.2645 -33.2572 -33.2572 -14.3121 -14.3121 -14.2774 -14.2774 -12.9388 -12.9388 -12.8781 -12.8781 -12.8336 -12.8336 -12.8149 -12.8149 -3.1603 -3.1603 -1.2874 -1.2874 -0.7885 -0.7885 2.0985 2.0985 2.9576 2.9576 4.6894 4.6894 5.5588 5.5588 6.2219 6.2219 6.7107 6.7107 7.1555 7.1555 7.6770 7.6770 7.7530 7.7530 8.1308 8.1308 8.3100 8.3100 8.4752 8.4752 9.6496 9.6496 10.3299 10.3299 10.6906 10.6906 11.5596 11.5596 11.5736 11.5736 k = 0.0000 0.0000 0.1647 ( 4589 PWs) bands (ev): -33.2646 -33.2646 -33.2573 -33.2573 -14.3118 -14.3118 -14.2768 -14.2768 -12.9390 -12.9390 -12.8781 -12.8781 -12.8321 -12.8321 -12.8130 -12.8130 -3.1754 -3.1754 -1.3031 -1.3031 -0.8040 -0.8040 2.0920 2.0920 3.0167 3.0167 4.6765 4.6765 5.6240 5.6240 6.2062 6.2062 6.6920 6.6920 7.2810 7.2810 7.6686 7.6686 7.7631 7.7631 8.1316 8.1316 8.2643 8.2643 8.4489 8.4489 9.6200 9.6200 10.2599 10.2599 10.8119 10.8119 11.5661 11.5661 11.6008 11.6008 k = 0.0000 0.0000 0.1318 ( 4597 PWs) bands (ev): -33.2648 -33.2648 -33.2574 -33.2574 -14.3115 -14.3115 -14.2762 -14.2762 -12.9392 -12.9392 -12.8781 -12.8781 -12.8309 -12.8309 -12.8114 -12.8114 -3.1878 -3.1878 -1.3160 -1.3160 -0.8167 -0.8167 2.0866 2.0866 3.0661 3.0661 4.6659 4.6659 5.6785 5.6785 6.1933 6.1933 6.6748 6.6748 7.4055 7.4055 7.6618 7.6618 7.7757 7.7757 8.1300 8.1300 8.2114 8.2114 8.4226 8.4226 9.5938 9.5938 10.1978 10.1978 10.9329 10.9329 11.5620 11.5620 11.6325 11.6325 k = 0.0000 0.0000 0.0988 ( 4593 PWs) bands (ev): -33.2648 -33.2648 -33.2574 -33.2574 -14.3113 -14.3113 -14.2758 -14.2758 -12.9394 -12.9394 -12.8782 -12.8782 -12.8300 -12.8300 -12.8101 -12.8101 -3.1975 -3.1975 -1.3261 -1.3261 -0.8266 -0.8266 2.0822 2.0822 3.1054 3.1054 4.6577 4.6577 5.7216 5.7216 6.1833 6.1833 6.6606 6.6606 7.5251 7.5251 7.6579 7.6579 7.7893 7.7893 8.1131 8.1131 8.1634 8.1634 8.3984 8.3984 9.5722 9.5722 10.1466 10.1466 11.0502 11.0502 11.5550 11.5550 11.6599 11.6599 k = 0.0000 0.0000 0.0659 ( 4585 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3111 -14.3111 -14.2755 -14.2755 -12.9395 -12.9395 -12.8782 -12.8782 -12.8293 -12.8293 -12.8092 -12.8092 -3.2043 -3.2043 -1.3332 -1.3332 -0.8337 -0.8337 2.0791 2.0791 3.1338 3.1338 4.6518 4.6518 5.7527 5.7527 6.1761 6.1761 6.6501 6.6501 7.6222 7.6222 7.6724 7.6724 7.8021 7.8021 8.0528 8.0528 8.1486 8.1486 8.3787 8.3787 9.5561 9.5561 10.1084 10.1084 11.1578 11.1578 11.5478 11.5478 11.6807 11.6807 k = 0.0000 0.0000 0.0329 ( 4585 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9396 -12.9396 -12.8782 -12.8782 -12.8289 -12.8289 -12.8086 -12.8086 -3.2085 -3.2085 -1.3375 -1.3375 -0.8379 -0.8379 2.0771 2.0771 3.1510 3.1510 4.6482 4.6482 5.7715 5.7715 6.1718 6.1718 6.6436 6.6436 7.6395 7.6395 7.7559 7.7559 7.8163 7.8163 7.9715 7.9715 8.1462 8.1462 8.3657 8.3657 9.5462 9.5462 10.0849 10.0849 11.2419 11.2419 11.5423 11.5423 11.6931 11.6931 k = 0.0000 0.0000 0.0000 ( 4575 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3110 -14.3110 -14.2752 -14.2752 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2098 -3.2098 -1.3390 -1.3390 -0.8394 -0.8394 2.0765 2.0765 3.1567 3.1567 4.6470 4.6470 5.7778 5.7778 6.1704 6.1704 6.6414 6.6414 7.6402 7.6402 7.7957 7.7957 7.8599 7.8599 7.8986 7.8986 8.1457 8.1457 8.3612 8.3612 9.5429 9.5429 10.0770 10.0770 11.2761 11.2761 11.5403 11.5403 11.6968 11.6968 k = 0.0000 0.0000 0.0000 ( 4575 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3110 -14.3110 -14.2752 -14.2752 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2098 -3.2098 -1.3390 -1.3390 -0.8394 -0.8394 2.0765 2.0765 3.1567 3.1567 4.6470 4.6470 5.7778 5.7778 6.1704 6.1704 6.6414 6.6414 7.6402 7.6402 7.7957 7.7957 7.8599 7.8599 7.8986 7.8986 8.1457 8.1457 8.3612 8.3612 9.5429 9.5429 10.0770 10.0770 11.2761 11.2761 11.5403 11.5403 11.6968 11.6968 k =-0.0312 0.0061-0.0000 ( 4587 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2095 -3.2095 -1.3457 -1.3457 -0.8310 -0.8310 2.0712 2.0712 3.1567 3.1567 4.6542 4.6542 5.7778 5.7778 6.1703 6.1703 6.6416 6.6416 7.6412 7.6412 7.7776 7.7776 7.8671 7.8671 7.9025 7.9025 8.1445 8.1445 8.3611 8.3611 9.5275 9.5275 10.1019 10.1019 11.2761 11.2761 11.5437 11.5437 11.6959 11.6959 k =-0.0625 0.0122-0.0000 ( 4599 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2083 -3.2083 -1.3646 -1.3646 -0.8073 -0.8073 2.0556 2.0556 3.1567 3.1567 4.6754 4.6754 5.7776 5.7776 6.1701 6.1701 6.6419 6.6419 7.6439 7.6439 7.7376 7.7376 7.8743 7.8743 7.9147 7.9147 8.1409 8.1409 8.3611 8.3611 9.4893 9.4893 10.1688 10.1688 11.2759 11.2759 11.5536 11.5536 11.6899 11.6899 k =-0.0938 0.0183-0.0000 ( 4587 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9396 -12.9396 -12.8782 -12.8782 -12.8287 -12.8287 -12.8084 -12.8084 -3.2065 -3.2065 -1.3924 -1.3924 -0.7715 -0.7715 2.0305 2.0305 3.1567 3.1567 4.7100 4.7100 5.7775 5.7775 6.1696 6.1696 6.6425 6.6425 7.6463 7.6463 7.6878 7.6878 7.8759 7.8759 7.9310 7.9310 8.1349 8.1349 8.3611 8.3611 9.4422 9.4422 10.2633 10.2633 11.2756 11.2756 11.5698 11.5698 11.6483 11.6483 k =-0.1250 0.0244-0.0000 ( 4583 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9396 -12.9396 -12.8783 -12.8783 -12.8287 -12.8287 -12.8084 -12.8084 -3.2040 -3.2040 -1.4258 -1.4258 -0.7273 -0.7273 1.9969 1.9969 3.1566 3.1566 4.7567 4.7567 5.7774 5.7774 6.1691 6.1691 6.6433 6.6433 7.6158 7.6158 7.6630 7.6630 7.8750 7.8750 7.9466 7.9466 8.1268 8.1268 8.3611 8.3611 9.3958 9.3958 10.3745 10.3745 11.2752 11.2752 11.5643 11.5643 11.5944 11.5944 k =-0.1562 0.0304-0.0000 ( 4587 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3110 -14.3110 -14.2753 -14.2753 -12.9395 -12.9395 -12.8783 -12.8783 -12.8287 -12.8287 -12.8085 -12.8085 -3.2009 -3.2009 -1.4619 -1.4619 -0.6776 -0.6776 1.9564 1.9564 3.1566 3.1566 4.8141 4.8141 5.7774 5.7774 6.1684 6.1684 6.6443 6.6443 7.5468 7.5468 7.6698 7.6698 7.8729 7.8729 7.9603 7.9603 8.1164 8.1164 8.3610 8.3610 9.3555 9.3555 10.4955 10.4955 11.2743 11.2743 11.4722 11.4722 11.6220 11.6220 k =-0.1875 0.0365-0.0000 ( 4587 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3109 -14.3109 -14.2753 -14.2753 -12.9395 -12.9395 -12.8783 -12.8783 -12.8287 -12.8287 -12.8085 -12.8085 -3.1974 -3.1974 -1.4987 -1.4987 -0.6246 -0.6246 1.9105 1.9105 3.1566 3.1566 4.8805 4.8805 5.7778 5.7778 6.1677 6.1677 6.6454 6.6454 7.4675 7.4675 7.6806 7.6806 7.8701 7.8701 7.9718 7.9718 8.1042 8.1042 8.3610 8.3610 9.3235 9.3235 10.6210 10.6210 11.2721 11.2721 11.3785 11.3785 11.6561 11.6561 k =-0.2188 0.0426-0.0000 ( 4581 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3109 -14.3109 -14.2753 -14.2753 -12.9395 -12.9395 -12.8783 -12.8783 -12.8287 -12.8287 -12.8085 -12.8085 -3.1935 -3.1935 -1.5348 -1.5348 -0.5703 -0.5703 1.8610 1.8610 3.1565 3.1565 4.9541 4.9541 5.7786 5.7786 6.1668 6.1668 6.6467 6.6467 7.3811 7.3811 7.6934 7.6934 7.8671 7.8671 7.9810 7.9810 8.0905 8.0905 8.3610 8.3610 9.3006 9.3006 10.7445 10.7445 11.2594 11.2594 11.3014 11.3014 11.6947 11.6947 k =-0.2500 0.0487-0.0000 ( 4591 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3109 -14.3109 -14.2753 -14.2753 -12.9394 -12.9394 -12.8784 -12.8784 -12.8287 -12.8287 -12.8085 -12.8085 -3.1894 -3.1894 -1.5691 -1.5691 -0.5161 -0.5161 1.8097 1.8097 3.1565 3.1565 5.0330 5.0330 5.7801 5.7801 6.1660 6.1660 6.6479 6.6479 7.2894 7.2894 7.7080 7.7080 7.8638 7.8638 7.9879 7.9879 8.0756 8.0756 8.3609 8.3609 9.2865 9.2865 10.8520 10.8520 11.2097 11.2097 11.2826 11.2826 11.7052 11.7052 k =-0.2812 0.0548-0.0000 ( 4599 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3109 -14.3109 -14.2753 -14.2753 -12.9394 -12.9394 -12.8784 -12.8784 -12.8287 -12.8287 -12.8085 -12.8085 -3.1852 -3.1852 -1.6010 -1.6010 -0.4635 -0.4635 1.7583 1.7583 3.1564 3.1564 5.1147 5.1147 5.7827 5.7827 6.1651 6.1651 6.6492 6.6492 7.1942 7.1942 7.7241 7.7241 7.8607 7.8607 7.9918 7.9918 8.0606 8.0606 8.3609 8.3609 9.2801 9.2801 10.9059 10.9059 11.2005 11.2005 11.2824 11.2824 11.7060 11.7060 k =-0.3125 0.0609-0.0000 ( 4601 PWs) bands (ev): -33.2650 -33.2650 -33.2575 -33.2575 -14.3109 -14.3109 -14.2753 -14.2753 -12.9393 -12.9393 -12.8785 -12.8785 -12.8287 -12.8287 -12.8085 -12.8085 -3.1812 -3.1812 -1.6296 -1.6296 -0.4138 -0.4138 1.7086 1.7086 3.1564 3.1564 5.1968 5.1968 5.7869 5.7869 6.1643 6.1643 6.6505 6.6505 7.0980 7.0980 7.7413 7.7413 7.8580 7.8580 7.9916 7.9916 8.0473 8.0473 8.3609 8.3609 9.2803 9.2803 10.8830 10.8830 11.2533 11.2533 11.3029 11.3029 11.7068 11.7068 k =-0.3438 0.0670-0.0000 ( 4609 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9393 -12.9393 -12.8785 -12.8785 -12.8287 -12.8287 -12.8085 -12.8085 -3.1774 -3.1774 -1.6546 -1.6546 -0.3683 -0.3683 1.6624 1.6624 3.1564 3.1564 5.2761 5.2761 5.7933 5.7933 6.1636 6.1636 6.6516 6.6516 7.0034 7.0034 7.7592 7.7592 7.8559 7.8559 7.9850 7.9850 8.0380 8.0380 8.3608 8.3608 9.2852 9.2852 10.8272 10.8272 11.2689 11.2689 11.3989 11.3989 11.7078 11.7078 k =-0.3750 0.0731-0.0000 ( 4617 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9393 -12.9393 -12.8785 -12.8785 -12.8287 -12.8287 -12.8085 -12.8085 -3.1741 -3.1741 -1.6756 -1.6756 -0.3285 -0.3285 1.6215 1.6215 3.1563 3.1563 5.3488 5.3488 5.8024 5.8024 6.1629 6.1629 6.6527 6.6527 6.9139 6.9139 7.7772 7.7772 7.8551 7.8551 7.9717 7.9717 8.0337 8.0337 8.3608 8.3608 9.2932 9.2932 10.7686 10.7686 11.2707 11.2707 11.5158 11.5158 11.7090 11.7090 k =-0.4062 0.0792-0.0000 ( 4613 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9392 -12.9392 -12.8785 -12.8785 -12.8287 -12.8287 -12.8086 -12.8086 -3.1713 -3.1713 -1.6923 -1.6923 -0.2957 -0.2957 1.5875 1.5875 3.1563 3.1563 5.4105 5.4105 5.8145 5.8145 6.1624 6.1624 6.6535 6.6535 6.8340 6.8340 7.7940 7.7940 7.8564 7.8564 7.9543 7.9543 8.0323 8.0323 8.3608 8.3608 9.3022 9.3022 10.7174 10.7174 11.2711 11.2711 11.6276 11.6276 11.7114 11.7114 k =-0.4375 0.0853-0.0000 ( 4631 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8287 -12.8287 -12.8086 -12.8086 -3.1692 -3.1692 -1.7044 -1.7044 -0.2712 -0.2712 1.5620 1.5620 3.1563 3.1563 5.4572 5.4572 5.8280 5.8280 6.1620 6.1620 6.6542 6.6542 6.7692 6.7692 7.8075 7.8075 7.8616 7.8616 7.9352 7.9352 8.0322 8.0322 8.3607 8.3607 9.3103 9.3103 10.6782 10.6782 11.2712 11.2712 11.6997 11.6997 11.7379 11.7379 k =-0.4688 0.0913-0.0000 ( 4635 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8287 -12.8287 -12.8086 -12.8086 -3.1679 -3.1679 -1.7117 -1.7117 -0.2560 -0.2560 1.5462 1.5462 3.1563 3.1563 5.4859 5.4859 5.8395 5.8395 6.1618 6.1618 6.6546 6.6546 6.7262 6.7262 7.8156 7.8156 7.8712 7.8712 7.9169 7.9169 8.0323 8.0323 8.3607 8.3607 9.3159 9.3159 10.6537 10.6537 11.2711 11.2711 11.7060 11.7060 11.7717 11.7717 k =-0.5000 0.0974-0.0000 ( 4640 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3108 -14.3108 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8287 -12.8287 -12.8086 -12.8086 -3.1675 -3.1675 -1.7141 -1.7141 -0.2509 -0.2509 1.5408 1.5408 3.1563 3.1563 5.4955 5.4955 5.8441 5.8441 6.1617 6.1617 6.6548 6.6548 6.7110 6.7110 7.8181 7.8181 7.8787 7.8787 7.9067 7.9067 8.0324 8.0324 8.3607 8.3607 9.3180 9.3180 10.6454 10.6454 11.2711 11.2711 11.7066 11.7066 11.7733 11.7733 k =-0.5000 0.0974-0.0000 ( 4640 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3108 -14.3108 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8287 -12.8287 -12.8086 -12.8086 -3.1675 -3.1675 -1.7141 -1.7141 -0.2509 -0.2509 1.5408 1.5408 3.1563 3.1563 5.4955 5.4955 5.8441 5.8441 6.1617 6.1617 6.6548 6.6548 6.7110 6.7110 7.8181 7.8181 7.8787 7.8787 7.9067 7.9067 8.0324 8.0324 8.3607 8.3607 9.3180 9.3180 10.6454 10.6454 11.2711 11.2711 11.7066 11.7066 11.7733 11.7733 k =-0.4937 0.1299-0.0000 ( 4636 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9392 -12.9392 -12.8787 -12.8787 -12.8288 -12.8288 -12.8086 -12.8086 -3.1661 -3.1661 -1.7128 -1.7128 -0.2500 -0.2500 1.5423 1.5423 3.1483 3.1483 5.4948 5.4948 5.8361 5.8361 6.1660 6.1660 6.6558 6.6558 6.7141 6.7141 7.8177 7.8177 7.8683 7.8683 7.8923 7.8923 8.0561 8.0561 8.3613 8.3613 9.3210 9.3210 10.6507 10.6507 11.2526 11.2526 11.6784 11.6784 11.7737 11.7737 k =-0.4873 0.1624-0.0000 ( 4628 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3110 -14.3110 -14.2756 -14.2756 -12.9394 -12.9394 -12.8790 -12.8790 -12.8290 -12.8290 -12.8086 -12.8086 -3.1620 -3.1620 -1.7087 -1.7087 -0.2475 -0.2475 1.5468 1.5468 3.1245 3.1245 5.4922 5.4922 5.8131 5.8131 6.1789 6.1789 6.6592 6.6592 6.7232 6.7232 7.7964 7.7964 7.8357 7.8357 7.8972 7.8972 8.1002 8.1002 8.3633 8.3633 9.3301 9.3301 10.6665 10.6665 11.2024 11.2024 11.6072 11.6072 11.7751 11.7751 k =-0.4810 0.1949-0.0000 ( 4624 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3112 -14.3112 -14.2759 -14.2759 -12.9396 -12.9396 -12.8796 -12.8796 -12.8293 -12.8293 -12.8087 -12.8087 -3.1552 -3.1552 -1.7019 -1.7019 -0.2434 -0.2434 1.5543 1.5543 3.0856 3.0856 5.4861 5.4861 5.7779 5.7779 6.1992 6.1992 6.6649 6.6649 6.7384 6.7384 7.7297 7.7297 7.8316 7.8316 7.9143 7.9143 8.1450 8.1450 8.3666 8.3666 9.3447 9.3447 10.6922 10.6922 11.1310 11.1310 11.5143 11.5143 11.7774 11.7774 k =-0.4747 0.2274-0.0000 ( 4616 PWs) bands (ev): -33.2648 -33.2648 -33.2574 -33.2574 -14.3115 -14.3115 -14.2763 -14.2763 -12.9398 -12.9398 -12.8805 -12.8805 -12.8298 -12.8298 -12.8088 -12.8088 -3.1457 -3.1457 -1.6924 -1.6924 -0.2375 -0.2375 1.5648 1.5648 3.0326 3.0326 5.4728 5.4728 5.7355 5.7355 6.2255 6.2255 6.6733 6.6733 6.7597 6.7597 7.6515 7.6515 7.8293 7.8293 7.9403 7.9403 8.1857 8.1857 8.3717 8.3717 9.3644 9.3644 10.7269 10.7269 11.0474 11.0474 11.4117 11.4117 11.7806 11.7806 k =-0.4684 0.2598-0.0000 ( 4602 PWs) bands (ev): -33.2648 -33.2648 -33.2573 -33.2573 -14.3118 -14.3118 -14.2768 -14.2768 -12.9402 -12.9402 -12.8816 -12.8816 -12.8304 -12.8304 -12.8089 -12.8089 -3.1334 -3.1334 -1.6802 -1.6802 -0.2300 -0.2300 1.5783 1.5783 2.9669 2.9669 5.4458 5.4458 5.6946 5.6946 6.2561 6.2561 6.6846 6.6846 6.7870 6.7870 7.5687 7.5687 7.8246 7.8246 7.9728 7.9728 8.2211 8.2211 8.3789 8.3789 9.3881 9.3881 10.7693 10.7693 10.9577 10.9577 11.3052 11.3052 11.7848 11.7848 k =-0.4620 0.2923-0.0000 ( 4604 PWs) bands (ev): -33.2647 -33.2647 -33.2572 -33.2572 -14.3122 -14.3122 -14.2774 -14.2774 -12.9406 -12.9406 -12.8829 -12.8829 -12.8311 -12.8311 -12.8090 -12.8090 -3.1184 -3.1184 -1.6654 -1.6654 -0.2208 -0.2208 1.5946 1.5946 2.8897 2.8897 5.3976 5.3976 5.6647 5.6647 6.2888 6.2888 6.6987 6.6987 6.8201 6.8201 7.4838 7.4838 7.8171 7.8171 8.0096 8.0096 8.2511 8.2511 8.3882 8.3882 9.4145 9.4145 10.8177 10.8177 10.8665 10.8665 11.1977 11.1977 11.7902 11.7902 k =-0.4557 0.3248-0.0000 ( 4608 PWs) bands (ev): -33.2646 -33.2646 -33.2571 -33.2571 -14.3127 -14.3127 -14.2781 -14.2781 -12.9412 -12.9412 -12.8845 -12.8845 -12.8319 -12.8319 -12.8091 -12.8091 -3.1007 -3.1007 -1.6481 -1.6481 -0.2099 -0.2099 1.6138 1.6138 2.8026 2.8026 5.3263 5.3263 5.6494 5.6494 6.3216 6.3216 6.7157 6.7157 6.8577 6.8577 7.3994 7.3994 7.8071 7.8071 8.0484 8.0484 8.2760 8.2760 8.3997 8.3997 9.4423 9.4423 10.7768 10.7768 10.8704 10.8704 11.0913 11.0913 11.7968 11.7968 k =-0.4494 0.3573-0.0000 ( 4610 PWs) bands (ev): -33.2645 -33.2645 -33.2570 -33.2570 -14.3133 -14.3133 -14.2790 -14.2790 -12.9418 -12.9418 -12.8862 -12.8862 -12.8328 -12.8328 -12.8092 -12.8092 -3.0803 -3.0803 -1.6282 -1.6282 -0.1974 -0.1974 1.6358 1.6358 2.7068 2.7068 5.2366 5.2366 5.6460 5.6460 6.3526 6.3526 6.7357 6.7357 6.8970 6.8970 7.3199 7.3199 7.7945 7.7945 8.0874 8.0874 8.2964 8.2964 8.4135 8.4135 9.4694 9.4694 10.6928 10.6928 10.9178 10.9178 10.9941 10.9941 11.8046 11.8046 k =-0.4430 0.3898-0.0000 ( 4598 PWs) bands (ev): -33.2643 -33.2643 -33.2568 -33.2568 -14.3139 -14.3139 -14.2799 -14.2799 -12.9426 -12.9426 -12.8883 -12.8883 -12.8337 -12.8337 -12.8093 -12.8093 -3.0572 -3.0572 -1.6059 -1.6059 -0.1832 -0.1832 1.6606 1.6606 2.6038 2.6038 5.1339 5.1339 5.6504 5.6504 6.3802 6.3802 6.7584 6.7584 6.9302 6.9302 7.2541 7.2541 7.7793 7.7793 8.1249 8.1249 8.3128 8.3128 8.4292 8.4292 9.4939 9.4939 10.6172 10.6172 10.8683 10.8683 10.9970 10.9970 11.8138 11.8138 k =-0.4367 0.4222-0.0000 ( 4602 PWs) bands (ev): -33.2641 -33.2641 -33.2567 -33.2567 -14.3146 -14.3146 -14.2809 -14.2809 -12.9434 -12.9434 -12.8905 -12.8905 -12.8347 -12.8347 -12.8094 -12.8094 -3.0313 -3.0313 -1.5812 -1.5812 -0.1673 -0.1673 1.6881 1.6881 2.4945 2.4945 5.0222 5.0222 5.6598 5.6598 6.4026 6.4026 6.7835 6.7835 6.9408 6.9408 7.2199 7.2199 7.7618 7.7618 8.1595 8.1595 8.3258 8.3258 8.4469 8.4469 9.5137 9.5137 10.5533 10.5533 10.7693 10.7693 11.0513 11.0513 11.8243 11.8243 k =-0.4304 0.4547-0.0000 ( 4592 PWs) bands (ev): -33.2640 -33.2640 -33.2565 -33.2565 -14.3153 -14.3153 -14.2820 -14.2820 -12.9444 -12.9444 -12.8930 -12.8930 -12.8357 -12.8357 -12.8094 -12.8094 -3.0028 -3.0028 -1.5542 -1.5542 -0.1497 -0.1497 1.7181 1.7181 2.3801 2.3801 4.9042 4.9042 5.6727 5.6727 6.4175 6.4175 6.8094 6.8094 6.9170 6.9170 7.2326 7.2326 7.7419 7.7419 8.1896 8.1896 8.3353 8.3353 8.4668 8.4668 9.5272 9.5272 10.5037 10.5037 10.6702 10.6702 11.1067 11.1067 11.8362 11.8362 k =-0.4241 0.4872-0.0000 ( 4598 PWs) bands (ev): -33.2638 -33.2638 -33.2563 -33.2563 -14.3162 -14.3162 -14.2832 -14.2832 -12.9455 -12.9455 -12.8956 -12.8956 -12.8367 -12.8367 -12.8093 -12.8093 -2.9716 -2.9716 -1.5251 -1.5251 -0.1303 -0.1303 1.7506 1.7506 2.2615 2.2615 4.7814 4.7814 5.6884 5.6884 6.4216 6.4216 6.8249 6.8249 6.8840 6.8840 7.2807 7.2807 7.7199 7.7199 8.2137 8.2137 8.3413 8.3413 8.4892 8.4892 9.5341 9.5341 10.4696 10.4696 10.5743 10.5743 11.1596 11.1596 11.8494 11.8494 k =-0.4177 0.5197-0.0000 ( 4604 PWs) bands (ev): -33.2636 -33.2636 -33.2561 -33.2561 -14.3170 -14.3170 -14.2844 -14.2844 -12.9467 -12.9467 -12.8984 -12.8984 -12.8377 -12.8377 -12.8093 -12.8093 -2.9377 -2.9377 -1.4939 -1.4939 -0.1093 -0.1093 1.7855 1.7855 2.1395 2.1395 4.6553 4.6553 5.7062 5.7062 6.4098 6.4098 6.7988 6.7988 6.8952 6.8952 7.3467 7.3467 7.6961 7.6961 8.2305 8.2305 8.3435 8.3435 8.5143 8.5143 9.5356 9.5356 10.4430 10.4430 10.4906 10.4906 11.2090 11.2090 11.8641 11.8641 k =-0.4114 0.5522-0.0000 ( 4596 PWs) bands (ev): -33.2634 -33.2634 -33.2559 -33.2559 -14.3179 -14.3179 -14.2857 -14.2857 -12.9480 -12.9480 -12.9014 -12.9014 -12.8387 -12.8387 -12.8092 -12.8092 -2.9011 -2.9011 -1.4607 -1.4607 -0.0865 -0.0865 1.8227 1.8227 2.0147 2.0147 4.5268 4.5268 5.7258 5.7258 6.3776 6.3776 6.7657 6.7657 6.9288 6.9288 7.4215 7.4215 7.6709 7.6709 8.2383 8.2383 8.3419 8.3419 8.5423 8.5423 9.5346 9.5346 10.3753 10.3753 10.4668 10.4668 11.2546 11.2546 11.8802 11.8802 k =-0.4051 0.5846-0.0000 ( 4588 PWs) bands (ev): -33.2632 -33.2632 -33.2557 -33.2557 -14.3189 -14.3189 -14.2871 -14.2871 -12.9495 -12.9495 -12.9046 -12.9046 -12.8396 -12.8396 -12.8090 -12.8090 -2.8618 -2.8618 -1.4258 -1.4258 -0.0619 -0.0619 1.8618 1.8618 1.8878 1.8878 4.3966 4.3966 5.7469 5.7469 6.3245 6.3245 6.7464 6.7464 6.9684 6.9684 7.5003 7.5003 7.6453 7.6453 8.2357 8.2357 8.3368 8.3368 8.5734 8.5734 9.5353 9.5353 10.2891 10.2891 10.4780 10.4780 11.2969 11.2969 11.8964 11.8964 k =-0.3987 0.6171-0.0000 ( 4584 PWs) bands (ev): -33.2630 -33.2630 -33.2555 -33.2555 -14.3199 -14.3199 -14.2886 -14.2886 -12.9510 -12.9510 -12.9078 -12.9078 -12.8405 -12.8405 -12.8088 -12.8088 -2.8198 -2.8198 -1.3893 -1.3893 -0.0355 -0.0355 1.7591 1.7591 1.9031 1.9031 4.2654 4.2654 5.7693 5.7693 6.2551 6.2551 6.7400 6.7400 7.0116 7.0116 7.5738 7.5738 7.6268 7.6268 8.2207 8.2207 8.3296 8.3296 8.6078 8.6078 9.5414 9.5414 10.2037 10.2037 10.5020 10.5020 11.3365 11.3365 11.9011 11.9011 k =-0.3924 0.6496-0.0000 ( 4596 PWs) bands (ev): -33.2628 -33.2628 -33.2553 -33.2553 -14.3209 -14.3209 -14.2900 -14.2900 -12.9527 -12.9527 -12.9112 -12.9112 -12.8414 -12.8414 -12.8086 -12.8086 -2.7752 -2.7752 -1.3513 -1.3513 -0.0072 -0.0072 1.6293 1.6293 1.9459 1.9459 4.1337 4.1337 5.7927 5.7927 6.1753 6.1753 6.7422 6.7422 7.0579 7.0579 7.5781 7.5781 7.6781 7.6781 8.1922 8.1922 8.3220 8.3220 8.6454 8.6454 9.5561 9.5561 10.1210 10.1210 10.5343 10.5343 11.3743 11.3743 11.8646 11.8646 k =-0.3861 0.6821-0.0000 ( 4592 PWs) bands (ev): -33.2625 -33.2625 -33.2551 -33.2551 -14.3219 -14.3219 -14.2916 -14.2916 -12.9544 -12.9544 -12.9146 -12.9146 -12.8421 -12.8421 -12.8083 -12.8083 -2.7280 -2.7280 -1.3120 -1.3120 0.0230 0.0230 1.4988 1.4988 1.9903 1.9903 4.0022 4.0022 5.8170 5.8170 6.0897 6.0897 6.7487 6.7487 7.1071 7.1071 7.5513 7.5513 7.7603 7.7603 8.1505 8.1505 8.3157 8.3157 8.6861 8.6861 9.5810 9.5810 10.0415 10.0415 10.5722 10.5722 11.4109 11.4109 11.8112 11.8112 k =-0.3797 0.7146-0.0000 ( 4586 PWs) bands (ev): -33.2623 -33.2623 -33.2549 -33.2549 -14.3230 -14.3230 -14.2931 -14.2931 -12.9562 -12.9562 -12.9181 -12.9181 -12.8428 -12.8428 -12.8080 -12.8080 -2.6781 -2.6781 -1.2717 -1.2717 0.0552 0.0552 1.3678 1.3678 2.0357 2.0357 3.8713 3.8713 5.8419 5.8419 6.0015 6.0015 6.7570 6.7570 7.1591 7.1591 7.5221 7.5221 7.8439 7.8439 8.0977 8.0977 8.3120 8.3120 8.7298 8.7298 9.6164 9.6164 9.9652 9.9652 10.6134 10.6134 11.4463 11.4463 11.7525 11.7525 k =-0.3734 0.7470-0.0000 ( 4604 PWs) bands (ev): -33.2621 -33.2621 -33.2547 -33.2547 -14.3241 -14.3241 -14.2947 -14.2947 -12.9582 -12.9582 -12.9216 -12.9216 -12.8434 -12.8434 -12.8076 -12.8076 -2.6256 -2.6256 -1.2306 -1.2306 0.0894 0.0894 1.2366 1.2366 2.0819 2.0819 3.7415 3.7415 5.8670 5.8670 5.9123 5.9123 6.7653 6.7653 7.2138 7.2138 7.4922 7.4922 7.9255 7.9255 8.0367 8.0367 8.3120 8.3120 8.7763 8.7763 9.6619 9.6619 9.8923 9.8923 10.6565 10.6565 11.4793 11.4793 11.6868 11.6868 k =-0.3671 0.7795-0.0000 ( 4604 PWs) bands (ev): -33.2618 -33.2618 -33.2545 -33.2545 -14.3252 -14.3252 -14.2962 -14.2962 -12.9601 -12.9601 -12.9251 -12.9251 -12.8440 -12.8440 -12.8073 -12.8073 -2.5704 -2.5704 -1.1889 -1.1889 0.1258 0.1258 1.1057 1.1057 2.1284 2.1284 3.6134 3.6134 5.8232 5.8232 5.8926 5.8926 6.7723 6.7723 7.2710 7.2710 7.4623 7.4623 7.9621 7.9621 8.0109 8.0109 8.3181 8.3181 8.8253 8.8253 9.7165 9.7165 9.8230 9.8230 10.7001 10.7001 11.5059 11.5059 11.5996 11.5996 k =-0.3608 0.8120-0.0000 ( 4596 PWs) bands (ev): -33.2616 -33.2616 -33.2543 -33.2543 -14.3263 -14.3263 -14.2978 -14.2978 -12.9621 -12.9621 -12.9285 -12.9285 -12.8444 -12.8444 -12.8069 -12.8069 -2.5126 -2.5126 -1.1469 -1.1469 0.1645 0.1645 0.9751 0.9751 2.1743 2.1743 3.4878 3.4878 5.7354 5.7354 5.9175 5.9175 6.7773 6.7773 7.3308 7.3308 7.4327 7.4327 7.8935 7.8935 8.0801 8.0801 8.3337 8.3337 8.8765 8.8765 9.7560 9.7560 9.7805 9.7805 10.7432 10.7432 11.4677 11.4677 11.5288 11.5288 k =-0.3544 0.8445-0.0000 ( 4590 PWs) bands (ev): -33.2614 -33.2614 -33.2540 -33.2540 -14.3273 -14.3273 -14.2994 -14.2994 -12.9641 -12.9641 -12.9320 -12.9320 -12.8448 -12.8448 -12.8065 -12.8065 -2.4523 -2.4523 -1.1049 -1.1049 0.2056 0.2056 0.8452 0.8452 2.2188 2.2188 3.3656 3.3656 5.6493 5.6493 5.9419 5.9419 6.7795 6.7795 7.3921 7.3921 7.4046 7.4046 7.8205 7.8205 8.1415 8.1415 8.3634 8.3634 8.9296 8.9296 9.6946 9.6946 9.8495 9.8495 10.7850 10.7850 11.3335 11.3335 11.5067 11.5067 k =-0.3481 0.8770-0.0000 ( 4580 PWs) bands (ev): -33.2611 -33.2611 -33.2538 -33.2538 -14.3284 -14.3284 -14.3009 -14.3009 -12.9662 -12.9662 -12.9353 -12.9353 -12.8451 -12.8451 -12.8061 -12.8061 -2.3893 -2.3893 -1.0632 -1.0632 0.2490 0.2490 0.7162 0.7162 2.2602 2.2602 3.2483 3.2483 5.5653 5.5653 5.9652 5.9652 6.7784 6.7784 7.3746 7.3746 7.4582 7.4582 7.7476 7.7476 8.1897 8.1897 8.4104 8.4104 8.9841 8.9841 9.6362 9.6362 9.9251 9.9251 10.8247 10.8247 11.1956 11.1956 11.4452 11.4452 k =-0.3418 0.9094-0.0000 ( 4560 PWs) bands (ev): -33.2609 -33.2609 -33.2536 -33.2536 -14.3294 -14.3294 -14.3024 -14.3024 -12.9682 -12.9682 -12.9386 -12.9386 -12.8453 -12.8453 -12.8056 -12.8056 -2.3238 -2.3238 -1.0220 -1.0220 0.2949 0.2949 0.5883 0.5883 2.2963 2.2963 3.1383 3.1383 5.4839 5.4839 5.9869 5.9869 6.7738 6.7738 7.3470 7.3470 7.5251 7.5251 7.6769 7.6769 8.2270 8.2270 8.4726 8.4726 9.0397 9.0397 9.5816 9.5816 10.0057 10.0057 10.8615 10.8615 11.0596 11.0596 11.3730 11.3730 k =-0.3354 0.9419-0.0000 ( 4558 PWs) bands (ev): -33.2606 -33.2606 -33.2534 -33.2534 -14.3304 -14.3304 -14.3039 -14.3039 -12.9702 -12.9702 -12.9417 -12.9417 -12.8455 -12.8455 -12.8052 -12.8052 -2.2558 -2.2558 -0.9818 -0.9818 0.3423 0.3423 0.4630 0.4630 2.3230 2.3230 3.0391 3.0391 5.4053 5.4053 6.0065 6.0065 6.7656 6.7656 7.3203 7.3203 7.5936 7.5936 7.6108 7.6108 8.2593 8.2593 8.5443 8.5443 9.0955 9.0955 9.5308 9.5308 10.0903 10.0903 10.8899 10.8899 10.9320 10.9320 11.2955 11.2955 k =-0.3291 0.9744-0.0000 ( 4562 PWs) bands (ev): -33.2604 -33.2604 -33.2532 -33.2532 -14.3314 -14.3314 -14.3053 -14.3053 -12.9721 -12.9721 -12.9447 -12.9447 -12.8456 -12.8456 -12.8048 -12.8048 -2.1851 -2.1851 -0.9429 -0.9429 0.3288 0.3288 0.4026 0.4026 2.3344 2.3344 2.9567 2.9567 5.3299 5.3299 6.0236 6.0236 6.7537 6.7537 7.2947 7.2947 7.5482 7.5482 7.6659 7.6659 8.2911 8.2911 8.6209 8.6209 9.1507 9.1507 9.4839 9.4839 10.1777 10.1777 10.7944 10.7944 10.9291 10.9291 11.2137 11.2137 k =-0.3228 1.0069-0.0000 ( 4560 PWs) bands (ev): -33.2603 -33.2603 -33.2530 -33.2530 -14.3324 -14.3324 -14.3066 -14.3066 -12.9739 -12.9739 -12.9476 -12.9476 -12.8457 -12.8457 -12.8044 -12.8044 -2.1120 -2.1120 -0.9056 -0.9056 0.2080 0.2080 0.4540 0.4540 2.3231 2.3231 2.8981 2.8981 5.2578 5.2578 6.0375 6.0375 6.7382 6.7382 7.2704 7.2704 7.4934 7.4934 7.7390 7.7390 8.3253 8.3253 8.6994 8.6994 9.2039 9.2039 9.4411 9.4411 10.2664 10.2664 10.6730 10.6730 10.9528 10.9528 11.1297 11.1297 k =-0.3165 1.0394-0.0000 ( 4548 PWs) bands (ev): -33.2601 -33.2601 -33.2528 -33.2528 -14.3332 -14.3332 -14.3079 -14.3079 -12.9757 -12.9757 -12.9502 -12.9502 -12.8458 -12.8458 -12.8041 -12.8041 -2.0363 -2.0363 -0.8702 -0.8702 0.0857 0.0857 0.5118 0.5118 2.2843 2.2843 2.8679 2.8679 5.1892 5.1892 6.0480 6.0480 6.7196 6.7196 7.2476 7.2476 7.4463 7.4463 7.8140 7.8140 8.3631 8.3631 8.7782 8.7782 9.2532 9.2532 9.4024 9.4024 10.3533 10.3533 10.5604 10.5604 10.9612 10.9612 11.0523 11.0523 k =-0.3101 1.0718-0.0000 ( 4552 PWs) bands (ev): -33.2599 -33.2599 -33.2527 -33.2527 -14.3341 -14.3341 -14.3091 -14.3091 -12.9773 -12.9773 -12.9527 -12.9527 -12.8458 -12.8458 -12.8037 -12.8037 -1.9582 -1.9582 -0.8371 -0.8371 -0.0353 -0.0353 0.5733 0.5733 2.2199 2.2199 2.8638 2.8638 5.1244 5.1244 6.0546 6.0546 6.6980 6.6980 7.2266 7.2266 7.4078 7.4078 7.8905 7.8905 8.4052 8.4052 8.8562 8.8562 9.2958 9.2958 9.3681 9.3681 10.4172 10.4172 10.4775 10.4775 10.9171 10.9171 10.9860 10.9860 k =-0.3038 1.1043-0.0000 ( 4552 PWs) bands (ev): -33.2598 -33.2598 -33.2526 -33.2526 -14.3348 -14.3348 -14.3102 -14.3102 -12.9789 -12.9789 -12.9550 -12.9550 -12.8458 -12.8458 -12.8034 -12.8034 -1.8775 -1.8775 -0.8066 -0.8066 -0.1546 -0.1546 0.6383 0.6383 2.1373 2.1373 2.8782 2.8782 5.0634 5.0634 6.0575 6.0575 6.6740 6.6740 7.2075 7.2075 7.3785 7.3785 7.9683 7.9683 8.4516 8.4516 8.9322 8.9322 9.3260 9.3260 9.3401 9.3401 10.3570 10.3570 10.5200 10.5200 10.8442 10.8442 10.8953 10.8953 k =-0.2975 1.1368-0.0000 ( 4550 PWs) bands (ev): -33.2596 -33.2596 -33.2524 -33.2524 -14.3355 -14.3355 -14.3111 -14.3111 -12.9803 -12.9803 -12.9570 -12.9570 -12.8458 -12.8458 -12.8031 -12.8031 -1.7944 -1.7944 -0.7792 -0.7792 -0.2717 -0.2717 0.7068 0.7068 2.0435 2.0435 2.9034 2.9034 5.0065 5.0065 6.0569 6.0569 6.6479 6.6479 7.1905 7.1905 7.3587 7.3587 8.0470 8.0470 8.5023 8.5023 9.0052 9.0052 9.3115 9.3115 9.3461 9.3461 10.2896 10.2896 10.5499 10.5499 10.7943 10.7943 10.8053 10.8053 k =-0.2911 1.1693-0.0000 ( 4550 PWs) bands (ev): -33.2595 -33.2595 -33.2523 -33.2523 -14.3361 -14.3361 -14.3120 -14.3120 -12.9815 -12.9815 -12.9589 -12.9589 -12.8457 -12.8457 -12.8028 -12.8028 -1.7089 -1.7089 -0.7555 -0.7555 -0.3861 -0.3861 0.7789 0.7789 1.9436 1.9436 2.9340 2.9340 4.9538 4.9538 6.0535 6.0535 6.6202 6.6202 7.1757 7.1757 7.3484 7.3484 8.1263 8.1263 8.5572 8.5572 9.0739 9.0739 9.2913 9.2913 9.3421 9.3421 10.2449 10.2449 10.5114 10.5114 10.7139 10.7139 10.8081 10.8081 k =-0.2848 1.2018-0.0000 ( 4552 PWs) bands (ev): -33.2594 -33.2594 -33.2522 -33.2522 -14.3367 -14.3367 -14.3128 -14.3128 -12.9826 -12.9826 -12.9605 -12.9605 -12.8457 -12.8457 -12.8025 -12.8025 -1.6210 -1.6210 -0.7373 -0.7373 -0.4963 -0.4963 0.8546 0.8546 1.8406 1.8406 2.9665 2.9665 4.9052 4.9052 6.0483 6.0483 6.5914 6.5914 7.1631 7.1631 7.3473 7.3473 8.2057 8.2057 8.6158 8.6158 9.1361 9.1361 9.2765 9.2765 9.3154 9.3154 10.2262 10.2262 10.4292 10.4292 10.6324 10.6324 10.8483 10.8483 k =-0.2785 1.2342-0.0000 ( 4560 PWs) bands (ev): -33.2593 -33.2593 -33.2521 -33.2521 -14.3371 -14.3371 -14.3135 -14.3135 -12.9835 -12.9835 -12.9618 -12.9618 -12.8456 -12.8456 -12.8023 -12.8023 -1.5307 -1.5307 -0.7313 -0.7313 -0.5955 -0.5955 0.9339 0.9339 1.7362 1.7362 2.9986 2.9986 4.8610 4.8610 6.0425 6.0425 6.5619 6.5619 7.1524 7.1524 7.3550 7.3550 8.2846 8.2846 8.6780 8.6780 9.1869 9.1869 9.2681 9.2681 9.2692 9.2692 10.2285 10.2285 10.3366 10.3366 10.5597 10.5597 10.8866 10.8866 k =-0.2722 1.2667-0.0000 ( 4558 PWs) bands (ev): -33.2593 -33.2593 -33.2520 -33.2520 -14.3375 -14.3375 -14.3140 -14.3140 -12.9843 -12.9843 -12.9629 -12.9629 -12.8456 -12.8456 -12.8022 -12.8022 -1.4380 -1.4380 -0.7687 -0.7687 -0.6524 -0.6524 1.0166 1.0166 1.6316 1.6316 3.0286 3.0286 4.8210 4.8210 6.0374 6.0374 6.5321 6.5321 7.1437 7.1437 7.3708 7.3708 8.3623 8.3623 8.7431 8.7431 9.1858 9.1858 9.2389 9.2389 9.2737 9.2737 10.2004 10.2004 10.2904 10.2904 10.4988 10.4988 10.9142 10.9142 k =-0.2658 1.2992-0.0000 ( 4552 PWs) bands (ev): -33.2592 -33.2592 -33.2520 -33.2520 -14.3378 -14.3378 -14.3144 -14.3144 -12.9849 -12.9849 -12.9637 -12.9637 -12.8456 -12.8456 -12.8020 -12.8020 -1.3430 -1.3430 -0.8575 -0.8575 -0.6592 -0.6592 1.1029 1.1029 1.5276 1.5276 3.0555 3.0555 4.7855 4.7855 6.0344 6.0344 6.5025 6.5025 7.1369 7.1369 7.3938 7.3938 8.4379 8.4379 8.8108 8.8108 9.1113 9.1113 9.2478 9.2478 9.2949 9.2949 10.1048 10.1048 10.3248 10.3248 10.4534 10.4534 10.9315 10.9315 k =-0.2595 1.3317-0.0000 ( 4554 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9852 -12.9852 -12.9642 -12.9642 -12.8456 -12.8456 -12.8020 -12.8020 -1.2457 -1.2457 -0.9584 -0.9584 -0.6552 -0.6552 1.1926 1.1926 1.4245 1.4245 3.0781 3.0781 4.7542 4.7542 6.0349 6.0349 6.4735 6.4735 7.1320 7.1320 7.4231 7.4231 8.5104 8.5104 8.8800 8.8800 9.0237 9.0237 9.2566 9.2566 9.3136 9.3136 9.9995 9.9995 10.3723 10.3723 10.4323 10.4323 10.9408 10.9408 k =-0.2595 1.3317-0.0000 ( 4554 PWs) bands (ev): -33.2592 -33.2592 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9852 -12.9852 -12.9642 -12.9642 -12.8456 -12.8456 -12.8020 -12.8020 -1.2457 -1.2457 -0.9584 -0.9584 -0.6552 -0.6552 1.1926 1.1926 1.4245 1.4245 3.0781 3.0781 4.7542 4.7542 6.0349 6.0349 6.4735 6.4735 7.1320 7.1320 7.4231 7.4231 8.5104 8.5104 8.8800 8.8800 9.0237 9.0237 9.2566 9.2566 9.3136 9.3136 9.9995 9.9995 10.3723 10.3723 10.4323 10.4323 10.9408 10.9408 k =-0.2595 1.3317 0.0329 ( 4550 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3380 -14.3380 -14.3147 -14.3147 -12.9852 -12.9852 -12.9642 -12.9642 -12.8457 -12.8457 -12.8021 -12.8021 -1.2446 -1.2446 -0.9573 -0.9573 -0.6543 -0.6543 1.1938 1.1938 1.4255 1.4255 3.0764 3.0764 4.7558 4.7558 6.0358 6.0358 6.4733 6.4733 7.1291 7.1291 7.4234 7.4234 8.4643 8.4643 8.9098 8.9098 8.9902 8.9902 9.1589 9.1589 9.4179 9.4179 10.0169 10.0169 10.3650 10.3650 10.4273 10.4273 10.9481 10.9481 k =-0.2595 1.3317 0.0659 ( 4554 PWs) bands (ev): -33.2591 -33.2591 -33.2519 -33.2519 -14.3381 -14.3381 -14.3148 -14.3148 -12.9850 -12.9850 -12.9642 -12.9642 -12.8462 -12.8462 -12.8026 -12.8026 -1.2413 -1.2413 -0.9543 -0.9543 -0.6515 -0.6515 1.1975 1.1975 1.4284 1.4284 3.0712 3.0712 4.7607 4.7607 6.0384 6.0384 6.4726 6.4726 7.1208 7.1208 7.4241 7.4241 8.3563 8.3563 8.8937 8.8937 8.9683 8.9683 9.0532 9.0532 9.5516 9.5516 10.0376 10.0376 10.3626 10.3626 10.4190 10.4190 10.9673 10.9673 k =-0.2595 1.3317 0.0988 ( 4560 PWs) bands (ev): -33.2590 -33.2590 -33.2519 -33.2519 -14.3382 -14.3382 -14.3150 -14.3150 -12.9848 -12.9848 -12.9641 -12.9641 -12.8469 -12.8469 -12.8034 -12.8034 -1.2359 -1.2359 -0.9491 -0.9491 -0.6468 -0.6468 1.2036 1.2036 1.4332 1.4332 3.0626 3.0626 4.7689 4.7689 6.0427 6.0427 6.4714 6.4714 7.1077 7.1077 7.4245 7.4245 8.2206 8.2206 8.7673 8.7673 8.9102 8.9102 9.0618 9.0618 9.6897 9.6897 10.0025 10.0025 10.3742 10.3742 10.4506 10.4506 10.9943 10.9943 k =-0.2595 1.3317 0.1318 ( 4558 PWs) bands (ev): -33.2589 -33.2589 -33.2518 -33.2518 -14.3383 -14.3383 -14.3153 -14.3153 -12.9845 -12.9845 -12.9640 -12.9640 -12.8480 -12.8480 -12.8045 -12.8045 -1.2282 -1.2282 -0.9420 -0.9420 -0.6403 -0.6403 1.2121 1.2121 1.4399 1.4399 3.0505 3.0505 4.7803 4.7803 6.0487 6.0487 6.4695 6.4695 7.0905 7.0905 7.4236 7.4236 8.0716 8.0716 8.6204 8.6204 8.8013 8.8013 9.1132 9.1132 9.8228 9.8228 9.9158 9.9158 10.3614 10.3614 10.5584 10.5584 11.0267 11.0267 k =-0.2595 1.3317 0.1647 ( 4553 PWs) bands (ev): -33.2588 -33.2588 -33.2517 -33.2517 -14.3385 -14.3385 -14.3156 -14.3156 -12.9840 -12.9840 -12.9639 -12.9639 -12.8493 -12.8493 -12.8059 -12.8059 -1.2184 -1.2184 -0.9328 -0.9328 -0.6319 -0.6319 1.2231 1.2231 1.4485 1.4485 3.0350 3.0350 4.7948 4.7948 6.0561 6.0561 6.4667 6.4667 7.0702 7.0702 7.4200 7.4200 7.9160 7.9160 8.4647 8.4647 8.6911 8.6911 9.1510 9.1510 9.7739 9.7739 9.9789 9.9789 10.3447 10.3447 10.6919 10.6919 11.0645 11.0645 k =-0.2595 1.3317 0.1977 ( 4555 PWs) bands (ev): -33.2586 -33.2586 -33.2516 -33.2516 -14.3388 -14.3388 -14.3161 -14.3161 -12.9835 -12.9835 -12.9638 -12.9638 -12.8509 -12.8509 -12.8076 -12.8076 -1.2064 -1.2064 -0.9216 -0.9216 -0.6217 -0.6217 1.2364 1.2364 1.4590 1.4590 3.0162 3.0162 4.8124 4.8124 6.0648 6.0648 6.4625 6.4625 7.0477 7.0477 7.4114 7.4114 7.7573 7.7573 8.3073 8.3073 8.5817 8.5817 9.1698 9.1698 9.6346 9.6346 10.1120 10.1120 10.3326 10.3326 10.8235 10.8235 11.1083 11.1083 k =-0.2595 1.3317 0.2306 ( 4564 PWs) bands (ev): -33.2585 -33.2585 -33.2515 -33.2515 -14.3391 -14.3391 -14.3166 -14.3166 -12.9829 -12.9829 -12.9636 -12.9636 -12.8527 -12.8527 -12.8096 -12.8096 -1.1923 -1.1923 -0.9085 -0.9085 -0.6097 -0.6097 1.2521 1.2521 1.4712 1.4712 2.9940 2.9940 4.8331 4.8331 6.0747 6.0747 6.4565 6.4565 7.0240 7.0240 7.3947 7.3947 7.5981 7.5981 8.1543 8.1543 8.4732 8.4732 9.1682 9.1682 9.4846 9.4846 10.2340 10.2340 10.3339 10.3339 10.9346 10.9346 11.1576 11.1576 k =-0.2595 1.3317 0.2635 ( 4562 PWs) bands (ev): -33.2583 -33.2583 -33.2514 -33.2514 -14.3394 -14.3394 -14.3172 -14.3172 -12.9822 -12.9822 -12.9635 -12.9635 -12.8548 -12.8548 -12.8119 -12.8119 -1.1761 -1.1761 -0.8934 -0.8934 -0.5958 -0.5958 1.2702 1.2702 1.4851 1.4851 2.9685 2.9685 4.8566 4.8566 6.0855 6.0855 6.4478 6.4478 6.9999 6.9999 7.3649 7.3649 7.4407 7.4407 8.0123 8.0123 8.3657 8.3657 9.1466 9.1466 9.3295 9.3295 10.2971 10.2971 10.3940 10.3940 11.0132 11.0132 11.2060 11.2060 k =-0.2595 1.3317 0.2965 ( 4563 PWs) bands (ev): -33.2580 -33.2580 -33.2513 -33.2513 -14.3398 -14.3398 -14.3178 -14.3178 -12.9815 -12.9815 -12.9633 -12.9633 -12.8572 -12.8572 -12.8143 -12.8143 -1.1578 -1.1578 -0.8764 -0.8764 -0.5801 -0.5801 1.2906 1.2906 1.5006 1.5006 2.9397 2.9397 4.8828 4.8828 6.0969 6.0969 6.4350 6.4350 6.9761 6.9761 7.2873 7.2873 7.3148 7.3148 7.8898 7.8898 8.2593 8.2593 9.1046 9.1046 9.1738 9.1738 10.3110 10.3110 10.5020 10.5020 11.0591 11.0591 11.2436 11.2436 k =-0.2595 1.3317 0.3294 ( 4561 PWs) bands (ev): -33.2578 -33.2578 -33.2511 -33.2511 -14.3402 -14.3402 -14.3185 -14.3185 -12.9807 -12.9807 -12.9632 -12.9632 -12.8597 -12.8597 -12.8171 -12.8171 -1.1375 -1.1375 -0.8575 -0.8575 -0.5626 -0.5626 1.3133 1.3133 1.5177 1.5177 2.9079 2.9079 4.9117 4.9117 6.1086 6.1086 6.4159 6.4159 6.9530 6.9530 7.1411 7.1411 7.2372 7.2372 7.7943 7.7943 8.1542 8.1542 9.0033 9.0033 9.0608 9.0608 10.3224 10.3224 10.6095 10.6095 11.0777 11.0777 11.2717 11.2717 k =-0.2595 1.3317 0.3624 ( 4567 PWs) bands (ev): -33.2575 -33.2575 -33.2510 -33.2510 -14.3406 -14.3406 -14.3193 -14.3193 -12.9798 -12.9798 -12.9630 -12.9630 -12.8624 -12.8624 -12.8200 -12.8200 -1.1151 -1.1151 -0.8367 -0.8367 -0.5432 -0.5432 1.3382 1.3382 1.5362 1.5362 2.8730 2.8730 4.9428 4.9428 6.1203 6.1203 6.3873 6.3873 6.9299 6.9299 7.0072 7.0072 7.1311 7.1311 7.7275 7.7275 8.0507 8.0507 8.8468 8.8468 8.9904 8.9904 10.3356 10.3356 10.7112 10.7112 11.0750 11.0750 11.2976 11.2976 k =-0.2595 1.3317 0.3953 ( 4567 PWs) bands (ev): -33.2572 -33.2572 -33.2508 -33.2508 -14.3411 -14.3411 -14.3202 -14.3202 -12.9789 -12.9789 -12.9628 -12.9628 -12.8653 -12.8653 -12.8231 -12.8231 -1.0908 -1.0908 -0.8142 -0.8142 -0.5221 -0.5221 1.3654 1.3654 1.5560 1.5560 2.8354 2.8354 4.9760 4.9760 6.1315 6.1315 6.3443 6.3443 6.8768 6.8768 6.9197 6.9197 7.0049 7.0049 7.6833 7.6833 7.9492 7.9492 8.6881 8.6881 8.9131 8.9131 10.3500 10.3500 10.8073 10.8073 11.0587 11.0587 11.3235 11.3235 k =-0.2595 1.3317 0.4283 ( 4571 PWs) bands (ev): -33.2569 -33.2569 -33.2506 -33.2506 -14.3416 -14.3416 -14.3211 -14.3211 -12.9779 -12.9779 -12.9627 -12.9627 -12.8683 -12.8683 -12.8263 -12.8263 -1.0646 -1.0646 -0.7900 -0.7900 -0.4993 -0.4993 1.3947 1.3947 1.5768 1.5768 2.7952 2.7952 5.0106 5.0106 6.1419 6.1419 6.2818 6.2818 6.7830 6.7830 6.8491 6.8491 6.9130 6.9130 7.6529 7.6529 7.8503 7.8503 8.5304 8.5304 8.8291 8.8291 10.3650 10.3650 10.8982 10.8982 11.0359 11.0359 11.3482 11.3482 k =-0.2595 1.3317 0.4612 ( 4575 PWs) bands (ev): -33.2566 -33.2566 -33.2504 -33.2504 -14.3422 -14.3422 -14.3221 -14.3221 -12.9770 -12.9770 -12.9625 -12.9625 -12.8714 -12.8714 -12.8297 -12.8297 -1.0365 -1.0365 -0.7641 -0.7641 -0.4747 -0.4747 1.4260 1.4260 1.5985 1.5985 2.7527 2.7527 5.0461 5.0461 6.1507 6.1507 6.1983 6.1983 6.7038 6.7038 6.7095 6.7095 6.8955 6.8955 7.6288 7.6288 7.7556 7.7556 8.3750 8.3750 8.7399 8.7399 10.3797 10.3797 10.9776 10.9776 11.0185 11.0185 11.3699 11.3699 k =-0.2595 1.3317 0.4941 ( 4573 PWs) bands (ev): -33.2562 -33.2562 -33.2502 -33.2502 -14.3427 -14.3427 -14.3231 -14.3231 -12.9760 -12.9760 -12.9624 -12.9624 -12.8746 -12.8746 -12.8332 -12.8332 -1.0065 -1.0065 -0.7365 -0.7365 -0.4484 -0.4484 1.4594 1.4594 1.6208 1.6208 2.7082 2.7082 5.0814 5.0814 6.0962 6.0962 6.1592 6.1592 6.5518 6.5518 6.6550 6.6550 6.8866 6.8866 7.6021 7.6021 7.6702 7.6702 8.2227 8.2227 8.6472 8.6472 10.3941 10.3941 10.9772 10.9772 11.0786 11.0786 11.3876 11.3876 k =-0.2595 1.3317 0.5271 ( 4571 PWs) bands (ev): -33.2558 -33.2558 -33.2500 -33.2500 -14.3433 -14.3433 -14.3242 -14.3242 -12.9750 -12.9750 -12.9623 -12.9623 -12.8778 -12.8778 -12.8368 -12.8368 -0.9749 -0.9749 -0.7075 -0.7075 -0.4204 -0.4204 1.4948 1.4948 1.6433 1.6433 2.6623 2.6623 5.1147 5.1147 5.9869 5.9869 6.1629 6.1629 6.3996 6.3996 6.6138 6.6138 6.8820 6.8820 7.5488 7.5488 7.6158 7.6158 8.0751 8.0751 8.5522 8.5522 10.4079 10.4079 10.9546 10.9546 11.1607 11.1607 11.4006 11.4006 k =-0.2595 1.3317 0.5600 ( 4571 PWs) bands (ev): -33.2555 -33.2555 -33.2498 -33.2498 -14.3439 -14.3439 -14.3253 -14.3253 -12.9741 -12.9741 -12.9622 -12.9622 -12.8811 -12.8811 -12.8404 -12.8404 -0.9416 -0.9416 -0.6770 -0.6770 -0.3908 -0.3908 1.5320 1.5320 1.6654 1.6654 2.6153 2.6153 5.1430 5.1430 5.8775 5.8775 6.1549 6.1549 6.2580 6.2580 6.5793 6.5793 6.8814 6.8814 7.4719 7.4719 7.5865 7.5865 7.9349 7.9349 8.4561 8.4561 10.4213 10.4213 10.9339 10.9339 11.2428 11.2428 11.4087 11.4087 k =-0.2595 1.3317 0.5930 ( 4571 PWs) bands (ev): -33.2551 -33.2551 -33.2496 -33.2496 -14.3446 -14.3446 -14.3265 -14.3265 -12.9732 -12.9732 -12.9621 -12.9621 -12.8843 -12.8843 -12.8441 -12.8441 -0.9067 -0.9067 -0.6452 -0.6452 -0.3595 -0.3595 1.5710 1.5710 1.6867 1.6867 2.5682 2.5682 5.1608 5.1608 5.7775 5.7775 6.0680 6.0680 6.1951 6.1951 6.5468 6.5468 6.8841 6.8841 7.3947 7.3947 7.5537 7.5537 7.8079 7.8079 8.3596 8.3596 10.4344 10.4344 10.9165 10.9165 11.3242 11.3242 11.4122 11.4122 k =-0.2595 1.3317 0.6259 ( 4571 PWs) bands (ev): -33.2547 -33.2547 -33.2494 -33.2494 -14.3452 -14.3452 -14.3277 -14.3277 -12.9724 -12.9724 -12.9621 -12.9621 -12.8875 -12.8875 -12.8477 -12.8477 -0.8703 -0.8703 -0.6122 -0.6122 -0.3267 -0.3267 1.6117 1.6117 1.7062 1.7062 2.5217 2.5217 5.1593 5.1593 5.6982 5.6982 5.9250 5.9250 6.1885 6.1885 6.5129 6.5129 6.8896 6.8896 7.3225 7.3225 7.5002 7.5002 7.7075 7.7075 8.2634 8.2634 10.4474 10.4474 10.9032 10.9032 11.4050 11.4050 11.4116 11.4116 k =-0.2595 1.3317 0.6589 ( 4573 PWs) bands (ev): -33.2543 -33.2543 -33.2492 -33.2492 -14.3458 -14.3458 -14.3290 -14.3290 -12.9716 -12.9716 -12.9621 -12.9621 -12.8906 -12.8906 -12.8513 -12.8513 -0.8325 -0.8325 -0.5781 -0.5781 -0.2923 -0.2923 1.6539 1.6539 1.7230 1.7230 2.4770 2.4770 5.1287 5.1287 5.6507 5.6507 5.7785 5.7785 6.1866 6.1866 6.4755 6.4755 6.8970 6.8970 7.2561 7.2561 7.4154 7.4154 7.6446 7.6446 8.1681 8.1681 10.4606 10.4606 10.8943 10.8943 11.4072 11.4072 11.4856 11.4856 k =-0.2595 1.3317 0.6918 ( 4571 PWs) bands (ev): -33.2539 -33.2539 -33.2489 -33.2489 -14.3465 -14.3465 -14.3302 -14.3302 -12.9710 -12.9710 -12.9621 -12.9621 -12.8935 -12.8935 -12.8549 -12.8549 -0.7934 -0.7934 -0.5430 -0.5430 -0.2564 -0.2564 1.6975 1.6975 1.7356 1.7356 2.4355 2.4355 5.0666 5.0666 5.6286 5.6286 5.6433 5.6433 6.1842 6.1842 6.4332 6.4332 6.9047 6.9047 7.1941 7.1941 7.3147 7.3147 7.6076 7.6076 8.0743 8.0743 10.4743 10.4743 10.8899 10.8899 11.4002 11.4002 11.5658 11.5658 k =-0.2595 1.3317 0.7247 ( 4573 PWs) bands (ev): -33.2535 -33.2535 -33.2487 -33.2487 -14.3471 -14.3471 -14.3315 -14.3315 -12.9705 -12.9705 -12.9622 -12.9622 -12.8963 -12.8963 -12.8584 -12.8584 -0.7532 -0.7532 -0.5071 -0.5071 -0.2190 -0.2190 1.7380 1.7380 1.7468 1.7468 2.3991 2.3991 4.9813 4.9813 5.4905 5.4905 5.6545 5.6545 6.1803 6.1803 6.3855 6.3855 6.9092 6.9092 7.1294 7.1294 7.2242 7.2242 7.5810 7.5810 7.9822 7.9822 10.4886 10.4886 10.8898 10.8898 11.3914 11.3914 11.6458 11.6458 k =-0.2595 1.3317 0.7577 ( 4577 PWs) bands (ev): -33.2531 -33.2531 -33.2485 -33.2485 -14.3478 -14.3478 -14.3328 -14.3328 -12.9702 -12.9702 -12.9623 -12.9623 -12.8989 -12.8989 -12.8619 -12.8619 -0.7120 -0.7120 -0.4706 -0.4706 -0.1802 -0.1802 1.7402 1.7402 1.7897 1.7897 2.3695 2.3695 4.8832 4.8832 5.3518 5.3518 5.6867 5.6867 6.1744 6.1744 6.3327 6.3327 6.9005 6.9005 7.0599 7.0599 7.1631 7.1631 7.5578 7.5578 7.8922 7.8922 10.5037 10.5037 10.8939 10.8939 11.3819 11.3819 11.7258 11.7258 k =-0.2595 1.3317 0.7906 ( 4577 PWs) bands (ev): -33.2527 -33.2527 -33.2484 -33.2484 -14.3484 -14.3484 -14.3342 -14.3342 -12.9700 -12.9700 -12.9625 -12.9625 -12.9013 -12.9013 -12.8652 -12.8652 -0.6700 -0.6700 -0.4338 -0.4338 -0.1400 -0.1400 1.7300 1.7300 1.8368 1.8368 2.3482 2.3482 4.7798 4.7798 5.2168 5.2168 5.7286 5.7286 6.1653 6.1653 6.2761 6.2761 6.8562 6.8562 7.0161 7.0161 7.1259 7.1259 7.5354 7.5354 7.8046 7.8046 10.5198 10.5198 10.9016 10.9016 11.3728 11.3728 11.8057 11.8057 k =-0.2595 1.3317 0.8236 ( 4563 PWs) bands (ev): -33.2523 -33.2523 -33.2482 -33.2482 -14.3490 -14.3490 -14.3355 -14.3355 -12.9700 -12.9700 -12.9627 -12.9627 -12.9034 -12.9034 -12.8684 -12.8684 -0.6273 -0.6273 -0.3967 -0.3967 -0.0984 -0.0984 1.7095 1.7095 1.8848 1.8848 2.3363 2.3363 4.6754 4.6754 5.0858 5.0858 5.7749 5.7749 6.1517 6.1517 6.2177 6.2177 6.7793 6.7793 7.0066 7.0066 7.1022 7.1022 7.5125 7.5125 7.7198 7.7198 10.5371 10.5371 10.9122 10.9122 11.3655 11.3655 11.8854 11.8854 k =-0.2595 1.3317 0.8565 ( 4567 PWs) bands (ev): -33.2519 -33.2519 -33.2480 -33.2480 -14.3495 -14.3495 -14.3368 -14.3368 -12.9701 -12.9701 -12.9630 -12.9630 -12.9052 -12.9052 -12.8715 -12.8715 -0.5842 -0.5842 -0.3598 -0.3598 -0.0555 -0.0555 1.6789 1.6789 1.9334 1.9334 2.3336 2.3336 4.5726 4.5726 4.9592 4.9592 5.8208 5.8208 6.1316 6.1316 6.1613 6.1613 6.6975 6.6975 7.0095 7.0095 7.0878 7.0878 7.4885 7.4885 7.6379 7.6379 10.5555 10.5555 10.9249 10.9249 11.3611 11.3611 11.9651 11.9651 k =-0.2595 1.3317 0.8895 ( 4568 PWs) bands (ev): -33.2515 -33.2515 -33.2478 -33.2478 -14.3501 -14.3501 -14.3381 -14.3381 -12.9703 -12.9703 -12.9635 -12.9635 -12.9067 -12.9067 -12.8744 -12.8744 -0.5408 -0.5408 -0.3234 -0.3234 -0.0112 -0.0112 1.6391 1.6391 1.9824 1.9824 2.3389 2.3389 4.4730 4.4730 4.8373 4.8373 5.8585 5.8585 6.1024 6.1024 6.1145 6.1145 6.6245 6.6245 7.0147 7.0147 7.0805 7.0805 7.4628 7.4628 7.5596 7.5596 10.5752 10.5752 10.9385 10.9385 11.3613 11.3613 12.0444 12.0444 k =-0.2595 1.3317 0.9224 ( 4564 PWs) bands (ev): -33.2511 -33.2511 -33.2477 -33.2477 -14.3506 -14.3506 -14.3394 -14.3394 -12.9707 -12.9707 -12.9640 -12.9640 -12.9079 -12.9079 -12.8772 -12.8772 -0.4974 -0.4974 -0.2877 -0.2877 0.0345 0.0345 1.5918 1.5918 2.0315 2.0315 2.3507 2.3507 4.3778 4.3778 4.7204 4.7204 5.8730 5.8730 6.0625 6.0625 6.0925 6.0925 6.5661 6.5661 7.0193 7.0193 7.0786 7.0786 7.4338 7.4338 7.4864 7.4864 10.5960 10.5960 10.9516 10.9516 11.3672 11.3672 12.1233 12.1233 k =-0.2595 1.3317 0.9554 ( 4559 PWs) bands (ev): -33.2507 -33.2507 -33.2475 -33.2475 -14.3510 -14.3510 -14.3406 -14.3406 -12.9711 -12.9711 -12.9647 -12.9647 -12.9087 -12.9087 -12.8799 -12.8799 -0.4543 -0.4543 -0.2532 -0.2532 0.0815 0.0815 1.5385 1.5385 2.0803 2.0803 2.3672 2.3672 4.2878 4.2878 4.6088 4.6088 5.8520 5.8520 6.0114 6.0114 6.1079 6.1079 6.5245 6.5245 7.0229 7.0229 7.0799 7.0799 7.3929 7.3929 7.4273 7.4273 10.6181 10.6181 10.9630 10.9630 11.3801 11.3801 12.2014 12.2014 k =-0.2595 1.3317 0.9883 ( 4557 PWs) bands (ev): -33.2504 -33.2504 -33.2474 -33.2474 -14.3514 -14.3514 -14.3419 -14.3419 -12.9715 -12.9715 -12.9655 -12.9655 -12.9093 -12.9093 -12.8824 -12.8824 -0.4117 -0.4117 -0.2204 -0.2204 0.1300 0.1300 1.4807 1.4807 2.1286 2.1286 2.3867 2.3867 4.2037 4.2037 4.5028 4.5028 5.8072 5.8072 5.9512 5.9512 6.1495 6.1495 6.4984 6.4984 7.0260 7.0260 7.0822 7.0822 7.3328 7.3328 7.3900 7.3900 10.6412 10.6412 10.9719 10.9719 11.4006 11.4006 12.2778 12.2778 k =-0.2595 1.3317 1.0212 ( 4559 PWs) bands (ev): -33.2500 -33.2500 -33.2473 -33.2473 -14.3518 -14.3518 -14.3430 -14.3430 -12.9720 -12.9720 -12.9664 -12.9664 -12.9096 -12.9096 -12.8847 -12.8847 -0.3699 -0.3699 -0.1895 -0.1895 0.1798 0.1798 1.4195 1.4195 2.1760 2.1760 2.4078 2.4078 4.1263 4.1263 4.4027 4.4027 5.7539 5.7539 5.8855 5.8855 6.2025 6.2025 6.4852 6.4852 7.0288 7.0288 7.0835 7.0835 7.2703 7.2703 7.3584 7.3584 10.6652 10.6652 10.9777 10.9777 11.4286 11.4286 12.3499 12.3499 k =-0.2595 1.3317 1.0542 ( 4569 PWs) bands (ev): -33.2497 -33.2497 -33.2473 -33.2473 -14.3521 -14.3521 -14.3442 -14.3442 -12.9725 -12.9725 -12.9673 -12.9673 -12.9096 -12.9096 -12.8870 -12.8870 -0.3293 -0.3293 -0.1611 -0.1611 0.2312 0.2312 1.3559 1.3559 2.2221 2.2221 2.4293 2.4293 4.0559 4.0559 4.3090 4.3090 5.6992 5.6992 5.8179 5.8179 6.2602 6.2602 6.4817 6.4817 7.0311 7.0311 7.0818 7.0818 7.2123 7.2123 7.3275 7.3275 10.6899 10.6899 10.9805 10.9805 11.4637 11.4637 12.3983 12.3983 k =-0.2595 1.3317 1.0871 ( 4573 PWs) bands (ev): -33.2494 -33.2494 -33.2472 -33.2472 -14.3523 -14.3523 -14.3452 -14.3452 -12.9730 -12.9730 -12.9682 -12.9682 -12.9094 -12.9094 -12.8891 -12.8891 -0.2902 -0.2902 -0.1357 -0.1357 0.2841 0.2841 1.2907 1.2907 2.2665 2.2665 2.4501 2.4501 3.9932 3.9932 4.2219 4.2219 5.6464 5.6464 5.7515 5.7515 6.3194 6.3194 6.4857 6.4857 7.0309 7.0309 7.0749 7.0749 7.1629 7.1629 7.2969 7.2969 10.7152 10.7152 10.9804 10.9804 11.5047 11.5047 12.3735 12.3735 k =-0.2595 1.3317 1.1201 ( 4569 PWs) bands (ev): -33.2491 -33.2491 -33.2472 -33.2472 -14.3525 -14.3525 -14.3463 -14.3463 -12.9735 -12.9735 -12.9692 -12.9692 -12.9090 -12.9090 -12.8910 -12.8910 -0.2531 -0.2531 -0.1136 -0.1136 0.3384 0.3384 1.2243 1.2243 2.3087 2.3087 2.4694 2.4694 3.9386 3.9386 4.1419 4.1419 5.5973 5.5973 5.6885 5.6885 6.3785 6.3785 6.4954 6.4954 7.0220 7.0220 7.0622 7.0622 7.1286 7.1286 7.2672 7.2672 10.7407 10.7407 10.9779 10.9779 11.5504 11.5504 12.3214 12.3214 k =-0.2595 1.3317 1.1530 ( 4571 PWs) bands (ev): -33.2488 -33.2488 -33.2472 -33.2472 -14.3526 -14.3526 -14.3472 -14.3472 -12.9739 -12.9739 -12.9701 -12.9701 -12.9084 -12.9084 -12.8929 -12.8929 -0.2182 -0.2182 -0.0952 -0.0952 0.3943 0.3943 1.1574 1.1574 2.3482 2.3482 2.4862 2.4862 3.8925 3.8925 4.0694 4.0694 5.5531 5.5531 5.6307 5.6307 6.4361 6.4361 6.5097 6.5097 6.9951 6.9951 7.0509 7.0509 7.1107 7.1107 7.2394 7.2394 10.7661 10.7661 10.9732 10.9732 11.5997 11.5997 12.2648 12.2648 k =-0.2595 1.3317 1.1860 ( 4573 PWs) bands (ev): -33.2486 -33.2486 -33.2472 -33.2472 -14.3526 -14.3526 -14.3481 -14.3481 -12.9742 -12.9742 -12.9710 -12.9710 -12.9076 -12.9076 -12.8947 -12.8947 -0.1860 -0.1860 -0.0809 -0.0809 0.4517 0.4517 1.0901 1.0901 2.3845 2.3845 2.4999 2.4999 3.8553 3.8553 4.0047 4.0047 5.5147 5.5147 5.5791 5.5791 6.4904 6.4904 6.5281 6.5281 6.9583 6.9583 7.0381 7.0381 7.1036 7.1036 7.2148 7.2148 10.7911 10.7911 10.9666 10.9666 11.6513 11.6513 12.2072 12.2072 k =-0.2595 1.3317 1.2189 ( 4571 PWs) bands (ev): -33.2483 -33.2483 -33.2472 -33.2472 -14.3525 -14.3525 -14.3489 -14.3489 -12.9744 -12.9744 -12.9718 -12.9718 -12.9068 -12.9068 -12.8964 -12.8964 -0.1568 -0.1568 -0.0710 -0.0710 0.5105 0.5105 1.0229 1.0229 2.4172 2.4172 2.5099 2.5099 3.8274 3.8274 3.9482 3.9482 5.4830 5.4830 5.5350 5.5350 6.5364 6.5364 6.5530 6.5530 6.9223 6.9223 7.0180 7.0180 7.1035 7.1035 7.1940 7.1940 10.8153 10.8153 10.9581 10.9581 11.7046 11.7046 12.1496 12.1496 k =-0.2595 1.3317 1.2518 ( 4558 PWs) bands (ev): -33.2481 -33.2481 -33.2472 -33.2472 -14.3524 -14.3524 -14.3497 -14.3497 -12.9745 -12.9745 -12.9726 -12.9726 -12.9058 -12.9058 -12.8979 -12.8979 -0.1311 -0.1311 -0.0657 -0.0657 0.5707 0.5707 0.9559 0.9559 2.4458 2.4458 2.5156 2.5156 3.8089 3.8089 3.9004 3.9004 5.4584 5.4584 5.4990 5.4990 6.5653 6.5653 6.5890 6.5890 6.8933 6.8933 6.9907 6.9907 7.1076 7.1076 7.1773 7.1773 10.8384 10.8384 10.9479 10.9479 11.7587 11.7587 12.0924 12.0924 k =-0.2595 1.3317 1.2848 ( 4558 PWs) bands (ev): -33.2479 -33.2479 -33.2473 -33.2473 -14.3521 -14.3521 -14.3503 -14.3503 -12.9745 -12.9745 -12.9732 -12.9732 -12.9047 -12.9047 -12.8995 -12.8995 -0.1092 -0.1092 -0.0650 -0.0650 0.6322 0.6322 0.8895 0.8895 2.4700 2.4700 2.5167 2.5167 3.8000 3.8000 3.8615 3.8615 5.4415 5.4415 5.4720 5.4720 6.5889 6.5889 6.6183 6.6183 6.8769 6.8769 6.9588 6.9588 7.1135 7.1135 7.1640 7.1640 10.8597 10.8597 10.9361 10.9361 11.8133 11.8133 12.0357 12.0357 k =-0.2595 1.3317 1.3177 ( 4556 PWs) bands (ev): -33.2477 -33.2477 -33.2474 -33.2474 -14.3518 -14.3518 -14.3509 -14.3509 -12.9744 -12.9744 -12.9737 -12.9737 -12.9035 -12.9035 -12.9009 -12.9009 -0.0914 -0.0914 -0.0692 -0.0692 0.6950 0.6950 0.8238 0.8238 2.4893 2.4893 2.5127 2.5127 3.8007 3.8007 3.8320 3.8320 5.4320 5.4320 5.4547 5.4547 6.6102 6.6102 6.6308 6.6308 6.8779 6.8779 6.9262 6.9262 7.1196 7.1196 7.1542 7.1542 10.8780 10.8780 10.9236 10.9236 11.8681 11.8681 11.9798 11.9798 k =-0.2595 1.3317 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3513 -14.3513 -12.9742 -12.9742 -12.9740 -12.9740 -12.9023 -12.9023 -12.9022 -12.9022 -0.0782 -0.0782 -0.0778 -0.0778 0.7586 0.7586 0.7592 0.7592 2.5028 2.5028 2.5044 2.5044 3.8089 3.8089 3.8141 3.8141 5.4292 5.4292 5.4486 5.4486 6.6249 6.6249 6.6274 6.6274 6.8921 6.8921 6.9014 6.9014 7.1225 7.1225 7.1501 7.1501 10.8875 10.8875 10.9160 10.9160 11.9172 11.9172 11.9303 11.9303 k =-0.2595 1.3317 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3515 -14.3515 -14.3513 -14.3513 -12.9742 -12.9742 -12.9740 -12.9740 -12.9023 -12.9023 -12.9022 -12.9022 -0.0782 -0.0782 -0.0778 -0.0778 0.7586 0.7586 0.7592 0.7592 2.5028 2.5028 2.5044 2.5044 3.8089 3.8089 3.8141 3.8141 5.4292 5.4292 5.4486 5.4486 6.6249 6.6249 6.6274 6.6274 6.8921 6.8921 6.9014 6.9014 7.1225 7.1225 7.1501 7.1501 10.8875 10.8875 10.9160 10.9160 11.9172 11.9172 11.9303 11.9303 k =-0.2658 1.2992 1.3507 ( 4560 PWs) bands (ev): -33.2476 -33.2476 -33.2476 -33.2476 -14.3514 -14.3514 -14.3511 -14.3511 -12.9739 -12.9739 -12.9735 -12.9735 -12.9023 -12.9023 -12.9022 -12.9022 -0.0872 -0.0872 -0.0865 -0.0865 0.7596 0.7596 0.7606 0.7606 2.4926 2.4926 2.4949 2.4949 3.8230 3.8230 3.8279 3.8279 5.4579 5.4579 5.4766 5.4766 6.6021 6.6021 6.6052 6.6052 6.9011 6.9011 6.9076 6.9076 7.1321 7.1321 7.1608 7.1608 10.8503 10.8503 10.8800 10.8800 11.9476 11.9476 11.9627 11.9627 k =-0.2722 1.2667 1.3507 ( 4564 PWs) bands (ev): -33.2477 -33.2477 -33.2477 -33.2477 -14.3512 -14.3512 -14.3508 -14.3508 -12.9735 -12.9735 -12.9729 -12.9729 -12.9024 -12.9024 -12.9022 -12.9022 -0.1003 -0.1003 -0.0993 -0.0993 0.7606 0.7606 0.7619 0.7619 2.4780 2.4780 2.4811 2.4811 3.8461 3.8461 3.8507 3.8507 5.4919 5.4919 5.5095 5.5095 6.5781 6.5781 6.5867 6.5867 6.9118 6.9118 6.9155 6.9155 7.1443 7.1443 7.1740 7.1740 10.8048 10.8048 10.8355 10.8355 11.9789 11.9789 11.9962 11.9962 k =-0.2785 1.2342 1.3507 ( 4566 PWs) bands (ev): -33.2477 -33.2477 -33.2477 -33.2477 -14.3509 -14.3509 -14.3505 -14.3505 -12.9729 -12.9729 -12.9721 -12.9721 -12.9025 -12.9025 -12.9022 -12.9022 -0.1172 -0.1172 -0.1159 -0.1159 0.7616 0.7616 0.7632 0.7632 2.4595 2.4595 2.4632 2.4632 3.8781 3.8781 3.8824 3.8824 5.5301 5.5301 5.5463 5.5463 6.5562 6.5562 6.5706 6.5706 6.9242 6.9242 6.9250 6.9250 7.1590 7.1590 7.1896 7.1896 10.7516 10.7516 10.7833 10.7833 12.0112 12.0112 12.0307 12.0307 k =-0.2848 1.2018 1.3507 ( 4562 PWs) bands (ev): -33.2478 -33.2478 -33.2478 -33.2478 -14.3506 -14.3506 -14.3501 -14.3501 -12.9721 -12.9721 -12.9711 -12.9711 -12.9026 -12.9026 -12.9022 -12.9022 -0.1375 -0.1375 -0.1360 -0.1360 0.7625 0.7625 0.7643 0.7643 2.4374 2.4374 2.4418 2.4418 3.9186 3.9186 3.9227 3.9227 5.5709 5.5709 5.5852 5.5852 6.5379 6.5379 6.5584 6.5584 6.9365 6.9365 6.9385 6.9385 7.1760 7.1760 7.2074 7.2074 10.6919 10.6919 10.7244 10.7244 12.0442 12.0442 12.0660 12.0660 k =-0.2911 1.1693 1.3507 ( 4558 PWs) bands (ev): -33.2479 -33.2479 -33.2479 -33.2479 -14.3502 -14.3502 -14.3496 -14.3496 -12.9712 -12.9712 -12.9700 -12.9700 -12.9027 -12.9027 -12.9022 -12.9022 -0.1610 -0.1610 -0.1592 -0.1592 0.7630 0.7630 0.7652 0.7652 2.4123 2.4123 2.4171 2.4171 3.9673 3.9673 3.9713 3.9713 5.6126 5.6126 5.6245 5.6245 6.5248 6.5248 6.5518 6.5518 6.9501 6.9501 6.9549 6.9549 7.1952 7.1952 7.2274 7.2274 10.6270 10.6270 10.6601 10.6601 12.0780 12.0780 12.1019 12.1019 k =-0.2975 1.1368 1.3507 ( 4554 PWs) bands (ev): -33.2480 -33.2480 -33.2480 -33.2480 -14.3497 -14.3497 -14.3490 -14.3490 -12.9701 -12.9701 -12.9688 -12.9688 -12.9028 -12.9028 -12.9022 -12.9022 -0.1873 -0.1873 -0.1853 -0.1853 0.7633 0.7633 0.7657 0.7657 2.3845 2.3845 2.3898 2.3898 4.0239 4.0239 4.0278 4.0278 5.6528 5.6528 5.6619 5.6619 6.5188 6.5188 6.5526 6.5526 6.9659 6.9659 6.9734 6.9734 7.2164 7.2164 7.2495 7.2495 10.5580 10.5580 10.5918 10.5918 12.1123 12.1123 12.1383 12.1383 k =-0.3038 1.1043 1.3507 ( 4566 PWs) bands (ev): -33.2482 -33.2482 -33.2482 -33.2482 -14.3491 -14.3491 -14.3484 -14.3484 -12.9689 -12.9689 -12.9674 -12.9674 -12.9028 -12.9028 -12.9022 -12.9022 -0.2160 -0.2160 -0.2138 -0.2138 0.7631 0.7631 0.7658 0.7658 2.3546 2.3546 2.3603 2.3603 4.0879 4.0879 4.0917 4.0917 5.6891 5.6891 5.6950 5.6950 6.5221 6.5221 6.5631 6.5631 6.9841 6.9841 6.9942 6.9942 7.2395 7.2395 7.2736 7.2736 10.4863 10.4863 10.5207 10.5207 12.1469 12.1469 12.1749 12.1749 k =-0.3101 1.0718 1.3507 ( 4566 PWs) bands (ev): -33.2483 -33.2483 -33.2483 -33.2483 -14.3485 -14.3485 -14.3477 -14.3477 -12.9676 -12.9676 -12.9660 -12.9660 -12.9028 -12.9028 -12.9022 -12.9022 -0.2468 -0.2468 -0.2444 -0.2444 0.7625 0.7625 0.7654 0.7654 2.3230 2.3230 2.3290 2.3290 4.1589 4.1589 4.1627 4.1627 5.7192 5.7192 5.7219 5.7219 6.5366 6.5366 6.5848 6.5848 7.0050 7.0050 7.0175 7.0175 7.2644 7.2644 7.2998 7.2998 10.4131 10.4131 10.4479 10.4479 12.1816 12.1816 12.2115 12.2115 k =-0.3165 1.0394 1.3507 ( 4562 PWs) bands (ev): -33.2485 -33.2485 -33.2485 -33.2485 -14.3479 -14.3479 -14.3470 -14.3470 -12.9662 -12.9662 -12.9645 -12.9645 -12.9028 -12.9028 -12.9020 -12.9020 -0.2793 -0.2793 -0.2767 -0.2767 0.7614 0.7614 0.7645 0.7645 2.2901 2.2901 2.2964 2.2964 4.2362 4.2362 4.2401 4.2401 5.7411 5.7411 5.7412 5.7412 6.5637 6.5637 6.6189 6.6189 7.0289 7.0289 7.0435 7.0435 7.2908 7.2908 7.3281 7.3281 10.3393 10.3393 10.3747 10.3747 12.2160 12.2160 12.2477 12.2477 k =-0.3228 1.0069 1.3507 ( 4566 PWs) bands (ev): -33.2486 -33.2486 -33.2486 -33.2486 -14.3472 -14.3472 -14.3462 -14.3462 -12.9648 -12.9648 -12.9630 -12.9630 -12.9026 -12.9026 -12.9018 -12.9018 -0.3132 -0.3132 -0.3104 -0.3104 0.7598 0.7598 0.7631 0.7631 2.2563 2.2563 2.2628 2.2628 4.3194 4.3194 4.3235 4.3235 5.7522 5.7522 5.7545 5.7545 6.6037 6.6037 6.6652 6.6652 7.0563 7.0563 7.0724 7.0724 7.3189 7.3189 7.3585 7.3585 10.2658 10.2658 10.3019 10.3019 12.2498 12.2498 12.2832 12.2832 k =-0.3291 0.9744 1.3507 ( 4570 PWs) bands (ev): -33.2488 -33.2488 -33.2488 -33.2488 -14.3464 -14.3464 -14.3454 -14.3454 -12.9634 -12.9634 -12.9614 -12.9614 -12.9024 -12.9024 -12.9016 -12.9016 -0.3481 -0.3481 -0.3452 -0.3452 0.7577 0.7577 0.7612 0.7612 2.2221 2.2221 2.2287 2.2287 4.4077 4.4077 4.4121 4.4121 5.7559 5.7559 5.7595 5.7595 6.6554 6.6554 6.7222 6.7222 7.0878 7.0878 7.1046 7.1046 7.3485 7.3485 7.3913 7.3913 10.1936 10.1936 10.2304 10.2304 12.2826 12.2826 12.3176 12.3176 k =-0.3354 0.9419 1.3507 ( 4582 PWs) bands (ev): -33.2490 -33.2490 -33.2490 -33.2490 -14.3456 -14.3456 -14.3445 -14.3445 -12.9619 -12.9619 -12.9599 -12.9599 -12.9020 -12.9020 -12.9012 -12.9012 -0.3838 -0.3838 -0.3808 -0.3808 0.7550 0.7550 0.7588 0.7588 2.1876 2.1876 2.1943 2.1943 4.5003 4.5003 4.5052 4.5052 5.7537 5.7537 5.7577 5.7577 6.7167 6.7167 6.7874 6.7874 7.1245 7.1245 7.1403 7.1403 7.3799 7.3799 7.4270 7.4270 10.1232 10.1232 10.1608 10.1608 12.3139 12.3139 12.3505 12.3505 k =-0.3418 0.9094 1.3507 ( 4574 PWs) bands (ev): -33.2492 -33.2492 -33.2492 -33.2492 -14.3448 -14.3448 -14.3437 -14.3437 -12.9605 -12.9605 -12.9584 -12.9584 -12.9016 -12.9016 -12.9007 -12.9007 -0.4199 -0.4199 -0.4169 -0.4169 0.7519 0.7519 0.7558 0.7558 2.1532 2.1532 2.1599 2.1599 4.5964 4.5964 4.6018 4.6018 5.7476 5.7476 5.7514 5.7514 6.7846 6.7846 6.8573 6.8573 7.1678 7.1678 7.1798 7.1798 7.4135 7.4135 7.4663 7.4663 10.0553 10.0553 10.0938 10.0938 12.3432 12.3432 12.3813 12.3813 k =-0.3481 0.8770 1.3507 ( 4564 PWs) bands (ev): -33.2494 -33.2494 -33.2494 -33.2494 -14.3439 -14.3439 -14.3428 -14.3428 -12.9591 -12.9591 -12.9569 -12.9569 -12.9009 -12.9009 -12.9000 -12.9000 -0.4563 -0.4563 -0.4531 -0.4531 0.7482 0.7482 0.7522 0.7522 2.1192 2.1192 2.1259 2.1259 4.6944 4.6944 4.7006 4.7006 5.7400 5.7400 5.7429 5.7429 6.8559 6.8559 6.9278 6.9278 7.2187 7.2187 7.2232 7.2232 7.4503 7.4503 7.5103 7.5103 9.9903 9.9903 10.0299 10.0299 12.3701 12.3701 12.4097 12.4097 k =-0.3544 0.8445 1.3507 ( 4564 PWs) bands (ev): -33.2496 -33.2496 -33.2496 -33.2496 -14.3430 -14.3430 -14.3419 -14.3419 -12.9578 -12.9578 -12.9556 -12.9556 -12.9001 -12.9001 -12.8992 -12.8992 -0.4925 -0.4925 -0.4894 -0.4894 0.7441 0.7441 0.7482 0.7482 2.0858 2.0858 2.0924 2.0924 4.7928 4.7928 4.8000 4.8000 5.7336 5.7336 5.7353 5.7353 6.9275 6.9275 6.9950 6.9950 7.2699 7.2699 7.2775 7.2775 7.4924 7.4924 7.5610 7.5610 9.9287 9.9287 9.9696 9.9696 12.3938 12.3938 12.4351 12.4351 k =-0.3608 0.8120 1.3507 ( 4568 PWs) bands (ev): -33.2498 -33.2498 -33.2498 -33.2498 -14.3422 -14.3422 -14.3410 -14.3410 -12.9566 -12.9566 -12.9544 -12.9544 -12.8991 -12.8991 -12.8983 -12.8983 -0.5285 -0.5285 -0.5253 -0.5253 0.7394 0.7394 0.7436 0.7436 2.0531 2.0531 2.0596 2.0596 4.8889 4.8889 4.8974 4.8974 5.7318 5.7318 5.7318 5.7318 6.9968 6.9968 7.0565 7.0565 7.3187 7.3187 7.3409 7.3409 7.5439 7.5439 7.6206 7.6206 9.8708 9.8708 9.9132 9.9132 12.4135 12.4135 12.4569 12.4569 k =-0.3671 0.7795 1.3507 ( 4568 PWs) bands (ev): -33.2501 -33.2501 -33.2501 -33.2501 -14.3413 -14.3413 -14.3401 -14.3401 -12.9555 -12.9555 -12.9534 -12.9534 -12.8979 -12.8979 -12.8971 -12.8971 -0.5640 -0.5640 -0.5608 -0.5608 0.7344 0.7344 0.7386 0.7386 2.0214 2.0214 2.0277 2.0277 4.9791 4.9791 4.9891 4.9891 5.7367 5.7367 5.7387 5.7387 7.0622 7.0622 7.1123 7.1123 7.3672 7.3672 7.4017 7.4017 7.6108 7.6108 7.6915 7.6915 9.8171 9.8171 9.8611 9.8611 12.4268 12.4268 12.4735 12.4735 k =-0.3734 0.7470 1.3507 ( 4568 PWs) bands (ev): -33.2503 -33.2503 -33.2503 -33.2503 -14.3404 -14.3404 -14.3392 -14.3392 -12.9545 -12.9545 -12.9525 -12.9525 -12.8965 -12.8965 -12.8958 -12.8958 -0.5989 -0.5989 -0.5957 -0.5957 0.7290 0.7290 0.7332 0.7332 1.9909 1.9909 1.9970 1.9970 5.0586 5.0586 5.0702 5.0702 5.7556 5.7556 5.7595 5.7595 7.1234 7.1234 7.1634 7.1634 7.4133 7.4133 7.4537 7.4537 7.6969 7.6969 7.7751 7.7751 9.7676 9.7676 9.8135 9.8135 12.4242 12.4242 12.4764 12.4764 k =-0.3797 0.7146 1.3507 ( 4568 PWs) bands (ev): -33.2505 -33.2505 -33.2505 -33.2505 -14.3395 -14.3395 -14.3383 -14.3383 -12.9537 -12.9537 -12.9518 -12.9518 -12.8950 -12.8950 -12.8943 -12.8943 -0.6329 -0.6329 -0.6297 -0.6297 0.7232 0.7232 0.7274 0.7274 1.9615 1.9615 1.9674 1.9674 5.1224 5.1224 5.1352 5.1352 5.7941 5.7941 5.7996 5.7996 7.1805 7.1805 7.2116 7.2116 7.4554 7.4554 7.4959 7.4959 7.8004 7.8004 7.8715 7.8715 9.7227 9.7227 9.7708 9.7708 12.3673 12.3673 12.4076 12.4076 k =-0.3861 0.6821 1.3507 ( 4560 PWs) bands (ev): -33.2507 -33.2507 -33.2507 -33.2507 -14.3386 -14.3386 -14.3374 -14.3374 -12.9531 -12.9531 -12.9512 -12.9512 -12.8933 -12.8933 -12.8927 -12.8927 -0.6659 -0.6659 -0.6628 -0.6628 0.7171 0.7171 0.7212 0.7212 1.9335 1.9335 1.9391 1.9391 5.1670 5.1670 5.1804 5.1804 5.8562 5.8562 5.8626 5.8626 7.2345 7.2345 7.2580 7.2580 7.4934 7.4934 7.5311 7.5311 7.9164 7.9164 7.9791 7.9791 9.6826 9.6826 9.7331 9.7331 12.2579 12.2579 12.2908 12.2908 k =-0.3924 0.6496 1.3507 ( 4564 PWs) bands (ev): -33.2509 -33.2509 -33.2509 -33.2509 -14.3377 -14.3377 -14.3365 -14.3365 -12.9525 -12.9525 -12.9508 -12.9508 -12.8914 -12.8914 -12.8910 -12.8910 -0.6977 -0.6977 -0.6947 -0.6947 0.7108 0.7108 0.7148 0.7148 1.9069 1.9069 1.9122 1.9122 5.1929 5.1929 5.2061 5.2061 5.9417 5.9417 5.9481 5.9481 7.2861 7.2861 7.3033 7.3033 7.5274 7.5274 7.5615 7.5615 8.0407 8.0407 8.0956 8.0956 9.6475 9.6475 9.7008 9.7008 12.1310 12.1310 12.1625 12.1625 k =-0.3987 0.6171 1.3507 ( 4568 PWs) bands (ev): -33.2511 -33.2511 -33.2511 -33.2511 -14.3368 -14.3368 -14.3357 -14.3357 -12.9521 -12.9521 -12.9505 -12.9505 -12.8895 -12.8895 -12.8891 -12.8891 -0.7283 -0.7283 -0.7254 -0.7254 0.7043 0.7043 0.7082 0.7082 1.8818 1.8818 1.8867 1.8867 5.2037 5.2037 5.2161 5.2161 6.0468 6.0468 6.0527 6.0527 7.3358 7.3358 7.3481 7.3481 7.5581 7.5581 7.5885 7.5885 8.1703 8.1703 8.2189 8.2189 9.6178 9.6178 9.6740 9.6740 11.9945 11.9945 12.0260 12.0260 k =-0.4051 0.5846 1.3507 ( 4568 PWs) bands (ev): -33.2514 -33.2514 -33.2514 -33.2514 -14.3360 -14.3360 -14.3349 -14.3349 -12.9519 -12.9519 -12.9503 -12.9503 -12.8874 -12.8874 -12.8871 -12.8871 -0.7575 -0.7575 -0.7547 -0.7547 0.6976 0.6976 0.7014 0.7014 1.8582 1.8582 1.8628 1.8628 5.2036 5.2036 5.2150 5.2150 6.1667 6.1667 6.1717 6.1717 7.3839 7.3839 7.3925 7.3925 7.5863 7.5863 7.6130 7.6130 8.3028 8.3028 8.3465 8.3465 9.5936 9.5936 9.6532 9.6532 11.8503 11.8503 11.8819 11.8819 k =-0.4114 0.5522 1.3507 ( 4560 PWs) bands (ev): -33.2515 -33.2515 -33.2515 -33.2515 -14.3352 -14.3352 -14.3341 -14.3341 -12.9517 -12.9517 -12.9503 -12.9503 -12.8853 -12.8853 -12.8851 -12.8851 -0.7853 -0.7853 -0.7826 -0.7826 0.6910 0.6910 0.6946 0.6946 1.8361 1.8361 1.8404 1.8404 5.1965 5.1965 5.2069 5.2069 6.2974 6.2974 6.3014 6.3014 7.4305 7.4305 7.4363 7.4363 7.6125 7.6125 7.6358 7.6358 8.4362 8.4362 8.4762 8.4762 9.5758 9.5758 9.6388 9.6388 11.6993 11.6993 11.7308 11.7308 k =-0.4177 0.5197 1.3507 ( 4556 PWs) bands (ev): -33.2517 -33.2517 -33.2517 -33.2517 -14.3344 -14.3344 -14.3334 -14.3334 -12.9516 -12.9516 -12.9503 -12.9503 -12.8832 -12.8832 -12.8831 -12.8831 -0.8115 -0.8115 -0.8089 -0.8089 0.6843 0.6843 0.6877 0.6877 1.8156 1.8156 1.8196 1.8196 5.1851 5.1851 5.1945 5.1945 6.4356 6.4356 6.4386 6.4386 7.4753 7.4753 7.4792 7.4792 7.6377 7.6377 7.6576 7.6576 8.5680 8.5680 8.6054 8.6054 9.5654 9.5654 9.6319 9.6319 11.5425 11.5425 11.5736 11.5736 k =-0.4241 0.4872 1.3507 ( 4554 PWs) bands (ev): -33.2519 -33.2519 -33.2519 -33.2519 -14.3337 -14.3337 -14.3327 -14.3327 -12.9516 -12.9516 -12.9504 -12.9504 -12.8812 -12.8812 -12.8811 -12.8811 -0.8360 -0.8360 -0.8336 -0.8336 0.6778 0.6778 0.6810 0.6810 1.7967 1.7967 1.8004 1.8004 5.1712 5.1712 5.1797 5.1797 6.5791 6.5791 6.5810 6.5810 7.5177 7.5177 7.5207 7.5207 7.6630 7.6630 7.6794 7.6794 8.6954 8.6954 8.7304 8.7304 9.5642 9.5642 9.6336 9.6336 11.3811 11.3811 11.4116 11.4116 k =-0.4304 0.4547 1.3507 ( 4558 PWs) bands (ev): -33.2521 -33.2521 -33.2521 -33.2521 -14.3330 -14.3330 -14.3321 -14.3321 -12.9516 -12.9516 -12.9506 -12.9506 -12.8791 -12.8791 -12.8791 -12.8791 -0.8588 -0.8588 -0.8565 -0.8565 0.6714 0.6714 0.6744 0.6744 1.7794 1.7794 1.7827 1.7827 5.1563 5.1563 5.1639 5.1639 6.7258 6.7258 6.7267 6.7267 7.5566 7.5566 7.5596 7.5596 7.6900 7.6900 7.7027 7.7027 8.8145 8.8145 8.8466 8.8466 9.5752 9.5752 9.6462 9.6462 11.2169 11.2169 11.2464 11.2464 k =-0.4367 0.4222 1.3507 ( 4558 PWs) bands (ev): -33.2523 -33.2523 -33.2523 -33.2523 -14.3324 -14.3324 -14.3315 -14.3315 -12.9517 -12.9517 -12.9508 -12.9508 -12.8772 -12.8772 -12.8772 -12.8772 -0.8798 -0.8798 -0.8777 -0.8777 0.6653 0.6653 0.6680 0.6680 1.7636 1.7636 1.7666 1.7666 5.1410 5.1410 5.1478 5.1478 6.8735 6.8735 6.8737 6.8737 7.5908 7.5908 7.5945 7.5945 7.7210 7.7210 7.7300 7.7300 8.9202 8.9202 8.9476 8.9476 9.6025 9.6025 9.6723 9.6723 11.0523 11.0523 11.0804 11.0804 k =-0.4430 0.3898 1.3507 ( 4566 PWs) bands (ev): -33.2524 -33.2524 -33.2524 -33.2524 -14.3318 -14.3318 -14.3310 -14.3310 -12.9518 -12.9518 -12.9510 -12.9510 -12.8754 -12.8754 -12.8753 -12.8753 -0.8989 -0.8989 -0.8970 -0.8970 0.6595 0.6595 0.6620 0.6620 1.7495 1.7495 1.7521 1.7521 5.1261 5.1261 5.1321 5.1321 7.0190 7.0190 7.0203 7.0203 7.6197 7.6197 7.6239 7.6239 7.7580 7.7580 7.7638 7.7638 9.0072 9.0072 9.0266 9.0266 9.6503 9.6503 9.7143 9.7143 10.8905 10.8905 10.9164 10.9164 k =-0.4494 0.3573 1.3507 ( 4562 PWs) bands (ev): -33.2525 -33.2525 -33.2525 -33.2525 -14.3312 -14.3312 -14.3305 -14.3305 -12.9520 -12.9520 -12.9512 -12.9512 -12.8737 -12.8737 -12.8736 -12.8736 -0.9162 -0.9162 -0.9144 -0.9144 0.6541 0.6541 0.6564 0.6564 1.7369 1.7369 1.7392 1.7392 5.1119 5.1119 5.1172 5.1172 7.1597 7.1597 7.1620 7.1620 7.6438 7.6438 7.6478 7.6478 7.8031 7.8031 7.8068 7.8068 9.0711 9.0711 9.0793 9.0793 9.7183 9.7183 9.7713 9.7713 10.7366 10.7366 10.7589 10.7589 k =-0.4557 0.3248 1.3507 ( 4562 PWs) bands (ev): -33.2527 -33.2527 -33.2527 -33.2527 -14.3307 -14.3307 -14.3301 -14.3301 -12.9521 -12.9521 -12.9515 -12.9515 -12.8721 -12.8721 -12.8721 -12.8721 -0.9315 -0.9315 -0.9299 -0.9299 0.6492 0.6492 0.6512 0.6512 1.7258 1.7258 1.7278 1.7278 5.0989 5.0989 5.1035 5.1035 7.2906 7.2906 7.2934 7.2934 7.6649 7.6649 7.6675 7.6675 7.8589 7.8589 7.8614 7.8614 9.1062 9.1062 9.1105 9.1105 9.7985 9.7985 9.8356 9.8356 10.5997 10.5997 10.6154 10.6154 k =-0.4620 0.2923 1.3507 ( 4558 PWs) bands (ev): -33.2528 -33.2528 -33.2528 -33.2528 -14.3303 -14.3303 -14.3297 -14.3297 -12.9522 -12.9522 -12.9517 -12.9517 -12.8707 -12.8707 -12.8707 -12.8707 -0.9448 -0.9448 -0.9435 -0.9435 0.6449 0.6449 0.6466 0.6466 1.7163 1.7163 1.7180 1.7180 5.0873 5.0873 5.0912 5.0912 7.4043 7.4043 7.4066 7.4066 7.6854 7.6854 7.6854 7.6854 7.9296 7.9296 7.9314 7.9314 9.1107 9.1107 9.1264 9.1264 9.8729 9.8729 9.8890 9.8890 10.4967 10.4967 10.5002 10.5002 k =-0.4684 0.2598 1.3507 ( 4562 PWs) bands (ev): -33.2529 -33.2529 -33.2529 -33.2529 -14.3299 -14.3299 -14.3294 -14.3294 -12.9523 -12.9523 -12.9519 -12.9519 -12.8695 -12.8695 -12.8695 -12.8695 -0.9561 -0.9561 -0.9550 -0.9550 0.6411 0.6411 0.6425 0.6425 1.7083 1.7083 1.7097 1.7097 5.0772 5.0772 5.0805 5.0805 7.4930 7.4930 7.4937 7.4937 7.7041 7.7041 7.7070 7.7070 8.0199 8.0199 8.0204 8.0204 9.0953 9.0953 9.1200 9.1200 9.9041 9.9041 9.9125 9.9125 10.4390 10.4390 10.4530 10.4530 k =-0.4747 0.2274 1.3507 ( 4560 PWs) bands (ev): -33.2529 -33.2529 -33.2529 -33.2529 -14.3296 -14.3296 -14.3292 -14.3292 -12.9524 -12.9524 -12.9521 -12.9521 -12.8685 -12.8685 -12.8684 -12.8684 -0.9654 -0.9654 -0.9645 -0.9645 0.6380 0.6380 0.6391 0.6391 1.7018 1.7018 1.7029 1.7029 5.0689 5.0689 5.0715 5.0715 7.5518 7.5518 7.5533 7.5533 7.7247 7.7247 7.7300 7.7300 8.1288 8.1288 8.1306 8.1306 9.0607 9.0607 9.0909 9.0909 9.8712 9.8712 9.8962 9.8962 10.4512 10.4512 10.4773 10.4773 k =-0.4810 0.1949 1.3507 ( 4572 PWs) bands (ev): -33.2530 -33.2530 -33.2530 -33.2530 -14.3293 -14.3293 -14.3290 -14.3290 -12.9525 -12.9525 -12.9522 -12.9522 -12.8677 -12.8677 -12.8677 -12.8677 -0.9726 -0.9726 -0.9719 -0.9719 0.6355 0.6355 0.6364 0.6364 1.6967 1.6967 1.6976 1.6976 5.0624 5.0624 5.0643 5.0643 7.5863 7.5863 7.5889 7.5889 7.7458 7.7458 7.7516 7.7516 8.2514 8.2514 8.2562 8.2562 9.0063 9.0063 9.0378 9.0378 9.8160 9.8160 9.8439 9.8439 10.5151 10.5151 10.5424 10.5424 k =-0.4873 0.1624 1.3507 ( 4576 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3291 -14.3291 -14.3289 -14.3289 -12.9525 -12.9525 -12.9524 -12.9524 -12.8671 -12.8671 -12.8671 -12.8671 -0.9777 -0.9777 -0.9772 -0.9772 0.6338 0.6338 0.6343 0.6343 1.6932 1.6932 1.6938 1.6938 5.0578 5.0578 5.0590 5.0590 7.6056 7.6056 7.6079 7.6079 7.7639 7.7639 7.7685 7.7685 8.3786 8.3786 8.3866 8.3866 8.9337 8.9337 8.9622 8.9622 9.7666 9.7666 9.7888 9.7888 10.5931 10.5931 10.6150 10.6150 k =-0.4937 0.1299 1.3507 ( 4584 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3288 -14.3288 -12.9526 -12.9526 -12.9525 -12.9525 -12.8668 -12.8668 -12.8667 -12.8667 -0.9807 -0.9807 -0.9805 -0.9805 0.6328 0.6328 0.6331 0.6331 1.6911 1.6911 1.6914 1.6914 5.0551 5.0551 5.0557 5.0557 7.6155 7.6155 7.6169 7.6169 7.7761 7.7761 7.7786 7.7786 8.4956 8.4956 8.5046 8.5046 8.8542 8.8542 8.8743 8.8743 9.7370 9.7370 9.7490 9.7490 10.6569 10.6569 10.6693 10.6693 k =-0.5000 0.0974 1.3507 ( 4572 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9817 -0.9817 -0.9817 -0.9817 0.6325 0.6325 0.6325 0.6325 1.6905 1.6905 1.6905 1.6905 5.0544 5.0544 5.0544 5.0544 7.6190 7.6190 7.6190 7.6190 7.7811 7.7811 7.7811 7.7811 8.5594 8.5594 8.5594 8.5594 8.8163 8.8163 8.8163 8.8163 9.7310 9.7310 9.7310 9.7310 10.6857 10.6857 10.6857 10.6857 k =-0.5000 0.0974 1.3507 ( 4572 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9817 -0.9817 -0.9817 -0.9817 0.6325 0.6325 0.6325 0.6325 1.6905 1.6905 1.6905 1.6905 5.0544 5.0544 5.0544 5.0544 7.6190 7.6190 7.6190 7.6190 7.7811 7.7811 7.7811 7.7811 8.5594 8.5594 8.5594 8.5594 8.8163 8.8163 8.8163 8.8163 9.7310 9.7310 9.7310 9.7310 10.6857 10.6857 10.6857 10.6857 k =-0.5000 0.0974 1.3177 ( 4580 PWs) bands (ev): -33.2533 -33.2533 -33.2530 -33.2530 -14.3294 -14.3294 -14.3282 -14.3282 -12.9534 -12.9534 -12.9514 -12.9514 -12.8672 -12.8672 -12.8661 -12.8661 -1.0834 -1.0834 -0.8779 -0.8779 0.5356 0.5356 0.7295 0.7295 1.6001 1.6001 1.7828 1.7828 4.9669 4.9669 5.1454 5.1454 7.5766 7.5766 7.6568 7.6568 7.7616 7.7616 7.8037 7.8037 8.4606 8.4606 8.6570 8.6570 8.7397 8.7397 8.9000 8.9000 9.6402 9.6402 9.8228 9.8228 10.6051 10.6051 10.7709 10.7709 k =-0.5000 0.0974 1.2848 ( 4576 PWs) bands (ev): -33.2534 -33.2534 -33.2529 -33.2529 -14.3299 -14.3299 -14.3273 -14.3273 -12.9540 -12.9540 -12.9500 -12.9500 -12.8678 -12.8678 -12.8656 -12.8656 -1.1830 -1.1830 -0.7723 -0.7723 0.4391 0.4391 0.8262 0.8262 1.5115 1.5115 1.8768 1.8768 4.8834 4.8834 5.2395 5.2395 7.5317 7.5317 7.6853 7.6853 7.7479 7.7479 7.8287 7.8287 8.3624 8.3624 8.6653 8.6653 8.7589 8.7589 8.9883 8.9883 9.5505 9.5505 9.9154 9.9154 10.5308 10.5308 10.8596 10.8596 k =-0.5000 0.0974 1.2518 ( 4566 PWs) bands (ev): -33.2536 -33.2536 -33.2528 -33.2528 -14.3303 -14.3303 -14.3264 -14.3264 -12.9543 -12.9543 -12.9483 -12.9483 -12.8684 -12.8684 -12.8651 -12.8651 -1.2804 -1.2804 -0.6647 -0.6647 0.3434 0.3434 0.9221 0.9221 1.4248 1.4248 1.9725 1.9725 4.8043 4.8043 5.3363 5.3363 7.4856 7.4856 7.6939 7.6939 7.7482 7.7482 7.8558 7.8558 8.2659 8.2659 8.6061 8.6061 8.8527 8.8527 9.0797 9.0797 9.4623 9.4623 10.0085 10.0085 10.4645 10.4645 10.9503 10.9503 k =-0.5000 0.0974 1.2189 ( 4568 PWs) bands (ev): -33.2539 -33.2539 -33.2527 -33.2527 -14.3305 -14.3305 -14.3254 -14.3254 -12.9544 -12.9544 -12.9464 -12.9464 -12.8690 -12.8690 -12.8646 -12.8646 -1.3757 -1.3757 -0.5553 -0.5553 0.2486 0.2486 1.0167 1.0167 1.3401 1.3401 2.0698 2.0698 4.7303 4.7303 5.4353 5.4353 7.4389 7.4389 7.6840 7.6840 7.7580 7.7580 7.8847 7.8847 8.1720 8.1720 8.5585 8.5585 8.9427 8.9427 9.1732 9.1732 9.3759 9.3759 10.1019 10.1019 10.4085 10.4085 11.0412 11.0412 k =-0.5000 0.0974 1.1860 ( 4572 PWs) bands (ev): -33.2541 -33.2541 -33.2527 -33.2527 -14.3306 -14.3306 -14.3242 -14.3242 -12.9543 -12.9543 -12.9442 -12.9442 -12.8696 -12.8696 -12.8642 -12.8642 -1.4688 -1.4688 -0.4444 -0.4444 0.1551 0.1551 1.1092 1.1092 1.2578 1.2578 2.1687 2.1687 4.6618 4.6618 5.5360 5.5360 7.3924 7.3924 7.6674 7.6674 7.7622 7.7622 7.9153 7.9153 8.0820 8.0820 8.5255 8.5255 9.0255 9.0255 9.2649 9.2649 9.2944 9.2944 10.1952 10.1952 10.3658 10.3658 11.0821 11.0821 k =-0.5000 0.0974 1.1530 ( 4578 PWs) bands (ev): -33.2544 -33.2544 -33.2527 -33.2527 -14.3306 -14.3306 -14.3229 -14.3229 -12.9539 -12.9539 -12.9417 -12.9417 -12.8702 -12.8702 -12.8638 -12.8638 -1.5596 -1.5596 -0.3323 -0.3323 0.0635 0.0635 1.1708 1.1708 1.2058 1.2058 2.2693 2.2693 4.5996 4.5996 5.6382 5.6382 7.3464 7.3464 7.6468 7.6468 7.7552 7.7552 7.9472 7.9472 7.9978 7.9978 8.5082 8.5082 9.0970 9.0970 9.2105 9.2105 9.3628 9.3628 10.2852 10.2852 10.3428 10.3428 10.9884 10.9884 k =-0.5000 0.0974 1.1201 ( 4582 PWs) bands (ev): -33.2547 -33.2547 -33.2527 -33.2527 -14.3306 -14.3306 -14.3216 -14.3216 -12.9534 -12.9534 -12.9390 -12.9390 -12.8708 -12.8708 -12.8635 -12.8635 -1.6482 -1.6482 -0.2210 -0.2210 -0.0241 -0.0241 1.0962 1.0962 1.2892 1.2892 2.3713 2.3713 4.5443 4.5443 5.7412 5.7412 7.3012 7.3012 7.6208 7.6208 7.7363 7.7363 7.9207 7.9207 7.9810 7.9810 8.5055 8.5055 9.1233 9.1233 9.1666 9.1666 9.4546 9.4546 10.3232 10.3232 10.3908 10.3908 10.8985 10.8985 k =-0.5000 0.0974 1.0871 ( 4578 PWs) bands (ev): -33.2550 -33.2550 -33.2527 -33.2527 -14.3304 -14.3304 -14.3201 -14.3201 -12.9526 -12.9526 -12.9361 -12.9361 -12.8713 -12.8713 -12.8631 -12.8631 -1.7344 -1.7344 -0.1480 -0.1480 -0.0704 -0.0704 1.0198 1.0198 1.3725 1.3725 2.4749 2.4749 4.4967 4.4967 5.8446 5.8446 7.2571 7.2571 7.5860 7.5860 7.7070 7.7070 7.8564 7.8564 8.0149 8.0149 8.5136 8.5136 9.0579 9.0579 9.2049 9.2049 9.5423 9.5423 10.3400 10.3400 10.4814 10.4814 10.8176 10.8176 k =-0.5000 0.0974 1.0542 ( 4574 PWs) bands (ev): -33.2553 -33.2553 -33.2528 -33.2528 -14.3301 -14.3301 -14.3186 -14.3186 -12.9516 -12.9516 -12.9330 -12.9330 -12.8717 -12.8717 -12.8628 -12.8628 -1.8183 -1.8183 -0.2150 -0.2150 0.0266 0.0266 0.9452 0.9452 1.4513 1.4513 2.5800 2.5800 4.4574 4.4574 5.9477 5.9477 7.2143 7.2143 7.5397 7.5397 7.6694 7.6694 7.8075 7.8075 8.0495 8.0495 8.5259 8.5259 8.9976 8.9976 9.2318 9.2318 9.6223 9.6223 10.3774 10.3774 10.5711 10.5711 10.7508 10.7508 k =-0.5000 0.0974 1.0212 ( 4570 PWs) bands (ev): -33.2557 -33.2557 -33.2528 -33.2528 -14.3297 -14.3297 -14.3170 -14.3170 -12.9505 -12.9505 -12.9296 -12.9296 -12.8721 -12.8721 -12.8626 -12.8626 -1.8998 -1.8998 -0.2985 -0.2985 0.1434 0.1434 0.8727 0.8727 1.5247 1.5247 2.6867 2.6867 4.4272 4.4272 6.0499 6.0499 7.1731 7.1731 7.4822 7.4822 7.6257 7.6257 7.7749 7.7749 8.0841 8.0841 8.5334 8.5334 8.9535 8.9535 9.2445 9.2445 9.6899 9.6899 10.4362 10.4362 10.6410 10.6410 10.7197 10.7197 k =-0.5000 0.0974 0.9883 ( 4576 PWs) bands (ev): -33.2560 -33.2560 -33.2529 -33.2529 -14.3292 -14.3292 -14.3153 -14.3153 -12.9493 -12.9493 -12.9261 -12.9261 -12.8724 -12.8724 -12.8623 -12.8623 -1.9790 -1.9790 -0.3819 -0.3819 0.2632 0.2632 0.8023 0.8023 1.5917 1.5917 2.7948 2.7948 4.4067 4.4067 6.1504 6.1504 7.1337 7.1337 7.4166 7.4166 7.5790 7.5790 7.7552 7.7552 8.1181 8.1181 8.5255 8.5255 8.9339 8.9339 9.2461 9.2461 9.7391 9.7391 10.5138 10.5138 10.6409 10.6409 10.7792 10.7792 k =-0.5000 0.0974 0.9554 ( 4566 PWs) bands (ev): -33.2564 -33.2564 -33.2530 -33.2530 -14.3287 -14.3287 -14.3136 -14.3136 -12.9480 -12.9480 -12.9224 -12.9224 -12.8725 -12.8725 -12.8620 -12.8620 -2.0557 -2.0557 -0.4637 -0.4637 0.3847 0.3847 0.7341 0.7341 1.6515 1.6515 2.9046 2.9046 4.3966 4.3966 6.2480 6.2480 7.0961 7.0961 7.3466 7.3466 7.5323 7.5323 7.7440 7.7440 8.1506 8.1506 8.4965 8.4965 8.9428 8.9428 9.2410 9.2410 9.7643 9.7643 10.6066 10.6066 10.6386 10.6386 10.8659 10.8659 k =-0.5000 0.0974 0.9224 ( 4558 PWs) bands (ev): -33.2567 -33.2567 -33.2531 -33.2531 -14.3281 -14.3281 -14.3118 -14.3118 -12.9467 -12.9467 -12.9186 -12.9186 -12.8725 -12.8725 -12.8618 -12.8618 -2.1300 -2.1300 -0.5437 -0.5437 0.5073 0.5073 0.6682 0.6682 1.7035 1.7035 3.0160 3.0160 4.3973 4.3973 6.3415 6.3415 7.0607 7.0607 7.2749 7.2749 7.4881 7.4881 7.7386 7.7386 8.1806 8.1806 8.4492 8.4492 8.9760 8.9760 9.2335 9.2335 9.7632 9.7632 10.6606 10.6606 10.7112 10.7112 10.9541 10.9541 k =-0.5000 0.0974 0.8895 ( 4564 PWs) bands (ev): -33.2572 -33.2572 -33.2533 -33.2533 -14.3274 -14.3274 -14.3099 -14.3099 -12.9453 -12.9453 -12.9147 -12.9147 -12.8723 -12.8723 -12.8615 -12.8615 -2.2018 -2.2018 -0.6215 -0.6215 0.6027 0.6027 0.6327 0.6327 1.7472 1.7472 3.1290 3.1290 4.4089 4.4089 6.4292 6.4292 7.0276 7.0276 7.2031 7.2031 7.4488 7.4488 7.7369 7.7369 8.2071 8.2071 8.3901 8.3901 9.0257 9.0257 9.2280 9.2280 9.7381 9.7381 10.7057 10.7057 10.8243 10.8243 11.0400 11.0400 k =-0.5000 0.0974 0.8565 ( 4560 PWs) bands (ev): -33.2576 -33.2576 -33.2534 -33.2534 -14.3267 -14.3267 -14.3081 -14.3081 -12.9439 -12.9439 -12.9108 -12.9108 -12.8720 -12.8720 -12.8611 -12.8611 -2.2712 -2.2712 -0.6972 -0.6972 0.5423 0.5423 0.7560 0.7560 1.7825 1.7825 3.2436 3.2436 4.4313 4.4313 6.5087 6.5087 6.9970 6.9970 7.1324 7.1324 7.4166 7.4166 7.7382 7.7382 8.2287 8.2287 8.3246 8.3246 9.0844 9.0844 9.2292 9.2292 9.6950 9.6950 10.7668 10.7668 10.9423 10.9423 11.1220 11.1220 k =-0.5000 0.0974 0.8236 ( 4562 PWs) bands (ev): -33.2580 -33.2580 -33.2536 -33.2536 -14.3259 -14.3259 -14.3062 -14.3062 -12.9426 -12.9426 -12.9068 -12.9068 -12.8714 -12.8714 -12.8607 -12.8607 -2.3380 -2.3380 -0.7705 -0.7705 0.4830 0.4830 0.8812 0.8812 1.8092 1.8092 3.3597 3.3597 4.4642 4.4642 6.5773 6.5773 6.9692 6.9692 7.0633 7.0633 7.3942 7.3942 7.7415 7.7415 8.2428 8.2428 8.2575 8.2575 9.1441 9.1441 9.2440 9.2440 9.6397 9.6397 10.8347 10.8347 11.0561 11.0561 11.1578 11.1578 k =-0.5000 0.0974 0.7906 ( 4562 PWs) bands (ev): -33.2584 -33.2584 -33.2538 -33.2538 -14.3251 -14.3251 -14.3043 -14.3043 -12.9413 -12.9413 -12.9029 -12.9029 -12.8706 -12.8706 -12.8602 -12.8602 -2.4024 -2.4024 -0.8415 -0.8415 0.4258 0.4258 1.0067 1.0067 1.8279 1.8279 3.4773 3.4773 4.5069 4.5069 6.6323 6.6323 6.9442 6.9442 6.9966 6.9966 7.3842 7.3842 7.7466 7.7466 8.1844 8.1844 8.2548 8.2548 9.1923 9.1923 9.2843 9.2843 9.5776 9.5776 10.8991 10.8991 11.0690 11.0690 11.1975 11.1975 k =-0.5000 0.0974 0.7577 ( 4566 PWs) bands (ev): -33.2588 -33.2588 -33.2540 -33.2540 -14.3243 -14.3243 -14.3024 -14.3024 -12.9402 -12.9402 -12.8991 -12.8991 -12.8695 -12.8695 -12.8595 -12.8595 -2.4643 -2.4643 -0.9101 -0.9101 0.3709 0.3709 1.1326 1.1326 1.8389 1.8389 3.5963 3.5963 4.5586 4.5586 6.6710 6.6710 6.9197 6.9197 6.9352 6.9352 7.3884 7.3884 7.7531 7.7531 8.1139 8.1139 8.2570 8.2570 9.2275 9.2275 9.3496 9.3496 9.5135 9.5135 10.9482 10.9482 11.0139 11.0139 11.2926 11.2926 k =-0.5000 0.0974 0.7247 ( 4564 PWs) bands (ev): -33.2592 -33.2592 -33.2542 -33.2542 -14.3235 -14.3235 -14.3005 -14.3005 -12.9392 -12.9392 -12.8955 -12.8955 -12.8682 -12.8682 -12.8586 -12.8586 -2.5236 -2.5236 -0.9762 -0.9762 0.3183 0.3183 1.2583 1.2583 1.8431 1.8431 3.7164 3.7164 4.6182 4.6182 6.6925 6.6925 6.8681 6.8681 6.9078 6.9078 7.4067 7.4067 7.7606 7.7606 8.0439 8.0439 8.2527 8.2527 9.2602 9.2602 9.4110 9.4110 9.4678 9.4678 10.9582 10.9582 10.9748 10.9748 11.3755 11.3755 k =-0.5000 0.0974 0.6918 ( 4574 PWs) bands (ev): -33.2596 -33.2596 -33.2544 -33.2544 -14.3226 -14.3226 -14.2986 -14.2986 -12.9383 -12.9383 -12.8922 -12.8922 -12.8666 -12.8666 -12.8575 -12.8575 -2.5803 -2.5803 -1.0398 -1.0398 0.2680 0.2680 1.3838 1.3838 1.8412 1.8412 3.8373 3.8373 4.6844 4.6844 6.6976 6.6976 6.8110 6.8110 6.8939 6.8939 7.4367 7.4367 7.7691 7.7691 7.9756 7.9756 8.2424 8.2424 9.2839 9.2839 9.3867 9.3867 9.5294 9.5294 10.9120 10.9120 10.9689 10.9689 11.4590 11.4590 k =-0.5000 0.0974 0.6589 ( 4574 PWs) bands (ev): -33.2600 -33.2600 -33.2546 -33.2546 -14.3217 -14.3217 -14.2967 -14.2967 -12.9376 -12.9376 -12.8892 -12.8892 -12.8647 -12.8647 -12.8560 -12.8560 -2.6346 -2.6346 -1.1007 -1.1007 0.2200 0.2200 1.5088 1.5088 1.8342 1.8342 3.9588 3.9588 4.7559 4.7559 6.6873 6.6873 6.7597 6.7597 6.8852 6.8852 7.4736 7.4736 7.7782 7.7782 7.9104 7.9104 8.2270 8.2270 9.2583 9.2583 9.3961 9.3961 9.6194 9.6194 10.8708 10.8708 10.9395 10.9395 11.5235 11.5235 k =-0.5000 0.0974 0.6259 ( 4574 PWs) bands (ev): -33.2604 -33.2604 -33.2548 -33.2548 -14.3208 -14.3208 -14.2949 -14.2949 -12.9371 -12.9371 -12.8866 -12.8866 -12.8627 -12.8627 -12.8541 -12.8541 -2.6862 -2.6862 -1.1590 -1.1590 0.1742 0.1742 1.6328 1.6328 1.8228 1.8228 4.0805 4.0805 4.8313 4.8313 6.6603 6.6603 6.7192 6.7192 6.8818 6.8818 7.5111 7.5111 7.7876 7.7876 7.8511 7.8511 8.2077 8.2077 9.1981 9.1981 9.4469 9.4469 9.7150 9.7150 10.8361 10.8361 10.8921 10.8921 11.5318 11.5318 k =-0.5000 0.0974 0.5930 ( 4574 PWs) bands (ev): -33.2608 -33.2608 -33.2550 -33.2550 -14.3200 -14.3200 -14.2931 -14.2931 -12.9367 -12.9367 -12.8845 -12.8845 -12.8605 -12.8605 -12.8518 -12.8518 -2.7352 -2.7352 -1.2146 -1.2146 0.1308 0.1308 1.7556 1.7556 1.8082 1.8082 4.2020 4.2020 4.9092 4.9092 6.6197 6.6197 6.6899 6.6899 6.8842 6.8842 7.5401 7.5401 7.7916 7.7916 7.8088 7.8088 8.1856 8.1856 9.1314 9.1314 9.5121 9.5121 9.8141 9.8141 10.8074 10.8074 10.8321 10.8321 11.5401 11.5401 k =-0.5000 0.0974 0.5600 ( 4578 PWs) bands (ev): -33.2612 -33.2612 -33.2553 -33.2553 -14.3191 -14.3191 -14.2914 -14.2914 -12.9364 -12.9364 -12.8828 -12.8828 -12.8582 -12.8582 -12.8490 -12.8490 -2.7817 -2.7817 -1.2675 -1.2675 0.0897 0.0897 1.7906 1.7906 1.8770 1.8770 4.3227 4.3227 4.9882 4.9882 6.5744 6.5744 6.6652 6.6652 6.8930 6.8930 7.5475 7.5475 7.7722 7.7722 7.8123 7.8123 8.1616 8.1616 9.0641 9.0641 9.5859 9.5859 9.9163 9.9163 10.7606 10.7606 10.7870 10.7870 11.5514 11.5514 k =-0.5000 0.0974 0.5271 ( 4574 PWs) bands (ev): -33.2616 -33.2616 -33.2555 -33.2555 -14.3183 -14.3183 -14.2897 -14.2897 -12.9363 -12.9363 -12.8815 -12.8815 -12.8559 -12.8559 -12.8460 -12.8460 -2.8256 -2.8256 -1.3175 -1.3175 0.0509 0.0509 1.7714 1.7714 1.9963 1.9963 4.4421 4.4421 5.0669 5.0669 6.5292 6.5292 6.6421 6.6421 6.9088 6.9088 7.5248 7.5248 7.7733 7.7733 7.8238 7.8238 8.1367 8.1367 8.9977 8.9977 9.6664 9.6664 10.0212 10.0212 10.6843 10.6843 10.7700 10.7700 11.5661 11.5661 k =-0.5000 0.0974 0.4941 ( 4590 PWs) bands (ev): -33.2620 -33.2620 -33.2557 -33.2557 -14.3175 -14.3175 -14.2881 -14.2881 -12.9363 -12.9363 -12.8805 -12.8805 -12.8535 -12.8535 -12.8427 -12.8427 -2.8668 -2.8668 -1.3648 -1.3648 0.0144 0.0144 1.7508 1.7508 2.1130 2.1130 4.5596 4.5596 5.1442 5.1442 6.4857 6.4857 6.6203 6.6203 6.9323 6.9323 7.4802 7.4802 7.7910 7.7910 7.8375 7.8375 8.1117 8.1117 8.9329 8.9329 9.7526 9.7526 10.1283 10.1283 10.6019 10.6019 10.7583 10.7583 11.5842 11.5842 k =-0.5000 0.0974 0.4612 ( 4594 PWs) bands (ev): -33.2623 -33.2623 -33.2560 -33.2560 -14.3167 -14.3167 -14.2866 -14.2866 -12.9363 -12.9363 -12.8797 -12.8797 -12.8510 -12.8510 -12.8392 -12.8392 -2.9054 -2.9054 -1.4092 -1.4092 -0.0197 -0.0197 1.7295 1.7295 2.2269 2.2269 4.6745 4.6745 5.2188 5.2188 6.4446 6.4446 6.6002 6.6002 6.9641 6.9641 7.4256 7.4256 7.8120 7.8120 7.8542 7.8542 8.0874 8.0874 8.8701 8.8701 9.8437 9.8437 10.2372 10.2372 10.5147 10.5147 10.7510 10.7510 11.6059 11.6059 k =-0.5000 0.0974 0.4283 ( 4596 PWs) bands (ev): -33.2627 -33.2627 -33.2562 -33.2562 -14.3159 -14.3159 -14.2851 -14.2851 -12.9365 -12.9365 -12.8792 -12.8792 -12.8485 -12.8485 -12.8357 -12.8357 -2.9414 -2.9414 -1.4507 -1.4507 -0.0515 -0.0515 1.7080 1.7080 2.3373 2.3373 4.7858 4.7858 5.2900 5.2900 6.4059 6.4059 6.5823 6.5823 7.0044 7.0044 7.3670 7.3670 7.8293 7.8293 7.8737 7.8737 8.0646 8.0646 8.8095 8.8095 9.9391 9.9391 10.3469 10.3469 10.4238 10.4238 10.7471 10.7471 11.6312 11.6312 k =-0.5000 0.0974 0.3953 ( 4588 PWs) bands (ev): -33.2629 -33.2629 -33.2563 -33.2563 -14.3152 -14.3152 -14.2837 -14.2837 -12.9367 -12.9367 -12.8789 -12.8789 -12.8461 -12.8461 -12.8322 -12.8322 -2.9748 -2.9748 -1.4893 -1.4893 -0.0810 -0.0810 1.6867 1.6867 2.4436 2.4436 4.8926 4.8926 5.3570 5.3570 6.3700 6.3700 6.5670 6.5670 7.0534 7.0534 7.3072 7.3072 7.8427 7.8427 7.8929 7.8929 8.0443 8.0443 8.7515 8.7515 10.0379 10.0379 10.3282 10.3282 10.4580 10.4580 10.7467 10.7467 11.6599 11.6599 k =-0.5000 0.0974 0.3624 ( 4596 PWs) bands (ev): -33.2633 -33.2633 -33.2565 -33.2565 -14.3146 -14.3146 -14.2824 -14.2824 -12.9370 -12.9370 -12.8786 -12.8786 -12.8437 -12.8437 -12.8289 -12.8289 -3.0055 -3.0055 -1.5249 -1.5249 -0.1081 -0.1081 1.6659 1.6659 2.5452 2.5452 4.9938 4.9938 5.4197 5.4197 6.3368 6.3368 6.5546 6.5546 7.1102 7.1102 7.2481 7.2481 7.8536 7.8536 7.9082 7.9082 8.0278 8.0278 8.6961 8.6961 10.1344 10.1344 10.2363 10.2363 10.5635 10.5635 10.7523 10.7523 11.6922 11.6922 k =-0.5000 0.0974 0.3294 ( 4598 PWs) bands (ev): -33.2635 -33.2635 -33.2567 -33.2567 -14.3139 -14.3139 -14.2813 -14.2813 -12.9372 -12.9372 -12.8785 -12.8785 -12.8414 -12.8414 -12.8257 -12.8257 -3.0336 -3.0336 -1.5575 -1.5575 -0.1328 -0.1328 1.6461 1.6461 2.6415 2.6415 5.0881 5.0881 5.4783 5.4783 6.3064 6.3064 6.5455 6.5455 7.1620 7.1620 7.2026 7.2026 7.8630 7.8630 7.9165 7.9165 8.0171 8.0171 8.6437 8.6437 10.1164 10.1164 10.2593 10.2593 10.6490 10.6490 10.7787 10.7787 11.7277 11.7277 k =-0.5000 0.0974 0.2965 ( 4606 PWs) bands (ev): -33.2638 -33.2638 -33.2569 -33.2569 -14.3134 -14.3134 -14.2802 -14.2802 -12.9375 -12.9375 -12.8784 -12.8784 -12.8392 -12.8392 -12.8226 -12.8226 -3.0590 -3.0590 -1.5871 -1.5871 -0.1552 -0.1552 1.6274 1.6274 2.7317 2.7317 5.1740 5.1740 5.5332 5.5332 6.2789 6.2789 6.5401 6.5401 7.1228 7.1228 7.2563 7.2563 7.8711 7.8711 7.9168 7.9168 8.0131 8.0131 8.5946 8.5946 10.0163 10.0163 10.3650 10.3650 10.6857 10.6857 10.8536 10.8536 11.7664 11.7664 k =-0.5000 0.0974 0.2635 ( 4606 PWs) bands (ev): -33.2641 -33.2641 -33.2570 -33.2570 -14.3129 -14.3129 -14.2792 -14.2792 -12.9378 -12.9378 -12.8784 -12.8784 -12.8371 -12.8371 -12.8198 -12.8198 -3.0817 -3.0817 -1.6136 -1.6136 -0.1753 -0.1753 1.6102 1.6102 2.8151 2.8151 5.2501 5.2501 5.5852 5.5852 6.2543 6.2543 6.5384 6.5384 7.0665 7.0665 7.3343 7.3343 7.8782 7.8782 7.9110 7.9110 8.0143 8.0143 8.5490 8.5490 9.9117 9.9117 10.4764 10.4764 10.6918 10.6918 10.9581 10.9581 11.8079 11.8079 k =-0.5000 0.0974 0.2306 ( 4602 PWs) bands (ev): -33.2643 -33.2643 -33.2571 -33.2571 -14.3124 -14.3124 -14.2783 -14.2783 -12.9381 -12.9381 -12.8784 -12.8784 -12.8352 -12.8352 -12.8173 -12.8173 -3.1018 -3.1018 -1.6371 -1.6371 -0.1930 -0.1930 1.5945 1.5945 2.8911 2.8911 5.3152 5.3152 5.6349 5.6349 6.2325 6.2325 6.5408 6.5408 7.0107 7.0107 7.4173 7.4173 7.8836 7.8836 7.9025 7.9025 8.0179 8.0179 8.5074 8.5074 9.8067 9.8067 10.5898 10.5898 10.6894 10.6894 11.0704 11.0704 11.8515 11.8515 k =-0.5000 0.0974 0.1977 ( 4604 PWs) bands (ev): -33.2644 -33.2644 -33.2572 -33.2572 -14.3120 -14.3120 -14.2775 -14.2775 -12.9384 -12.9384 -12.8784 -12.8784 -12.8336 -12.8336 -12.8150 -12.8150 -3.1192 -3.1192 -1.6575 -1.6575 -0.2084 -0.2084 1.5807 1.5807 2.9588 2.9588 5.3689 5.3689 5.6822 5.6822 6.2136 6.2136 6.5473 6.5473 6.9566 6.9566 7.5022 7.5022 7.8848 7.8848 7.8969 7.8969 8.0219 8.0219 8.4701 8.4701 9.7036 9.7036 10.6744 10.6744 10.7141 10.7141 11.1843 11.1843 11.8953 11.8953 k =-0.5000 0.0974 0.1647 ( 4608 PWs) bands (ev): -33.2646 -33.2646 -33.2573 -33.2573 -14.3116 -14.3116 -14.2769 -14.2769 -12.9386 -12.9386 -12.8784 -12.8784 -12.8321 -12.8321 -12.8131 -12.8131 -3.1340 -3.1340 -1.6748 -1.6748 -0.2213 -0.2213 1.5687 1.5687 3.0175 3.0175 5.4115 5.4115 5.7263 5.7263 6.1977 6.1977 6.5581 6.5581 6.9046 6.9046 7.5859 7.5859 7.8788 7.8788 7.8983 7.8983 8.0254 8.0254 8.4376 8.4376 9.6048 9.6048 10.6708 10.6708 10.8264 10.8264 11.2973 11.2973 11.9196 11.9196 k =-0.5000 0.0974 0.1318 ( 4608 PWs) bands (ev): -33.2647 -33.2647 -33.2574 -33.2574 -14.3114 -14.3114 -14.2763 -14.2763 -12.9388 -12.9388 -12.8785 -12.8785 -12.8309 -12.8309 -12.8115 -12.8115 -3.1460 -3.1460 -1.6889 -1.6889 -0.2320 -0.2320 1.5588 1.5588 3.0666 3.0666 5.4439 5.4439 5.7657 5.7657 6.1847 6.1847 6.5732 6.5732 6.8551 6.8551 7.6642 7.6642 7.8721 7.8721 7.9014 7.9014 8.0281 8.0281 8.4103 8.4103 9.5138 9.5138 10.6632 10.6632 10.9420 10.9420 11.4074 11.4074 11.8964 11.8964 k =-0.5000 0.0974 0.0988 ( 4620 PWs) bands (ev): -33.2649 -33.2649 -33.2575 -33.2575 -14.3111 -14.3111 -14.2759 -14.2759 -12.9390 -12.9390 -12.8785 -12.8785 -12.8300 -12.8300 -12.8102 -12.8102 -3.1554 -3.1554 -1.7000 -1.7000 -0.2402 -0.2402 1.5510 1.5510 3.1054 3.1054 5.4675 5.4675 5.7986 5.7986 6.1746 6.1746 6.5925 6.5925 6.8087 6.8087 7.7322 7.7322 7.8678 7.8678 7.9040 7.9040 8.0301 8.0301 8.3888 8.3888 9.4346 9.4346 10.6560 10.6560 11.0544 11.0544 11.5118 11.5118 11.8712 11.8712 k =-0.5000 0.0974 0.0659 ( 4636 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3110 -14.3110 -14.2756 -14.2756 -12.9391 -12.9391 -12.8785 -12.8785 -12.8293 -12.8293 -12.8093 -12.8093 -3.1621 -3.1621 -1.7078 -1.7078 -0.2461 -0.2461 1.5453 1.5453 3.1336 3.1336 5.4834 5.4834 5.8234 5.8234 6.1674 6.1674 6.6154 6.6154 6.7662 6.7662 7.7830 7.7830 7.8681 7.8681 7.9058 7.9058 8.0314 8.0314 8.3732 8.3732 9.3722 9.3722 10.6503 10.6503 11.1576 11.1576 11.6057 11.6057 11.8508 11.8508 k =-0.5000 0.0974 0.0329 ( 4636 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3109 -14.3109 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8288 -12.8288 -12.8088 -12.8088 -3.1662 -3.1662 -1.7126 -1.7126 -0.2497 -0.2497 1.5419 1.5419 3.1506 3.1506 5.4925 5.4925 5.8389 5.8389 6.1631 6.1631 6.6399 6.6399 6.7299 6.7299 7.8107 7.8107 7.8742 7.8742 7.9066 7.9066 8.0321 8.0321 8.3638 8.3638 9.3319 9.3319 10.6466 10.6466 11.2383 11.2383 11.6780 11.6780 11.8043 11.8043 k =-0.5000 0.0974-0.0000 ( 4640 PWs) bands (ev): -33.2650 -33.2650 -33.2576 -33.2576 -14.3108 -14.3108 -14.2754 -14.2754 -12.9392 -12.9392 -12.8786 -12.8786 -12.8287 -12.8287 -12.8086 -12.8086 -3.1675 -3.1675 -1.7141 -1.7141 -0.2509 -0.2509 1.5408 1.5408 3.1563 3.1563 5.4955 5.4955 5.8441 5.8441 6.1617 6.1617 6.6548 6.6548 6.7110 6.7110 7.8181 7.8181 7.8787 7.8787 7.9067 7.9067 8.0324 8.0324 8.3607 8.3607 9.3180 9.3180 10.6454 10.6454 11.2711 11.2711 11.7066 11.7066 11.7733 11.7733 k = 0.0000 0.0000 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9923 -0.9923 -0.9923 -0.9923 0.7973 0.7973 0.7973 0.7973 1.4323 1.4323 1.4323 1.4323 5.8367 5.8367 5.8367 5.8367 6.4331 6.4331 6.4331 6.4331 7.6993 7.6993 7.6993 7.6993 8.8190 8.8190 8.8190 8.8190 9.0684 9.0684 9.0684 9.0684 10.1153 10.1153 10.1153 10.1153 10.2052 10.2052 10.2052 10.2052 k =-0.0312 0.0061 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9922 -0.9922 -0.9922 -0.9922 0.7951 0.7951 0.7951 0.7951 1.4352 1.4352 1.4352 1.4352 5.8187 5.8187 5.8187 5.8187 6.4537 6.4537 6.4537 6.4537 7.6999 7.6999 7.6999 7.6999 8.8162 8.8162 8.8162 8.8162 9.0675 9.0675 9.0675 9.0675 10.1115 10.1115 10.1115 10.1115 10.2084 10.2084 10.2084 10.2084 k =-0.0625 0.0122 1.3507 ( 4572 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9919 -0.9919 -0.9919 -0.9919 0.7890 0.7890 0.7890 0.7890 1.4439 1.4439 1.4439 1.4439 5.7710 5.7710 5.7710 5.7710 6.5091 6.5091 6.5091 6.5091 7.7018 7.7018 7.7018 7.7018 8.8079 8.8079 8.8079 8.8079 9.0648 9.0648 9.0648 9.0648 10.0996 10.0996 10.0996 10.0996 10.2190 10.2190 10.2190 10.2190 k =-0.0938 0.0183 1.3507 ( 4584 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9914 -0.9914 -0.9914 -0.9914 0.7793 0.7793 0.7793 0.7793 1.4576 1.4576 1.4576 1.4576 5.7056 5.7056 5.7056 5.7056 6.5874 6.5874 6.5874 6.5874 7.7050 7.7050 7.7050 7.7050 8.7947 8.7947 8.7947 8.7947 9.0601 9.0601 9.0601 9.0601 10.0789 10.0789 10.0789 10.0789 10.2381 10.2381 10.2381 10.2381 k =-0.1250 0.0244 1.3507 ( 4586 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9908 -0.9908 -0.9908 -0.9908 0.7667 0.7667 0.7667 0.7667 1.4756 1.4756 1.4756 1.4756 5.6318 5.6318 5.6318 5.6318 6.6790 6.6790 6.6790 6.6790 7.7094 7.7094 7.7094 7.7094 8.7773 8.7773 8.7773 8.7773 9.0532 9.0532 9.0532 9.0532 10.0503 10.0503 10.0503 10.0503 10.2655 10.2655 10.2655 10.2655 k =-0.1562 0.0304 1.3507 ( 4580 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9900 -0.9900 -0.9900 -0.9900 0.7522 0.7522 0.7522 0.7522 1.4969 1.4969 1.4969 1.4969 5.5553 5.5553 5.5553 5.5553 6.7781 6.7781 6.7781 6.7781 7.7148 7.7148 7.7148 7.7148 8.7564 8.7564 8.7564 8.7564 9.0439 9.0439 9.0439 9.0439 10.0161 10.0161 10.0161 10.0161 10.2998 10.2998 10.2998 10.2998 k =-0.1875 0.0365 1.3507 ( 4574 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9891 -0.9891 -0.9891 -0.9891 0.7365 0.7365 0.7365 0.7365 1.5204 1.5204 1.5204 1.5204 5.4797 5.4797 5.4797 5.4797 6.8810 6.8810 6.8810 6.8810 7.7211 7.7211 7.7211 7.7211 8.7331 8.7331 8.7331 8.7331 9.0316 9.0316 9.0316 9.0316 9.9782 9.9782 9.9782 9.9782 10.3397 10.3397 10.3397 10.3397 k =-0.2188 0.0426 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9881 -0.9881 -0.9881 -0.9881 0.7203 0.7203 0.7203 0.7203 1.5451 1.5451 1.5451 1.5451 5.4069 5.4069 5.4069 5.4069 6.9853 6.9853 6.9853 6.9853 7.7282 7.7282 7.7282 7.7282 8.7084 8.7084 8.7084 8.7084 9.0160 9.0160 9.0160 9.0160 9.9388 9.9388 9.9388 9.9388 10.3835 10.3835 10.3835 10.3835 k =-0.2500 0.0487 1.3507 ( 4578 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9870 -0.9870 -0.9870 -0.9870 0.7043 0.7043 0.7043 0.7043 1.5701 1.5701 1.5701 1.5701 5.3386 5.3386 5.3386 5.3386 7.0888 7.0888 7.0888 7.0888 7.7358 7.7358 7.7358 7.7358 8.6833 8.6833 8.6833 8.6833 8.9969 8.9969 8.9969 8.9969 9.8997 9.8997 9.8997 9.8997 10.4298 10.4298 10.4298 10.4298 k =-0.2812 0.0548 1.3507 ( 4578 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9860 -0.9860 -0.9860 -0.9860 0.6891 0.6891 0.6891 0.6891 1.5945 1.5945 1.5945 1.5945 5.2758 5.2758 5.2758 5.2758 7.1898 7.1898 7.1898 7.1898 7.7436 7.7436 7.7436 7.7436 8.6585 8.6585 8.6585 8.6585 8.9740 8.9740 8.9740 8.9740 9.8626 9.8626 9.8626 9.8626 10.4769 10.4769 10.4769 10.4769 k =-0.3125 0.0609 1.3507 ( 4570 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9850 -0.9850 -0.9850 -0.9850 0.6751 0.6751 0.6751 0.6751 1.6175 1.6175 1.6175 1.6175 5.2196 5.2196 5.2196 5.2196 7.2862 7.2862 7.2862 7.2862 7.7515 7.7515 7.7515 7.7515 8.6351 8.6351 8.6351 8.6351 8.9478 8.9478 8.9478 8.9478 9.8287 9.8287 9.8287 9.8287 10.5231 10.5231 10.5231 10.5231 k =-0.3438 0.0670 1.3507 ( 4574 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8667 -12.8667 -12.8667 -12.8667 -0.9841 -0.9841 -0.9841 -0.9841 0.6627 0.6627 0.6627 0.6627 1.6383 1.6383 1.6383 1.6383 5.1706 5.1706 5.1706 5.1706 7.3758 7.3758 7.3758 7.3758 7.7591 7.7591 7.7591 7.7591 8.6137 8.6137 8.6137 8.6137 8.9190 8.9190 8.9190 8.9190 9.7992 9.7992 9.7992 9.7992 10.5668 10.5668 10.5668 10.5668 k =-0.3750 0.0731 1.3507 ( 4576 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9832 -0.9832 -0.9832 -0.9832 0.6521 0.6521 0.6521 0.6521 1.6563 1.6563 1.6563 1.6563 5.1296 5.1296 5.1296 5.1296 7.4559 7.4559 7.4559 7.4559 7.7661 7.7661 7.7661 7.7661 8.5951 8.5951 8.5951 8.5951 8.8894 8.8894 8.8894 8.8894 9.7747 9.7747 9.7747 9.7747 10.6062 10.6062 10.6062 10.6062 k =-0.4062 0.0792 1.3507 ( 4568 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9826 -0.9826 -0.9826 -0.9826 0.6437 0.6437 0.6437 0.6437 1.6709 1.6709 1.6709 1.6709 5.0970 5.0970 5.0970 5.0970 7.5235 7.5235 7.5235 7.5235 7.7721 7.7721 7.7721 7.7721 8.5799 8.5799 8.5799 8.5799 8.8613 8.8613 8.8613 8.8613 9.7555 9.7555 9.7555 9.7555 10.6393 10.6393 10.6393 10.6393 k =-0.4375 0.0853 1.3507 ( 4576 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9821 -0.9821 -0.9821 -0.9821 0.6375 0.6375 0.6375 0.6375 1.6817 1.6817 1.6817 1.6817 5.0735 5.0735 5.0735 5.0735 7.5753 7.5753 7.5753 7.5753 7.7769 7.7769 7.7769 7.7769 8.5687 8.5687 8.5687 8.5687 8.8377 8.8377 8.8377 8.8377 9.7419 9.7419 9.7419 9.7419 10.6645 10.6645 10.6645 10.6645 k =-0.4688 0.0913 1.3507 ( 4578 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9818 -0.9818 -0.9818 -0.9818 0.6338 0.6338 0.6338 0.6338 1.6883 1.6883 1.6883 1.6883 5.0592 5.0592 5.0592 5.0592 7.6079 7.6079 7.6079 7.6079 7.7800 7.7800 7.7800 7.7800 8.5618 8.5618 8.5618 8.5618 8.8219 8.8219 8.8219 8.8219 9.7338 9.7338 9.7338 9.7338 10.6803 10.6803 10.6803 10.6803 k =-0.5000 0.0974 1.3507 ( 4572 PWs) bands (ev): -33.2531 -33.2531 -33.2531 -33.2531 -14.3289 -14.3289 -14.3289 -14.3289 -12.9525 -12.9525 -12.9525 -12.9525 -12.8666 -12.8666 -12.8666 -12.8666 -0.9817 -0.9817 -0.9817 -0.9817 0.6325 0.6325 0.6325 0.6325 1.6905 1.6905 1.6905 1.6905 5.0544 5.0544 5.0544 5.0544 7.6190 7.6190 7.6190 7.6190 7.7811 7.7811 7.7811 7.7811 8.5594 8.5594 8.5594 8.5594 8.8163 8.8163 8.8163 8.8163 9.7310 9.7310 9.7310 9.7310 10.6857 10.6857 10.6857 10.6857 Writing output data file YGe3.save init_run : 0.32s CPU 0.49s WALL ( 1 calls) electrons : 280.58s CPU 283.88s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 280.57s CPU 283.86s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.07s WALL ( 382 calls) cegterg : 249.00s CPU 251.53s WALL ( 630 calls) Called by sum_band: Called by *egterg: h_psi : 171.58s CPU 173.19s WALL ( 10224 calls) s_psi : 6.64s CPU 6.53s WALL ( 10224 calls) g_psi : 0.35s CPU 0.32s WALL ( 9212 calls) cdiaghg : 74.88s CPU 76.10s WALL ( 9594 calls) cegterg:over : 8.44s CPU 8.51s WALL ( 9212 calls) cegterg:upda : 7.85s CPU 8.10s WALL ( 9212 calls) cegterg:last : 3.86s CPU 3.84s WALL ( 1394 calls) cdiaghg:chol : 4.47s CPU 4.34s WALL ( 9594 calls) cdiaghg:inve : 2.83s CPU 2.90s WALL ( 9594 calls) cdiaghg:para : 4.32s CPU 4.53s WALL ( 19188 calls) Called by h_psi: h_psi:vloc : 155.40s CPU 156.79s WALL ( 10224 calls) h_psi:vnl : 15.79s CPU 16.05s WALL ( 10224 calls) add_vuspsi : 7.58s CPU 7.68s WALL ( 10224 calls) General routines calbec : 8.18s CPU 8.35s WALL ( 10224 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 137.44s CPU 138.98s WALL ( 1035592 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.28s WALL ( 764 calls) Parallel routines fft_scatter : 33.49s CPU 33.58s WALL ( 1035615 calls) PWSCF : 5m 0.74s CPU 5m19.35s WALL This run was terminated on: 19:12:56 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=