Program PWSCF v.5.1.1 starts on 9Oct2015 at 21:22:34 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaTiO3.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Ti.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3D 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 54 19 6 2084 447 74 Max 55 20 7 2088 466 80 Sum 2593 945 293 100129 21791 3703 bravais-lattice index = 14 lattice parameter (alat) = 7.5230 a.u. unit-cell volume = 428.8068 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 52.0000 Ry charge density cutoff = 576.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.523029 celldm(2)= 1.000000 celldm(3)= 1.007130 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.003055 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.003055 0.999995 0.000000 ) a(3) = ( 0.000000 0.000000 1.007130 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.003055 -0.000000 ) b(2) = ( 0.000000 1.000005 -0.000000 ) b(3) = ( 0.000000 0.000000 0.992921 ) PseudoPot. # 1 for Ba read from file: /home/autes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ti read from file: /home/autes/Pseudo/Ti.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ed6a930860ac2325f16e0d84c006faf2 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1177 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 Ba 10.00 137.32700 Ba( 1.00) O 6.00 15.99940 O( 1.00) Ti 12.00 47.86700 Ti( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 478 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 2) = ( 0.0089014 0.0089286 -0.0000000), wk = 0.0020921 k( 3) = ( 0.0178027 0.0178572 -0.0000000), wk = 0.0020921 k( 4) = ( 0.0267041 0.0267858 -0.0000000), wk = 0.0020921 k( 5) = ( 0.0356055 0.0357145 -0.0000000), wk = 0.0020921 k( 6) = ( 0.0445069 0.0446431 -0.0000000), wk = 0.0020921 k( 7) = ( 0.0534083 0.0535717 -0.0000000), wk = 0.0020921 k( 8) = ( 0.0623096 0.0625003 -0.0000000), wk = 0.0020921 k( 9) = ( 0.0712110 0.0714289 -0.0000000), wk = 0.0020921 k( 10) = ( 0.0801124 0.0803575 -0.0000000), wk = 0.0020921 k( 11) = ( 0.0890138 0.0892861 -0.0000000), wk = 0.0020921 k( 12) = ( 0.0979152 0.0982147 -0.0000000), wk = 0.0020921 k( 13) = ( 0.1068165 0.1071434 -0.0000000), wk = 0.0020921 k( 14) = ( 0.1157179 0.1160720 -0.0000000), wk = 0.0020921 k( 15) = ( 0.1246193 0.1250006 -0.0000000), wk = 0.0020921 k( 16) = ( 0.1335207 0.1339292 -0.0000000), wk = 0.0020921 k( 17) = ( 0.1424220 0.1428578 -0.0000000), wk = 0.0020921 k( 18) = ( 0.1513234 0.1517864 -0.0000000), wk = 0.0020921 k( 19) = ( 0.1602248 0.1607150 -0.0000000), wk = 0.0020921 k( 20) = ( 0.1691262 0.1696437 -0.0000000), wk = 0.0020921 k( 21) = ( 0.1780275 0.1785723 -0.0000000), wk = 0.0020921 k( 22) = ( 0.1869289 0.1875009 -0.0000000), wk = 0.0020921 k( 23) = ( 0.1958303 0.1964295 -0.0000000), wk = 0.0020921 k( 24) = ( 0.2047317 0.2053581 -0.0000000), wk = 0.0020921 k( 25) = ( 0.2136330 0.2142867 -0.0000000), wk = 0.0020921 k( 26) = ( 0.2225344 0.2232153 -0.0000000), wk = 0.0020921 k( 27) = ( 0.2314358 0.2321439 -0.0000000), wk = 0.0020921 k( 28) = ( 0.2403372 0.2410726 -0.0000000), wk = 0.0020921 k( 29) = ( 0.2492386 0.2500012 -0.0000000), wk = 0.0020921 k( 30) = ( 0.2581399 0.2589298 -0.0000000), wk = 0.0020921 k( 31) = ( 0.2670413 0.2678584 -0.0000000), wk = 0.0020921 k( 32) = ( 0.2759427 0.2767870 -0.0000000), wk = 0.0020921 k( 33) = ( 0.2848441 0.2857156 -0.0000000), wk = 0.0020921 k( 34) = ( 0.2937455 0.2946442 -0.0000000), wk = 0.0020921 k( 35) = ( 0.3026468 0.3035728 -0.0000000), wk = 0.0020921 k( 36) = ( 0.3115482 0.3125015 -0.0000000), wk = 0.0020921 k( 37) = ( 0.3204496 0.3214301 -0.0000000), wk = 0.0020921 k( 38) = ( 0.3293510 0.3303587 -0.0000000), wk = 0.0020921 k( 39) = ( 0.3382523 0.3392873 -0.0000000), wk = 0.0020921 k( 40) = ( 0.3471537 0.3482159 -0.0000000), wk = 0.0020921 k( 41) = ( 0.3560551 0.3571445 -0.0000000), wk = 0.0020921 k( 42) = ( 0.3649565 0.3660731 -0.0000000), wk = 0.0020921 k( 43) = ( 0.3738578 0.3750017 -0.0000000), wk = 0.0020921 k( 44) = ( 0.3827592 0.3839304 -0.0000000), wk = 0.0020921 k( 45) = ( 0.3916606 0.3928590 -0.0000000), wk = 0.0020921 k( 46) = ( 0.4005620 0.4017876 -0.0000000), wk = 0.0020921 k( 47) = ( 0.4094634 0.4107162 -0.0000000), wk = 0.0020921 k( 48) = ( 0.4183647 0.4196448 -0.0000000), wk = 0.0020921 k( 49) = ( 0.4272661 0.4285734 -0.0000000), wk = 0.0020921 k( 50) = ( 0.4361675 0.4375020 -0.0000000), wk = 0.0020921 k( 51) = ( 0.4450689 0.4464307 -0.0000000), wk = 0.0020921 k( 52) = ( 0.4539702 0.4553593 -0.0000000), wk = 0.0020921 k( 53) = ( 0.4628716 0.4642879 -0.0000000), wk = 0.0020921 k( 54) = ( 0.4717730 0.4732165 -0.0000000), wk = 0.0020921 k( 55) = ( 0.4806744 0.4821451 -0.0000000), wk = 0.0020921 k( 56) = ( 0.4895757 0.4910737 -0.0000000), wk = 0.0020921 k( 57) = ( 0.4984771 0.5000023 -0.0000000), wk = 0.0020921 k( 58) = ( 0.4984771 0.5000023 -0.0000000), wk = 0.0020921 k( 59) = ( 0.4860152 0.5000023 -0.0000000), wk = 0.0020921 k( 60) = ( 0.4735533 0.5000023 -0.0000000), wk = 0.0020921 k( 61) = ( 0.4610913 0.5000023 -0.0000000), wk = 0.0020921 k( 62) = ( 0.4486294 0.5000023 -0.0000000), wk = 0.0020921 k( 63) = ( 0.4361675 0.5000023 -0.0000000), wk = 0.0020921 k( 64) = ( 0.4237056 0.5000023 -0.0000000), wk = 0.0020921 k( 65) = ( 0.4112436 0.5000023 -0.0000000), wk = 0.0020921 k( 66) = ( 0.3987817 0.5000023 -0.0000000), wk = 0.0020921 k( 67) = ( 0.3863198 0.5000023 -0.0000000), wk = 0.0020921 k( 68) = ( 0.3738578 0.5000023 -0.0000000), wk = 0.0020921 k( 69) = ( 0.3613959 0.5000023 -0.0000000), wk = 0.0020921 k( 70) = ( 0.3489340 0.5000023 -0.0000000), wk = 0.0020921 k( 71) = ( 0.3364721 0.5000023 -0.0000000), wk = 0.0020921 k( 72) = ( 0.3240101 0.5000023 -0.0000000), wk = 0.0020921 k( 73) = ( 0.3115482 0.5000023 -0.0000000), wk = 0.0020921 k( 74) = ( 0.2990863 0.5000023 -0.0000000), wk = 0.0020921 k( 75) = ( 0.2866244 0.5000023 -0.0000000), wk = 0.0020921 k( 76) = ( 0.2741624 0.5000023 -0.0000000), wk = 0.0020921 k( 77) = ( 0.2617005 0.5000023 -0.0000000), wk = 0.0020921 k( 78) = ( 0.2492386 0.5000023 -0.0000000), wk = 0.0020921 k( 79) = ( 0.2367766 0.5000023 -0.0000000), wk = 0.0020921 k( 80) = ( 0.2243147 0.5000023 -0.0000000), wk = 0.0020921 k( 81) = ( 0.2118528 0.5000023 -0.0000000), wk = 0.0020921 k( 82) = ( 0.1993909 0.5000023 -0.0000000), wk = 0.0020921 k( 83) = ( 0.1869289 0.5000023 -0.0000000), wk = 0.0020921 k( 84) = ( 0.1744670 0.5000023 -0.0000000), wk = 0.0020921 k( 85) = ( 0.1620051 0.5000023 -0.0000000), wk = 0.0020921 k( 86) = ( 0.1495431 0.5000023 -0.0000000), wk = 0.0020921 k( 87) = ( 0.1370812 0.5000023 -0.0000000), wk = 0.0020921 k( 88) = ( 0.1246193 0.5000023 -0.0000000), wk = 0.0020921 k( 89) = ( 0.1121574 0.5000023 -0.0000000), wk = 0.0020921 k( 90) = ( 0.0996954 0.5000023 -0.0000000), wk = 0.0020921 k( 91) = ( 0.0872335 0.5000023 -0.0000000), wk = 0.0020921 k( 92) = ( 0.0747716 0.5000023 -0.0000000), wk = 0.0020921 k( 93) = ( 0.0623096 0.5000023 -0.0000000), wk = 0.0020921 k( 94) = ( 0.0498477 0.5000023 -0.0000000), wk = 0.0020921 k( 95) = ( 0.0373858 0.5000023 -0.0000000), wk = 0.0020921 k( 96) = ( 0.0249239 0.5000023 -0.0000000), wk = 0.0020921 k( 97) = ( 0.0124619 0.5000023 -0.0000000), wk = 0.0020921 k( 98) = ( 0.0000000 0.5000023 -0.0000000), wk = 0.0020921 k( 99) = ( 0.0000000 0.5000023 -0.0000000), wk = 0.0020921 k( 100) = ( 0.0000000 0.5000023 0.0124115), wk = 0.0020921 k( 101) = ( 0.0000000 0.5000023 0.0248230), wk = 0.0020921 k( 102) = ( 0.0000000 0.5000023 0.0372345), wk = 0.0020921 k( 103) = ( 0.0000000 0.5000023 0.0496460), wk = 0.0020921 k( 104) = ( 0.0000000 0.5000023 0.0620575), wk = 0.0020921 k( 105) = ( 0.0000000 0.5000023 0.0744690), wk = 0.0020921 k( 106) = ( 0.0000000 0.5000023 0.0868806), wk = 0.0020921 k( 107) = ( 0.0000000 0.5000023 0.0992921), wk = 0.0020921 k( 108) = ( 0.0000000 0.5000023 0.1117036), wk = 0.0020921 k( 109) = ( 0.0000000 0.5000023 0.1241151), wk = 0.0020921 k( 110) = ( 0.0000000 0.5000023 0.1365266), wk = 0.0020921 k( 111) = ( 0.0000000 0.5000023 0.1489381), wk = 0.0020921 k( 112) = ( 0.0000000 0.5000023 0.1613496), wk = 0.0020921 k( 113) = ( 0.0000000 0.5000023 0.1737611), wk = 0.0020921 k( 114) = ( 0.0000000 0.5000023 0.1861726), wk = 0.0020921 k( 115) = ( 0.0000000 0.5000023 0.1985841), wk = 0.0020921 k( 116) = ( 0.0000000 0.5000023 0.2109956), wk = 0.0020921 k( 117) = ( 0.0000000 0.5000023 0.2234071), wk = 0.0020921 k( 118) = ( 0.0000000 0.5000023 0.2358186), wk = 0.0020921 k( 119) = ( 0.0000000 0.5000023 0.2482301), wk = 0.0020921 k( 120) = ( 0.0000000 0.5000023 0.2606417), wk = 0.0020921 k( 121) = ( 0.0000000 0.5000023 0.2730532), wk = 0.0020921 k( 122) = ( 0.0000000 0.5000023 0.2854647), wk = 0.0020921 k( 123) = ( 0.0000000 0.5000023 0.2978762), wk = 0.0020921 k( 124) = ( 0.0000000 0.5000023 0.3102877), wk = 0.0020921 k( 125) = ( 0.0000000 0.5000023 0.3226992), wk = 0.0020921 k( 126) = ( 0.0000000 0.5000023 0.3351107), wk = 0.0020921 k( 127) = ( 0.0000000 0.5000023 0.3475222), wk = 0.0020921 k( 128) = ( 0.0000000 0.5000023 0.3599337), wk = 0.0020921 k( 129) = ( 0.0000000 0.5000023 0.3723452), wk = 0.0020921 k( 130) = ( 0.0000000 0.5000023 0.3847567), wk = 0.0020921 k( 131) = ( 0.0000000 0.5000023 0.3971682), wk = 0.0020921 k( 132) = ( 0.0000000 0.5000023 0.4095797), wk = 0.0020921 k( 133) = ( 0.0000000 0.5000023 0.4219913), wk = 0.0020921 k( 134) = ( 0.0000000 0.5000023 0.4344028), wk = 0.0020921 k( 135) = ( 0.0000000 0.5000023 0.4468143), wk = 0.0020921 k( 136) = ( 0.0000000 0.5000023 0.4592258), wk = 0.0020921 k( 137) = ( 0.0000000 0.5000023 0.4716373), wk = 0.0020921 k( 138) = ( 0.0000000 0.5000023 0.4840488), wk = 0.0020921 k( 139) = ( 0.0000000 0.5000023 0.4964603), wk = 0.0020921 k( 140) = ( 0.0000000 0.5000023 0.4964603), wk = 0.0020921 k( 141) = ( 0.0124619 0.5000023 0.4964603), wk = 0.0020921 k( 142) = ( 0.0249239 0.5000023 0.4964603), wk = 0.0020921 k( 143) = ( 0.0373858 0.5000023 0.4964603), wk = 0.0020921 k( 144) = ( 0.0498477 0.5000023 0.4964603), wk = 0.0020921 k( 145) = ( 0.0623096 0.5000023 0.4964603), wk = 0.0020921 k( 146) = ( 0.0747716 0.5000023 0.4964603), wk = 0.0020921 k( 147) = ( 0.0872335 0.5000023 0.4964603), wk = 0.0020921 k( 148) = ( 0.0996954 0.5000023 0.4964603), wk = 0.0020921 k( 149) = ( 0.1121574 0.5000023 0.4964603), wk = 0.0020921 k( 150) = ( 0.1246193 0.5000023 0.4964603), wk = 0.0020921 k( 151) = ( 0.1370812 0.5000023 0.4964603), wk = 0.0020921 k( 152) = ( 0.1495431 0.5000023 0.4964603), wk = 0.0020921 k( 153) = ( 0.1620051 0.5000023 0.4964603), wk = 0.0020921 k( 154) = ( 0.1744670 0.5000023 0.4964603), wk = 0.0020921 k( 155) = ( 0.1869289 0.5000023 0.4964603), wk = 0.0020921 k( 156) = ( 0.1993909 0.5000023 0.4964603), wk = 0.0020921 k( 157) = ( 0.2118528 0.5000023 0.4964603), wk = 0.0020921 k( 158) = ( 0.2243147 0.5000023 0.4964603), wk = 0.0020921 k( 159) = ( 0.2367766 0.5000023 0.4964603), wk = 0.0020921 k( 160) = ( 0.2492386 0.5000023 0.4964603), wk = 0.0020921 k( 161) = ( 0.2617005 0.5000023 0.4964603), wk = 0.0020921 k( 162) = ( 0.2741624 0.5000023 0.4964603), wk = 0.0020921 k( 163) = ( 0.2866244 0.5000023 0.4964603), wk = 0.0020921 k( 164) = ( 0.2990863 0.5000023 0.4964603), wk = 0.0020921 k( 165) = ( 0.3115482 0.5000023 0.4964603), wk = 0.0020921 k( 166) = ( 0.3240101 0.5000023 0.4964603), wk = 0.0020921 k( 167) = ( 0.3364721 0.5000023 0.4964603), wk = 0.0020921 k( 168) = ( 0.3489340 0.5000023 0.4964603), wk = 0.0020921 k( 169) = ( 0.3613959 0.5000023 0.4964603), wk = 0.0020921 k( 170) = ( 0.3738578 0.5000023 0.4964603), wk = 0.0020921 k( 171) = ( 0.3863198 0.5000023 0.4964603), wk = 0.0020921 k( 172) = ( 0.3987817 0.5000023 0.4964603), wk = 0.0020921 k( 173) = ( 0.4112436 0.5000023 0.4964603), wk = 0.0020921 k( 174) = ( 0.4237056 0.5000023 0.4964603), wk = 0.0020921 k( 175) = ( 0.4361675 0.5000023 0.4964603), wk = 0.0020921 k( 176) = ( 0.4486294 0.5000023 0.4964603), wk = 0.0020921 k( 177) = ( 0.4610913 0.5000023 0.4964603), wk = 0.0020921 k( 178) = ( 0.4735533 0.5000023 0.4964603), wk = 0.0020921 k( 179) = ( 0.4860152 0.5000023 0.4964603), wk = 0.0020921 k( 180) = ( 0.4984771 0.5000023 0.4964603), wk = 0.0020921 k( 181) = ( 0.4984771 0.5000023 0.4964603), wk = 0.0020921 k( 182) = ( 0.4895757 0.4910737 0.4964603), wk = 0.0020921 k( 183) = ( 0.4806744 0.4821451 0.4964603), wk = 0.0020921 k( 184) = ( 0.4717730 0.4732165 0.4964603), wk = 0.0020921 k( 185) = ( 0.4628716 0.4642879 0.4964603), wk = 0.0020921 k( 186) = ( 0.4539702 0.4553593 0.4964603), wk = 0.0020921 k( 187) = ( 0.4450689 0.4464307 0.4964603), wk = 0.0020921 k( 188) = ( 0.4361675 0.4375020 0.4964603), wk = 0.0020921 k( 189) = ( 0.4272661 0.4285734 0.4964603), wk = 0.0020921 k( 190) = ( 0.4183647 0.4196448 0.4964603), wk = 0.0020921 k( 191) = ( 0.4094634 0.4107162 0.4964603), wk = 0.0020921 k( 192) = ( 0.4005620 0.4017876 0.4964603), wk = 0.0020921 k( 193) = ( 0.3916606 0.3928590 0.4964603), wk = 0.0020921 k( 194) = ( 0.3827592 0.3839304 0.4964603), wk = 0.0020921 k( 195) = ( 0.3738578 0.3750017 0.4964603), wk = 0.0020921 k( 196) = ( 0.3649565 0.3660731 0.4964603), wk = 0.0020921 k( 197) = ( 0.3560551 0.3571445 0.4964603), wk = 0.0020921 k( 198) = ( 0.3471537 0.3482159 0.4964603), wk = 0.0020921 k( 199) = ( 0.3382523 0.3392873 0.4964603), wk = 0.0020921 k( 200) = ( 0.3293510 0.3303587 0.4964603), wk = 0.0020921 k( 201) = ( 0.3204496 0.3214301 0.4964603), wk = 0.0020921 k( 202) = ( 0.3115482 0.3125015 0.4964603), wk = 0.0020921 k( 203) = ( 0.3026468 0.3035728 0.4964603), wk = 0.0020921 k( 204) = ( 0.2937455 0.2946442 0.4964603), wk = 0.0020921 k( 205) = ( 0.2848441 0.2857156 0.4964603), wk = 0.0020921 k( 206) = ( 0.2759427 0.2767870 0.4964603), wk = 0.0020921 k( 207) = ( 0.2670413 0.2678584 0.4964603), wk = 0.0020921 k( 208) = ( 0.2581399 0.2589298 0.4964603), wk = 0.0020921 k( 209) = ( 0.2492386 0.2500012 0.4964603), wk = 0.0020921 k( 210) = ( 0.2403372 0.2410726 0.4964603), wk = 0.0020921 k( 211) = ( 0.2314358 0.2321439 0.4964603), wk = 0.0020921 k( 212) = ( 0.2225344 0.2232153 0.4964603), wk = 0.0020921 k( 213) = ( 0.2136330 0.2142867 0.4964603), wk = 0.0020921 k( 214) = ( 0.2047317 0.2053581 0.4964603), wk = 0.0020921 k( 215) = ( 0.1958303 0.1964295 0.4964603), wk = 0.0020921 k( 216) = ( 0.1869289 0.1875009 0.4964603), wk = 0.0020921 k( 217) = ( 0.1780275 0.1785723 0.4964603), wk = 0.0020921 k( 218) = ( 0.1691262 0.1696437 0.4964603), wk = 0.0020921 k( 219) = ( 0.1602248 0.1607150 0.4964603), wk = 0.0020921 k( 220) = ( 0.1513234 0.1517864 0.4964603), wk = 0.0020921 k( 221) = ( 0.1424220 0.1428578 0.4964603), wk = 0.0020921 k( 222) = ( 0.1335207 0.1339292 0.4964603), wk = 0.0020921 k( 223) = ( 0.1246193 0.1250006 0.4964603), wk = 0.0020921 k( 224) = ( 0.1157179 0.1160720 0.4964603), wk = 0.0020921 k( 225) = ( 0.1068165 0.1071434 0.4964603), wk = 0.0020921 k( 226) = ( 0.0979152 0.0982147 0.4964603), wk = 0.0020921 k( 227) = ( 0.0890138 0.0892861 0.4964603), wk = 0.0020921 k( 228) = ( 0.0801124 0.0803575 0.4964603), wk = 0.0020921 k( 229) = ( 0.0712110 0.0714289 0.4964603), wk = 0.0020921 k( 230) = ( 0.0623096 0.0625003 0.4964603), wk = 0.0020921 k( 231) = ( 0.0534083 0.0535717 0.4964603), wk = 0.0020921 k( 232) = ( 0.0445069 0.0446431 0.4964603), wk = 0.0020921 k( 233) = ( 0.0356055 0.0357145 0.4964603), wk = 0.0020921 k( 234) = ( 0.0267041 0.0267858 0.4964603), wk = 0.0020921 k( 235) = ( 0.0178027 0.0178572 0.4964603), wk = 0.0020921 k( 236) = ( 0.0089014 0.0089286 0.4964603), wk = 0.0020921 k( 237) = ( 0.0000000 0.0000000 0.4964603), wk = 0.0020921 k( 238) = ( 0.0000000 0.0000000 0.4964603), wk = 0.0020921 k( 239) = ( 0.0000000 0.0000000 0.4840488), wk = 0.0020921 k( 240) = ( 0.0000000 0.0000000 0.4716373), wk = 0.0020921 k( 241) = ( 0.0000000 0.0000000 0.4592258), wk = 0.0020921 k( 242) = ( 0.0000000 0.0000000 0.4468143), wk = 0.0020921 k( 243) = ( 0.0000000 0.0000000 0.4344028), wk = 0.0020921 k( 244) = ( 0.0000000 0.0000000 0.4219913), wk = 0.0020921 k( 245) = ( 0.0000000 0.0000000 0.4095797), wk = 0.0020921 k( 246) = ( 0.0000000 0.0000000 0.3971682), wk = 0.0020921 k( 247) = ( 0.0000000 0.0000000 0.3847567), wk = 0.0020921 k( 248) = ( 0.0000000 0.0000000 0.3723452), wk = 0.0020921 k( 249) = ( 0.0000000 0.0000000 0.3599337), wk = 0.0020921 k( 250) = ( 0.0000000 0.0000000 0.3475222), wk = 0.0020921 k( 251) = ( 0.0000000 0.0000000 0.3351107), wk = 0.0020921 k( 252) = ( 0.0000000 0.0000000 0.3226992), wk = 0.0020921 k( 253) = ( 0.0000000 0.0000000 0.3102877), wk = 0.0020921 k( 254) = ( 0.0000000 0.0000000 0.2978762), wk = 0.0020921 k( 255) = ( 0.0000000 0.0000000 0.2854647), wk = 0.0020921 k( 256) = ( 0.0000000 0.0000000 0.2730532), wk = 0.0020921 k( 257) = ( 0.0000000 0.0000000 0.2606417), wk = 0.0020921 k( 258) = ( 0.0000000 0.0000000 0.2482301), wk = 0.0020921 k( 259) = ( 0.0000000 0.0000000 0.2358186), wk = 0.0020921 k( 260) = ( 0.0000000 0.0000000 0.2234071), wk = 0.0020921 k( 261) = ( 0.0000000 0.0000000 0.2109956), wk = 0.0020921 k( 262) = ( 0.0000000 0.0000000 0.1985841), wk = 0.0020921 k( 263) = ( 0.0000000 0.0000000 0.1861726), wk = 0.0020921 k( 264) = ( 0.0000000 0.0000000 0.1737611), wk = 0.0020921 k( 265) = ( 0.0000000 0.0000000 0.1613496), wk = 0.0020921 k( 266) = ( 0.0000000 0.0000000 0.1489381), wk = 0.0020921 k( 267) = ( 0.0000000 0.0000000 0.1365266), wk = 0.0020921 k( 268) = ( 0.0000000 0.0000000 0.1241151), wk = 0.0020921 k( 269) = ( 0.0000000 0.0000000 0.1117036), wk = 0.0020921 k( 270) = ( 0.0000000 0.0000000 0.0992921), wk = 0.0020921 k( 271) = ( 0.0000000 0.0000000 0.0868806), wk = 0.0020921 k( 272) = ( 0.0000000 0.0000000 0.0744690), wk = 0.0020921 k( 273) = ( 0.0000000 0.0000000 0.0620575), wk = 0.0020921 k( 274) = ( 0.0000000 0.0000000 0.0496460), wk = 0.0020921 k( 275) = ( 0.0000000 0.0000000 0.0372345), wk = 0.0020921 k( 276) = ( 0.0000000 0.0000000 0.0248230), wk = 0.0020921 k( 277) = ( 0.0000000 0.0000000 0.0124115), wk = 0.0020921 k( 278) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 279) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 280) = ( -0.0089286 0.0089013 0.0000000), wk = 0.0020921 k( 281) = ( -0.0178571 0.0178027 0.0000000), wk = 0.0020921 k( 282) = ( -0.0267857 0.0267040 0.0000000), wk = 0.0020921 k( 283) = ( -0.0357143 0.0356053 0.0000000), wk = 0.0020921 k( 284) = ( -0.0446429 0.0445067 0.0000000), wk = 0.0020921 k( 285) = ( -0.0535714 0.0534080 0.0000000), wk = 0.0020921 k( 286) = ( -0.0625000 0.0623093 0.0000000), wk = 0.0020921 k( 287) = ( -0.0714286 0.0712107 0.0000000), wk = 0.0020921 k( 288) = ( -0.0803571 0.0801120 0.0000000), wk = 0.0020921 k( 289) = ( -0.0892857 0.0890134 0.0000000), wk = 0.0020921 k( 290) = ( -0.0982143 0.0979147 0.0000000), wk = 0.0020921 k( 291) = ( -0.1071429 0.1068160 0.0000000), wk = 0.0020921 k( 292) = ( -0.1160714 0.1157174 0.0000000), wk = 0.0020921 k( 293) = ( -0.1250000 0.1246187 0.0000000), wk = 0.0020921 k( 294) = ( -0.1339286 0.1335200 0.0000000), wk = 0.0020921 k( 295) = ( -0.1428571 0.1424214 0.0000000), wk = 0.0020921 k( 296) = ( -0.1517857 0.1513227 0.0000000), wk = 0.0020921 k( 297) = ( -0.1607143 0.1602240 0.0000000), wk = 0.0020921 k( 298) = ( -0.1696429 0.1691254 0.0000000), wk = 0.0020921 k( 299) = ( -0.1785714 0.1780267 0.0000000), wk = 0.0020921 k( 300) = ( -0.1875000 0.1869280 0.0000000), wk = 0.0020921 k( 301) = ( -0.1964286 0.1958294 0.0000000), wk = 0.0020921 k( 302) = ( -0.2053571 0.2047307 0.0000000), wk = 0.0020921 k( 303) = ( -0.2142857 0.2136321 0.0000000), wk = 0.0020921 k( 304) = ( -0.2232143 0.2225334 0.0000000), wk = 0.0020921 k( 305) = ( -0.2321429 0.2314347 0.0000000), wk = 0.0020921 k( 306) = ( -0.2410714 0.2403361 0.0000000), wk = 0.0020921 k( 307) = ( -0.2500000 0.2492374 0.0000000), wk = 0.0020921 k( 308) = ( -0.2589286 0.2581387 0.0000000), wk = 0.0020921 k( 309) = ( -0.2678571 0.2670401 0.0000000), wk = 0.0020921 k( 310) = ( -0.2767857 0.2759414 0.0000000), wk = 0.0020921 k( 311) = ( -0.2857143 0.2848427 0.0000000), wk = 0.0020921 k( 312) = ( -0.2946429 0.2937441 0.0000000), wk = 0.0020921 k( 313) = ( -0.3035714 0.3026454 0.0000000), wk = 0.0020921 k( 314) = ( -0.3125000 0.3115467 0.0000000), wk = 0.0020921 k( 315) = ( -0.3214286 0.3204481 0.0000000), wk = 0.0020921 k( 316) = ( -0.3303571 0.3293494 0.0000000), wk = 0.0020921 k( 317) = ( -0.3392857 0.3382508 0.0000000), wk = 0.0020921 k( 318) = ( -0.3482143 0.3471521 0.0000000), wk = 0.0020921 k( 319) = ( -0.3571429 0.3560534 0.0000000), wk = 0.0020921 k( 320) = ( -0.3660714 0.3649548 0.0000000), wk = 0.0020921 k( 321) = ( -0.3750000 0.3738561 0.0000000), wk = 0.0020921 k( 322) = ( -0.3839286 0.3827574 0.0000000), wk = 0.0020921 k( 323) = ( -0.3928571 0.3916588 0.0000000), wk = 0.0020921 k( 324) = ( -0.4017857 0.4005601 0.0000000), wk = 0.0020921 k( 325) = ( -0.4107143 0.4094614 0.0000000), wk = 0.0020921 k( 326) = ( -0.4196429 0.4183628 0.0000000), wk = 0.0020921 k( 327) = ( -0.4285714 0.4272641 0.0000000), wk = 0.0020921 k( 328) = ( -0.4375000 0.4361654 0.0000000), wk = 0.0020921 k( 329) = ( -0.4464286 0.4450668 0.0000000), wk = 0.0020921 k( 330) = ( -0.4553571 0.4539681 0.0000000), wk = 0.0020921 k( 331) = ( -0.4642857 0.4628695 0.0000000), wk = 0.0020921 k( 332) = ( -0.4732143 0.4717708 0.0000000), wk = 0.0020921 k( 333) = ( -0.4821429 0.4806721 0.0000000), wk = 0.0020921 k( 334) = ( -0.4910714 0.4895735 0.0000000), wk = 0.0020921 k( 335) = ( -0.5000000 0.4984748 0.0000000), wk = 0.0020921 k( 336) = ( -0.5000000 0.4984748 0.0000000), wk = 0.0020921 k( 337) = ( -0.4984771 0.5000023 -0.0000000), wk = 0.0020921 k( 338) = ( -0.4984771 0.5000023 -0.0000000), wk = 0.0020921 k( 339) = ( -0.4984771 0.5000023 0.0124115), wk = 0.0020921 k( 340) = ( -0.4984771 0.5000023 0.0248230), wk = 0.0020921 k( 341) = ( -0.4984771 0.5000023 0.0372345), wk = 0.0020921 k( 342) = ( -0.4984771 0.5000023 0.0496460), wk = 0.0020921 k( 343) = ( -0.4984771 0.5000023 0.0620575), wk = 0.0020921 k( 344) = ( -0.4984771 0.5000023 0.0744690), wk = 0.0020921 k( 345) = ( -0.4984771 0.5000023 0.0868806), wk = 0.0020921 k( 346) = ( -0.4984771 0.5000023 0.0992921), wk = 0.0020921 k( 347) = ( -0.4984771 0.5000023 0.1117036), wk = 0.0020921 k( 348) = ( -0.4984771 0.5000023 0.1241151), wk = 0.0020921 k( 349) = ( -0.4984771 0.5000023 0.1365266), wk = 0.0020921 k( 350) = ( -0.4984771 0.5000023 0.1489381), wk = 0.0020921 k( 351) = ( -0.4984771 0.5000023 0.1613496), wk = 0.0020921 k( 352) = ( -0.4984771 0.5000023 0.1737611), wk = 0.0020921 k( 353) = ( -0.4984771 0.5000023 0.1861726), wk = 0.0020921 k( 354) = ( -0.4984771 0.5000023 0.1985841), wk = 0.0020921 k( 355) = ( -0.4984771 0.5000023 0.2109956), wk = 0.0020921 k( 356) = ( -0.4984771 0.5000023 0.2234071), wk = 0.0020921 k( 357) = ( -0.4984771 0.5000023 0.2358186), wk = 0.0020921 k( 358) = ( -0.4984771 0.5000023 0.2482301), wk = 0.0020921 k( 359) = ( -0.4984771 0.5000023 0.2606417), wk = 0.0020921 k( 360) = ( -0.4984771 0.5000023 0.2730532), wk = 0.0020921 k( 361) = ( -0.4984771 0.5000023 0.2854647), wk = 0.0020921 k( 362) = ( -0.4984771 0.5000023 0.2978762), wk = 0.0020921 k( 363) = ( -0.4984771 0.5000023 0.3102877), wk = 0.0020921 k( 364) = ( -0.4984771 0.5000023 0.3226992), wk = 0.0020921 k( 365) = ( -0.4984771 0.5000023 0.3351107), wk = 0.0020921 k( 366) = ( -0.4984771 0.5000023 0.3475222), wk = 0.0020921 k( 367) = ( -0.4984771 0.5000023 0.3599337), wk = 0.0020921 k( 368) = ( -0.4984771 0.5000023 0.3723452), wk = 0.0020921 k( 369) = ( -0.4984771 0.5000023 0.3847567), wk = 0.0020921 k( 370) = ( -0.4984771 0.5000023 0.3971682), wk = 0.0020921 k( 371) = ( -0.4984771 0.5000023 0.4095797), wk = 0.0020921 k( 372) = ( -0.4984771 0.5000023 0.4219913), wk = 0.0020921 k( 373) = ( -0.4984771 0.5000023 0.4344028), wk = 0.0020921 k( 374) = ( -0.4984771 0.5000023 0.4468143), wk = 0.0020921 k( 375) = ( -0.4984771 0.5000023 0.4592258), wk = 0.0020921 k( 376) = ( -0.4984771 0.5000023 0.4716373), wk = 0.0020921 k( 377) = ( -0.4984771 0.5000023 0.4840488), wk = 0.0020921 k( 378) = ( -0.4984771 0.5000023 0.4964603), wk = 0.0020921 k( 379) = ( -0.4984771 0.5000023 0.4964603), wk = 0.0020921 k( 380) = ( -0.5000000 0.4984748 0.4964603), wk = 0.0020921 k( 381) = ( -0.5000000 0.4984748 0.4964603), wk = 0.0020921 k( 382) = ( -0.5000000 0.4984748 0.4840488), wk = 0.0020921 k( 383) = ( -0.5000000 0.4984748 0.4716373), wk = 0.0020921 k( 384) = ( -0.5000000 0.4984748 0.4592258), wk = 0.0020921 k( 385) = ( -0.5000000 0.4984748 0.4468143), wk = 0.0020921 k( 386) = ( -0.5000000 0.4984748 0.4344028), wk = 0.0020921 k( 387) = ( -0.5000000 0.4984748 0.4219913), wk = 0.0020921 k( 388) = ( -0.5000000 0.4984748 0.4095797), wk = 0.0020921 k( 389) = ( -0.5000000 0.4984748 0.3971682), wk = 0.0020921 k( 390) = ( -0.5000000 0.4984748 0.3847567), wk = 0.0020921 k( 391) = ( -0.5000000 0.4984748 0.3723452), wk = 0.0020921 k( 392) = ( -0.5000000 0.4984748 0.3599337), wk = 0.0020921 k( 393) = ( -0.5000000 0.4984748 0.3475222), wk = 0.0020921 k( 394) = ( -0.5000000 0.4984748 0.3351107), wk = 0.0020921 k( 395) = ( -0.5000000 0.4984748 0.3226992), wk = 0.0020921 k( 396) = ( -0.5000000 0.4984748 0.3102877), wk = 0.0020921 k( 397) = ( -0.5000000 0.4984748 0.2978762), wk = 0.0020921 k( 398) = ( -0.5000000 0.4984748 0.2854647), wk = 0.0020921 k( 399) = ( -0.5000000 0.4984748 0.2730532), wk = 0.0020921 k( 400) = ( -0.5000000 0.4984748 0.2606417), wk = 0.0020921 k( 401) = ( -0.5000000 0.4984748 0.2482301), wk = 0.0020921 k( 402) = ( -0.5000000 0.4984748 0.2358186), wk = 0.0020921 k( 403) = ( -0.5000000 0.4984748 0.2234071), wk = 0.0020921 k( 404) = ( -0.5000000 0.4984748 0.2109956), wk = 0.0020921 k( 405) = ( -0.5000000 0.4984748 0.1985841), wk = 0.0020921 k( 406) = ( -0.5000000 0.4984748 0.1861726), wk = 0.0020921 k( 407) = ( -0.5000000 0.4984748 0.1737611), wk = 0.0020921 k( 408) = ( -0.5000000 0.4984748 0.1613496), wk = 0.0020921 k( 409) = ( -0.5000000 0.4984748 0.1489381), wk = 0.0020921 k( 410) = ( -0.5000000 0.4984748 0.1365266), wk = 0.0020921 k( 411) = ( -0.5000000 0.4984748 0.1241151), wk = 0.0020921 k( 412) = ( -0.5000000 0.4984748 0.1117036), wk = 0.0020921 k( 413) = ( -0.5000000 0.4984748 0.0992921), wk = 0.0020921 k( 414) = ( -0.5000000 0.4984748 0.0868806), wk = 0.0020921 k( 415) = ( -0.5000000 0.4984748 0.0744690), wk = 0.0020921 k( 416) = ( -0.5000000 0.4984748 0.0620575), wk = 0.0020921 k( 417) = ( -0.5000000 0.4984748 0.0496460), wk = 0.0020921 k( 418) = ( -0.5000000 0.4984748 0.0372345), wk = 0.0020921 k( 419) = ( -0.5000000 0.4984748 0.0248230), wk = 0.0020921 k( 420) = ( -0.5000000 0.4984748 0.0124115), wk = 0.0020921 k( 421) = ( -0.5000000 0.4984748 0.0000000), wk = 0.0020921 k( 422) = ( 0.0000000 0.0000000 0.4964603), wk = 0.0020921 k( 423) = ( -0.0089286 0.0089013 0.4964603), wk = 0.0020921 k( 424) = ( -0.0178571 0.0178027 0.4964603), wk = 0.0020921 k( 425) = ( -0.0267857 0.0267040 0.4964603), wk = 0.0020921 k( 426) = ( -0.0357143 0.0356053 0.4964603), wk = 0.0020921 k( 427) = ( -0.0446429 0.0445067 0.4964603), wk = 0.0020921 k( 428) = ( -0.0535714 0.0534080 0.4964603), wk = 0.0020921 k( 429) = ( -0.0625000 0.0623093 0.4964603), wk = 0.0020921 k( 430) = ( -0.0714286 0.0712107 0.4964603), wk = 0.0020921 k( 431) = ( -0.0803571 0.0801120 0.4964603), wk = 0.0020921 k( 432) = ( -0.0892857 0.0890134 0.4964603), wk = 0.0020921 k( 433) = ( -0.0982143 0.0979147 0.4964603), wk = 0.0020921 k( 434) = ( -0.1071429 0.1068160 0.4964603), wk = 0.0020921 k( 435) = ( -0.1160714 0.1157174 0.4964603), wk = 0.0020921 k( 436) = ( -0.1250000 0.1246187 0.4964603), wk = 0.0020921 k( 437) = ( -0.1339286 0.1335200 0.4964603), wk = 0.0020921 k( 438) = ( -0.1428571 0.1424214 0.4964603), wk = 0.0020921 k( 439) = ( -0.1517857 0.1513227 0.4964603), wk = 0.0020921 k( 440) = ( -0.1607143 0.1602240 0.4964603), wk = 0.0020921 k( 441) = ( -0.1696429 0.1691254 0.4964603), wk = 0.0020921 k( 442) = ( -0.1785714 0.1780267 0.4964603), wk = 0.0020921 k( 443) = ( -0.1875000 0.1869280 0.4964603), wk = 0.0020921 k( 444) = ( -0.1964286 0.1958294 0.4964603), wk = 0.0020921 k( 445) = ( -0.2053571 0.2047307 0.4964603), wk = 0.0020921 k( 446) = ( -0.2142857 0.2136321 0.4964603), wk = 0.0020921 k( 447) = ( -0.2232143 0.2225334 0.4964603), wk = 0.0020921 k( 448) = ( -0.2321429 0.2314347 0.4964603), wk = 0.0020921 k( 449) = ( -0.2410714 0.2403361 0.4964603), wk = 0.0020921 k( 450) = ( -0.2500000 0.2492374 0.4964603), wk = 0.0020921 k( 451) = ( -0.2589286 0.2581387 0.4964603), wk = 0.0020921 k( 452) = ( -0.2678571 0.2670401 0.4964603), wk = 0.0020921 k( 453) = ( -0.2767857 0.2759414 0.4964603), wk = 0.0020921 k( 454) = ( -0.2857143 0.2848427 0.4964603), wk = 0.0020921 k( 455) = ( -0.2946429 0.2937441 0.4964603), wk = 0.0020921 k( 456) = ( -0.3035714 0.3026454 0.4964603), wk = 0.0020921 k( 457) = ( -0.3125000 0.3115467 0.4964603), wk = 0.0020921 k( 458) = ( -0.3214286 0.3204481 0.4964603), wk = 0.0020921 k( 459) = ( -0.3303571 0.3293494 0.4964603), wk = 0.0020921 k( 460) = ( -0.3392857 0.3382508 0.4964603), wk = 0.0020921 k( 461) = ( -0.3482143 0.3471521 0.4964603), wk = 0.0020921 k( 462) = ( -0.3571429 0.3560534 0.4964603), wk = 0.0020921 k( 463) = ( -0.3660714 0.3649548 0.4964603), wk = 0.0020921 k( 464) = ( -0.3750000 0.3738561 0.4964603), wk = 0.0020921 k( 465) = ( -0.3839286 0.3827574 0.4964603), wk = 0.0020921 k( 466) = ( -0.3928571 0.3916588 0.4964603), wk = 0.0020921 k( 467) = ( -0.4017857 0.4005601 0.4964603), wk = 0.0020921 k( 468) = ( -0.4107143 0.4094614 0.4964603), wk = 0.0020921 k( 469) = ( -0.4196429 0.4183628 0.4964603), wk = 0.0020921 k( 470) = ( -0.4285714 0.4272641 0.4964603), wk = 0.0020921 k( 471) = ( -0.4375000 0.4361654 0.4964603), wk = 0.0020921 k( 472) = ( -0.4464286 0.4450668 0.4964603), wk = 0.0020921 k( 473) = ( -0.4553571 0.4539681 0.4964603), wk = 0.0020921 k( 474) = ( -0.4642857 0.4628695 0.4964603), wk = 0.0020921 k( 475) = ( -0.4732143 0.4717708 0.4964603), wk = 0.0020921 k( 476) = ( -0.4821429 0.4806721 0.4964603), wk = 0.0020921 k( 477) = ( -0.4910714 0.4895735 0.4964603), wk = 0.0020921 k( 478) = ( -0.5000000 0.4984748 0.4964603), wk = 0.0020921 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 2) = ( 0.0089014 0.0089014 -0.0000000), wk = 0.0020921 k( 3) = ( 0.0178027 0.0178027 0.0000000), wk = 0.0020921 k( 4) = ( 0.0267041 0.0267041 0.0000000), wk = 0.0020921 k( 5) = ( 0.0356055 0.0356055 0.0000000), wk = 0.0020921 k( 6) = ( 0.0445069 0.0445069 0.0000000), wk = 0.0020921 k( 7) = ( 0.0534083 0.0534083 0.0000000), wk = 0.0020921 k( 8) = ( 0.0623096 0.0623096 0.0000000), wk = 0.0020921 k( 9) = ( 0.0712110 0.0712110 0.0000000), wk = 0.0020921 k( 10) = ( 0.0801124 0.0801124 0.0000000), wk = 0.0020921 k( 11) = ( 0.0890138 0.0890138 0.0000000), wk = 0.0020921 k( 12) = ( 0.0979152 0.0979152 0.0000000), wk = 0.0020921 k( 13) = ( 0.1068165 0.1068165 0.0000000), wk = 0.0020921 k( 14) = ( 0.1157179 0.1157179 0.0000000), wk = 0.0020921 k( 15) = ( 0.1246193 0.1246193 0.0000000), wk = 0.0020921 k( 16) = ( 0.1335207 0.1335207 0.0000000), wk = 0.0020921 k( 17) = ( 0.1424220 0.1424220 0.0000000), wk = 0.0020921 k( 18) = ( 0.1513234 0.1513234 0.0000000), wk = 0.0020921 k( 19) = ( 0.1602248 0.1602248 0.0000000), wk = 0.0020921 k( 20) = ( 0.1691262 0.1691262 0.0000000), wk = 0.0020921 k( 21) = ( 0.1780275 0.1780275 0.0000000), wk = 0.0020921 k( 22) = ( 0.1869289 0.1869289 0.0000000), wk = 0.0020921 k( 23) = ( 0.1958303 0.1958303 0.0000000), wk = 0.0020921 k( 24) = ( 0.2047317 0.2047317 0.0000000), wk = 0.0020921 k( 25) = ( 0.2136330 0.2136330 0.0000000), wk = 0.0020921 k( 26) = ( 0.2225344 0.2225344 0.0000000), wk = 0.0020921 k( 27) = ( 0.2314358 0.2314358 0.0000000), wk = 0.0020921 k( 28) = ( 0.2403372 0.2403372 0.0000000), wk = 0.0020921 k( 29) = ( 0.2492386 0.2492386 0.0000000), wk = 0.0020921 k( 30) = ( 0.2581399 0.2581399 0.0000000), wk = 0.0020921 k( 31) = ( 0.2670413 0.2670413 0.0000000), wk = 0.0020921 k( 32) = ( 0.2759427 0.2759427 0.0000000), wk = 0.0020921 k( 33) = ( 0.2848441 0.2848441 0.0000000), wk = 0.0020921 k( 34) = ( 0.2937455 0.2937455 0.0000000), wk = 0.0020921 k( 35) = ( 0.3026468 0.3026468 0.0000000), wk = 0.0020921 k( 36) = ( 0.3115482 0.3115482 0.0000000), wk = 0.0020921 k( 37) = ( 0.3204496 0.3204496 0.0000000), wk = 0.0020921 k( 38) = ( 0.3293510 0.3293510 0.0000000), wk = 0.0020921 k( 39) = ( 0.3382523 0.3382523 0.0000000), wk = 0.0020921 k( 40) = ( 0.3471537 0.3471537 0.0000000), wk = 0.0020921 k( 41) = ( 0.3560551 0.3560551 0.0000000), wk = 0.0020921 k( 42) = ( 0.3649565 0.3649565 0.0000000), wk = 0.0020921 k( 43) = ( 0.3738578 0.3738578 0.0000000), wk = 0.0020921 k( 44) = ( 0.3827592 0.3827592 0.0000000), wk = 0.0020921 k( 45) = ( 0.3916606 0.3916606 0.0000000), wk = 0.0020921 k( 46) = ( 0.4005620 0.4005620 0.0000000), wk = 0.0020921 k( 47) = ( 0.4094634 0.4094633 0.0000000), wk = 0.0020921 k( 48) = ( 0.4183647 0.4183647 0.0000000), wk = 0.0020921 k( 49) = ( 0.4272661 0.4272661 0.0000000), wk = 0.0020921 k( 50) = ( 0.4361675 0.4361675 0.0000000), wk = 0.0020921 k( 51) = ( 0.4450689 0.4450689 0.0000000), wk = 0.0020921 k( 52) = ( 0.4539702 0.4539702 0.0000000), wk = 0.0020921 k( 53) = ( 0.4628716 0.4628716 0.0000000), wk = 0.0020921 k( 54) = ( 0.4717730 0.4717730 0.0000000), wk = 0.0020921 k( 55) = ( 0.4806744 0.4806744 0.0000000), wk = 0.0020921 k( 56) = ( 0.4895757 0.4895757 0.0000000), wk = 0.0020921 k( 57) = ( 0.4984771 0.4984771 0.0000000), wk = 0.0020921 k( 58) = ( 0.4984771 0.4984771 0.0000000), wk = 0.0020921 k( 59) = ( 0.4860152 0.4985152 0.0000000), wk = 0.0020921 k( 60) = ( 0.4735533 0.4985533 0.0000000), wk = 0.0020921 k( 61) = ( 0.4610913 0.4985913 0.0000000), wk = 0.0020921 k( 62) = ( 0.4486294 0.4986294 0.0000000), wk = 0.0020921 k( 63) = ( 0.4361675 0.4986675 0.0000000), wk = 0.0020921 k( 64) = ( 0.4237056 0.4987056 0.0000000), wk = 0.0020921 k( 65) = ( 0.4112436 0.4987436 0.0000000), wk = 0.0020921 k( 66) = ( 0.3987817 0.4987817 0.0000000), wk = 0.0020921 k( 67) = ( 0.3863198 0.4988198 0.0000000), wk = 0.0020921 k( 68) = ( 0.3738578 0.4988578 0.0000000), wk = 0.0020921 k( 69) = ( 0.3613959 0.4988959 0.0000000), wk = 0.0020921 k( 70) = ( 0.3489340 0.4989340 0.0000000), wk = 0.0020921 k( 71) = ( 0.3364721 0.4989721 0.0000000), wk = 0.0020921 k( 72) = ( 0.3240101 0.4990101 0.0000000), wk = 0.0020921 k( 73) = ( 0.3115482 0.4990482 0.0000000), wk = 0.0020921 k( 74) = ( 0.2990863 0.4990863 0.0000000), wk = 0.0020921 k( 75) = ( 0.2866244 0.4991243 0.0000000), wk = 0.0020921 k( 76) = ( 0.2741624 0.4991624 0.0000000), wk = 0.0020921 k( 77) = ( 0.2617005 0.4992005 0.0000000), wk = 0.0020921 k( 78) = ( 0.2492386 0.4992386 0.0000000), wk = 0.0020921 k( 79) = ( 0.2367766 0.4992766 0.0000000), wk = 0.0020921 k( 80) = ( 0.2243147 0.4993147 0.0000000), wk = 0.0020921 k( 81) = ( 0.2118528 0.4993528 0.0000000), wk = 0.0020921 k( 82) = ( 0.1993909 0.4993908 0.0000000), wk = 0.0020921 k( 83) = ( 0.1869289 0.4994289 0.0000000), wk = 0.0020921 k( 84) = ( 0.1744670 0.4994670 0.0000000), wk = 0.0020921 k( 85) = ( 0.1620051 0.4995051 0.0000000), wk = 0.0020921 k( 86) = ( 0.1495431 0.4995431 0.0000000), wk = 0.0020921 k( 87) = ( 0.1370812 0.4995812 0.0000000), wk = 0.0020921 k( 88) = ( 0.1246193 0.4996193 0.0000000), wk = 0.0020921 k( 89) = ( 0.1121574 0.4996573 0.0000000), wk = 0.0020921 k( 90) = ( 0.0996954 0.4996954 0.0000000), wk = 0.0020921 k( 91) = ( 0.0872335 0.4997335 0.0000000), wk = 0.0020921 k( 92) = ( 0.0747716 0.4997716 -0.0000000), wk = 0.0020921 k( 93) = ( 0.0623096 0.4998096 0.0000000), wk = 0.0020921 k( 94) = ( 0.0498477 0.4998477 0.0000000), wk = 0.0020921 k( 95) = ( 0.0373858 0.4998858 0.0000000), wk = 0.0020921 k( 96) = ( 0.0249239 0.4999239 0.0000000), wk = 0.0020921 k( 97) = ( 0.0124619 0.4999619 0.0000000), wk = 0.0020921 k( 98) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020921 k( 99) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020921 k( 100) = ( 0.0000000 0.5000000 0.0125000), wk = 0.0020921 k( 101) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0020921 k( 102) = ( 0.0000000 0.5000000 0.0375000), wk = 0.0020921 k( 103) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0020921 k( 104) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0020921 k( 105) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0020921 k( 106) = ( 0.0000000 0.5000000 0.0875000), wk = 0.0020921 k( 107) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0020921 k( 108) = ( 0.0000000 0.5000000 0.1125000), wk = 0.0020921 k( 109) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0020921 k( 110) = ( 0.0000000 0.5000000 0.1375000), wk = 0.0020921 k( 111) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0020921 k( 112) = ( 0.0000000 0.5000000 0.1625000), wk = 0.0020921 k( 113) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0020921 k( 114) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0020921 k( 115) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0020921 k( 116) = ( 0.0000000 0.5000000 0.2125000), wk = 0.0020921 k( 117) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0020921 k( 118) = ( 0.0000000 0.5000000 0.2375000), wk = 0.0020921 k( 119) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0020921 k( 120) = ( 0.0000000 0.5000000 0.2625000), wk = 0.0020921 k( 121) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0020921 k( 122) = ( 0.0000000 0.5000000 0.2875000), wk = 0.0020921 k( 123) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0020921 k( 124) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0020921 k( 125) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0020921 k( 126) = ( 0.0000000 0.5000000 0.3375000), wk = 0.0020921 k( 127) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0020921 k( 128) = ( 0.0000000 0.5000000 0.3625000), wk = 0.0020921 k( 129) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0020921 k( 130) = ( 0.0000000 0.5000000 0.3875000), wk = 0.0020921 k( 131) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0020921 k( 132) = ( 0.0000000 0.5000000 0.4125000), wk = 0.0020921 k( 133) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0020921 k( 134) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0020921 k( 135) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0020921 k( 136) = ( 0.0000000 0.5000000 0.4625000), wk = 0.0020921 k( 137) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0020921 k( 138) = ( 0.0000000 0.5000000 0.4875000), wk = 0.0020921 k( 139) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020921 k( 140) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020921 k( 141) = ( 0.0124619 0.4999619 0.5000000), wk = 0.0020921 k( 142) = ( 0.0249239 0.4999239 0.5000000), wk = 0.0020921 k( 143) = ( 0.0373858 0.4998858 0.5000000), wk = 0.0020921 k( 144) = ( 0.0498477 0.4998477 0.5000000), wk = 0.0020921 k( 145) = ( 0.0623096 0.4998096 0.5000000), wk = 0.0020921 k( 146) = ( 0.0747716 0.4997716 0.5000000), wk = 0.0020921 k( 147) = ( 0.0872335 0.4997335 0.5000000), wk = 0.0020921 k( 148) = ( 0.0996954 0.4996954 0.5000000), wk = 0.0020921 k( 149) = ( 0.1121574 0.4996573 0.5000000), wk = 0.0020921 k( 150) = ( 0.1246193 0.4996193 0.5000000), wk = 0.0020921 k( 151) = ( 0.1370812 0.4995812 0.5000000), wk = 0.0020921 k( 152) = ( 0.1495431 0.4995431 0.5000000), wk = 0.0020921 k( 153) = ( 0.1620051 0.4995051 0.5000000), wk = 0.0020921 k( 154) = ( 0.1744670 0.4994670 0.5000000), wk = 0.0020921 k( 155) = ( 0.1869289 0.4994289 0.5000000), wk = 0.0020921 k( 156) = ( 0.1993909 0.4993908 0.5000000), wk = 0.0020921 k( 157) = ( 0.2118528 0.4993528 0.5000000), wk = 0.0020921 k( 158) = ( 0.2243147 0.4993147 0.5000000), wk = 0.0020921 k( 159) = ( 0.2367766 0.4992766 0.5000000), wk = 0.0020921 k( 160) = ( 0.2492386 0.4992386 0.5000000), wk = 0.0020921 k( 161) = ( 0.2617005 0.4992005 0.5000000), wk = 0.0020921 k( 162) = ( 0.2741624 0.4991624 0.5000000), wk = 0.0020921 k( 163) = ( 0.2866244 0.4991243 0.5000000), wk = 0.0020921 k( 164) = ( 0.2990863 0.4990863 0.5000000), wk = 0.0020921 k( 165) = ( 0.3115482 0.4990482 0.5000000), wk = 0.0020921 k( 166) = ( 0.3240101 0.4990101 0.5000000), wk = 0.0020921 k( 167) = ( 0.3364721 0.4989721 0.5000000), wk = 0.0020921 k( 168) = ( 0.3489340 0.4989340 0.5000000), wk = 0.0020921 k( 169) = ( 0.3613959 0.4988959 0.5000000), wk = 0.0020921 k( 170) = ( 0.3738578 0.4988578 0.5000000), wk = 0.0020921 k( 171) = ( 0.3863198 0.4988198 0.5000000), wk = 0.0020921 k( 172) = ( 0.3987817 0.4987817 0.5000000), wk = 0.0020921 k( 173) = ( 0.4112436 0.4987436 0.5000000), wk = 0.0020921 k( 174) = ( 0.4237056 0.4987056 0.5000000), wk = 0.0020921 k( 175) = ( 0.4361675 0.4986675 0.5000000), wk = 0.0020921 k( 176) = ( 0.4486294 0.4986294 0.5000000), wk = 0.0020921 k( 177) = ( 0.4610913 0.4985913 0.5000000), wk = 0.0020921 k( 178) = ( 0.4735533 0.4985533 0.5000000), wk = 0.0020921 k( 179) = ( 0.4860152 0.4985152 0.5000000), wk = 0.0020921 k( 180) = ( 0.4984771 0.4984771 0.5000000), wk = 0.0020921 k( 181) = ( 0.4984771 0.4984771 0.5000000), wk = 0.0020921 k( 182) = ( 0.4895757 0.4895757 0.5000000), wk = 0.0020921 k( 183) = ( 0.4806744 0.4806744 0.5000000), wk = 0.0020921 k( 184) = ( 0.4717730 0.4717730 0.5000000), wk = 0.0020921 k( 185) = ( 0.4628716 0.4628716 0.5000000), wk = 0.0020921 k( 186) = ( 0.4539702 0.4539702 0.5000000), wk = 0.0020921 k( 187) = ( 0.4450689 0.4450689 0.5000000), wk = 0.0020921 k( 188) = ( 0.4361675 0.4361675 0.5000000), wk = 0.0020921 k( 189) = ( 0.4272661 0.4272661 0.5000000), wk = 0.0020921 k( 190) = ( 0.4183647 0.4183647 0.5000000), wk = 0.0020921 k( 191) = ( 0.4094634 0.4094633 0.5000000), wk = 0.0020921 k( 192) = ( 0.4005620 0.4005620 0.5000000), wk = 0.0020921 k( 193) = ( 0.3916606 0.3916606 0.5000000), wk = 0.0020921 k( 194) = ( 0.3827592 0.3827592 0.5000000), wk = 0.0020921 k( 195) = ( 0.3738578 0.3738578 0.5000000), wk = 0.0020921 k( 196) = ( 0.3649565 0.3649565 0.5000000), wk = 0.0020921 k( 197) = ( 0.3560551 0.3560551 0.5000000), wk = 0.0020921 k( 198) = ( 0.3471537 0.3471537 0.5000000), wk = 0.0020921 k( 199) = ( 0.3382523 0.3382523 0.5000000), wk = 0.0020921 k( 200) = ( 0.3293510 0.3293510 0.5000000), wk = 0.0020921 k( 201) = ( 0.3204496 0.3204496 0.5000000), wk = 0.0020921 k( 202) = ( 0.3115482 0.3115482 0.5000000), wk = 0.0020921 k( 203) = ( 0.3026468 0.3026468 0.5000000), wk = 0.0020921 k( 204) = ( 0.2937455 0.2937455 0.5000000), wk = 0.0020921 k( 205) = ( 0.2848441 0.2848441 0.5000000), wk = 0.0020921 k( 206) = ( 0.2759427 0.2759427 0.5000000), wk = 0.0020921 k( 207) = ( 0.2670413 0.2670413 0.5000000), wk = 0.0020921 k( 208) = ( 0.2581399 0.2581399 0.5000000), wk = 0.0020921 k( 209) = ( 0.2492386 0.2492386 0.5000000), wk = 0.0020921 k( 210) = ( 0.2403372 0.2403372 0.5000000), wk = 0.0020921 k( 211) = ( 0.2314358 0.2314358 0.5000000), wk = 0.0020921 k( 212) = ( 0.2225344 0.2225344 0.5000000), wk = 0.0020921 k( 213) = ( 0.2136330 0.2136330 0.5000000), wk = 0.0020921 k( 214) = ( 0.2047317 0.2047317 0.5000000), wk = 0.0020921 k( 215) = ( 0.1958303 0.1958303 0.5000000), wk = 0.0020921 k( 216) = ( 0.1869289 0.1869289 0.5000000), wk = 0.0020921 k( 217) = ( 0.1780275 0.1780275 0.5000000), wk = 0.0020921 k( 218) = ( 0.1691262 0.1691262 0.5000000), wk = 0.0020921 k( 219) = ( 0.1602248 0.1602248 0.5000000), wk = 0.0020921 k( 220) = ( 0.1513234 0.1513234 0.5000000), wk = 0.0020921 k( 221) = ( 0.1424220 0.1424220 0.5000000), wk = 0.0020921 k( 222) = ( 0.1335207 0.1335207 0.5000000), wk = 0.0020921 k( 223) = ( 0.1246193 0.1246193 0.5000000), wk = 0.0020921 k( 224) = ( 0.1157179 0.1157179 0.5000000), wk = 0.0020921 k( 225) = ( 0.1068165 0.1068165 0.5000000), wk = 0.0020921 k( 226) = ( 0.0979152 0.0979152 0.5000000), wk = 0.0020921 k( 227) = ( 0.0890138 0.0890138 0.5000000), wk = 0.0020921 k( 228) = ( 0.0801124 0.0801124 0.5000000), wk = 0.0020921 k( 229) = ( 0.0712110 0.0712110 0.5000000), wk = 0.0020921 k( 230) = ( 0.0623096 0.0623096 0.5000000), wk = 0.0020921 k( 231) = ( 0.0534083 0.0534083 0.5000000), wk = 0.0020921 k( 232) = ( 0.0445069 0.0445069 0.5000000), wk = 0.0020921 k( 233) = ( 0.0356055 0.0356055 0.5000000), wk = 0.0020921 k( 234) = ( 0.0267041 0.0267041 0.5000000), wk = 0.0020921 k( 235) = ( 0.0178027 0.0178027 0.5000000), wk = 0.0020921 k( 236) = ( 0.0089014 0.0089014 0.5000000), wk = 0.0020921 k( 237) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020921 k( 238) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020921 k( 239) = ( 0.0000000 0.0000000 0.4875000), wk = 0.0020921 k( 240) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0020921 k( 241) = ( 0.0000000 0.0000000 0.4625000), wk = 0.0020921 k( 242) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0020921 k( 243) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0020921 k( 244) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0020921 k( 245) = ( 0.0000000 0.0000000 0.4125000), wk = 0.0020921 k( 246) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0020921 k( 247) = ( 0.0000000 0.0000000 0.3875000), wk = 0.0020921 k( 248) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0020921 k( 249) = ( 0.0000000 0.0000000 0.3625000), wk = 0.0020921 k( 250) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0020921 k( 251) = ( 0.0000000 0.0000000 0.3375000), wk = 0.0020921 k( 252) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0020921 k( 253) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0020921 k( 254) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0020921 k( 255) = ( 0.0000000 0.0000000 0.2875000), wk = 0.0020921 k( 256) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0020921 k( 257) = ( 0.0000000 0.0000000 0.2625000), wk = 0.0020921 k( 258) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0020921 k( 259) = ( 0.0000000 0.0000000 0.2375000), wk = 0.0020921 k( 260) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0020921 k( 261) = ( 0.0000000 0.0000000 0.2125000), wk = 0.0020921 k( 262) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0020921 k( 263) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0020921 k( 264) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0020921 k( 265) = ( 0.0000000 0.0000000 0.1625000), wk = 0.0020921 k( 266) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0020921 k( 267) = ( 0.0000000 0.0000000 0.1375000), wk = 0.0020921 k( 268) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0020921 k( 269) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0020921 k( 270) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0020921 k( 271) = ( 0.0000000 0.0000000 0.0875000), wk = 0.0020921 k( 272) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0020921 k( 273) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0020921 k( 274) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0020921 k( 275) = ( 0.0000000 0.0000000 0.0375000), wk = 0.0020921 k( 276) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0020921 k( 277) = ( 0.0000000 0.0000000 0.0125000), wk = 0.0020921 k( 278) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 279) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020921 k( 280) = ( -0.0089286 0.0089286 0.0000000), wk = 0.0020921 k( 281) = ( -0.0178571 0.0178571 0.0000000), wk = 0.0020921 k( 282) = ( -0.0267857 0.0267857 -0.0000000), wk = 0.0020921 k( 283) = ( -0.0357143 0.0357143 -0.0000000), wk = 0.0020921 k( 284) = ( -0.0446429 0.0446429 0.0000000), wk = 0.0020921 k( 285) = ( -0.0535714 0.0535714 -0.0000000), wk = 0.0020921 k( 286) = ( -0.0625000 0.0625000 -0.0000000), wk = 0.0020921 k( 287) = ( -0.0714286 0.0714286 -0.0000000), wk = 0.0020921 k( 288) = ( -0.0803571 0.0803571 0.0000000), wk = 0.0020921 k( 289) = ( -0.0892857 0.0892857 -0.0000000), wk = 0.0020921 k( 290) = ( -0.0982143 0.0982143 -0.0000000), wk = 0.0020921 k( 291) = ( -0.1071429 0.1071429 -0.0000000), wk = 0.0020921 k( 292) = ( -0.1160714 0.1160714 -0.0000000), wk = 0.0020921 k( 293) = ( -0.1250000 0.1250000 -0.0000000), wk = 0.0020921 k( 294) = ( -0.1339286 0.1339286 -0.0000000), wk = 0.0020921 k( 295) = ( -0.1428571 0.1428571 -0.0000000), wk = 0.0020921 k( 296) = ( -0.1517857 0.1517857 -0.0000000), wk = 0.0020921 k( 297) = ( -0.1607143 0.1607143 0.0000000), wk = 0.0020921 k( 298) = ( -0.1696429 0.1696429 -0.0000000), wk = 0.0020921 k( 299) = ( -0.1785714 0.1785714 -0.0000000), wk = 0.0020921 k( 300) = ( -0.1875000 0.1875000 -0.0000000), wk = 0.0020921 k( 301) = ( -0.1964286 0.1964286 -0.0000000), wk = 0.0020921 k( 302) = ( -0.2053571 0.2053571 -0.0000000), wk = 0.0020921 k( 303) = ( -0.2142857 0.2142857 -0.0000000), wk = 0.0020921 k( 304) = ( -0.2232143 0.2232143 0.0000000), wk = 0.0020921 k( 305) = ( -0.2321429 0.2321429 -0.0000000), wk = 0.0020921 k( 306) = ( -0.2410714 0.2410714 -0.0000000), wk = 0.0020921 k( 307) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0020921 k( 308) = ( -0.2589286 0.2589286 -0.0000000), wk = 0.0020921 k( 309) = ( -0.2678571 0.2678571 -0.0000000), wk = 0.0020921 k( 310) = ( -0.2767857 0.2767857 0.0000000), wk = 0.0020921 k( 311) = ( -0.2857143 0.2857143 -0.0000000), wk = 0.0020921 k( 312) = ( -0.2946429 0.2946429 -0.0000000), wk = 0.0020921 k( 313) = ( -0.3035714 0.3035714 -0.0000000), wk = 0.0020921 k( 314) = ( -0.3125000 0.3125000 0.0000000), wk = 0.0020921 k( 315) = ( -0.3214286 0.3214286 -0.0000000), wk = 0.0020921 k( 316) = ( -0.3303571 0.3303571 -0.0000000), wk = 0.0020921 k( 317) = ( -0.3392857 0.3392857 -0.0000000), wk = 0.0020921 k( 318) = ( -0.3482143 0.3482143 -0.0000000), wk = 0.0020921 k( 319) = ( -0.3571429 0.3571429 -0.0000000), wk = 0.0020921 k( 320) = ( -0.3660714 0.3660714 -0.0000000), wk = 0.0020921 k( 321) = ( -0.3750000 0.3750000 -0.0000000), wk = 0.0020921 k( 322) = ( -0.3839286 0.3839286 -0.0000000), wk = 0.0020921 k( 323) = ( -0.3928571 0.3928571 -0.0000000), wk = 0.0020921 k( 324) = ( -0.4017857 0.4017857 -0.0000000), wk = 0.0020921 k( 325) = ( -0.4107143 0.4107143 -0.0000000), wk = 0.0020921 k( 326) = ( -0.4196429 0.4196429 -0.0000000), wk = 0.0020921 k( 327) = ( -0.4285714 0.4285714 -0.0000000), wk = 0.0020921 k( 328) = ( -0.4375000 0.4375000 -0.0000000), wk = 0.0020921 k( 329) = ( -0.4464286 0.4464286 -0.0000000), wk = 0.0020921 k( 330) = ( -0.4553571 0.4553571 -0.0000000), wk = 0.0020921 k( 331) = ( -0.4642857 0.4642857 -0.0000000), wk = 0.0020921 k( 332) = ( -0.4732143 0.4732143 -0.0000000), wk = 0.0020921 k( 333) = ( -0.4821429 0.4821429 -0.0000000), wk = 0.0020921 k( 334) = ( -0.4910714 0.4910714 0.0000000), wk = 0.0020921 k( 335) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0020921 k( 336) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0020921 k( 337) = ( -0.4984771 0.5015229 -0.0000000), wk = 0.0020921 k( 338) = ( -0.4984771 0.5015229 -0.0000000), wk = 0.0020921 k( 339) = ( -0.4984771 0.5015229 0.0125000), wk = 0.0020921 k( 340) = ( -0.4984771 0.5015229 0.0250000), wk = 0.0020921 k( 341) = ( -0.4984771 0.5015229 0.0375000), wk = 0.0020921 k( 342) = ( -0.4984771 0.5015229 0.0500000), wk = 0.0020921 k( 343) = ( -0.4984771 0.5015229 0.0625000), wk = 0.0020921 k( 344) = ( -0.4984771 0.5015229 0.0750000), wk = 0.0020921 k( 345) = ( -0.4984771 0.5015229 0.0875000), wk = 0.0020921 k( 346) = ( -0.4984771 0.5015229 0.1000000), wk = 0.0020921 k( 347) = ( -0.4984771 0.5015229 0.1125000), wk = 0.0020921 k( 348) = ( -0.4984771 0.5015229 0.1250000), wk = 0.0020921 k( 349) = ( -0.4984771 0.5015229 0.1375000), wk = 0.0020921 k( 350) = ( -0.4984771 0.5015229 0.1500000), wk = 0.0020921 k( 351) = ( -0.4984771 0.5015229 0.1625000), wk = 0.0020921 k( 352) = ( -0.4984771 0.5015229 0.1750000), wk = 0.0020921 k( 353) = ( -0.4984771 0.5015229 0.1875000), wk = 0.0020921 k( 354) = ( -0.4984771 0.5015229 0.2000000), wk = 0.0020921 k( 355) = ( -0.4984771 0.5015229 0.2125000), wk = 0.0020921 k( 356) = ( -0.4984771 0.5015229 0.2250000), wk = 0.0020921 k( 357) = ( -0.4984771 0.5015229 0.2375000), wk = 0.0020921 k( 358) = ( -0.4984771 0.5015229 0.2500000), wk = 0.0020921 k( 359) = ( -0.4984771 0.5015229 0.2625000), wk = 0.0020921 k( 360) = ( -0.4984771 0.5015229 0.2750000), wk = 0.0020921 k( 361) = ( -0.4984771 0.5015229 0.2875000), wk = 0.0020921 k( 362) = ( -0.4984771 0.5015229 0.3000000), wk = 0.0020921 k( 363) = ( -0.4984771 0.5015229 0.3125000), wk = 0.0020921 k( 364) = ( -0.4984771 0.5015229 0.3250000), wk = 0.0020921 k( 365) = ( -0.4984771 0.5015229 0.3375000), wk = 0.0020921 k( 366) = ( -0.4984771 0.5015229 0.3500000), wk = 0.0020921 k( 367) = ( -0.4984771 0.5015229 0.3625000), wk = 0.0020921 k( 368) = ( -0.4984771 0.5015229 0.3750000), wk = 0.0020921 k( 369) = ( -0.4984771 0.5015229 0.3875000), wk = 0.0020921 k( 370) = ( -0.4984771 0.5015229 0.4000000), wk = 0.0020921 k( 371) = ( -0.4984771 0.5015229 0.4125000), wk = 0.0020921 k( 372) = ( -0.4984771 0.5015229 0.4250000), wk = 0.0020921 k( 373) = ( -0.4984771 0.5015229 0.4375000), wk = 0.0020921 k( 374) = ( -0.4984771 0.5015229 0.4500000), wk = 0.0020921 k( 375) = ( -0.4984771 0.5015229 0.4625000), wk = 0.0020921 k( 376) = ( -0.4984771 0.5015229 0.4750000), wk = 0.0020921 k( 377) = ( -0.4984771 0.5015229 0.4875000), wk = 0.0020921 k( 378) = ( -0.4984771 0.5015229 0.5000000), wk = 0.0020921 k( 379) = ( -0.4984771 0.5015229 0.5000000), wk = 0.0020921 k( 380) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0020921 k( 381) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0020921 k( 382) = ( -0.5000000 0.5000000 0.4875000), wk = 0.0020921 k( 383) = ( -0.5000000 0.5000000 0.4750000), wk = 0.0020921 k( 384) = ( -0.5000000 0.5000000 0.4625000), wk = 0.0020921 k( 385) = ( -0.5000000 0.5000000 0.4500000), wk = 0.0020921 k( 386) = ( -0.5000000 0.5000000 0.4375000), wk = 0.0020921 k( 387) = ( -0.5000000 0.5000000 0.4250000), wk = 0.0020921 k( 388) = ( -0.5000000 0.5000000 0.4125000), wk = 0.0020921 k( 389) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0020921 k( 390) = ( -0.5000000 0.5000000 0.3875000), wk = 0.0020921 k( 391) = ( -0.5000000 0.5000000 0.3750000), wk = 0.0020921 k( 392) = ( -0.5000000 0.5000000 0.3625000), wk = 0.0020921 k( 393) = ( -0.5000000 0.5000000 0.3500000), wk = 0.0020921 k( 394) = ( -0.5000000 0.5000000 0.3375000), wk = 0.0020921 k( 395) = ( -0.5000000 0.5000000 0.3250000), wk = 0.0020921 k( 396) = ( -0.5000000 0.5000000 0.3125000), wk = 0.0020921 k( 397) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0020921 k( 398) = ( -0.5000000 0.5000000 0.2875000), wk = 0.0020921 k( 399) = ( -0.5000000 0.5000000 0.2750000), wk = 0.0020921 k( 400) = ( -0.5000000 0.5000000 0.2625000), wk = 0.0020921 k( 401) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0020921 k( 402) = ( -0.5000000 0.5000000 0.2375000), wk = 0.0020921 k( 403) = ( -0.5000000 0.5000000 0.2250000), wk = 0.0020921 k( 404) = ( -0.5000000 0.5000000 0.2125000), wk = 0.0020921 k( 405) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0020921 k( 406) = ( -0.5000000 0.5000000 0.1875000), wk = 0.0020921 k( 407) = ( -0.5000000 0.5000000 0.1750000), wk = 0.0020921 k( 408) = ( -0.5000000 0.5000000 0.1625000), wk = 0.0020921 k( 409) = ( -0.5000000 0.5000000 0.1500000), wk = 0.0020921 k( 410) = ( -0.5000000 0.5000000 0.1375000), wk = 0.0020921 k( 411) = ( -0.5000000 0.5000000 0.1250000), wk = 0.0020921 k( 412) = ( -0.5000000 0.5000000 0.1125000), wk = 0.0020921 k( 413) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0020921 k( 414) = ( -0.5000000 0.5000000 0.0875000), wk = 0.0020921 k( 415) = ( -0.5000000 0.5000000 0.0750000), wk = 0.0020921 k( 416) = ( -0.5000000 0.5000000 0.0625000), wk = 0.0020921 k( 417) = ( -0.5000000 0.5000000 0.0500000), wk = 0.0020921 k( 418) = ( -0.5000000 0.5000000 0.0375000), wk = 0.0020921 k( 419) = ( -0.5000000 0.5000000 0.0250000), wk = 0.0020921 k( 420) = ( -0.5000000 0.5000000 0.0125000), wk = 0.0020921 k( 421) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0020921 k( 422) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020921 k( 423) = ( -0.0089286 0.0089286 0.5000000), wk = 0.0020921 k( 424) = ( -0.0178571 0.0178571 0.5000000), wk = 0.0020921 k( 425) = ( -0.0267857 0.0267857 0.5000000), wk = 0.0020921 k( 426) = ( -0.0357143 0.0357143 0.5000000), wk = 0.0020921 k( 427) = ( -0.0446429 0.0446429 0.5000000), wk = 0.0020921 k( 428) = ( -0.0535714 0.0535714 0.5000000), wk = 0.0020921 k( 429) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0020921 k( 430) = ( -0.0714286 0.0714286 0.5000000), wk = 0.0020921 k( 431) = ( -0.0803571 0.0803571 0.5000000), wk = 0.0020921 k( 432) = ( -0.0892857 0.0892857 0.5000000), wk = 0.0020921 k( 433) = ( -0.0982143 0.0982143 0.5000000), wk = 0.0020921 k( 434) = ( -0.1071429 0.1071429 0.5000000), wk = 0.0020921 k( 435) = ( -0.1160714 0.1160714 0.5000000), wk = 0.0020921 k( 436) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0020921 k( 437) = ( -0.1339286 0.1339286 0.5000000), wk = 0.0020921 k( 438) = ( -0.1428571 0.1428571 0.5000000), wk = 0.0020921 k( 439) = ( -0.1517857 0.1517857 0.5000000), wk = 0.0020921 k( 440) = ( -0.1607143 0.1607143 0.5000000), wk = 0.0020921 k( 441) = ( -0.1696429 0.1696429 0.5000000), wk = 0.0020921 k( 442) = ( -0.1785714 0.1785714 0.5000000), wk = 0.0020921 k( 443) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0020921 k( 444) = ( -0.1964286 0.1964286 0.5000000), wk = 0.0020921 k( 445) = ( -0.2053571 0.2053571 0.5000000), wk = 0.0020921 k( 446) = ( -0.2142857 0.2142857 0.5000000), wk = 0.0020921 k( 447) = ( -0.2232143 0.2232143 0.5000000), wk = 0.0020921 k( 448) = ( -0.2321429 0.2321429 0.5000000), wk = 0.0020921 k( 449) = ( -0.2410714 0.2410714 0.5000000), wk = 0.0020921 k( 450) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0020921 k( 451) = ( -0.2589286 0.2589286 0.5000000), wk = 0.0020921 k( 452) = ( -0.2678571 0.2678571 0.5000000), wk = 0.0020921 k( 453) = ( -0.2767857 0.2767857 0.5000000), wk = 0.0020921 k( 454) = ( -0.2857143 0.2857143 0.5000000), wk = 0.0020921 k( 455) = ( -0.2946429 0.2946429 0.5000000), wk = 0.0020921 k( 456) = ( -0.3035714 0.3035714 0.5000000), wk = 0.0020921 k( 457) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0020921 k( 458) = ( -0.3214286 0.3214286 0.5000000), wk = 0.0020921 k( 459) = ( -0.3303571 0.3303571 0.5000000), wk = 0.0020921 k( 460) = ( -0.3392857 0.3392857 0.5000000), wk = 0.0020921 k( 461) = ( -0.3482143 0.3482143 0.5000000), wk = 0.0020921 k( 462) = ( -0.3571429 0.3571429 0.5000000), wk = 0.0020921 k( 463) = ( -0.3660714 0.3660714 0.5000000), wk = 0.0020921 k( 464) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0020921 k( 465) = ( -0.3839286 0.3839286 0.5000000), wk = 0.0020921 k( 466) = ( -0.3928571 0.3928571 0.5000000), wk = 0.0020921 k( 467) = ( -0.4017857 0.4017857 0.5000000), wk = 0.0020921 k( 468) = ( -0.4107143 0.4107143 0.5000000), wk = 0.0020921 k( 469) = ( -0.4196429 0.4196429 0.5000000), wk = 0.0020921 k( 470) = ( -0.4285714 0.4285714 0.5000000), wk = 0.0020921 k( 471) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0020921 k( 472) = ( -0.4464286 0.4464286 0.5000000), wk = 0.0020921 k( 473) = ( -0.4553571 0.4553571 0.5000000), wk = 0.0020921 k( 474) = ( -0.4642857 0.4642857 0.5000000), wk = 0.0020921 k( 475) = ( -0.4732143 0.4732143 0.5000000), wk = 0.0020921 k( 476) = ( -0.4821429 0.4821429 0.5000000), wk = 0.0020921 k( 477) = ( -0.4910714 0.4910714 0.5000000), wk = 0.0020921 k( 478) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0020921 Dense grid: 100129 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 21791 G-vectors FFT dimensions: ( 36, 36, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.09 Mb ( 124, 48) NL pseudopotentials 0.11 Mb ( 62, 111) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2086) G-vector shells 0.01 Mb ( 1042) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.36 Mb ( 124, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.16 Mb ( 111, 2, 48) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./BaTiO3.save/charge-density.dat Starting wfc are 54 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.1 secs Computing kpt #: 2 total cpu time spent up to now is 45.4 secs Computing kpt #: 3 total cpu time spent up to now is 46.6 secs Computing kpt #: 4 total cpu time spent up to now is 47.8 secs Computing kpt #: 5 total cpu time spent up to now is 48.9 secs Computing kpt #: 6 total cpu time spent up to now is 50.3 secs Computing kpt #: 7 total cpu time spent up to now is 51.4 secs Computing kpt #: 8 total cpu time spent up to now is 52.7 secs Computing kpt #: 9 total cpu time spent up to now is 53.9 secs Computing kpt #: 10 total cpu time spent up to now is 55.1 secs Computing kpt #: 11 total cpu time spent up to now is 56.4 secs Computing kpt #: 12 total cpu time spent up to now is 57.6 secs Computing kpt #: 13 total cpu time spent up to now is 59.0 secs Computing kpt #: 14 total cpu time spent up to now is 60.2 secs Computing kpt #: 15 total cpu time spent up to now is 61.4 secs Computing kpt #: 16 total cpu time spent up to now is 62.7 secs Computing kpt #: 17 total cpu time spent up to now is 64.0 secs Computing kpt #: 18 total cpu time spent up to now is 65.2 secs Computing kpt #: 19 total cpu time spent up to now is 66.4 secs Computing kpt #: 20 total cpu time spent up to now is 67.6 secs Computing kpt #: 21 total cpu time spent up to now is 68.9 secs Computing kpt #: 22 total cpu time spent up to now is 70.1 secs Computing kpt #: 23 total cpu time spent up to now is 71.3 secs Computing kpt #: 24 total cpu time spent up to now is 72.6 secs Computing kpt #: 25 total cpu time spent up to now is 73.8 secs Computing kpt #: 26 total cpu time spent up to now is 75.0 secs Computing kpt #: 27 total cpu time spent up to now is 76.2 secs Computing kpt #: 28 total cpu time spent up to now is 77.6 secs Computing kpt #: 29 total cpu time spent up to now is 78.8 secs Computing kpt #: 30 total cpu time spent up to now is 80.0 secs Computing kpt #: 31 total cpu time spent up to now is 81.2 secs Computing kpt #: 32 total cpu time spent up to now is 82.6 secs Computing kpt #: 33 total cpu time spent up to now is 83.7 secs Computing kpt #: 34 total cpu time spent up to now is 84.9 secs Computing kpt #: 35 total cpu time spent up to now is 86.1 secs Computing kpt #: 36 total cpu time spent up to now is 87.3 secs Computing kpt #: 37 total cpu time spent up to now is 88.5 secs Computing kpt #: 38 total cpu time spent up to now is 89.6 secs Computing kpt #: 39 total cpu time spent up to now is 90.8 secs Computing kpt #: 40 total cpu time spent up to now is 91.9 secs Computing kpt #: 41 total cpu time spent up to now is 93.5 secs Computing kpt #: 42 total cpu time spent up to now is 94.8 secs Computing kpt #: 43 total cpu time spent up to now is 96.1 secs Computing kpt #: 44 total cpu time spent up to now is 97.2 secs Computing kpt #: 45 total cpu time spent up to now is 98.6 secs Computing kpt #: 46 total cpu time spent up to now is 99.8 secs Computing kpt #: 47 total cpu time spent up to now is 101.1 secs Computing kpt #: 48 total cpu time spent up to now is 102.4 secs Computing kpt #: 49 total cpu time spent up to now is 103.5 secs Computing kpt #: 50 total cpu time spent up to now is 104.5 secs Computing kpt #: 51 total cpu time spent up to now is 105.6 secs Computing kpt #: 52 total cpu time spent up to now is 106.5 secs Computing kpt #: 53 total cpu time spent up to now is 107.6 secs Computing kpt #: 54 total cpu time spent up to now is 108.6 secs Computing kpt #: 55 total cpu time spent up to now is 109.7 secs Computing kpt #: 56 total cpu time spent up to now is 110.8 secs Computing kpt #: 57 total cpu time spent up to now is 111.9 secs Computing kpt #: 58 total cpu time spent up to now is 112.8 secs Computing kpt #: 59 total cpu time spent up to now is 113.9 secs Computing kpt #: 60 total cpu time spent up to now is 114.8 secs Computing kpt #: 61 total cpu time spent up to now is 115.8 secs Computing kpt #: 62 total cpu time spent up to now is 116.9 secs Computing kpt #: 63 total cpu time spent up to now is 118.0 secs Computing kpt #: 64 total cpu time spent up to now is 119.0 secs Computing kpt #: 65 total cpu time spent up to now is 120.1 secs Computing kpt #: 66 total cpu time spent up to now is 121.2 secs Computing kpt #: 67 total cpu time spent up to now is 122.3 secs Computing kpt #: 68 total cpu time spent up to now is 123.4 secs Computing kpt #: 69 total cpu time spent up to now is 124.4 secs Computing kpt #: 70 total cpu time spent up to now is 125.4 secs Computing kpt #: 71 total cpu time spent up to now is 126.5 secs Computing kpt #: 72 total cpu time spent up to now is 127.7 secs Computing kpt #: 73 total cpu time spent up to now is 128.8 secs Computing kpt #: 74 total cpu time spent up to now is 129.9 secs Computing kpt #: 75 total cpu time spent up to now is 131.1 secs Computing kpt #: 76 total cpu time spent up to now is 132.2 secs Computing kpt #: 77 total cpu time spent up to now is 133.4 secs Computing kpt #: 78 total cpu time spent up to now is 134.6 secs Computing kpt #: 79 total cpu time spent up to now is 135.8 secs Computing kpt #: 80 total cpu time spent up to now is 137.0 secs Computing kpt #: 81 total cpu time spent up to now is 138.2 secs Computing kpt #: 82 total cpu time spent up to now is 139.4 secs Computing kpt #: 83 total cpu time spent up to now is 140.6 secs Computing kpt #: 84 total cpu time spent up to now is 141.8 secs Computing kpt #: 85 total cpu time spent up to now is 143.1 secs Computing kpt #: 86 total cpu time spent up to now is 144.4 secs Computing kpt #: 87 total cpu time spent up to now is 145.6 secs Computing kpt #: 88 total cpu time spent up to now is 146.9 secs Computing kpt #: 89 total cpu time spent up to now is 148.3 secs Computing kpt #: 90 total cpu time spent up to now is 149.7 secs Computing kpt #: 91 total cpu time spent up to now is 150.9 secs Computing kpt #: 92 total cpu time spent up to now is 152.3 secs Computing kpt #: 93 total cpu time spent up to now is 153.6 secs Computing kpt #: 94 total cpu time spent up to now is 154.9 secs Computing kpt #: 95 total cpu time spent up to now is 156.2 secs Computing kpt #: 96 total cpu time spent up to now is 157.5 secs Computing kpt #: 97 total cpu time spent up to now is 158.7 secs Computing kpt #: 98 total cpu time spent up to now is 159.9 secs Computing kpt #: 99 total cpu time spent up to now is 161.2 secs Computing kpt #: 100 total cpu time spent up to now is 162.8 secs Computing kpt #: 101 total cpu time spent up to now is 164.1 secs Computing kpt #: 102 total cpu time spent up to now is 165.4 secs Computing kpt #: 103 total cpu time spent up to now is 166.7 secs Computing kpt #: 104 total cpu time spent up to now is 167.9 secs Computing kpt #: 105 total cpu time spent up to now is 169.1 secs Computing kpt #: 106 total cpu time spent up to now is 170.4 secs Computing kpt #: 107 total cpu time spent up to now is 171.8 secs Computing kpt #: 108 total cpu time spent up to now is 173.0 secs Computing kpt #: 109 total cpu time spent up to now is 174.3 secs Computing kpt #: 110 total cpu time spent up to now is 175.6 secs Computing kpt #: 111 total cpu time spent up to now is 176.9 secs Computing kpt #: 112 total cpu time spent up to now is 178.2 secs Computing kpt #: 113 total cpu time spent up to now is 179.5 secs Computing kpt #: 114 total cpu time spent up to now is 180.8 secs Computing kpt #: 115 total cpu time spent up to now is 182.1 secs Computing kpt #: 116 total cpu time spent up to now is 183.6 secs Computing kpt #: 117 total cpu time spent up to now is 184.9 secs Computing kpt #: 118 total cpu time spent up to now is 186.1 secs Computing kpt #: 119 total cpu time spent up to now is 187.5 secs Computing kpt #: 120 total cpu time spent up to now is 188.8 secs Computing kpt #: 121 total cpu time spent up to now is 190.2 secs Computing kpt #: 122 total cpu time spent up to now is 192.0 secs Computing kpt #: 123 total cpu time spent up to now is 193.6 secs Computing kpt #: 124 total cpu time spent up to now is 195.0 secs Computing kpt #: 125 total cpu time spent up to now is 196.5 secs Computing kpt #: 126 total cpu time spent up to now is 197.8 secs Computing kpt #: 127 total cpu time spent up to now is 199.1 secs Computing kpt #: 128 total cpu time spent up to now is 200.4 secs Computing kpt #: 129 total cpu time spent up to now is 201.7 secs Computing kpt #: 130 total cpu time spent up to now is 202.9 secs Computing kpt #: 131 total cpu time spent up to now is 204.2 secs Computing kpt #: 132 total cpu time spent up to now is 205.4 secs Computing kpt #: 133 total cpu time spent up to now is 206.9 secs Computing kpt #: 134 total cpu time spent up to now is 208.2 secs Computing kpt #: 135 total cpu time spent up to now is 209.5 secs Computing kpt #: 136 total cpu time spent up to now is 210.7 secs Computing kpt #: 137 total cpu time spent up to now is 212.1 secs Computing kpt #: 138 total cpu time spent up to now is 213.4 secs Computing kpt #: 139 total cpu time spent up to now is 214.6 secs Computing kpt #: 140 total cpu time spent up to now is 215.8 secs Computing kpt #: 141 total cpu time spent up to now is 217.0 secs Computing kpt #: 142 total cpu time spent up to now is 218.3 secs Computing kpt #: 143 total cpu time spent up to now is 219.6 secs Computing kpt #: 144 total cpu time spent up to now is 220.8 secs Computing kpt #: 145 total cpu time spent up to now is 222.1 secs Computing kpt #: 146 total cpu time spent up to now is 223.3 secs Computing kpt #: 147 total cpu time spent up to now is 224.5 secs Computing kpt #: 148 total cpu time spent up to now is 225.9 secs Computing kpt #: 149 total cpu time spent up to now is 227.2 secs Computing kpt #: 150 total cpu time spent up to now is 228.4 secs Computing kpt #: 151 total cpu time spent up to now is 229.7 secs Computing kpt #: 152 total cpu time spent up to now is 231.0 secs Computing kpt #: 153 total cpu time spent up to now is 232.3 secs Computing kpt #: 154 total cpu time spent up to now is 233.6 secs Computing kpt #: 155 total cpu time spent up to now is 234.8 secs Computing kpt #: 156 total cpu time spent up to now is 236.1 secs Computing kpt #: 157 total cpu time spent up to now is 237.5 secs Computing kpt #: 158 total cpu time spent up to now is 238.9 secs Computing kpt #: 159 total cpu time spent up to now is 240.2 secs Computing kpt #: 160 total cpu time spent up to now is 241.6 secs Computing kpt #: 161 total cpu time spent up to now is 243.0 secs Computing kpt #: 162 total cpu time spent up to now is 244.4 secs Computing kpt #: 163 total cpu time spent up to now is 245.9 secs Computing kpt #: 164 total cpu time spent up to now is 247.5 secs Computing kpt #: 165 total cpu time spent up to now is 249.1 secs Computing kpt #: 166 total cpu time spent up to now is 250.7 secs Computing kpt #: 167 total cpu time spent up to now is 252.2 secs Computing kpt #: 168 total cpu time spent up to now is 254.0 secs Computing kpt #: 169 total cpu time spent up to now is 255.7 secs Computing kpt #: 170 total cpu time spent up to now is 257.7 secs Computing kpt #: 171 total cpu time spent up to now is 259.9 secs Computing kpt #: 172 total cpu time spent up to now is 261.6 secs Computing kpt #: 173 total cpu time spent up to now is 263.3 secs Computing kpt #: 174 total cpu time spent up to now is 265.7 secs Computing kpt #: 175 total cpu time spent up to now is 267.8 secs Computing kpt #: 176 total cpu time spent up to now is 270.9 secs Computing kpt #: 177 total cpu time spent up to now is 273.1 secs Computing kpt #: 178 total cpu time spent up to now is 275.4 secs Computing kpt #: 179 total cpu time spent up to now is 277.6 secs Computing kpt #: 180 total cpu time spent up to now is 280.1 secs Computing kpt #: 181 total cpu time spent up to now is 282.8 secs Computing kpt #: 182 total cpu time spent up to now is 285.0 secs Computing kpt #: 183 total cpu time spent up to now is 287.2 secs Computing kpt #: 184 total cpu time spent up to now is 290.1 secs Computing kpt #: 185 total cpu time spent up to now is 292.4 secs Computing kpt #: 186 total cpu time spent up to now is 294.6 secs Computing kpt #: 187 total cpu time spent up to now is 297.7 secs Computing kpt #: 188 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 300.8 secs Computing kpt #: 189 total cpu time spent up to now is 303.1 secs Computing kpt #: 190 total cpu time spent up to now is 305.4 secs Computing kpt #: 191 total cpu time spent up to now is 307.0 secs Computing kpt #: 192 total cpu time spent up to now is 309.2 secs Computing kpt #: 193 total cpu time spent up to now is 310.8 secs Computing kpt #: 194 total cpu time spent up to now is 312.9 secs Computing kpt #: 195 total cpu time spent up to now is 314.6 secs Computing kpt #: 196 total cpu time spent up to now is 316.4 secs Computing kpt #: 197 total cpu time spent up to now is 318.1 secs Computing kpt #: 198 total cpu time spent up to now is 320.2 secs Computing kpt #: 199 total cpu time spent up to now is 322.2 secs Computing kpt #: 200 total cpu time spent up to now is 323.8 secs Computing kpt #: 201 total cpu time spent up to now is 325.6 secs Computing kpt #: 202 total cpu time spent up to now is 327.3 secs Computing kpt #: 203 total cpu time spent up to now is 329.0 secs Computing kpt #: 204 total cpu time spent up to now is 330.7 secs Computing kpt #: 205 total cpu time spent up to now is 332.4 secs Computing kpt #: 206 total cpu time spent up to now is 334.1 secs Computing kpt #: 207 total cpu time spent up to now is 335.6 secs Computing kpt #: 208 total cpu time spent up to now is 337.3 secs Computing kpt #: 209 total cpu time spent up to now is 338.9 secs Computing kpt #: 210 total cpu time spent up to now is 340.6 secs Computing kpt #: 211 total cpu time spent up to now is 342.4 secs Computing kpt #: 212 total cpu time spent up to now is 344.0 secs Computing kpt #: 213 total cpu time spent up to now is 345.8 secs Computing kpt #: 214 total cpu time spent up to now is 347.4 secs Computing kpt #: 215 total cpu time spent up to now is 348.9 secs Computing kpt #: 216 total cpu time spent up to now is 350.9 secs Computing kpt #: 217 total cpu time spent up to now is 352.4 secs Computing kpt #: 218 total cpu time spent up to now is 354.2 secs Computing kpt #: 219 total cpu time spent up to now is 356.3 secs Computing kpt #: 220 total cpu time spent up to now is 357.8 secs Computing kpt #: 221 total cpu time spent up to now is 359.6 secs Computing kpt #: 222 total cpu time spent up to now is 361.3 secs Computing kpt #: 223 total cpu time spent up to now is 362.7 secs Computing kpt #: 224 total cpu time spent up to now is 364.2 secs Computing kpt #: 225 total cpu time spent up to now is 365.6 secs Computing kpt #: 226 total cpu time spent up to now is 367.1 secs Computing kpt #: 227 total cpu time spent up to now is 368.4 secs Computing kpt #: 228 total cpu time spent up to now is 369.9 secs Computing kpt #: 229 total cpu time spent up to now is 371.2 secs Computing kpt #: 230 total cpu time spent up to now is 372.6 secs Computing kpt #: 231 total cpu time spent up to now is 374.3 secs Computing kpt #: 232 total cpu time spent up to now is 375.7 secs Computing kpt #: 233 total cpu time spent up to now is 377.0 secs Computing kpt #: 234 total cpu time spent up to now is 378.3 secs Computing kpt #: 235 total cpu time spent up to now is 379.6 secs Computing kpt #: 236 total cpu time spent up to now is 380.9 secs Computing kpt #: 237 total cpu time spent up to now is 382.2 secs Computing kpt #: 238 total cpu time spent up to now is 383.5 secs Computing kpt #: 239 total cpu time spent up to now is 384.8 secs Computing kpt #: 240 total cpu time spent up to now is 386.1 secs Computing kpt #: 241 total cpu time spent up to now is 387.4 secs Computing kpt #: 242 total cpu time spent up to now is 388.7 secs Computing kpt #: 243 total cpu time spent up to now is 390.0 secs Computing kpt #: 244 total cpu time spent up to now is 391.3 secs Computing kpt #: 245 total cpu time spent up to now is 392.7 secs Computing kpt #: 246 total cpu time spent up to now is 394.1 secs Computing kpt #: 247 total cpu time spent up to now is 395.5 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 398.5 secs Computing kpt #: 249 total cpu time spent up to now is 400.3 secs Computing kpt #: 250 total cpu time spent up to now is 402.4 secs Computing kpt #: 251 total cpu time spent up to now is 404.5 secs Computing kpt #: 252 total cpu time spent up to now is 406.6 secs Computing kpt #: 253 total cpu time spent up to now is 408.4 secs Computing kpt #: 254 total cpu time spent up to now is 409.9 secs Computing kpt #: 255 total cpu time spent up to now is 411.4 secs Computing kpt #: 256 total cpu time spent up to now is 412.8 secs Computing kpt #: 257 total cpu time spent up to now is 414.4 secs Computing kpt #: 258 total cpu time spent up to now is 415.9 secs Computing kpt #: 259 total cpu time spent up to now is 417.5 secs Computing kpt #: 260 total cpu time spent up to now is 419.1 secs Computing kpt #: 261 total cpu time spent up to now is 420.6 secs Computing kpt #: 262 total cpu time spent up to now is 422.0 secs Computing kpt #: 263 total cpu time spent up to now is 423.3 secs Computing kpt #: 264 total cpu time spent up to now is 424.5 secs Computing kpt #: 265 total cpu time spent up to now is 425.7 secs Computing kpt #: 266 total cpu time spent up to now is 427.0 secs Computing kpt #: 267 total cpu time spent up to now is 428.1 secs Computing kpt #: 268 total cpu time spent up to now is 429.3 secs Computing kpt #: 269 total cpu time spent up to now is 430.6 secs Computing kpt #: 270 total cpu time spent up to now is 431.7 secs Computing kpt #: 271 total cpu time spent up to now is 432.9 secs Computing kpt #: 272 total cpu time spent up to now is 434.0 secs Computing kpt #: 273 total cpu time spent up to now is 435.3 secs Computing kpt #: 274 total cpu time spent up to now is 436.5 secs Computing kpt #: 275 total cpu time spent up to now is 437.6 secs Computing kpt #: 276 total cpu time spent up to now is 438.8 secs Computing kpt #: 277 total cpu time spent up to now is 440.0 secs Computing kpt #: 278 total cpu time spent up to now is 441.3 secs Computing kpt #: 279 total cpu time spent up to now is 442.4 secs Computing kpt #: 280 total cpu time spent up to now is 443.5 secs Computing kpt #: 281 total cpu time spent up to now is 444.7 secs Computing kpt #: 282 total cpu time spent up to now is 445.8 secs Computing kpt #: 283 total cpu time spent up to now is 447.2 secs Computing kpt #: 284 total cpu time spent up to now is 448.4 secs Computing kpt #: 285 total cpu time spent up to now is 449.6 secs Computing kpt #: 286 total cpu time spent up to now is 450.7 secs Computing kpt #: 287 total cpu time spent up to now is 451.9 secs Computing kpt #: 288 total cpu time spent up to now is 453.0 secs Computing kpt #: 289 total cpu time spent up to now is 454.2 secs Computing kpt #: 290 total cpu time spent up to now is 455.4 secs Computing kpt #: 291 total cpu time spent up to now is 456.6 secs Computing kpt #: 292 total cpu time spent up to now is 457.8 secs Computing kpt #: 293 total cpu time spent up to now is 459.0 secs Computing kpt #: 294 total cpu time spent up to now is 460.2 secs Computing kpt #: 295 total cpu time spent up to now is 461.4 secs Computing kpt #: 296 total cpu time spent up to now is 462.5 secs Computing kpt #: 297 total cpu time spent up to now is 463.6 secs Computing kpt #: 298 total cpu time spent up to now is 464.9 secs Computing kpt #: 299 total cpu time spent up to now is 466.5 secs Computing kpt #: 300 total cpu time spent up to now is 467.6 secs Computing kpt #: 301 total cpu time spent up to now is 468.7 secs Computing kpt #: 302 total cpu time spent up to now is 469.8 secs Computing kpt #: 303 total cpu time spent up to now is 470.9 secs Computing kpt #: 304 total cpu time spent up to now is 472.2 secs Computing kpt #: 305 total cpu time spent up to now is 473.3 secs Computing kpt #: 306 total cpu time spent up to now is 474.4 secs Computing kpt #: 307 total cpu time spent up to now is 475.5 secs Computing kpt #: 308 total cpu time spent up to now is 476.6 secs Computing kpt #: 309 total cpu time spent up to now is 477.9 secs Computing kpt #: 310 total cpu time spent up to now is 479.0 secs Computing kpt #: 311 total cpu time spent up to now is 480.1 secs Computing kpt #: 312 total cpu time spent up to now is 481.3 secs Computing kpt #: 313 total cpu time spent up to now is 482.4 secs Computing kpt #: 314 total cpu time spent up to now is 483.6 secs Computing kpt #: 315 total cpu time spent up to now is 484.8 secs Computing kpt #: 316 total cpu time spent up to now is 485.9 secs Computing kpt #: 317 total cpu time spent up to now is 487.0 secs Computing kpt #: 318 total cpu time spent up to now is 488.1 secs Computing kpt #: 319 total cpu time spent up to now is 489.3 secs Computing kpt #: 320 total cpu time spent up to now is 490.4 secs Computing kpt #: 321 total cpu time spent up to now is 492.1 secs Computing kpt #: 322 total cpu time spent up to now is 493.8 secs Computing kpt #: 323 total cpu time spent up to now is 495.3 secs Computing kpt #: 324 total cpu time spent up to now is 496.8 secs Computing kpt #: 325 total cpu time spent up to now is 497.8 secs Computing kpt #: 326 total cpu time spent up to now is 499.0 secs Computing kpt #: 327 total cpu time spent up to now is 500.1 secs Computing kpt #: 328 total cpu time spent up to now is 501.9 secs Computing kpt #: 329 total cpu time spent up to now is 504.1 secs Computing kpt #: 330 total cpu time spent up to now is 505.1 secs Computing kpt #: 331 total cpu time spent up to now is 506.7 secs Computing kpt #: 332 total cpu time spent up to now is 507.7 secs Computing kpt #: 333 total cpu time spent up to now is 508.7 secs Computing kpt #: 334 total cpu time spent up to now is 509.7 secs Computing kpt #: 335 total cpu time spent up to now is 510.8 secs Computing kpt #: 336 total cpu time spent up to now is 511.9 secs Computing kpt #: 337 total cpu time spent up to now is 513.2 secs Computing kpt #: 338 total cpu time spent up to now is 514.2 secs Computing kpt #: 339 total cpu time spent up to now is 515.2 secs Computing kpt #: 340 total cpu time spent up to now is 516.3 secs Computing kpt #: 341 total cpu time spent up to now is 517.4 secs Computing kpt #: 342 total cpu time spent up to now is 518.6 secs Computing kpt #: 343 total cpu time spent up to now is 519.7 secs Computing kpt #: 344 total cpu time spent up to now is 520.7 secs Computing kpt #: 345 total cpu time spent up to now is 521.8 secs Computing kpt #: 346 total cpu time spent up to now is 522.8 secs Computing kpt #: 347 total cpu time spent up to now is 524.0 secs Computing kpt #: 348 total cpu time spent up to now is 525.1 secs Computing kpt #: 349 total cpu time spent up to now is 526.2 secs Computing kpt #: 350 total cpu time spent up to now is 527.3 secs Computing kpt #: 351 total cpu time spent up to now is 528.4 secs Computing kpt #: 352 total cpu time spent up to now is 529.5 secs Computing kpt #: 353 total cpu time spent up to now is 530.7 secs Computing kpt #: 354 total cpu time spent up to now is 531.8 secs Computing kpt #: 355 total cpu time spent up to now is 532.9 secs Computing kpt #: 356 total cpu time spent up to now is 534.0 secs Computing kpt #: 357 total cpu time spent up to now is 535.2 secs Computing kpt #: 358 total cpu time spent up to now is 536.3 secs Computing kpt #: 359 total cpu time spent up to now is 537.5 secs Computing kpt #: 360 total cpu time spent up to now is 538.7 secs Computing kpt #: 361 total cpu time spent up to now is 539.9 secs Computing kpt #: 362 total cpu time spent up to now is 541.1 secs Computing kpt #: 363 total cpu time spent up to now is 542.3 secs Computing kpt #: 364 total cpu time spent up to now is 543.5 secs Computing kpt #: 365 total cpu time spent up to now is 545.0 secs Computing kpt #: 366 total cpu time spent up to now is 546.4 secs Computing kpt #: 367 total cpu time spent up to now is 547.9 secs Computing kpt #: 368 total cpu time spent up to now is 550.0 secs Computing kpt #: 369 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 553.1 secs Computing kpt #: 370 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 556.4 secs Computing kpt #: 371 total cpu time spent up to now is 558.7 secs Computing kpt #: 372 total cpu time spent up to now is 561.1 secs Computing kpt #: 373 total cpu time spent up to now is 563.4 secs Computing kpt #: 374 total cpu time spent up to now is 565.6 secs Computing kpt #: 375 total cpu time spent up to now is 568.1 secs Computing kpt #: 376 total cpu time spent up to now is 570.2 secs Computing kpt #: 377 total cpu time spent up to now is 572.9 secs Computing kpt #: 378 total cpu time spent up to now is 575.5 secs Computing kpt #: 379 total cpu time spent up to now is 577.7 secs Computing kpt #: 380 total cpu time spent up to now is 579.8 secs Computing kpt #: 381 total cpu time spent up to now is 581.8 secs Computing kpt #: 382 total cpu time spent up to now is 583.9 secs Computing kpt #: 383 total cpu time spent up to now is 586.1 secs Computing kpt #: 384 total cpu time spent up to now is 588.2 secs Computing kpt #: 385 total cpu time spent up to now is 590.4 secs Computing kpt #: 386 total cpu time spent up to now is 592.6 secs Computing kpt #: 387 total cpu time spent up to now is 594.7 secs Computing kpt #: 388 total cpu time spent up to now is 597.8 secs Computing kpt #: 389 total cpu time spent up to now is 600.2 secs Computing kpt #: 390 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 603.4 secs Computing kpt #: 391 total cpu time spent up to now is 605.7 secs Computing kpt #: 392 total cpu time spent up to now is 607.2 secs Computing kpt #: 393 total cpu time spent up to now is 608.5 secs Computing kpt #: 394 total cpu time spent up to now is 609.8 secs Computing kpt #: 395 total cpu time spent up to now is 610.9 secs Computing kpt #: 396 total cpu time spent up to now is 612.1 secs Computing kpt #: 397 total cpu time spent up to now is 613.4 secs Computing kpt #: 398 total cpu time spent up to now is 614.6 secs Computing kpt #: 399 total cpu time spent up to now is 615.8 secs Computing kpt #: 400 total cpu time spent up to now is 616.9 secs Computing kpt #: 401 total cpu time spent up to now is 618.1 secs Computing kpt #: 402 total cpu time spent up to now is 619.2 secs Computing kpt #: 403 total cpu time spent up to now is 620.8 secs Computing kpt #: 404 total cpu time spent up to now is 621.8 secs Computing kpt #: 405 total cpu time spent up to now is 622.9 secs Computing kpt #: 406 total cpu time spent up to now is 624.1 secs Computing kpt #: 407 total cpu time spent up to now is 625.3 secs Computing kpt #: 408 total cpu time spent up to now is 626.3 secs Computing kpt #: 409 total cpu time spent up to now is 627.7 secs Computing kpt #: 410 total cpu time spent up to now is 629.1 secs Computing kpt #: 411 total cpu time spent up to now is 630.2 secs Computing kpt #: 412 total cpu time spent up to now is 631.2 secs Computing kpt #: 413 total cpu time spent up to now is 632.3 secs Computing kpt #: 414 total cpu time spent up to now is 633.4 secs Computing kpt #: 415 total cpu time spent up to now is 634.5 secs Computing kpt #: 416 total cpu time spent up to now is 635.5 secs Computing kpt #: 417 total cpu time spent up to now is 636.7 secs Computing kpt #: 418 total cpu time spent up to now is 637.7 secs Computing kpt #: 419 total cpu time spent up to now is 638.8 secs Computing kpt #: 420 total cpu time spent up to now is 640.1 secs Computing kpt #: 421 total cpu time spent up to now is 641.2 secs Computing kpt #: 422 total cpu time spent up to now is 642.4 secs Computing kpt #: 423 total cpu time spent up to now is 643.7 secs Computing kpt #: 424 total cpu time spent up to now is 645.0 secs Computing kpt #: 425 total cpu time spent up to now is 646.3 secs Computing kpt #: 426 total cpu time spent up to now is 647.6 secs Computing kpt #: 427 total cpu time spent up to now is 648.9 secs Computing kpt #: 428 total cpu time spent up to now is 650.2 secs Computing kpt #: 429 total cpu time spent up to now is 651.5 secs Computing kpt #: 430 total cpu time spent up to now is 652.8 secs Computing kpt #: 431 total cpu time spent up to now is 654.1 secs Computing kpt #: 432 total cpu time spent up to now is 655.4 secs Computing kpt #: 433 total cpu time spent up to now is 656.7 secs Computing kpt #: 434 total cpu time spent up to now is 658.0 secs Computing kpt #: 435 total cpu time spent up to now is 659.3 secs Computing kpt #: 436 total cpu time spent up to now is 660.6 secs Computing kpt #: 437 total cpu time spent up to now is 662.1 secs Computing kpt #: 438 total cpu time spent up to now is 663.4 secs Computing kpt #: 439 total cpu time spent up to now is 664.8 secs Computing kpt #: 440 total cpu time spent up to now is 666.1 secs Computing kpt #: 441 total cpu time spent up to now is 668.0 secs Computing kpt #: 442 total cpu time spent up to now is 669.4 secs Computing kpt #: 443 total cpu time spent up to now is 670.7 secs Computing kpt #: 444 total cpu time spent up to now is 672.0 secs Computing kpt #: 445 total cpu time spent up to now is 673.4 secs Computing kpt #: 446 total cpu time spent up to now is 674.8 secs Computing kpt #: 447 total cpu time spent up to now is 676.2 secs Computing kpt #: 448 total cpu time spent up to now is 677.6 secs Computing kpt #: 449 total cpu time spent up to now is 679.0 secs Computing kpt #: 450 total cpu time spent up to now is 680.4 secs Computing kpt #: 451 total cpu time spent up to now is 682.1 secs Computing kpt #: 452 total cpu time spent up to now is 683.5 secs Computing kpt #: 453 total cpu time spent up to now is 684.9 secs Computing kpt #: 454 total cpu time spent up to now is 686.3 secs Computing kpt #: 455 total cpu time spent up to now is 687.9 secs Computing kpt #: 456 total cpu time spent up to now is 689.8 secs Computing kpt #: 457 total cpu time spent up to now is 691.4 secs Computing kpt #: 458 total cpu time spent up to now is 693.2 secs Computing kpt #: 459 total cpu time spent up to now is 694.8 secs Computing kpt #: 460 total cpu time spent up to now is 696.4 secs Computing kpt #: 461 total cpu time spent up to now is 698.6 secs Computing kpt #: 462 total cpu time spent up to now is 700.3 secs Computing kpt #: 463 total cpu time spent up to now is 701.9 secs Computing kpt #: 464 total cpu time spent up to now is 703.6 secs Computing kpt #: 465 total cpu time spent up to now is 705.8 secs Computing kpt #: 466 total cpu time spent up to now is 707.4 secs Computing kpt #: 467 total cpu time spent up to now is 709.4 secs Computing kpt #: 468 total cpu time spent up to now is 711.5 secs Computing kpt #: 469 total cpu time spent up to now is 713.6 secs Computing kpt #: 470 total cpu time spent up to now is 715.9 secs Computing kpt #: 471 total cpu time spent up to now is 718.2 secs Computing kpt #: 472 total cpu time spent up to now is 720.3 secs Computing kpt #: 473 total cpu time spent up to now is 722.6 secs Computing kpt #: 474 total cpu time spent up to now is 724.7 secs Computing kpt #: 475 total cpu time spent up to now is 727.0 secs Computing kpt #: 476 total cpu time spent up to now is 729.3 secs Computing kpt #: 477 total cpu time spent up to now is 731.9 secs Computing kpt #: 478 total cpu time spent up to now is 734.5 secs ethr = 2.50E-11, avg # of iterations = 31.6 total cpu time spent up to now is 734.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2741 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5637 -22.5637 -22.1706 -22.1706 -16.8834 -16.8834 -7.1443 -7.1443 -6.5373 -6.5373 -4.7023 -4.7023 -2.3610 -2.3610 -0.6260 -0.6260 0.3768 0.3768 7.6621 7.6621 7.8109 7.8109 7.8455 7.8455 8.0699 8.0699 8.7003 8.7003 8.8513 8.8513 8.9130 8.9130 8.9651 8.9651 10.4454 10.4454 10.5173 10.5173 10.5885 10.5885 10.7741 10.7741 12.0869 12.0869 k = 0.0089 0.0089-0.0000 ( 2745 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5638 -22.5636 -22.1708 -22.1705 -16.8833 -16.8833 -7.1439 -7.1438 -6.5372 -6.5370 -4.7034 -4.7024 -2.3619 -2.3592 -0.6265 -0.6247 0.3769 0.3771 7.6547 7.6616 7.8058 7.8080 7.8392 7.8467 8.0604 8.0676 8.6985 8.7124 8.8407 8.8519 8.9165 8.9259 8.9600 8.9725 10.4269 10.4441 10.4856 10.5384 10.5842 10.6212 10.7735 10.7740 12.0881 12.0903 k = 0.0178 0.0179-0.0000 ( 2745 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5641 -22.5637 -22.1710 -22.1706 -16.8830 -16.8830 -7.1424 -7.1423 -6.5369 -6.5364 -4.7056 -4.7036 -2.3619 -2.3566 -0.6264 -0.6226 0.3776 0.3779 7.6398 7.6526 7.7921 7.7988 7.8269 7.8440 8.0402 8.0531 8.7085 8.7332 8.8225 8.8415 8.9364 8.9531 8.9580 8.9798 10.3960 10.4092 10.4786 10.5282 10.6214 10.6608 10.7722 10.7733 12.0939 12.0984 k = 0.0267 0.0268-0.0000 ( 2737 PWs) bands (ev): -46.3922 -46.3922 -24.8166 -24.8166 -22.5643 -22.5638 -22.1713 -22.1707 -16.8825 -16.8825 -7.1399 -7.1397 -6.5362 -6.5354 -4.7089 -4.7059 -2.3610 -2.3531 -0.6255 -0.6199 0.3789 0.3793 7.6175 7.6347 7.7708 7.7854 7.8086 7.8376 8.0105 8.0269 8.7308 8.7621 8.7987 8.8220 8.9578 8.9706 8.9852 8.9922 10.3564 10.3621 10.4794 10.5180 10.6649 10.7028 10.7702 10.7724 12.1044 12.1110 k = 0.0356 0.0357-0.0000 ( 2729 PWs) bands (ev): -46.3922 -46.3922 -24.8165 -24.8165 -22.5647 -22.5640 -22.1718 -22.1709 -16.8818 -16.8818 -7.1365 -7.1362 -6.5352 -6.5342 -4.7133 -4.7093 -2.3594 -2.3488 -0.6239 -0.6164 0.3806 0.3811 7.5883 7.6077 7.7436 7.7683 7.7857 7.8276 7.9729 7.9906 8.7642 8.7707 8.7959 8.7989 8.9574 8.9878 9.0162 9.0403 10.3115 10.3124 10.4802 10.5108 10.7073 10.7450 10.7678 10.7722 12.1196 12.1283 k = 0.0445 0.0446-0.0000 ( 2729 PWs) bands (ev): -46.3921 -46.3921 -24.8165 -24.8165 -22.5652 -22.5643 -22.1723 -22.1713 -16.8810 -16.8809 -7.1321 -7.1317 -6.5339 -6.5326 -4.7187 -4.7137 -2.3569 -2.3438 -0.6217 -0.6123 0.3828 0.3835 7.5528 7.5726 7.7116 7.7445 7.7623 7.8140 7.9286 7.9464 8.7394 8.7636 8.8086 8.8429 8.9553 8.9871 9.0700 9.0951 10.2618 10.2638 10.4803 10.5053 10.7412 10.7627 10.7790 10.7890 12.1395 12.1501 k = 0.0534 0.0536-0.0000 ( 2725 PWs) bands (ev): -46.3921 -46.3921 -24.8165 -24.8165 -22.5658 -22.5647 -22.1730 -22.1717 -16.8799 -16.8799 -7.1266 -7.1263 -6.5323 -6.5308 -4.7250 -4.7191 -2.3538 -2.3382 -0.6188 -0.6076 0.3855 0.3863 7.5118 7.5310 7.6757 7.7116 7.7411 7.7967 7.8793 7.8962 8.7054 8.7288 8.8596 8.8934 8.9511 8.9832 9.1300 9.1551 10.2108 10.2145 10.4797 10.5007 10.7512 10.7588 10.8079 10.8304 12.1640 12.1763 k = 0.0623 0.0625-0.0000 ( 2727 PWs) bands (ev): -46.3921 -46.3921 -24.8164 -24.8164 -22.5665 -22.5653 -22.1737 -22.1723 -16.8787 -16.8786 -7.1203 -7.1199 -6.5304 -6.5287 -4.7322 -4.7254 -2.3501 -2.3319 -0.6154 -0.6024 0.3887 0.3897 7.4664 7.4845 7.6360 7.6722 7.7194 7.7755 7.8261 7.8419 8.6692 8.6909 8.9167 8.9447 8.9490 8.9767 9.1942 9.2190 10.1597 10.1643 10.4785 10.4965 10.7495 10.7538 10.8468 10.8712 12.1930 12.2069 k = 0.0712 0.0714-0.0000 ( 2723 PWs) bands (ev): -46.3921 -46.3921 -24.8164 -24.8164 -22.5673 -22.5658 -22.1746 -22.1729 -16.8772 -16.8772 -7.1130 -7.1125 -6.5281 -6.5262 -4.7401 -4.7325 -2.3459 -2.3252 -0.6115 -0.5966 0.3923 0.3935 7.4178 7.4344 7.5929 7.6280 7.6952 7.7498 7.7701 7.7855 8.6309 8.6504 8.9364 8.9674 8.9786 9.0095 9.2616 9.2857 10.1088 10.1138 10.4768 10.4924 10.7450 10.7481 10.8865 10.9109 12.2265 12.2418 k = 0.0801 0.0804-0.0000 ( 2723 PWs) bands (ev): -46.3920 -46.3920 -24.8163 -24.8163 -22.5681 -22.5665 -22.1755 -22.1737 -16.8756 -16.8756 -7.1047 -7.1042 -6.5256 -6.5235 -4.7487 -4.7403 -2.3412 -2.3182 -0.6072 -0.5904 0.3964 0.3977 7.3668 7.3820 7.5464 7.5798 7.6674 7.7122 7.7143 7.7329 8.5909 8.6077 8.9272 8.9569 9.0438 9.0730 9.3313 9.3547 10.0582 10.0634 10.4746 10.4882 10.7392 10.7417 10.9256 10.9494 12.2642 12.2808 k = 0.0890 0.0893-0.0000 ( 2719 PWs) bands (ev): -46.3920 -46.3920 -24.8162 -24.8162 -22.5691 -22.5673 -22.1765 -22.1745 -16.8739 -16.8738 -7.0955 -7.0950 -6.5228 -6.5205 -4.7578 -4.7487 -2.3362 -2.3108 -0.6026 -0.5839 0.4009 0.4024 7.3141 7.3280 7.4969 7.5280 7.6347 7.6542 7.6595 7.6941 8.5489 8.5628 8.9177 8.9457 9.1117 9.1393 9.4027 9.4253 10.0081 10.0132 10.4719 10.4839 10.7326 10.7347 10.9636 10.9867 12.3059 12.3235 k = 0.0979 0.0982-0.0000 ( 2718 PWs) bands (ev): -46.3920 -46.3920 -24.8162 -24.8161 -22.5701 -22.5681 -22.1776 -22.1755 -16.8719 -16.8719 -7.0854 -7.0849 -6.5197 -6.5173 -4.7674 -4.7575 -2.3311 -2.3033 -0.5977 -0.5771 0.4058 0.4075 7.2605 7.2731 7.4445 7.4733 7.5881 7.5989 7.6052 7.6561 8.5049 8.5157 8.9087 8.9347 9.1816 9.2077 9.4752 9.4972 9.9587 9.9636 10.4689 10.4794 10.7253 10.7271 11.0005 11.0226 12.3514 12.3699 k = 0.1068 0.1071-0.0000 ( 2714 PWs) bands (ev): -46.3919 -46.3919 -24.8161 -24.8161 -22.5711 -22.5690 -22.1788 -22.1765 -16.8699 -16.8698 -7.0744 -7.0739 -6.5163 -6.5138 -4.7773 -4.7667 -2.3257 -2.2958 -0.5926 -0.5702 0.4111 0.4130 7.2064 7.2178 7.3897 7.4161 7.5290 7.5373 7.5640 7.6145 8.4587 8.4663 8.9010 8.9248 9.2528 9.2776 9.5486 9.5699 9.9103 9.9149 10.4655 10.4748 10.7174 10.7191 11.0360 11.0572 12.4004 12.4196 k = 0.1157 0.1161-0.0000 ( 2722 PWs) bands (ev): -46.3919 -46.3919 -24.8161 -24.8160 -22.5723 -22.5701 -22.1801 -22.1776 -16.8676 -16.8676 -7.0626 -7.0621 -6.5127 -6.5101 -4.7874 -4.7763 -2.3204 -2.2883 -0.5875 -0.5633 0.4168 0.4189 7.1520 7.1625 7.3327 7.3567 7.4683 7.4753 7.5200 7.5689 8.4101 8.4146 8.8954 8.9170 9.3250 9.3485 9.6224 9.6432 9.8632 9.8672 10.4618 10.4700 10.7092 10.7107 11.0703 11.0905 12.4525 12.4722 k = 0.1246 0.1250-0.0000 ( 2726 PWs) bands (ev): -46.3918 -46.3918 -24.8160 -24.8160 -22.5736 -22.5712 -22.1815 -22.1788 -16.8653 -16.8652 -7.0499 -7.0494 -6.5088 -6.5061 -4.7977 -4.7859 -2.3151 -2.2809 -0.5825 -0.5564 0.4228 0.4251 7.0979 7.1074 7.2741 7.2956 7.4075 7.4135 7.4722 7.5192 8.3590 8.3605 8.8925 8.9117 9.3977 9.4201 9.6960 9.7168 9.8180 9.8208 10.4579 10.4651 10.7006 10.7021 11.1033 11.1225 12.5075 12.5275 k = 0.1335 0.1339-0.0000 ( 2726 PWs) bands (ev): -46.3918 -46.3918 -24.8159 -24.8159 -22.5748 -22.5723 -22.1829 -22.1801 -16.8628 -16.8627 -7.0364 -7.0359 -6.5047 -6.5019 -4.8079 -4.7957 -2.3100 -2.2738 -0.5776 -0.5497 0.4291 0.4316 7.0440 7.0527 7.2141 7.2333 7.3469 7.3521 7.4207 7.4656 8.3039 8.3051 8.8926 8.9096 9.4704 9.4919 9.7569 9.7753 9.7870 9.7914 10.4538 10.4601 10.6919 10.6933 11.1350 11.1531 12.5649 12.5851 k = 0.1424 0.1429-0.0000 ( 2718 PWs) bands (ev): -46.3917 -46.3917 -24.8157 -24.8157 -22.5761 -22.5735 -22.1843 -22.1814 -16.8601 -16.8601 -7.0221 -7.0217 -6.5004 -6.4976 -4.8181 -4.8054 -2.3052 -2.2670 -0.5730 -0.5433 0.4356 0.4383 6.9908 6.9987 7.1532 7.1700 7.2867 7.2912 7.3659 7.4086 8.2451 8.2487 8.8960 8.9108 9.5426 9.5636 9.7268 9.7332 9.8489 9.8646 10.4496 10.4551 10.6832 10.6846 11.1654 11.1825 12.6245 12.6448 k = 0.1513 0.1518-0.0000 ( 2718 PWs) bands (ev): -46.3917 -46.3917 -24.8156 -24.8156 -22.5775 -22.5748 -22.1858 -22.1828 -16.8574 -16.8573 -7.0070 -7.0066 -6.4958 -6.4930 -4.8281 -4.8150 -2.3007 -2.2606 -0.5688 -0.5373 0.4424 0.4453 6.9382 6.9454 7.0915 7.1061 7.2272 7.2310 7.3080 7.3485 8.1841 8.1897 8.9027 8.9156 9.6122 9.6343 9.6873 9.6945 9.9224 9.9381 10.4452 10.4500 10.6748 10.6762 11.1946 11.2106 12.6858 12.7061 k = 0.1602 0.1607-0.0000 ( 2722 PWs) bands (ev): -46.3916 -46.3916 -24.8155 -24.8155 -22.5790 -22.5762 -22.1874 -22.1843 -16.8546 -16.8545 -6.9912 -6.9909 -6.4910 -6.4883 -4.8379 -4.8244 -2.2965 -2.2546 -0.5651 -0.5318 0.4493 0.4524 6.8864 6.8929 7.0295 7.0418 7.1683 7.1716 7.2476 7.2857 8.1212 8.1285 8.9128 8.9239 9.6425 9.6474 9.6963 9.7060 9.9961 10.0112 10.4408 10.4450 10.6671 10.6683 11.2224 11.2375 12.7487 12.7688 k = 0.1691 0.1696-0.0000 ( 2720 PWs) bands (ev): -46.3915 -46.3915 -24.8155 -24.8154 -22.5805 -22.5775 -22.1891 -22.1858 -16.8517 -16.8516 -6.9746 -6.9745 -6.4861 -6.4834 -4.8474 -4.8336 -2.2928 -2.2492 -0.5619 -0.5269 0.4564 0.4597 6.8354 6.8413 6.9673 6.9775 7.1103 7.1130 7.1850 7.2206 8.0567 8.0653 8.9261 8.9355 9.6110 9.6117 9.7608 9.7744 10.0694 10.0837 10.4364 10.4400 10.6603 10.6615 11.2491 11.2631 12.8127 12.8327 k = 0.1780 0.1786-0.0000 ( 2714 PWs) bands (ev): -46.3915 -46.3915 -24.8153 -24.8153 -22.5820 -22.5790 -22.1907 -22.1873 -16.8486 -16.8486 -6.9574 -6.9574 -6.4810 -6.4784 -4.8564 -4.8423 -2.2896 -2.2443 -0.5595 -0.5228 0.4636 0.4671 6.7854 6.7906 6.9053 6.9134 7.0532 7.0555 7.1208 7.1539 7.9907 8.0004 8.9425 8.9504 9.5776 9.5782 9.8278 9.8410 10.1422 10.1554 10.4320 10.4351 10.6551 10.6562 11.2745 11.2875 12.8777 12.8973 k = 0.1869 0.1875-0.0000 ( 2718 PWs) bands (ev): -46.3914 -46.3914 -24.8152 -24.8152 -22.5836 -22.5805 -22.1925 -22.1890 -16.8456 -16.8455 -6.9396 -6.9395 -6.4757 -6.4733 -4.8650 -4.8507 -2.2869 -2.2401 -0.5578 -0.5195 0.4708 0.4745 6.7363 6.7409 6.8435 6.8496 6.9971 6.9989 7.0553 7.0858 7.9238 7.9342 8.9616 8.9681 9.5465 9.5475 9.8927 9.9049 10.2142 10.2260 10.4276 10.4302 10.6521 10.6530 11.2987 11.3107 12.9432 12.9626 k = 0.1958 0.1964-0.0000 ( 2722 PWs) bands (ev): -46.3914 -46.3914 -24.8151 -24.8151 -22.5852 -22.5820 -22.1942 -22.1907 -16.8424 -16.8423 -6.9213 -6.9210 -6.4702 -6.4680 -4.8732 -4.8587 -2.2847 -2.2365 -0.5570 -0.5171 0.4780 0.4820 6.6881 6.6919 6.7823 6.7865 6.9421 6.9434 6.9892 7.0170 7.8561 7.8671 8.9834 8.9886 9.5182 9.5198 9.9541 9.9650 10.2853 10.2953 10.4233 10.4256 10.6524 10.6529 11.3216 11.3328 13.0092 13.0281 k = 0.2047 0.2054-0.0000 ( 2714 PWs) bands (ev): -46.3913 -46.3913 -24.8149 -24.8149 -22.5868 -22.5835 -22.1960 -22.1923 -16.8392 -16.8391 -6.9024 -6.9019 -6.4647 -6.4627 -4.8808 -4.8661 -2.2832 -2.2336 -0.5570 -0.5157 0.4853 0.4894 6.6405 6.6435 6.7219 6.7244 6.8881 6.8890 6.9228 6.9479 7.7880 7.7993 9.0077 9.0115 9.4930 9.4954 10.0109 10.0203 10.3552 10.3627 10.4192 10.4215 10.6570 10.6572 11.3434 11.3536 13.0753 13.0937 k = 0.2136 0.2143-0.0000 ( 2718 PWs) bands (ev): -46.3912 -46.3912 -24.8148 -24.8148 -22.5884 -22.5851 -22.1978 -22.1941 -16.8360 -16.8359 -6.8830 -6.8823 -6.4590 -6.4573 -4.8878 -4.8731 -2.2822 -2.2313 -0.5581 -0.5154 0.4925 0.4968 6.5933 6.5951 6.6625 6.6637 6.8351 6.8357 6.8567 6.8790 7.7198 7.7312 9.0341 9.0366 9.4711 9.4745 10.0617 10.0695 10.4131 10.4137 10.4253 10.4325 10.6664 10.6679 11.3640 11.3733 13.1413 13.1592 k = 0.2225 0.2232-0.0000 ( 2714 PWs) bands (ev): -46.3912 -46.3912 -24.8147 -24.8147 -22.5901 -22.5867 -22.1996 -22.1958 -16.8327 -16.8326 -6.8630 -6.8621 -6.4532 -6.4518 -4.8943 -4.8796 -2.2818 -2.2298 -0.5601 -0.5161 0.4996 0.5040 6.5457 6.5457 6.6051 6.6055 6.7822 6.7832 6.7924 6.8112 7.6519 7.6632 9.0624 9.0636 9.4528 9.4572 10.1052 10.1113 10.4109 10.4114 10.4913 10.4935 10.6826 10.6861 11.3834 11.3918 13.2070 13.2244 k = 0.2314 0.2321-0.0000 ( 2714 PWs) bands (ev): -46.3911 -46.3911 -24.8146 -24.8146 -22.5917 -22.5883 -22.2014 -22.1976 -16.8295 -16.8294 -6.8427 -6.8415 -6.4474 -6.4463 -4.9003 -4.8855 -2.2821 -2.2290 -0.5632 -0.5179 0.5066 0.5112 6.4939 6.4963 6.5507 6.5513 6.7234 6.7299 6.7362 6.7463 7.5844 7.5956 9.0923 9.0925 9.4381 9.4438 10.1401 10.1447 10.4073 10.4076 10.5539 10.5566 10.7066 10.7132 11.4016 11.4091 13.2722 13.2890 k = 0.2403 0.2411-0.0000 ( 2720 PWs) bands (ev): -46.3910 -46.3910 -24.8145 -24.8144 -22.5934 -22.5900 -22.2032 -22.1994 -16.8262 -16.8261 -6.8219 -6.8204 -6.4415 -6.4408 -4.9056 -4.8908 -2.2829 -2.2290 -0.5673 -0.5209 0.5134 0.5182 6.4386 6.4439 6.5007 6.5020 6.6607 6.6711 6.6865 6.6898 7.5177 7.5287 9.1224 9.1242 9.4273 9.4345 10.1660 10.1692 10.4039 10.4039 10.6119 10.6199 10.7388 10.7493 11.4186 11.4253 13.3368 13.3530 k = 0.2492 0.2500-0.0000 ( 2712 PWs) bands (ev): -46.3910 -46.3910 -24.8143 -24.8143 -22.5950 -22.5916 -22.2050 -22.2012 -16.8229 -16.8228 -6.8008 -6.7990 -6.4355 -6.4352 -4.9104 -4.8957 -2.2843 -2.2296 -0.5724 -0.5250 0.5201 0.5250 6.3802 6.3879 6.4554 6.4573 6.5990 6.6086 6.6388 6.6402 7.4521 7.4627 9.1537 9.1573 9.4204 9.4293 10.1832 10.1852 10.4003 10.4006 10.6681 10.6813 10.7788 10.7934 11.4344 11.4404 13.4005 13.4162 k = 0.2581 0.2589-0.0000 ( 2708 PWs) bands (ev): -46.3909 -46.3909 -24.8141 -24.8141 -22.5967 -22.5933 -22.2068 -22.2030 -16.8196 -16.8195 -6.7793 -6.7772 -6.4297 -6.4295 -4.9147 -4.9000 -2.2863 -2.2310 -0.5785 -0.5303 0.5267 0.5316 6.3197 6.3293 6.4139 6.4160 6.5389 6.5468 6.5927 6.5933 7.3878 7.3980 9.1859 9.1916 9.4175 9.4283 10.1924 10.1937 10.3969 10.3974 10.7237 10.7410 10.8251 10.8431 11.4491 11.4543 13.4633 13.4783 k = 0.2670 0.2679-0.0000 ( 2704 PWs) bands (ev): -46.3908 -46.3908 -24.8140 -24.8140 -22.5983 -22.5949 -22.2086 -22.2048 -16.8164 -16.8163 -6.7576 -6.7551 -6.4242 -6.4235 -4.9184 -4.9039 -2.2889 -2.2331 -0.5856 -0.5366 0.5330 0.5381 6.2581 6.2691 6.3751 6.3772 6.4807 6.4870 6.5481 6.5482 7.3250 7.3347 9.2188 9.2270 9.4186 9.4319 10.1952 10.1959 10.3935 10.3943 10.7793 10.7995 10.8759 10.8963 11.4627 11.4671 13.5249 13.5392 k = 0.2759 0.2768-0.0000 ( 2704 PWs) bands (ev): -46.3907 -46.3907 -24.8139 -24.8139 -22.5999 -22.5965 -22.2104 -22.2066 -16.8132 -16.8131 -6.7357 -6.7327 -6.4188 -6.4174 -4.9216 -4.9073 -2.2920 -2.2358 -0.5935 -0.5440 0.5392 0.5443 6.1961 6.2079 6.3384 6.3406 6.4246 6.4296 6.5047 6.5049 7.2639 7.2731 9.2521 9.2632 9.4237 9.4398 10.1929 10.1932 10.3902 10.3913 10.8354 10.8574 10.9292 10.9510 11.4750 11.4788 13.5852 13.5989 k = 0.2848 0.2857-0.0000 ( 2710 PWs) bands (ev): -46.3907 -46.3907 -24.8138 -24.8137 -22.6016 -22.5982 -22.2122 -22.2084 -16.8100 -16.8099 -6.7136 -6.7102 -6.4134 -6.4114 -4.9244 -4.9102 -2.2956 -2.2393 -0.6023 -0.5524 0.5452 0.5504 6.1339 6.1462 6.3033 6.3056 6.3707 6.3747 6.4628 6.4633 7.2047 7.2134 9.2857 9.3002 9.4328 9.4523 10.1867 10.1867 10.3868 10.3882 10.8918 10.9148 10.9835 11.0062 11.4862 11.4893 13.6440 13.6571 k = 0.2937 0.2946-0.0000 ( 2710 PWs) bands (ev): -46.3906 -46.3906 -24.8136 -24.8136 -22.6031 -22.5998 -22.2139 -22.2102 -16.8069 -16.8068 -6.6915 -6.6875 -6.4080 -6.4054 -4.9267 -4.9128 -2.2996 -2.2433 -0.6118 -0.5616 0.5510 0.5562 6.0721 6.0844 6.2695 6.2719 6.3192 6.3226 6.4224 6.4232 7.1476 7.1557 9.3193 9.3378 9.4458 9.4692 10.1774 10.1776 10.3834 10.3850 10.9482 10.9719 11.0377 11.0610 11.4963 11.4987 13.7014 13.7138 k = 0.3026 0.3036-0.0000 ( 2706 PWs) bands (ev): -46.3905 -46.3905 -24.8135 -24.8135 -22.6047 -22.6014 -22.2156 -22.2119 -16.8038 -16.8037 -6.6693 -6.6648 -6.4028 -6.3995 -4.9287 -4.9151 -2.3041 -2.2480 -0.6220 -0.5718 0.5566 0.5618 6.0108 6.0230 6.2359 6.2389 6.2705 6.2741 6.3836 6.3846 7.0927 7.1003 9.3530 9.3758 9.4626 9.4904 10.1661 10.1663 10.3798 10.3817 11.0043 11.0283 11.0913 11.1148 11.5052 11.5070 13.7570 13.7688 k = 0.3115 0.3125-0.0000 ( 2702 PWs) bands (ev): -46.3905 -46.3905 -24.8134 -24.8133 -22.6062 -22.6030 -22.2172 -22.2136 -16.8008 -16.8007 -6.6472 -6.6420 -6.3976 -6.3936 -4.9303 -4.9170 -2.3089 -2.2532 -0.6326 -0.5826 0.5620 0.5672 5.9504 5.9622 6.2005 6.2040 6.2271 6.2310 6.3464 6.3476 7.0401 7.0471 9.3867 9.4142 9.4830 9.5153 10.1533 10.1535 10.3760 10.3782 11.0595 11.0838 11.1437 11.1675 11.5130 11.5142 13.8109 13.8220 k = 0.3204 0.3214-0.0000 ( 2692 PWs) bands (ev): -46.3904 -46.3904 -24.8132 -24.8131 -22.6076 -22.6045 -22.2188 -22.2153 -16.7979 -16.7978 -6.6252 -6.6193 -6.3926 -6.3877 -4.9317 -4.9187 -2.3141 -2.2590 -0.6437 -0.5940 0.5673 0.5724 5.8911 5.9023 6.1611 6.1640 6.1922 6.1954 6.3108 6.3122 6.9899 6.9964 9.4208 9.4530 9.5067 9.5437 10.1394 10.1397 10.3720 10.3744 11.1137 11.1383 11.1946 11.2187 11.5196 11.5203 13.8628 13.8734 k = 0.3294 0.3304-0.0000 ( 2696 PWs) bands (ev): -46.3904 -46.3903 -24.8131 -24.8130 -22.6090 -22.6060 -22.2203 -22.2170 -16.7951 -16.7950 -6.6035 -6.5968 -6.3877 -6.3819 -4.9328 -4.9202 -2.3195 -2.2652 -0.6551 -0.6060 0.5723 0.5773 5.8333 5.8438 6.1192 6.1213 6.1633 6.1657 6.2768 6.2784 6.9422 6.9481 9.4553 9.4920 9.5334 9.5748 10.1248 10.1251 10.3677 10.3704 11.1666 11.1914 11.2437 11.2681 11.5251 11.5253 13.9128 13.9227 k = 0.3383 0.3393-0.0000 ( 2696 PWs) bands (ev): -46.3903 -46.3903 -24.8130 -24.8129 -22.6104 -22.6075 -22.2218 -22.2186 -16.7924 -16.7923 -6.5820 -6.5745 -6.3830 -6.3761 -4.9337 -4.9215 -2.3252 -2.2719 -0.6667 -0.6183 0.5771 0.5820 5.7770 5.7867 6.0773 6.0789 6.1372 6.1394 6.2445 6.2462 6.8970 6.9024 9.4904 9.5313 9.5627 9.6080 10.1098 10.1102 10.3630 10.3660 11.2178 11.2429 11.2910 11.3157 11.5293 11.5296 13.9606 13.9699 k = 0.3472 0.3482-0.0000 ( 2700 PWs) bands (ev): -46.3902 -46.3902 -24.8129 -24.8128 -22.6117 -22.6089 -22.2233 -22.2202 -16.7898 -16.7897 -6.5610 -6.5525 -6.3783 -6.3704 -4.9345 -4.9227 -2.3310 -2.2790 -0.6783 -0.6310 0.5817 0.5865 5.7225 5.7315 6.0365 6.0378 6.1131 6.1152 6.2138 6.2157 6.8544 6.8593 9.5264 9.5709 9.5941 9.6429 10.0947 10.0950 10.3580 10.3612 11.2672 11.2927 11.3361 11.3614 11.5323 11.5330 14.0063 14.0150 k = 0.3561 0.3571-0.0000 ( 2708 PWs) bands (ev): -46.3902 -46.3902 -24.8128 -24.8128 -22.6130 -22.6103 -22.2247 -22.2217 -16.7873 -16.7872 -6.5405 -6.5310 -6.3738 -6.3648 -4.9351 -4.9239 -2.3369 -2.2864 -0.6898 -0.6437 0.5862 0.5908 5.6701 5.6783 5.9971 5.9982 6.0907 6.0928 6.1848 6.1868 6.8143 6.8188 9.5631 9.6110 9.6270 9.6789 10.0796 10.0799 10.3524 10.3559 11.3145 11.3405 11.3788 11.4050 11.5346 11.5354 14.0497 14.0578 k = 0.3650 0.3661-0.0000 ( 2704 PWs) bands (ev): -46.3901 -46.3901 -24.8127 -24.8126 -22.6142 -22.6116 -22.2260 -22.2231 -16.7849 -16.7848 -6.5207 -6.5100 -6.3695 -6.3592 -4.9357 -4.9250 -2.3428 -2.2940 -0.7011 -0.6565 0.5904 0.5949 5.6199 5.6273 5.9595 5.9603 6.0699 6.0720 6.1574 6.1596 6.7768 6.7808 9.6005 9.6515 9.6611 9.7157 10.0647 10.0650 10.3464 10.3502 11.3595 11.3863 11.4189 11.4463 11.5362 11.5370 14.0907 14.0982 k = 0.3739 0.3750-0.0000 ( 2706 PWs) bands (ev): -46.3901 -46.3901 -24.8126 -24.8126 -22.6154 -22.6129 -22.2273 -22.2245 -16.7826 -16.7825 -6.5016 -6.4897 -6.3653 -6.3537 -4.9362 -4.9260 -2.3486 -2.3018 -0.7120 -0.6692 0.5944 0.5987 5.5720 5.5787 5.9236 5.9242 6.0505 6.0527 6.1318 6.1341 6.7419 6.7455 9.6383 9.6914 9.6965 9.7530 10.0501 10.0504 10.3397 10.3439 11.4017 11.4297 11.4556 11.4855 11.5380 11.5380 14.1293 14.1362 k = 0.3828 0.3839-0.0000 ( 2702 PWs) bands (ev): -46.3900 -46.3900 -24.8125 -24.8125 -22.6164 -22.6141 -22.2284 -22.2258 -16.7805 -16.7804 -6.4834 -6.4703 -6.3611 -6.3482 -4.9367 -4.9271 -2.3543 -2.3096 -0.7226 -0.6816 0.5982 0.6023 5.5267 5.5326 5.8896 5.8901 6.0326 6.0348 6.1078 6.1103 6.7095 6.7127 9.6762 9.7279 9.7358 9.7903 10.0361 10.0363 10.3325 10.3369 11.4407 11.4708 11.4871 11.5222 11.5389 11.5418 14.1655 14.1718 k = 0.3917 0.3929-0.0000 ( 2704 PWs) bands (ev): -46.3900 -46.3900 -24.8124 -24.8124 -22.6174 -22.6152 -22.2295 -22.2271 -16.7785 -16.7784 -6.4662 -6.4517 -6.3570 -6.3427 -4.9372 -4.9282 -2.3599 -2.3176 -0.7326 -0.6938 0.6018 0.6057 5.4841 5.4893 5.8576 5.8579 6.0161 6.0184 6.0856 6.0882 6.6796 6.6825 9.7140 9.7622 9.7769 9.8275 10.0228 10.0229 10.3245 10.3293 11.4749 11.5059 11.5112 11.5412 11.5532 11.5565 14.1991 14.2049 k = 0.4006 0.4018-0.0000 ( 2700 PWs) bands (ev): -46.3899 -46.3899 -24.8123 -24.8123 -22.6183 -22.6163 -22.2305 -22.2282 -16.7766 -16.7765 -6.4502 -6.4344 -6.3529 -6.3372 -4.9377 -4.9294 -2.3651 -2.3254 -0.7420 -0.7055 0.6052 0.6088 5.4443 5.4489 5.8277 5.8279 6.0009 6.0034 6.0651 6.0678 6.6523 6.6548 9.7513 9.7956 9.8181 9.8641 10.0102 10.0102 10.3159 10.3210 11.4997 11.5138 11.5460 11.5495 11.5750 11.5883 14.2301 14.2354 k = 0.4095 0.4107-0.0000 ( 2700 PWs) bands (ev): -46.3899 -46.3899 -24.8122 -24.8122 -22.6191 -22.6173 -22.2314 -22.2293 -16.7749 -16.7748 -6.4355 -6.4185 -6.3487 -6.3317 -4.9382 -4.9305 -2.3700 -2.3331 -0.7506 -0.7167 0.6083 0.6116 5.4075 5.4115 5.7999 5.8000 5.9871 5.9896 6.0464 6.0491 6.6274 6.6296 9.7878 9.8280 9.8586 9.8997 9.9984 9.9987 10.3065 10.3119 11.5101 11.5139 11.5688 11.5793 11.6004 11.6175 14.2586 14.2633 k = 0.4184 0.4196-0.0000 ( 2694 PWs) bands (ev): -46.3899 -46.3899 -24.8121 -24.8121 -22.6199 -22.6182 -22.2322 -22.2303 -16.7733 -16.7733 -6.4222 -6.4043 -6.3442 -6.3262 -4.9387 -4.9317 -2.3745 -2.3406 -0.7585 -0.7273 0.6112 0.6142 5.3737 5.3772 5.7745 5.7745 5.9747 5.9773 6.0294 6.0321 6.6049 6.6069 9.8231 9.8592 9.8977 9.9333 9.9878 9.9889 10.2963 10.3020 11.5113 11.5115 11.5939 11.6098 11.6251 11.6441 14.2844 14.2886 k = 0.4273 0.4286-0.0000 ( 2696 PWs) bands (ev): -46.3898 -46.3898 -24.8121 -24.8121 -22.6205 -22.6190 -22.2329 -22.2312 -16.7719 -16.7718 -6.4103 -6.3921 -6.3392 -6.3208 -4.9392 -4.9329 -2.3785 -2.3478 -0.7655 -0.7372 0.6138 0.6166 5.3432 5.3461 5.7514 5.7514 5.9637 5.9662 6.0142 6.0169 6.5849 6.5866 9.8570 9.8891 9.9340 9.9598 9.9795 9.9858 10.2853 10.2913 11.5079 11.5091 11.6192 11.6374 11.6481 11.6679 14.3075 14.3112 k = 0.4362 0.4375-0.0000 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8121 -24.8120 -22.6212 -22.6198 -22.2336 -22.2321 -16.7706 -16.7706 -6.4000 -6.3821 -6.3336 -6.3155 -4.9397 -4.9341 -2.3819 -2.3546 -0.7716 -0.7464 0.6162 0.6186 5.3159 5.3184 5.7307 5.7308 5.9539 5.9563 6.0008 6.0034 6.5672 6.5687 9.8891 9.9174 9.9575 9.9623 9.9830 10.0056 10.2735 10.2798 11.5037 11.5055 11.6427 11.6616 11.6691 11.6890 14.3280 14.3313 k = 0.4451 0.4464-0.0000 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8120 -24.8120 -22.6217 -22.6205 -22.2342 -22.2329 -16.7695 -16.7695 -6.3911 -6.3745 -6.3273 -6.3106 -4.9401 -4.9352 -2.3848 -2.3610 -0.7767 -0.7548 0.6183 0.6204 5.2920 5.2941 5.7125 5.7126 5.9455 5.9478 5.9892 5.9916 6.5519 6.5531 9.9192 9.9434 9.9560 9.9562 10.0105 10.0329 10.2610 10.2675 11.4994 11.5014 11.6638 11.6820 11.6884 11.7073 14.3458 14.3486 k = 0.4540 0.4554-0.0000 ( 2696 PWs) bands (ev): -46.3898 -46.3898 -24.8119 -24.8119 -22.6221 -22.6211 -22.2346 -22.2335 -16.7686 -16.7685 -6.3836 -6.3691 -6.3208 -6.3061 -4.9404 -4.9364 -2.3870 -2.3668 -0.7808 -0.7622 0.6201 0.6219 5.2716 5.2732 5.6970 5.6971 5.9383 5.9404 5.9794 5.9816 6.5390 6.5400 9.9464 9.9494 9.9505 9.9683 10.0403 10.0588 10.2480 10.2545 11.4952 11.4972 11.6822 11.6982 11.7062 11.7227 14.3610 14.3633 k = 0.4629 0.4643-0.0000 ( 2692 PWs) bands (ev): -46.3897 -46.3897 -24.8119 -24.8119 -22.6224 -22.6216 -22.2349 -22.2340 -16.7678 -16.7678 -6.3774 -6.3655 -6.3144 -6.3023 -4.9407 -4.9374 -2.3885 -2.3721 -0.7839 -0.7688 0.6217 0.6231 5.2547 5.2560 5.6841 5.6842 5.9325 5.9343 5.9714 5.9733 6.5283 6.5291 9.9442 9.9442 9.9721 9.9894 10.0677 10.0820 10.2345 10.2409 11.4914 11.4932 11.6977 11.7109 11.7217 11.7351 14.3735 14.3754 k = 0.4718 0.4732-0.0000 ( 2696 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6226 -22.6220 -22.2352 -22.2345 -16.7672 -16.7672 -6.3724 -6.3633 -6.3086 -6.2994 -4.9408 -4.9383 -2.3893 -2.3767 -0.7860 -0.7744 0.6229 0.6240 5.2413 5.2423 5.6739 5.6740 5.9280 5.9295 5.9652 5.9667 6.5200 6.5206 9.9398 9.9398 9.9937 10.0071 10.0920 10.1022 10.2209 10.2270 11.4882 11.4896 11.7103 11.7204 11.7344 11.7446 14.3834 14.3848 k = 0.4807 0.4821-0.0000 ( 2696 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6224 -22.2354 -22.2349 -16.7667 -16.7667 -6.3685 -6.3623 -6.3038 -6.2975 -4.9408 -4.9391 -2.3893 -2.3807 -0.7870 -0.7790 0.6239 0.6247 5.2317 5.2323 5.6665 5.6666 5.9248 5.9259 5.9607 5.9618 6.5140 6.5144 9.9365 9.9365 10.0111 10.0205 10.1129 10.1191 10.2081 10.2132 11.4858 11.4868 11.7199 11.7268 11.7441 11.7512 14.3906 14.3916 k = 0.4896 0.4911-0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6227 -22.2355 -22.2352 -16.7664 -16.7664 -6.3656 -6.3622 -6.3002 -6.2968 -4.9407 -4.9398 -2.3886 -2.3839 -0.7869 -0.7826 0.6246 0.6250 5.2256 5.2260 5.6619 5.6619 5.9229 5.9235 5.9581 5.9587 6.5103 6.5105 9.9345 9.9345 10.0234 10.0286 10.1290 10.1319 10.1975 10.2008 11.4843 11.4849 11.7265 11.7302 11.7509 11.7546 14.3952 14.3958 k = 0.4985 0.5000-0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3636 -6.3631 -6.2978 -6.2973 -4.9404 -4.9403 -2.3871 -2.3864 -0.7858 -0.7852 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9223 5.9224 5.9571 5.9572 6.5088 6.5088 9.9336 9.9336 10.0299 10.0307 10.1375 10.1378 10.1928 10.1934 11.4838 11.4839 11.7301 11.7307 11.7545 11.7551 14.3972 14.3973 k = 0.4985 0.5000-0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3636 -6.3631 -6.2978 -6.2973 -4.9404 -4.9403 -2.3871 -2.3864 -0.7858 -0.7852 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9223 5.9224 5.9571 5.9572 6.5088 6.5088 9.9336 9.9336 10.0299 10.0307 10.1375 10.1378 10.1928 10.1934 11.4838 11.4839 11.7301 11.7307 11.7545 11.7551 14.3972 14.3973 k = 0.4860 0.5000-0.0000 ( 2699 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6227 -22.2354 -22.2353 -16.7664 -16.7664 -6.3652 -6.3627 -6.2996 -6.2970 -4.9406 -4.9399 -2.3881 -2.3846 -0.7865 -0.7833 0.6246 0.6250 5.2254 5.2257 5.6618 5.6618 5.9230 5.9234 5.9580 5.9584 6.5100 6.5102 9.9344 9.9344 10.0246 10.0285 10.1298 10.1319 10.1975 10.2001 11.4843 11.4847 11.7271 11.7298 11.7517 11.7545 14.3955 14.3959 k = 0.4736 0.5000-0.0000 ( 2699 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6225 -22.2354 -22.2350 -16.7667 -16.7667 -6.3678 -6.3634 -6.3024 -6.2979 -4.9406 -4.9393 -2.3883 -2.3820 -0.7861 -0.7803 0.6240 0.6246 5.2311 5.2316 5.6665 5.6666 5.9246 5.9253 5.9608 5.9616 6.5133 6.5136 9.9363 9.9363 10.0136 10.0204 10.1148 10.1192 10.2078 10.2117 11.4856 11.4864 11.7199 11.7241 11.7477 11.7521 14.3913 14.3920 k = 0.4611 0.5000-0.0000 ( 2701 PWs) bands (ev): -46.3897 -46.3897 -24.8119 -24.8119 -22.6226 -22.6222 -22.2352 -22.2347 -16.7671 -16.7671 -6.3715 -6.3650 -6.3064 -6.2998 -4.9404 -4.9386 -2.3877 -2.3787 -0.7847 -0.7764 0.6232 0.6240 5.2400 5.2406 5.6745 5.6747 5.9261 5.9270 5.9669 5.9679 6.5186 6.5190 9.9394 9.9394 9.9973 10.0067 10.0963 10.1031 10.2196 10.2243 11.4878 11.4889 11.7069 11.7114 11.7450 11.7496 14.3847 14.3857 k = 0.4486 0.5000-0.0000 ( 2706 PWs) bands (ev): -46.3898 -46.3898 -24.8119 -24.8119 -22.6224 -22.6218 -22.2349 -22.2343 -16.7677 -16.7677 -6.3763 -6.3678 -6.3114 -6.3027 -4.9401 -4.9378 -2.3864 -2.3748 -0.7822 -0.7715 0.6220 0.6230 5.2517 5.2525 5.6861 5.6863 5.9265 5.9275 5.9771 5.9782 6.5259 6.5264 9.9436 9.9436 9.9763 9.9880 10.0758 10.0849 10.2312 10.2364 11.4908 11.4921 11.6876 11.6913 11.7437 11.7477 14.3758 14.3770 k = 0.4362 0.5000-0.0000 ( 2702 PWs) bands (ev): -46.3898 -46.3898 -24.8119 -24.8119 -22.6220 -22.6213 -22.2345 -22.2338 -16.7685 -16.7685 -6.3820 -6.3716 -6.3173 -6.3067 -4.9396 -4.9367 -2.3844 -2.3701 -0.7788 -0.7656 0.6206 0.6218 5.2656 5.2665 5.7018 5.7021 5.9255 5.9264 5.9919 5.9929 6.5352 6.5359 9.9472 9.9484 9.9530 9.9652 10.0536 10.0647 10.2419 10.2473 11.4945 11.4960 11.6620 11.6650 11.7431 11.7464 14.3645 14.3661 k = 0.4237 0.5000-0.0000 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8120 -24.8120 -22.6216 -22.6208 -22.2341 -22.2331 -16.7694 -16.7693 -6.3888 -6.3764 -6.3242 -6.3116 -4.9389 -4.9356 -2.3816 -2.3648 -0.7742 -0.7587 0.6189 0.6204 5.2809 5.2819 5.7221 5.7225 5.9232 5.9240 6.0109 6.0119 6.5465 6.5474 9.9224 9.9365 9.9556 9.9561 10.0298 10.0424 10.2511 10.2567 11.4987 11.5002 11.6306 11.6328 11.7428 11.7456 14.3511 14.3530 k = 0.4112 0.5000-0.0000 ( 2706 PWs) bands (ev): -46.3898 -46.3898 -24.8121 -24.8121 -22.6211 -22.6202 -22.2335 -22.2325 -16.7704 -16.7704 -6.3966 -6.3824 -6.3318 -6.3174 -4.9381 -4.9343 -2.3781 -2.3589 -0.7687 -0.7508 0.6170 0.6187 5.2968 5.2979 5.7476 5.7483 5.9199 5.9206 6.0339 6.0348 6.5598 6.5609 9.8913 9.9066 9.9618 9.9622 10.0049 10.0183 10.2589 10.2644 11.5030 11.5041 11.5942 11.5955 11.7426 11.7450 14.3356 14.3378 k = 0.3988 0.5000-0.0000 ( 2702 PWs) bands (ev): -46.3898 -46.3898 -24.8121 -24.8121 -22.6205 -22.6195 -22.2328 -22.2317 -16.7716 -16.7716 -6.4054 -6.3895 -6.3400 -6.3240 -4.9372 -4.9330 -2.3739 -2.3524 -0.7621 -0.7421 0.6148 0.6168 5.3126 5.3137 5.7790 5.7799 5.9157 5.9164 6.0607 6.0615 6.5752 6.5764 9.8576 9.8736 9.9617 9.9667 9.9851 9.9951 10.2650 10.2704 11.5053 11.5058 11.5546 11.5555 11.7425 11.7445 14.3183 14.3207 k = 0.3863 0.5000-0.0000 ( 2704 PWs) bands (ev): -46.3899 -46.3899 -24.8122 -24.8122 -22.6199 -22.6187 -22.2321 -22.2308 -16.7729 -16.7729 -6.4151 -6.3979 -6.3488 -6.3313 -4.9361 -4.9315 -2.3689 -2.3453 -0.7544 -0.7324 0.6125 0.6148 5.3277 5.3287 5.8165 5.8178 5.9109 5.9115 6.0911 6.0919 6.5925 6.5939 9.8218 9.8383 9.9389 9.9531 9.9868 9.9885 10.2695 10.2747 11.4872 11.4912 11.5262 11.5310 11.7424 11.7442 14.2992 14.3020 k = 0.3739 0.5000-0.0000 ( 2699 PWs) bands (ev): -46.3899 -46.3899 -24.8122 -24.8122 -22.6191 -22.6179 -22.2312 -22.2298 -16.7744 -16.7743 -6.4259 -6.4075 -6.3578 -6.3392 -4.9350 -4.9300 -2.3632 -2.3376 -0.7458 -0.7218 0.6101 0.6125 5.3414 5.3424 5.8605 5.8621 5.9054 5.9061 6.1251 6.1259 6.6118 6.6135 9.7842 9.8009 9.9075 9.9238 9.9960 9.9963 10.2722 10.2772 11.4403 11.4435 11.5260 11.5302 11.7423 11.7439 14.2786 14.2816 k = 0.3614 0.5000-0.0000 ( 2698 PWs) bands (ev): -46.3899 -46.3899 -24.8123 -24.8123 -22.6183 -22.6170 -22.2303 -22.2288 -16.7759 -16.7759 -6.4375 -6.4183 -6.3671 -6.3476 -4.9337 -4.9284 -2.3569 -2.3294 -0.7362 -0.7103 0.6075 0.6101 5.3535 5.3544 5.8994 5.8995 5.9109 5.9135 6.1625 6.1633 6.6331 6.6351 9.7449 9.7618 9.8731 9.8903 10.0069 10.0069 10.2732 10.2780 11.3835 11.3861 11.5306 11.5345 11.7423 11.7436 14.2567 14.2599 k = 0.3489 0.5000-0.0000 ( 2699 PWs) bands (ev): -46.3900 -46.3900 -24.8124 -24.8124 -22.6175 -22.6161 -22.2294 -22.2278 -16.7776 -16.7776 -6.4500 -6.4304 -6.3765 -6.3565 -4.9324 -4.9268 -2.3499 -2.3207 -0.7256 -0.6981 0.6048 0.6076 5.3640 5.3648 5.8930 5.8934 5.9674 5.9700 6.2033 6.2041 6.6565 6.6587 9.7042 9.7211 9.8366 9.8543 10.0188 10.0189 10.2724 10.2771 11.3211 11.3233 11.5359 11.5396 11.7422 11.7434 14.2336 14.2371 k = 0.3365 0.5000-0.0000 ( 2704 PWs) bands (ev): -46.3900 -46.3900 -24.8125 -24.8125 -22.6167 -22.6152 -22.2283 -22.2267 -16.7794 -16.7793 -6.4633 -6.4436 -6.3859 -6.3658 -4.9310 -4.9252 -2.3423 -2.3116 -0.7140 -0.6850 0.6020 0.6050 5.3728 5.3735 5.8862 5.8866 6.0294 6.0325 6.2474 6.2483 6.6820 6.6846 9.6623 9.6792 9.7982 9.8163 10.0314 10.0316 10.2700 10.2744 11.2539 11.2559 11.5413 11.5448 11.7421 11.7432 14.2096 14.2133 k = 0.3240 0.5000-0.0000 ( 2705 PWs) bands (ev): -46.3901 -46.3901 -24.8126 -24.8126 -22.6157 -22.6142 -22.2272 -22.2255 -16.7812 -16.7812 -6.4774 -6.4579 -6.3953 -6.3753 -4.9296 -4.9235 -2.3341 -2.3021 -0.7017 -0.6713 0.5992 0.6024 5.3802 5.3807 5.8791 5.8794 6.0964 6.1001 6.2948 6.2957 6.7097 6.7126 9.6193 9.6360 9.7583 9.7766 10.0447 10.0449 10.2660 10.2701 11.1824 11.1841 11.5464 11.5498 11.7421 11.7430 14.1848 14.1888 k = 0.3115 0.5000-0.0000 ( 2711 PWs) bands (ev): -46.3901 -46.3901 -24.8127 -24.8127 -22.6148 -22.6132 -22.2261 -22.2243 -16.7831 -16.7831 -6.4921 -6.4730 -6.4046 -6.3851 -4.9281 -4.9219 -2.3253 -2.2922 -0.6884 -0.6569 0.5963 0.5997 5.3862 5.3866 5.8717 5.8720 6.1676 6.1720 6.3454 6.3464 6.7398 6.7431 9.5755 9.5920 9.7170 9.7354 10.0585 10.0588 10.2604 10.2643 11.1068 11.1085 11.5510 11.5543 11.7420 11.7428 14.1596 14.1637 k = 0.2991 0.5000-0.0000 ( 2711 PWs) bands (ev): -46.3902 -46.3902 -24.8128 -24.8128 -22.6138 -22.6122 -22.2249 -22.2230 -16.7851 -16.7851 -6.5074 -6.4890 -6.4140 -6.3950 -4.9266 -4.9203 -2.3160 -2.2821 -0.6744 -0.6419 0.5935 0.5970 5.3910 5.3914 5.8641 5.8643 6.2422 6.2473 6.3990 6.4003 6.7725 6.7763 9.5309 9.5471 9.6746 9.6930 10.0727 10.0730 10.2533 10.2569 11.0276 11.0291 11.5552 11.5583 11.7419 11.7426 14.1340 14.1383 k = 0.2866 0.5000-0.0000 ( 2717 PWs) bands (ev): -46.3902 -46.3902 -24.8129 -24.8129 -22.6129 -22.6112 -22.2236 -22.2217 -16.7871 -16.7871 -6.5232 -6.5055 -6.4233 -6.4050 -4.9251 -4.9187 -2.3063 -2.2717 -0.6598 -0.6264 0.5906 0.5943 5.3950 5.3952 5.8563 5.8565 6.3190 6.3250 6.4558 6.4573 6.8081 6.8124 9.4857 9.5016 9.6312 9.6495 10.0872 10.0876 10.2447 10.2481 10.9448 10.9463 11.5587 11.5617 11.7419 11.7425 14.1084 14.1129 k = 0.2742 0.5000-0.0000 ( 2711 PWs) bands (ev): -46.3902 -46.3902 -24.8130 -24.8129 -22.6118 -22.6101 -22.2223 -22.2204 -16.7892 -16.7892 -6.5393 -6.5224 -6.4325 -6.4150 -4.9236 -4.9171 -2.2962 -2.2611 -0.6445 -0.6105 0.5879 0.5917 5.3981 5.3982 5.8484 5.8486 6.3971 6.4041 6.5154 6.5173 6.8472 6.8521 9.4402 9.4556 9.5872 9.6051 10.1019 10.1022 10.2349 10.2380 10.8589 10.8603 11.5614 11.5643 11.7418 11.7423 14.0828 14.0875 k = 0.2617 0.5000-0.0000 ( 2714 PWs) bands (ev): -46.3903 -46.3903 -24.8130 -24.8130 -22.6108 -22.6090 -22.2210 -22.2190 -16.7913 -16.7912 -6.5558 -6.5397 -6.4416 -6.4250 -4.9221 -4.9156 -2.2857 -2.2503 -0.6287 -0.5943 0.5852 0.5891 5.4005 5.4006 5.8405 5.8407 6.4750 6.4831 6.5779 6.5802 6.8905 6.8960 9.3944 9.4093 9.5426 9.5602 10.1165 10.1169 10.2239 10.2266 10.7701 10.7715 11.5634 11.5661 11.7417 11.7422 14.0576 14.0623 k = 0.2492 0.5000-0.0000 ( 2716 PWs) bands (ev): -46.3903 -46.3903 -24.8131 -24.8131 -22.6097 -22.6080 -22.2196 -22.2177 -16.7934 -16.7934 -6.5724 -6.5572 -6.4506 -6.4349 -4.9206 -4.9142 -2.2749 -2.2396 -0.6124 -0.5779 0.5826 0.5866 5.4024 5.4024 5.8325 5.8327 6.5514 6.5606 6.6429 6.6458 6.9389 6.9450 9.3485 9.3629 9.4977 9.5149 10.1310 10.1314 10.2119 10.2142 10.6787 10.6802 11.5644 11.5671 11.7417 11.7421 14.0328 14.0377 k = 0.2368 0.5000-0.0000 ( 2714 PWs) bands (ev): -46.3904 -46.3904 -24.8132 -24.8132 -22.6087 -22.6070 -22.2182 -22.2163 -16.7955 -16.7955 -6.5890 -6.5748 -6.4594 -6.4446 -4.9191 -4.9128 -2.2640 -2.2288 -0.5959 -0.5613 0.5801 0.5842 5.4037 5.4038 5.8246 5.8248 6.6249 6.6350 6.7104 6.7138 6.9935 7.0001 9.3027 9.3165 9.4527 9.4694 10.1450 10.1451 10.1993 10.2010 10.5851 10.5867 11.5645 11.5670 11.7416 11.7420 14.0086 14.0136 k = 0.2243 0.5000-0.0000 ( 2716 PWs) bands (ev): -46.3904 -46.3904 -24.8133 -24.8133 -22.6077 -22.6060 -22.2168 -22.2149 -16.7976 -16.7975 -6.6056 -6.5923 -6.4680 -6.4541 -4.9177 -4.9115 -2.2528 -2.2181 -0.5791 -0.5447 0.5777 0.5818 5.4047 5.4048 5.8168 5.8170 6.6942 6.7049 6.7801 6.7838 7.0553 7.0621 9.2572 9.2704 9.4078 9.4239 10.1565 10.1577 10.1874 10.1876 10.4898 10.4917 11.5637 11.5661 11.7415 11.7419 13.9853 13.9903 k = 0.2119 0.5000-0.0000 ( 2716 PWs) bands (ev): -46.3905 -46.3905 -24.8134 -24.8134 -22.6067 -22.6050 -22.2154 -22.2136 -16.7997 -16.7996 -6.6220 -6.6096 -6.4765 -6.4634 -4.9164 -4.9103 -2.2416 -2.2075 -0.5622 -0.5283 0.5755 0.5796 5.4053 5.4055 5.8092 5.8093 6.7583 6.7690 6.8520 6.8557 7.1244 7.1312 9.2121 9.2246 9.3632 9.3786 10.1584 10.1639 10.1779 10.1834 10.3936 10.3962 11.5618 11.5641 11.7414 11.7417 13.9629 13.9679 k = 0.1994 0.5000-0.0000 ( 2718 PWs) bands (ev): -46.3905 -46.3905 -24.8135 -24.8135 -22.6057 -22.6040 -22.2141 -22.2122 -16.8017 -16.8016 -6.6381 -6.6266 -6.4846 -6.4724 -4.9150 -4.9092 -2.2304 -2.1971 -0.5453 -0.5120 0.5734 0.5775 5.4057 5.4059 5.8017 5.8018 6.8170 6.8270 6.9263 6.9297 7.2003 7.2069 9.1676 9.1794 9.3191 9.3337 10.1464 10.1525 10.1794 10.1880 10.2999 10.3047 11.5590 11.5611 11.7414 11.7417 13.9415 13.9466 k = 0.1869 0.5000-0.0000 ( 2720 PWs) bands (ev): -46.3906 -46.3906 -24.8136 -24.8136 -22.6047 -22.6031 -22.2127 -22.2109 -16.8036 -16.8036 -6.6539 -6.6432 -6.4924 -6.4811 -4.9138 -4.9081 -2.2193 -2.1870 -0.5285 -0.4961 0.5715 0.5756 5.4059 5.4061 5.7944 5.7945 6.8702 6.8792 7.0031 7.0060 7.2818 7.2880 9.1239 9.1349 9.2756 9.2894 10.1263 10.1343 10.1563 10.1703 10.2345 10.2426 11.5551 11.5571 11.7413 11.7416 13.9213 13.9263 k = 0.1745 0.5000-0.0000 ( 2718 PWs) bands (ev): -46.3906 -46.3906 -24.8137 -24.8137 -22.6038 -22.6022 -22.2114 -22.2097 -16.8055 -16.8055 -6.6691 -6.6592 -6.4999 -6.4895 -4.9126 -4.9072 -2.2084 -2.1773 -0.5120 -0.4807 0.5698 0.5738 5.4060 5.4062 5.7875 5.7876 6.9187 6.9267 7.0821 7.0845 7.3672 7.3729 9.0811 9.0914 9.2329 9.2458 10.0674 10.0684 10.1245 10.1277 10.2311 10.2351 11.5503 11.5522 11.7413 11.7415 13.9023 13.9073 k = 0.1620 0.5000-0.0000 ( 2720 PWs) bands (ev): -46.3907 -46.3907 -24.8138 -24.8138 -22.6029 -22.6014 -22.2101 -22.2085 -16.8074 -16.8073 -6.6838 -6.6747 -6.5070 -6.4974 -4.9114 -4.9063 -2.1977 -2.1680 -0.4958 -0.4658 0.5682 0.5721 5.4059 5.4061 5.7808 5.7809 6.9632 6.9702 7.1631 7.1651 7.4548 7.4600 9.0395 9.0489 9.1912 9.2032 9.9712 9.9716 10.1075 10.1077 10.2405 10.2427 11.5446 11.5463 11.7412 11.7414 13.8846 13.8895 k = 0.1495 0.5000-0.0000 ( 2718 PWs) bands (ev): -46.3907 -46.3907 -24.8138 -24.8138 -22.6020 -22.6006 -22.2089 -22.2073 -16.8091 -16.8091 -6.6977 -6.6894 -6.5137 -6.5049 -4.9103 -4.9055 -2.1873 -2.1591 -0.4801 -0.4516 0.5668 0.5705 5.4057 5.4059 5.7745 5.7745 7.0044 7.0105 7.2459 7.2475 7.5432 7.5480 8.9991 9.0078 9.1506 9.1616 9.8696 9.8701 10.0910 10.0914 10.2514 10.2528 11.5381 11.5397 11.7412 11.7414 13.8683 13.8731 k = 0.1371 0.5000-0.0000 ( 2720 PWs) bands (ev): -46.3907 -46.3907 -24.8139 -24.8139 -22.6012 -22.5999 -22.2077 -22.2062 -16.8108 -16.8107 -6.7109 -6.7034 -6.5200 -6.5120 -4.9093 -4.9048 -2.1773 -2.1509 -0.4651 -0.4382 0.5655 0.5691 5.4054 5.4057 5.7685 5.7686 7.0426 7.0480 7.3301 7.3315 7.6311 7.6355 8.9603 8.9681 9.1112 9.1213 9.7666 9.7671 10.0753 10.0758 10.2623 10.2633 11.5309 11.5323 11.7411 11.7413 13.8534 13.8580 k = 0.1246 0.5000-0.0000 ( 2722 PWs) bands (ev): -46.3908 -46.3908 -24.8140 -24.8140 -22.6005 -22.5992 -22.2066 -22.2052 -16.8123 -16.8123 -6.7232 -6.7164 -6.5258 -6.5186 -4.9083 -4.9042 -2.1677 -2.1432 -0.4508 -0.4257 0.5644 0.5678 5.4051 5.4054 5.7630 5.7630 7.0782 7.0829 7.4156 7.4168 7.7174 7.7215 8.9231 8.9302 9.0732 9.0824 9.6634 9.6639 10.0603 10.0609 10.2726 10.2734 11.5231 11.5244 11.7411 11.7413 13.8400 13.8443 k = 0.1122 0.5000-0.0000 ( 2723 PWs) bands (ev): -46.3908 -46.3908 -24.8140 -24.8140 -22.5998 -22.5986 -22.2055 -22.2043 -16.8137 -16.8137 -6.7345 -6.7285 -6.5311 -6.5246 -4.9074 -4.9036 -2.1587 -2.1362 -0.4373 -0.4141 0.5635 0.5666 5.4048 5.4051 5.7579 5.7579 7.1113 7.1153 7.5020 7.5029 7.8011 7.8048 8.8878 8.8942 9.0368 9.0450 9.5606 9.5610 10.0462 10.0468 10.2823 10.2829 11.5149 11.5162 11.7411 11.7412 13.8279 13.8320 k = 0.0997 0.5000-0.0000 ( 2721 PWs) bands (ev): -46.3908 -46.3908 -24.8141 -24.8141 -22.5991 -22.5981 -22.2045 -22.2034 -16.8150 -16.8150 -6.7448 -6.7395 -6.5359 -6.5301 -4.9066 -4.9032 -2.1503 -2.1300 -0.4247 -0.4037 0.5627 0.5656 5.4045 5.4047 5.7532 5.7533 7.1416 7.1451 7.5886 7.5894 7.8813 7.8847 8.8546 8.8602 9.0022 9.0094 9.4588 9.4592 10.0332 10.0337 10.2912 10.2917 11.5066 11.5077 11.7411 11.7412 13.8173 13.8211 k = 0.0872 0.5000-0.0000 ( 2724 PWs) bands (ev): -46.3909 -46.3909 -24.8141 -24.8141 -22.5985 -22.5976 -22.2037 -22.2027 -16.8162 -16.8162 -6.7541 -6.7494 -6.5401 -6.5351 -4.9059 -4.9028 -2.1425 -2.1245 -0.4132 -0.3945 0.5620 0.5646 5.4042 5.4044 5.7491 5.7491 7.1693 7.1722 7.6750 7.6757 7.9571 7.9602 8.8236 8.8285 8.9695 8.9758 9.3588 9.3593 10.0212 10.0217 10.2992 10.2996 11.4984 11.4994 11.7411 11.7412 13.8081 13.8115 k = 0.0748 0.5000-0.0000 ( 2730 PWs) bands (ev): -46.3909 -46.3909 -24.8142 -24.8142 -22.5981 -22.5973 -22.2029 -22.2021 -16.8172 -16.8172 -6.7621 -6.7582 -6.5437 -6.5395 -4.9052 -4.9026 -2.1355 -2.1199 -0.4028 -0.3866 0.5615 0.5638 5.4039 5.4041 5.7455 5.7455 7.1939 7.1964 7.7602 7.7607 8.0274 8.0302 8.7951 8.7992 8.9392 8.9445 9.2616 9.2622 10.0106 10.0110 10.3063 10.3066 11.4905 11.4914 11.7411 11.7412 13.8002 13.8033 k = 0.0623 0.5000-0.0000 ( 2730 PWs) bands (ev): -46.3909 -46.3909 -24.8143 -24.8142 -22.5976 -22.5969 -22.2022 -22.2015 -16.8181 -16.8181 -6.7690 -6.7657 -6.5468 -6.5433 -4.9045 -4.9024 -2.1293 -2.1161 -0.3936 -0.3799 0.5612 0.5631 5.4036 5.4038 5.7424 5.7424 7.2154 7.2174 7.8427 7.8432 8.0914 8.0939 8.7692 8.7727 8.9116 8.9161 9.1687 9.1693 10.0014 10.0017 10.3123 10.3126 11.4833 11.4840 11.7411 11.7411 13.7937 13.7963 k = 0.0498 0.5000-0.0000 ( 2732 PWs) bands (ev): -46.3909 -46.3909 -24.8143 -24.8143 -22.5972 -22.5967 -22.2017 -22.2011 -16.8188 -16.8188 -6.7746 -6.7720 -6.5493 -6.5464 -4.9040 -4.9022 -2.1238 -2.1132 -0.3858 -0.3747 0.5609 0.5624 5.4034 5.4035 5.7398 5.7398 7.2335 7.2351 7.9206 7.9210 8.1478 8.1499 8.7463 8.7491 8.8875 8.8911 9.0822 9.0828 9.9937 9.9939 10.3173 10.3175 11.4769 11.4774 11.7411 11.7411 13.7885 13.7906 k = 0.0374 0.5000-0.0000 ( 2738 PWs) bands (ev): -46.3909 -46.3909 -24.8144 -24.8144 -22.5969 -22.5965 -22.2012 -22.2008 -16.8194 -16.8194 -6.7790 -6.7770 -6.5511 -6.5490 -4.9035 -4.9022 -2.1193 -2.1113 -0.3793 -0.3709 0.5607 0.5619 5.4032 5.4033 5.7378 5.7378 7.2479 7.2491 7.9908 7.9910 8.1951 8.1968 8.7269 8.7289 8.8675 8.8702 9.0053 9.0059 9.9876 9.9878 10.3213 10.3214 11.4716 11.4720 11.7411 11.7411 13.7846 13.7862 k = 0.0249 0.5000-0.0000 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8144 -24.8144 -22.5967 -22.5964 -22.2008 -22.2005 -16.8198 -16.8198 -6.7820 -6.7807 -6.5524 -6.5510 -4.9031 -4.9022 -2.1156 -2.1102 -0.3742 -0.3686 0.5607 0.5615 5.4030 5.4031 5.7364 5.7364 7.2584 7.2592 8.0484 8.0485 8.2314 8.2327 8.7117 8.7131 8.8523 8.8542 8.9428 8.9434 9.9832 9.9833 10.3241 10.3242 11.4677 11.4680 11.7411 11.7411 13.7819 13.7830 k = 0.0125 0.5000-0.0000 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8144 -24.8144 -22.5965 -22.5963 -22.2006 -22.2004 -16.8200 -16.8200 -6.7837 -6.7831 -6.5530 -6.5523 -4.9028 -4.9023 -2.1128 -2.1101 -0.3705 -0.3677 0.5607 0.5611 5.4030 5.4030 5.7355 5.7355 7.2648 7.2652 8.0872 8.0873 8.2548 8.2554 8.7020 8.7027 8.8426 8.8437 8.9012 8.9017 9.9806 9.9806 10.3258 10.3258 11.4653 11.4654 11.7411 11.7411 13.7804 13.7809 k = 0.0000 0.5000-0.0000 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8144 -24.8144 -22.5964 -22.5964 -22.2005 -22.2005 -16.8201 -16.8201 -6.7841 -6.7841 -6.5529 -6.5529 -4.9025 -4.9025 -2.1110 -2.1110 -0.3684 -0.3684 0.5609 0.5609 5.4030 5.4030 5.7352 5.7352 7.2671 7.2671 8.1011 8.1011 8.2631 8.2631 8.6989 8.6989 8.8395 8.8395 8.8868 8.8868 9.9797 9.9797 10.3264 10.3264 11.4645 11.4645 11.7411 11.7411 13.7801 13.7801 k = 0.0000 0.5000-0.0000 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8144 -24.8144 -22.5964 -22.5964 -22.2005 -22.2005 -16.8201 -16.8201 -6.7841 -6.7841 -6.5529 -6.5529 -4.9025 -4.9025 -2.1110 -2.1110 -0.3684 -0.3684 0.5609 0.5609 5.4030 5.4030 5.7352 5.7352 7.2671 7.2671 8.1011 8.1011 8.2631 8.2631 8.6989 8.6989 8.8395 8.8395 8.8868 8.8868 9.9797 9.9797 10.3264 10.3264 11.4645 11.4645 11.7411 11.7411 13.7801 13.7801 k = 0.0000 0.5000 0.0124 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8155 -24.8152 -22.5965 -22.5962 -22.2004 -22.2004 -16.8172 -16.8170 -6.7841 -6.7840 -6.5526 -6.5525 -4.9030 -4.9029 -2.1179 -2.1079 -0.3711 -0.3689 0.5479 0.5605 5.4025 5.4033 5.7383 5.7399 7.2676 7.2678 8.0879 8.1030 8.2497 8.2795 8.6978 8.7008 8.8296 8.8467 8.8907 8.8977 9.9786 9.9788 10.3274 10.3276 11.4704 11.4741 11.7405 11.7424 13.7802 13.7802 k = 0.0000 0.5000 0.0248 ( 2736 PWs) bands (ev): -46.3910 -46.3910 -24.8184 -24.8178 -22.5966 -22.5960 -22.2003 -22.2003 -16.8085 -16.8080 -6.7842 -6.7840 -6.5515 -6.5513 -4.9045 -4.9043 -2.1285 -2.1085 -0.3771 -0.3727 0.5216 0.5469 5.4020 5.4034 5.7491 5.7522 7.2693 7.2696 8.0669 8.0919 8.2412 8.2944 8.6976 8.7030 8.8228 8.8505 8.9100 8.9180 9.9753 9.9757 10.3306 10.3309 11.4914 11.4989 11.7406 11.7447 13.7805 13.7806 k = 0.0000 0.5000 0.0372 ( 2738 PWs) bands (ev): -46.3910 -46.3910 -24.8233 -24.8223 -22.5967 -22.5958 -22.2002 -22.2001 -16.7938 -16.7931 -6.7843 -6.7840 -6.5497 -6.5493 -4.9069 -4.9065 -2.1428 -2.1128 -0.3863 -0.3797 0.4824 0.5201 5.4014 5.4034 5.7675 5.7720 7.2721 7.2725 8.0413 8.0704 8.2349 8.3034 8.6982 8.7046 8.8234 8.8582 8.9388 8.9453 9.9700 9.9705 10.3359 10.3363 11.5265 11.5379 11.7416 11.7488 13.7811 13.7812 k = 0.0000 0.5000 0.0496 ( 2734 PWs) bands (ev): -46.3911 -46.3911 -24.8298 -24.8286 -22.5967 -22.5956 -22.1999 -22.1998 -16.7734 -16.7724 -6.7844 -6.7840 -6.5471 -6.5465 -4.9101 -4.9097 -2.1609 -2.1209 -0.3986 -0.3899 0.4309 0.4808 5.4009 5.4034 5.7934 5.7989 7.2761 7.2766 8.0128 8.0424 8.2269 8.3036 8.6982 8.7045 8.8346 8.8741 8.9742 8.9790 9.9626 9.9633 10.3433 10.3438 11.5735 11.5892 11.7446 11.7567 13.7819 13.7821 k = 0.0000 0.5000 0.0621 ( 2734 PWs) bands (ev): -46.3912 -46.3911 -24.8382 -24.8367 -22.5967 -22.5953 -22.1996 -22.1995 -16.7473 -16.7461 -6.7846 -6.7841 -6.5437 -6.5430 -4.9143 -4.9137 -2.1827 -2.1328 -0.4138 -0.4031 0.3677 0.4296 5.4006 5.4034 5.8264 5.8327 7.2812 7.2818 7.9827 8.0111 8.2144 8.2941 8.6959 8.7017 8.8587 8.8999 9.0151 9.0187 9.9532 9.9540 10.3526 10.3532 11.6265 11.6479 11.7531 11.7738 13.7829 13.7832 k = 0.0000 0.5000 0.0745 ( 2724 PWs) bands (ev): -46.3912 -46.3912 -24.8481 -24.8463 -22.5967 -22.5950 -22.1992 -22.1991 -16.7156 -16.7141 -6.7848 -6.7842 -6.5396 -6.5388 -4.9195 -4.9187 -2.2083 -2.1484 -0.4319 -0.4191 0.2938 0.3674 5.4005 5.4036 5.8662 5.8731 7.2873 7.2881 7.9517 7.9778 8.1968 8.2757 8.6906 8.6957 8.8954 8.9355 9.0614 9.0642 9.9417 9.9427 10.3637 10.3643 11.6719 11.6974 11.7826 11.8129 13.7841 13.7845 k = 0.0000 0.5000 0.0869 ( 2724 PWs) bands (ev): -46.3913 -46.3913 -24.8597 -24.8576 -22.5966 -22.5947 -22.1988 -22.1986 -16.6785 -16.6768 -6.7850 -6.7843 -6.5347 -6.5338 -4.9255 -4.9246 -2.2377 -2.1678 -0.4527 -0.4379 0.2102 0.2950 5.4007 5.4039 5.9126 5.9196 7.2946 7.2955 7.9200 7.9433 8.1747 8.2501 8.6825 8.6871 8.9426 8.9798 9.1129 9.1153 9.9283 9.9294 10.3765 10.3771 11.6979 11.7184 11.8523 11.8837 13.7856 13.7860 k = 0.0000 0.5000 0.0993 ( 2722 PWs) bands (ev): -46.3914 -46.3914 -24.8727 -24.8705 -22.5965 -22.5943 -22.1983 -22.1981 -16.6361 -16.6342 -6.7854 -6.7846 -6.5292 -6.5281 -4.9324 -4.9314 -2.2708 -2.1911 -0.4760 -0.4593 0.1181 0.2136 5.4012 5.4044 5.9650 5.9721 7.3028 7.3039 7.8876 7.9079 8.1491 8.2195 8.6720 8.6763 8.9979 9.0311 9.1698 9.1720 9.9130 9.9142 10.3907 10.3913 11.7110 11.7261 11.9466 11.9779 13.7873 13.7877 k = 0.0000 0.5000 0.1117 ( 2724 PWs) bands (ev): -46.3916 -46.3915 -24.8872 -24.8847 -22.5963 -22.5940 -22.1978 -22.1976 -16.5888 -16.5867 -6.7857 -6.7848 -6.5228 -6.5216 -4.9403 -4.9391 -2.3078 -2.2183 -0.5018 -0.4830 0.0187 0.1244 5.4019 5.4052 6.0232 6.0300 7.3121 7.3134 7.8546 7.8713 8.1214 8.1859 8.6598 8.6637 9.0588 9.0875 9.2322 9.2344 9.8959 9.8972 10.4062 10.4068 11.7190 11.7309 12.0543 12.0864 13.7891 13.7896 k = 0.0000 0.5000 0.1241 ( 2724 PWs) bands (ev): -46.3917 -46.3916 -24.9030 -24.9003 -22.5961 -22.5936 -22.1972 -22.1969 -16.5367 -16.5343 -6.7862 -6.7852 -6.5158 -6.5144 -4.9490 -4.9477 -2.3487 -2.2495 -0.5300 -0.5090 -0.0865 0.0286 5.4029 5.4061 6.0866 6.0930 7.3223 7.3238 7.8206 7.8336 8.0929 8.1510 8.6461 8.6498 9.1232 9.1476 9.3001 9.3025 9.8770 9.8785 10.4227 10.4234 11.7254 11.7352 12.1714 12.2049 13.7912 13.7917 k = 0.0000 0.5000 0.1365 ( 2730 PWs) bands (ev): -46.3918 -46.3918 -24.9198 -24.9170 -22.5959 -22.5933 -22.1966 -22.1963 -16.4800 -16.4775 -6.7868 -6.7857 -6.5081 -6.5066 -4.9586 -4.9571 -2.3934 -2.2849 -0.5606 -0.5372 -0.1958 -0.0723 5.4041 5.4072 6.1549 6.1608 7.3333 7.3350 7.7854 7.7944 8.0650 8.1165 8.6312 8.6348 9.1895 9.2098 9.3737 9.3765 9.8564 9.8581 10.4402 10.4408 11.7316 11.7401 12.2960 12.3307 13.7934 13.7940 k = 0.0000 0.5000 0.1489 ( 2724 PWs) bands (ev): -46.3920 -46.3919 -24.9376 -24.9346 -22.5956 -22.5928 -22.1959 -22.1956 -16.4191 -16.4163 -6.7875 -6.7863 -6.4997 -6.4981 -4.9691 -4.9674 -2.4421 -2.3246 -0.5943 -0.5677 -0.3069 -0.1768 5.4055 5.4086 6.2275 6.2327 7.3451 7.3472 7.7487 7.7537 8.0384 8.0833 8.6155 8.6190 9.2562 9.2729 9.4529 9.4565 9.8343 9.8365 10.4583 10.4589 11.7384 11.7459 12.4263 12.4623 13.7958 13.7965 k = 0.0000 0.5000 0.1613 ( 2724 PWs) bands (ev): -46.3922 -46.3921 -24.9563 -24.9531 -22.5953 -22.5924 -22.1951 -22.1949 -16.3542 -16.3513 -6.7883 -6.7870 -6.4906 -6.4889 -4.9804 -4.9785 -2.4949 -2.3688 -0.6325 -0.6009 -0.4164 -0.2833 5.4071 5.4100 6.3039 6.3085 7.3575 7.3600 7.7106 7.7117 8.0140 8.0525 8.5991 8.6026 9.3224 9.3359 9.5372 9.5420 9.8111 9.8140 10.4769 10.4775 11.7463 11.7531 12.5610 12.5980 13.7983 13.7990 k = 0.0000 0.5000 0.1738 ( 2722 PWs) bands (ev): -46.3923 -46.3922 -24.9757 -24.9725 -22.5949 -22.5919 -22.1944 -22.1941 -16.2857 -16.2826 -6.7893 -6.7879 -6.4809 -6.4790 -4.9926 -4.9904 -2.5518 -2.4177 -0.6799 -0.6381 -0.5175 -0.3896 5.4089 5.4117 6.3836 6.3876 7.3704 7.3733 7.6683 7.6711 7.9920 8.0247 8.5823 8.5857 9.3874 9.3983 9.6247 9.6317 9.7879 9.7927 10.4957 10.4963 11.7556 11.7619 12.6987 12.7365 13.8010 13.8018 k = 0.0000 0.5000 0.1862 ( 2720 PWs) bands (ev): -46.3925 -46.3924 -24.9957 -24.9924 -22.5945 -22.5915 -22.1936 -22.1933 -16.2139 -16.2106 -6.7904 -6.7890 -6.4706 -6.4686 -5.0055 -5.0031 -2.6127 -2.4717 -0.7466 -0.6816 -0.5980 -0.4923 5.4107 5.4134 6.4660 6.4694 7.3834 7.3870 7.6243 7.6305 7.9727 8.0001 8.5652 8.5686 9.4509 9.4596 9.7018 9.7141 9.7753 9.7860 10.5146 10.5152 11.7668 11.7727 12.8380 12.8763 13.8038 13.8046 k = 0.0000 0.5000 0.1986 ( 2718 PWs) bands (ev): -46.3927 -46.3926 -25.0162 -25.0128 -22.5940 -22.5910 -22.1927 -22.1924 -16.1392 -16.1357 -6.7918 -6.7903 -6.4597 -6.4576 -5.0193 -5.0165 -2.6779 -2.5308 -0.8365 -0.7347 -0.6536 -0.5857 5.4127 5.4152 6.5506 6.5535 7.3959 7.4007 7.5802 7.5896 7.9561 7.9790 8.5481 8.5515 9.5125 9.5195 9.7134 9.7201 9.8415 9.8493 10.5334 10.5340 11.7800 11.7857 12.9776 13.0161 13.8067 13.8075 k = 0.0000 0.5000 0.2110 ( 2720 PWs) bands (ev): -46.3929 -46.3928 -25.0370 -25.0336 -22.5935 -22.5905 -22.1919 -22.1916 -16.0619 -16.0582 -6.7933 -6.7918 -6.4483 -6.4460 -5.0338 -5.0307 -2.7471 -2.5954 -0.9379 -0.8032 -0.6957 -0.6613 5.4147 5.4172 6.6367 6.6392 7.4067 7.4132 7.5375 7.5500 7.9423 7.9612 8.5310 8.5344 9.5718 9.5774 9.6913 9.6949 9.9422 9.9499 10.5519 10.5525 11.7957 11.8011 13.1163 13.1546 13.8097 13.8106 k = 0.0000 0.5000 0.2234 ( 2720 PWs) bands (ev): -46.3930 -46.3930 -25.0579 -25.0545 -22.5930 -22.5900 -22.1910 -22.1907 -15.9824 -15.9786 -6.7951 -6.7935 -6.4363 -6.4340 -5.0490 -5.0456 -2.8204 -2.6655 -1.0411 -0.8876 -0.7329 -0.7172 5.4169 5.4191 6.7237 6.7261 7.4122 7.4213 7.5000 7.5153 7.9311 7.9467 8.5141 8.5176 9.6261 9.6297 9.6672 9.6691 10.0496 10.0584 10.5700 10.5705 11.8139 11.8193 13.2526 13.2906 13.8129 13.8137 k = 0.0000 0.5000 0.2358 ( 2714 PWs) bands (ev): -46.3932 -46.3931 -25.0789 -25.0755 -22.5925 -22.5894 -22.1901 -22.1898 -15.9012 -15.8972 -6.7971 -6.7955 -6.4238 -6.4214 -5.0648 -5.0612 -2.8975 -2.7410 -1.1416 -0.9796 -0.7683 -0.7607 5.4190 5.4212 6.8108 6.8134 7.4036 7.4136 7.4798 7.4941 7.9225 7.9354 8.4976 8.5011 9.6268 9.6289 9.6909 9.6945 10.1610 10.1710 10.5875 10.5880 11.8351 11.8404 13.3854 13.4226 13.8162 13.8170 k = 0.0000 0.5000 0.2482 ( 2718 PWs) bands (ev): -46.3934 -46.3933 -25.0999 -25.0965 -22.5919 -22.5889 -22.1892 -22.1889 -15.8186 -15.8145 -6.7994 -6.7977 -6.4110 -6.4085 -5.0813 -5.0773 -2.9781 -2.8220 -1.2374 -1.0725 -0.8030 -0.7976 5.4212 5.4232 6.8972 6.9005 7.3756 7.3853 7.4826 7.4917 7.9166 7.9271 8.4817 8.4852 9.5964 9.5985 9.7427 9.7458 10.2755 10.2865 10.6044 10.6049 11.8594 11.8646 13.5134 13.5494 13.8197 13.8205 k = 0.0000 0.5000 0.2606 ( 2716 PWs) bands (ev): -46.3936 -46.3935 -25.1205 -25.1172 -22.5913 -22.5883 -22.1883 -22.1880 -15.7352 -15.7310 -6.8020 -6.8003 -6.3977 -6.3951 -5.0984 -5.0940 -3.0619 -2.9078 -1.3272 -1.1629 -0.8369 -0.8310 5.4234 5.4253 6.9816 6.9867 7.3381 7.3499 7.4941 7.4997 7.9131 7.9217 8.4664 8.4700 9.5637 9.5657 9.7938 9.7963 10.3922 10.4044 10.6206 10.6211 11.8869 11.8922 13.6351 13.6693 13.8239 13.8249 k = 0.0000 0.5000 0.2731 ( 2716 PWs) bands (ev): -46.3938 -46.3937 -25.1409 -25.1376 -22.5907 -22.5878 -22.1874 -22.1872 -15.6513 -15.6470 -6.8048 -6.8031 -6.3841 -6.3815 -5.1159 -5.1111 -3.1482 -2.9980 -1.4104 -1.2493 -0.8694 -0.8627 5.4256 5.4274 7.0620 7.0712 7.2989 7.3147 7.5079 7.5114 7.9123 7.9192 8.4520 8.4556 9.5300 9.5319 9.8429 9.8448 10.5103 10.5234 10.6365 10.6370 11.9179 11.9233 13.7475 13.7760 13.8304 13.8359 k = 0.0000 0.5000 0.2855 ( 2714 PWs) bands (ev): -46.3940 -46.3939 -25.1608 -25.1576 -22.5901 -22.5873 -22.1866 -22.1863 -15.5676 -15.5632 -6.8080 -6.8063 -6.3703 -6.3676 -5.1339 -5.1287 -3.2365 -3.0917 -1.4868 -1.3309 -0.9005 -0.8931 5.4278 5.4295 7.1319 7.1521 7.2612 7.2875 7.5223 7.5246 7.9139 7.9194 8.4385 8.4422 9.4957 9.4976 9.8896 9.8912 10.6230 10.6341 10.6581 10.6616 11.9525 11.9579 13.8153 13.8208 13.8729 13.9019 k = 0.0000 0.5000 0.2979 ( 2714 PWs) bands (ev): -46.3942 -46.3941 -25.1801 -25.1771 -22.5894 -22.5867 -22.1857 -22.1854 -15.4844 -15.4800 -6.8114 -6.8097 -6.3562 -6.3536 -5.1522 -5.1466 -3.3259 -3.1879 -1.5563 -1.4072 -0.9300 -0.9223 5.4299 5.4315 7.1689 7.2075 7.2469 7.2908 7.5369 7.5383 7.9182 7.9223 8.4260 8.4299 9.4610 9.4628 9.9339 9.9351 10.6592 10.6607 10.7563 10.7696 11.9905 11.9960 13.8247 13.8279 13.9666 13.9962 k = 0.0000 0.5000 0.3103 ( 2720 PWs) bands (ev): -46.3944 -46.3943 -25.1989 -25.1960 -22.5888 -22.5862 -22.1849 -22.1846 -15.4023 -15.3979 -6.8152 -6.8135 -6.3421 -6.3394 -5.1707 -5.1648 -3.4157 -3.2855 -1.6192 -1.4780 -0.9581 -0.9503 5.4321 5.4335 7.1585 7.1802 7.3123 7.3387 7.5513 7.5531 7.9249 7.9278 8.4148 8.4188 9.4261 9.4279 9.9757 9.9767 10.6728 10.6737 10.8762 10.8905 12.0320 12.0377 13.8289 13.8315 14.0573 14.0849 k = 0.0000 0.5000 0.3227 ( 2720 PWs) bands (ev): -46.3945 -46.3944 -25.2168 -25.2140 -22.5882 -22.5857 -22.1841 -22.1838 -15.3218 -15.3174 -6.8192 -6.8176 -6.3279 -6.3252 -5.1894 -5.1831 -3.5048 -3.3832 -1.6758 -1.5434 -0.9847 -0.9770 5.4341 5.4354 7.1311 7.1459 7.3803 7.3997 7.5664 7.5693 7.9341 7.9359 8.4050 8.4090 9.3913 9.3931 10.0150 10.0157 10.6844 10.6851 10.9965 11.0114 12.0769 12.0826 13.8320 13.8345 14.1400 14.1652 k = 0.0000 0.5000 0.3351 ( 2718 PWs) bands (ev): -46.3947 -46.3946 -25.2339 -25.2313 -22.5876 -22.5853 -22.1833 -22.1831 -15.2435 -15.2392 -6.8235 -6.8220 -6.3138 -6.3112 -5.2080 -5.2014 -3.5923 -3.4799 -1.7264 -1.6035 -1.0098 -1.0023 5.4361 5.4373 7.1008 7.1126 7.4406 7.4572 7.5842 7.5887 7.9457 7.9465 8.3966 8.4008 9.3567 9.3585 10.0516 10.0522 10.6948 10.6955 11.1160 11.1310 12.1248 12.1307 13.8346 13.8371 14.2140 14.2368 k = 0.0000 0.5000 0.3475 ( 2714 PWs) bands (ev): -46.3948 -46.3948 -25.2500 -25.2475 -22.5869 -22.5848 -22.1825 -22.1823 -15.1679 -15.1637 -6.8280 -6.8266 -6.2998 -6.2973 -5.2265 -5.2197 -3.6773 -3.5745 -1.7715 -1.6584 -1.0333 -1.0261 5.4380 5.4391 7.0709 7.0810 7.4889 7.5039 7.6086 7.6139 7.9589 7.9597 8.3898 8.3941 9.3226 9.3244 10.0856 10.0860 10.7042 10.7048 11.2335 11.2486 12.1755 12.1815 13.8370 13.8394 14.2795 14.2998 k = 0.0000 0.5000 0.3599 ( 2708 PWs) bands (ev): -46.3950 -46.3949 -25.2650 -25.2627 -22.5863 -22.5843 -22.1818 -22.1816 -15.0956 -15.0916 -6.8327 -6.8314 -6.2862 -6.2837 -5.2447 -5.2377 -3.7589 -3.6657 -1.8113 -1.7082 -1.0551 -1.0483 5.4398 5.4408 7.0425 7.0514 7.5226 7.5350 7.6426 7.6470 7.9736 7.9754 8.3846 8.3890 9.2893 9.2911 10.1169 10.1173 10.7127 10.7133 11.3482 11.3632 12.2285 12.2344 13.8390 13.8415 14.3364 14.3544 k = 0.0000 0.5000 0.3723 ( 2710 PWs) bands (ev): -46.3951 -46.3951 -25.2791 -25.2770 -22.5858 -22.5839 -22.1812 -22.1810 -15.0272 -15.0233 -6.8375 -6.8363 -6.2729 -6.2706 -5.2625 -5.2553 -3.8361 -3.7526 -1.8463 -1.7532 -1.0752 -1.0688 5.4414 5.4424 7.0161 7.0240 7.5440 7.5535 7.6828 7.6854 7.9899 7.9927 8.3812 8.3857 9.2570 9.2588 10.1456 10.1458 10.7203 10.7208 11.4593 11.4739 12.2830 12.2890 13.8408 13.8433 14.3852 14.4009 k = 0.0000 0.5000 0.3848 ( 2718 PWs) bands (ev): -46.3953 -46.3952 -25.2921 -25.2901 -22.5853 -22.5836 -22.1806 -22.1804 -14.9632 -14.9595 -6.8423 -6.8413 -6.2603 -6.2581 -5.2795 -5.2723 -3.9082 -3.8341 -1.8768 -1.7937 -1.0935 -1.0877 5.4430 5.4438 6.9919 6.9989 7.5577 7.5650 7.7231 7.7241 8.0075 8.0112 8.3795 8.3840 9.2260 9.2278 10.1715 10.1717 10.7270 10.7275 11.5655 11.5796 12.3384 12.3442 13.8423 13.8448 14.4264 14.4399 k = 0.0000 0.5000 0.3972 ( 2714 PWs) bands (ev): -46.3954 -46.3953 -25.3037 -25.3020 -22.5848 -22.5833 -22.1800 -22.1799 -14.9041 -14.9007 -6.8471 -6.8462 -6.2483 -6.2463 -5.2956 -5.2886 -3.9742 -3.9094 -1.9031 -1.8298 -1.1100 -1.1047 5.4444 5.4452 6.9700 6.9761 7.5671 7.5727 7.7598 7.7601 8.0257 8.0303 8.3794 8.3840 9.1968 9.1985 10.1948 10.1949 10.7330 10.7334 11.6658 11.6792 12.3936 12.3992 13.8436 13.8460 14.4605 14.4720 k = 0.0000 0.5000 0.4096 ( 2710 PWs) bands (ev): -46.3955 -46.3954 -25.3141 -25.3126 -22.5843 -22.5830 -22.1795 -22.1793 -14.8505 -14.8474 -6.8517 -6.8509 -6.2372 -6.2354 -5.3105 -5.3038 -4.0337 -3.9779 -1.9253 -1.8617 -1.1246 -1.1200 5.4457 5.4464 6.9505 6.9559 7.5739 7.5783 7.7911 7.7923 8.0442 8.0492 8.3809 8.3852 9.1696 9.1713 10.2153 10.2154 10.7382 10.7386 11.7589 11.7714 12.4475 12.4529 13.8446 13.8469 14.4880 14.4977 k = 0.0000 0.5000 0.4220 ( 2710 PWs) bands (ev): -46.3956 -46.3955 -25.3232 -25.3218 -22.5839 -22.5827 -22.1790 -22.1789 -14.8029 -14.8001 -6.8560 -6.8554 -6.2271 -6.2255 -5.3241 -5.3179 -4.0858 -4.0388 -1.9436 -1.8895 -1.1374 -1.1333 5.4469 5.4474 6.9336 6.9381 7.5790 7.5825 7.8175 7.8192 8.0620 8.0672 8.3835 8.3876 9.1449 9.1464 10.2331 10.2332 10.7427 10.7430 11.8437 11.8550 12.4988 12.5037 13.8453 13.8475 14.5098 14.5178 k = 0.0000 0.5000 0.4344 ( 2710 PWs) bands (ev): -46.3956 -46.3956 -25.3309 -25.3298 -22.5835 -22.5825 -22.1786 -22.1785 -14.7617 -14.7593 -6.8600 -6.8594 -6.2181 -6.2168 -5.3359 -5.3304 -4.1303 -4.0916 -1.9582 -1.9135 -1.1481 -1.1447 5.4479 5.4483 6.9192 6.9230 7.5828 7.5856 7.8392 7.8411 8.0787 8.0836 8.3869 8.3906 9.1230 9.1244 10.2482 10.2482 10.7464 10.7467 11.9186 11.9285 12.5460 12.5504 13.8459 13.8478 14.5265 14.5330 k = 0.0000 0.5000 0.4468 ( 2706 PWs) bands (ev): -46.3957 -46.3957 -25.3373 -25.3364 -22.5831 -22.5824 -22.1783 -22.1782 -14.7273 -14.7254 -6.8634 -6.8630 -6.2105 -6.2095 -5.3459 -5.3413 -4.1665 -4.1360 -1.9693 -1.9337 -1.1569 -1.1542 5.4487 5.4491 6.9075 6.9105 7.5857 7.5878 7.8564 7.8583 8.0934 8.0978 8.3907 8.3939 9.1044 9.1056 10.2605 10.2606 10.7495 10.7497 11.9825 11.9907 12.5876 12.5914 13.8463 13.8480 14.5388 14.5439 k = 0.0000 0.5000 0.4592 ( 2706 PWs) bands (ev): -46.3957 -46.3957 -25.3422 -25.3416 -22.5829 -22.5823 -22.1781 -22.1780 -14.7002 -14.6987 -6.8662 -6.8659 -6.2044 -6.2036 -5.3538 -5.3501 -4.1943 -4.1717 -1.9769 -1.9503 -1.1637 -1.1616 5.4493 5.4496 6.8984 6.9006 7.5879 7.5894 7.8695 7.8710 8.1057 8.1092 8.3944 8.3969 9.0895 9.0904 10.2701 10.2701 10.7519 10.7520 12.0340 12.0404 12.6222 12.6251 13.8466 13.8479 14.5476 14.5514 k = 0.0000 0.5000 0.4716 ( 2704 PWs) bands (ev): -46.3958 -46.3958 -25.3457 -25.3453 -22.5826 -22.5822 -22.1779 -22.1778 -14.6805 -14.6795 -6.8682 -6.8680 -6.1999 -6.1994 -5.3594 -5.3568 -4.2133 -4.1983 -1.9810 -1.9633 -1.1684 -1.1671 5.4498 5.4500 6.8920 6.8935 7.5894 7.5904 7.8786 7.8797 8.1150 8.1175 8.3975 8.3993 9.0786 9.0793 10.2769 10.2770 10.7536 10.7537 12.0721 12.0764 12.6482 12.6502 13.8468 13.8477 14.5535 14.5560 k = 0.0000 0.5000 0.4840 ( 2704 PWs) bands (ev): -46.3958 -46.3958 -25.3478 -25.3476 -22.5825 -22.5823 -22.1778 -22.1777 -14.6685 -14.6680 -6.8695 -6.8694 -6.1971 -6.1969 -5.3625 -5.3612 -4.2232 -4.2158 -1.9817 -1.9728 -1.1712 -1.1705 5.4501 5.4502 6.8883 6.8890 7.5904 7.5909 7.8841 7.8847 8.1210 8.1222 8.3998 8.4006 9.0720 9.0724 10.2811 10.2811 10.7546 10.7547 12.0957 12.0979 12.6645 12.6655 13.8470 13.8475 14.5570 14.5582 k = 0.0000 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3958 -46.3958 -25.3485 -25.3485 -22.5823 -22.5823 -22.1777 -22.1777 -14.6643 -14.6643 -6.8699 -6.8699 -6.1961 -6.1961 -5.3631 -5.3631 -4.2241 -4.2241 -1.9790 -1.9790 -1.1718 -1.1718 5.4503 5.4503 6.8873 6.8873 7.5909 7.5909 7.8862 7.8862 8.1234 8.1234 8.4008 8.4008 9.0699 9.0699 10.2824 10.2824 10.7550 10.7550 12.1044 12.1044 12.6704 12.6704 13.8472 13.8472 14.5586 14.5586 k = 0.0000 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3958 -46.3958 -25.3485 -25.3485 -22.5823 -22.5823 -22.1777 -22.1777 -14.6643 -14.6643 -6.8699 -6.8699 -6.1961 -6.1961 -5.3631 -5.3631 -4.2241 -4.2241 -1.9790 -1.9790 -1.1718 -1.1718 5.4503 5.4503 6.8873 6.8873 7.5909 7.5909 7.8862 7.8862 8.1234 8.1234 8.4008 8.4008 9.0699 9.0699 10.2824 10.2824 10.7550 10.7550 12.1044 12.1044 12.6704 12.6704 13.8472 13.8472 14.5586 14.5586 k = 0.0125 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3958 -46.3958 -25.3485 -25.3485 -22.5824 -22.5823 -22.1778 -22.1777 -14.6642 -14.6642 -6.8690 -6.8688 -6.1961 -6.1960 -5.3632 -5.3620 -4.2250 -4.2237 -1.9819 -1.9779 -1.1754 -1.1708 5.4503 5.4503 6.8895 6.8902 7.5805 7.5813 7.8729 7.8748 8.1413 8.1426 8.4005 8.4006 9.0715 9.0716 10.2811 10.2814 10.7546 10.7547 12.1053 12.1067 12.6703 12.6712 13.8470 13.8484 14.5618 14.5636 k = 0.0249 0.5000 0.4965 ( 2710 PWs) bands (ev): -46.3958 -46.3958 -25.3485 -25.3484 -22.5826 -22.5824 -22.1781 -22.1778 -14.6640 -14.6640 -6.8662 -6.8659 -6.1960 -6.1959 -5.3622 -5.3599 -4.2265 -4.2237 -1.9867 -1.9788 -1.1816 -1.1723 5.4503 5.4503 6.8969 6.8982 7.5515 7.5529 7.8433 7.8461 8.1878 8.1896 8.3995 8.3999 9.0761 9.0764 10.2774 10.2780 10.7537 10.7539 12.1093 12.1120 12.6709 12.6727 13.8478 13.8504 14.5734 14.5770 k = 0.0374 0.5000 0.4965 ( 2704 PWs) bands (ev): -46.3958 -46.3958 -25.3483 -25.3483 -22.5828 -22.5825 -22.1784 -22.1780 -14.6636 -14.6636 -6.8615 -6.8611 -6.1958 -6.1956 -5.3602 -5.3567 -4.2284 -4.2243 -1.9934 -1.9816 -1.1901 -1.1763 5.4502 5.4503 6.9094 6.9113 7.5073 7.5091 7.8066 7.8098 8.2499 8.2518 8.3981 8.3986 9.0838 9.0842 10.2715 10.2724 10.7523 10.7526 12.1164 12.1205 12.6722 12.6749 13.8497 13.8535 14.5931 14.5982 k = 0.0498 0.5000 0.4965 ( 2710 PWs) bands (ev): -46.3958 -46.3958 -25.3483 -25.3483 -22.5832 -22.5827 -22.1789 -22.1784 -14.6631 -14.6630 -6.8549 -6.8544 -6.1955 -6.1953 -5.3571 -5.3525 -4.2308 -4.2253 -2.0019 -1.9863 -1.2011 -1.1829 5.4502 5.4502 6.9269 6.9294 7.4522 7.4542 7.7661 7.7692 8.3200 8.3217 8.3965 8.3972 9.0946 9.0950 10.2634 10.2645 10.7504 10.7507 12.1265 12.1319 12.6743 12.6778 13.8528 13.8576 14.6203 14.6270 k = 0.0623 0.5000 0.4965 ( 2714 PWs) bands (ev): -46.3958 -46.3958 -25.3483 -25.3483 -22.5836 -22.5830 -22.1795 -22.1789 -14.6624 -14.6624 -6.8465 -6.8459 -6.1951 -6.1949 -5.3531 -5.3473 -4.2337 -4.2268 -2.0121 -1.9928 -1.2145 -1.1919 5.4501 5.4502 6.9491 6.9523 7.3899 7.3919 7.7217 7.7246 8.3874 8.3876 8.4017 8.4039 9.1082 9.1087 10.2533 10.2547 10.7478 10.7483 12.1394 12.1461 12.6770 12.6815 13.8573 13.8630 14.6545 14.6626 k = 0.0748 0.5000 0.4965 ( 2716 PWs) bands (ev): -46.3957 -46.3957 -25.3482 -25.3482 -22.5840 -22.5833 -22.1802 -22.1794 -14.6615 -14.6615 -6.8363 -6.8356 -6.1947 -6.1943 -5.3480 -5.3411 -4.2371 -4.2289 -2.0240 -2.0012 -1.2300 -1.2032 5.4500 5.4501 6.9761 6.9798 7.3231 7.3251 7.6728 7.6756 8.3901 8.3906 8.4741 8.4761 9.1246 9.1252 10.2414 10.2430 10.7448 10.7453 12.1551 12.1630 12.6805 12.6858 13.8632 13.8697 14.6950 14.7045 k = 0.0872 0.5000 0.4965 ( 2718 PWs) bands (ev): -46.3957 -46.3957 -25.3481 -25.3481 -22.5846 -22.5838 -22.1810 -22.1801 -14.6605 -14.6605 -6.8244 -6.8235 -6.1941 -6.1937 -5.3420 -5.3339 -4.2410 -4.2314 -2.0375 -2.0113 -1.2477 -1.2168 5.4499 5.4500 7.0075 7.0117 7.2536 7.2556 7.6192 7.6217 8.3874 8.3880 8.5534 8.5552 9.1435 9.1441 10.2279 10.2296 10.7413 10.7418 12.1732 12.1823 12.6847 12.6908 13.8708 13.8779 14.7411 14.7517 k = 0.0997 0.5000 0.4965 ( 2712 PWs) bands (ev): -46.3957 -46.3957 -25.3479 -25.3479 -22.5851 -22.5842 -22.1818 -22.1808 -14.6594 -14.6594 -6.8107 -6.8097 -6.1935 -6.1931 -5.3349 -5.3257 -4.2455 -4.2344 -2.0526 -2.0230 -1.2673 -1.2326 5.4498 5.4498 7.0430 7.0478 7.1827 7.1848 7.5608 7.5632 8.3844 8.3851 8.6338 8.6355 9.1649 9.1655 10.2130 10.2149 10.7373 10.7379 12.1936 12.2040 12.6895 12.6966 13.8800 13.8876 14.7919 14.8036 k = 0.1122 0.5000 0.4965 ( 2716 PWs) bands (ev): -46.3957 -46.3957 -25.3478 -25.3477 -22.5858 -22.5848 -22.1828 -22.1816 -14.6582 -14.6582 -6.7954 -6.7943 -6.1928 -6.1923 -5.3270 -5.3165 -4.2504 -4.2379 -2.0690 -2.0364 -1.2887 -1.2504 5.4495 5.4496 7.0821 7.0876 7.1115 7.1133 7.4980 7.5003 8.3812 8.3819 8.7147 8.7163 9.1885 9.1891 10.1969 10.1990 10.7328 10.7334 12.2162 12.2277 12.6951 12.7030 13.8910 13.8989 14.8466 14.8593 k = 0.1246 0.5000 0.4965 ( 2716 PWs) bands (ev): -46.3956 -46.3956 -25.3476 -25.3476 -22.5865 -22.5854 -22.1838 -22.1826 -14.6568 -14.6568 -6.7785 -6.7772 -6.1921 -6.1915 -5.3181 -5.3065 -4.2558 -4.2419 -2.0867 -2.0512 -1.3118 -1.2702 5.4493 5.4493 7.0391 7.0416 7.1259 7.1312 7.4311 7.4333 8.3780 8.3788 8.7957 8.7973 9.2142 9.2148 10.1800 10.1822 10.7279 10.7286 12.2406 12.2532 12.7014 12.7102 13.9037 13.9119 14.9042 14.9179 k = 0.1371 0.5000 0.4965 ( 2714 PWs) bands (ev): -46.3956 -46.3956 -25.3474 -25.3474 -22.5872 -22.5860 -22.1849 -22.1835 -14.6553 -14.6553 -6.7601 -6.7587 -6.1913 -6.1906 -5.3083 -5.2955 -4.2618 -4.2464 -2.1056 -2.0674 -1.3364 -1.2916 5.4489 5.4490 6.9677 6.9703 7.1722 7.1778 7.3607 7.3629 8.3749 8.3756 8.8765 8.8779 9.2418 9.2423 10.1624 10.1647 10.7226 10.7233 12.2668 12.2804 12.7084 12.7180 13.9181 13.9264 14.9639 14.9786 k = 0.1495 0.5000 0.4965 ( 2714 PWs) bands (ev): -46.3956 -46.3956 -25.3473 -25.3473 -22.5880 -22.5868 -22.1860 -22.1846 -14.6538 -14.6537 -6.7403 -6.7388 -6.1904 -6.1897 -5.2977 -5.2837 -4.2682 -4.2514 -2.1255 -2.0850 -1.3623 -1.3147 5.4484 5.4485 6.8968 6.8996 7.2213 7.2270 7.2876 7.2897 8.3719 8.3726 8.9567 8.9581 9.2710 9.2714 10.1445 10.1468 10.7171 10.7177 12.2944 12.3091 12.7162 12.7265 13.9341 13.9425 15.0247 15.0404 k = 0.1620 0.5000 0.4965 ( 2712 PWs) bands (ev): -46.3955 -46.3955 -25.3471 -25.3471 -22.5889 -22.5875 -22.1872 -22.1857 -14.6521 -14.6521 -6.7192 -6.7176 -6.1895 -6.1887 -5.2862 -5.2710 -4.2752 -4.2569 -2.1464 -2.1036 -1.3894 -1.3392 5.4478 5.4479 6.8265 6.8295 7.2113 7.2140 7.2732 7.2797 8.3692 8.3698 9.0361 9.0375 9.3017 9.3020 10.1263 10.1287 10.7112 10.7119 12.3233 12.3389 12.7246 12.7357 13.9517 13.9602 15.0858 15.1025 k = 0.1745 0.5000 0.4965 ( 2710 PWs) bands (ev): -46.3955 -46.3955 -25.3469 -25.3469 -22.5897 -22.5883 -22.1885 -22.1869 -14.6503 -14.6503 -6.6969 -6.6952 -6.1885 -6.1876 -5.2740 -5.2576 -4.2826 -4.2629 -2.1680 -2.1234 -1.4174 -1.3650 5.4470 5.4471 6.7570 6.7602 7.1343 7.1370 7.3268 7.3334 8.3666 8.3672 9.1145 9.1158 9.3338 9.3339 10.1083 10.1107 10.7052 10.7058 12.3533 12.3698 12.7337 12.7455 13.9708 13.9793 15.1464 15.1641 k = 0.1869 0.5000 0.4965 ( 2712 PWs) bands (ev): -46.3954 -46.3954 -25.3467 -25.3467 -22.5907 -22.5892 -22.1898 -22.1882 -14.6485 -14.6485 -6.6735 -6.6717 -6.1875 -6.1865 -5.2610 -5.2434 -4.2906 -4.2695 -2.1902 -2.1440 -1.4462 -1.3918 5.4461 5.4461 6.6883 6.6918 7.0562 7.0591 7.3822 7.3889 8.3644 8.3649 9.1917 9.1929 9.3668 9.3669 10.0906 10.0930 10.6990 10.6996 12.3841 12.4015 12.7435 12.7560 13.9913 13.9998 15.2055 15.2244 k = 0.1994 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3954 -46.3954 -25.3465 -25.3464 -22.5916 -22.5901 -22.1911 -22.1894 -14.6466 -14.6466 -6.6491 -6.6472 -6.1864 -6.1854 -5.2473 -5.2285 -4.2990 -4.2765 -2.2130 -2.1654 -1.4757 -1.4196 5.4449 5.4449 6.6206 6.6243 6.9779 6.9810 7.4387 7.4455 8.3625 8.3629 9.2674 9.2686 9.4007 9.4009 10.0735 10.0758 10.6927 10.6933 12.4157 12.4338 12.7540 12.7672 14.0131 14.0215 15.2625 15.2826 k = 0.2119 0.5000 0.4965 ( 2704 PWs) bands (ev): -46.3953 -46.3953 -25.3462 -25.3462 -22.5925 -22.5910 -22.1924 -22.1907 -14.6446 -14.6446 -6.6239 -6.6219 -6.1853 -6.1842 -5.2329 -5.2129 -4.3079 -4.2840 -2.2361 -2.1875 -1.5055 -1.4482 5.4434 5.4435 6.5537 6.5578 6.9001 6.9033 7.4959 7.5027 8.3611 8.3613 9.3414 9.3426 9.4352 9.4356 10.0571 10.0594 10.6865 10.6871 12.4478 12.4666 12.7652 12.7789 14.0361 14.0444 15.3166 15.3380 k = 0.2243 0.5000 0.4965 ( 2706 PWs) bands (ev): -46.3953 -46.3953 -25.3460 -25.3460 -22.5936 -22.5920 -22.1937 -22.1920 -14.6426 -14.6426 -6.5980 -6.5958 -6.1842 -6.1830 -5.2180 -5.1968 -4.3173 -4.2919 -2.2594 -2.2100 -1.5355 -1.4773 5.4416 5.4416 6.4878 6.4922 6.8233 6.8269 7.5533 7.5602 8.3600 8.3601 9.4136 9.4147 9.4703 9.4709 10.0416 10.0438 10.6804 10.6809 12.4802 12.4996 12.7771 12.7913 14.0602 14.0684 15.3672 15.3900 k = 0.2368 0.5000 0.4965 ( 2702 PWs) bands (ev): -46.3953 -46.3953 -25.3458 -25.3458 -22.5945 -22.5930 -22.1951 -22.1933 -14.6406 -14.6406 -6.5715 -6.5692 -6.1831 -6.1818 -5.2024 -5.1802 -4.3271 -4.3004 -2.2827 -2.2329 -1.5657 -1.5068 5.4394 5.4394 6.4228 6.4276 6.7484 6.7522 7.6105 7.6173 8.3594 8.3594 9.4837 9.4847 9.5057 9.5064 10.0273 10.0294 10.6744 10.6749 12.5129 12.5327 12.7897 12.8043 14.0852 14.0933 15.4138 15.4382 k = 0.2492 0.5000 0.4965 ( 2704 PWs) bands (ev): -46.3952 -46.3952 -25.3456 -25.3456 -22.5956 -22.5940 -22.1964 -22.1947 -14.6386 -14.6385 -6.5445 -6.5421 -6.1820 -6.1806 -5.1864 -5.1630 -4.3373 -4.3093 -2.3060 -2.2560 -1.5957 -1.5366 5.4366 5.4366 6.3589 6.3640 6.6758 6.6799 7.6669 7.6736 8.3592 8.3594 9.5411 9.5420 9.5515 9.5526 10.0142 10.0162 10.6687 10.6692 12.5455 12.5656 12.8029 12.8178 14.1111 14.1190 15.4561 15.4821 k = 0.2617 0.5000 0.4965 ( 2702 PWs) bands (ev): -46.3952 -46.3952 -25.3454 -25.3454 -22.5966 -22.5950 -22.1977 -22.1960 -14.6365 -14.6365 -6.5173 -6.5148 -6.1808 -6.1793 -5.1700 -5.1455 -4.3479 -4.3187 -2.3290 -2.2792 -1.6254 -1.5664 5.4333 5.4333 6.2961 6.3015 6.6061 6.6104 7.7220 7.7286 8.3596 8.3599 9.5765 9.5776 9.6168 9.6178 10.0025 10.0044 10.6634 10.6638 12.5779 12.5982 12.8168 12.8319 14.1376 14.1454 15.4937 15.5215 k = 0.2742 0.5000 0.4965 ( 2700 PWs) bands (ev): -46.3951 -46.3951 -25.3452 -25.3452 -22.5976 -22.5960 -22.1990 -22.1973 -14.6345 -14.6345 -6.4900 -6.4873 -6.1797 -6.1781 -5.1532 -5.1277 -4.3589 -4.3285 -2.3517 -2.3024 -1.6546 -1.5961 5.4293 5.4293 6.2346 6.2402 6.5397 6.5442 7.7754 7.7819 8.3607 8.3611 9.6116 9.6129 9.6794 9.6803 9.9923 9.9941 10.6586 10.6590 12.6100 12.6303 12.8314 12.8465 14.1647 14.1723 15.5266 15.5562 k = 0.2866 0.5000 0.4965 ( 2698 PWs) bands (ev): -46.3951 -46.3951 -25.3450 -25.3450 -22.5986 -22.5970 -22.2003 -22.1986 -14.6325 -14.6325 -6.4627 -6.4599 -6.1786 -6.1768 -5.1361 -5.1096 -4.3702 -4.3388 -2.3738 -2.3253 -1.6832 -1.6255 5.4244 5.4245 6.1748 6.1806 6.4769 6.4816 7.8266 7.8329 8.3624 8.3630 9.6462 9.6477 9.7391 9.7399 9.9838 9.9854 10.6543 10.6546 12.6416 12.6616 12.8466 12.8615 14.1921 14.1995 15.5548 15.5863 k = 0.2991 0.5000 0.4965 ( 2702 PWs) bands (ev): -46.3950 -46.3950 -25.3448 -25.3448 -22.5996 -22.5981 -22.2016 -22.1999 -14.6305 -14.6305 -6.4357 -6.4328 -6.1775 -6.1756 -5.1188 -5.0914 -4.3818 -4.3494 -2.3954 -2.3479 -1.7110 -1.6544 5.4185 5.4187 6.1170 6.1229 6.4180 6.4227 7.8750 7.8812 8.3650 8.3657 9.6801 9.6818 9.7957 9.7964 9.9768 9.9784 10.6507 10.6510 12.6725 12.6921 12.8624 12.8769 14.2198 14.2270 15.5784 15.6120 k = 0.3115 0.5000 0.4965 ( 2704 PWs) bands (ev): -46.3950 -46.3950 -25.3446 -25.3446 -22.6006 -22.5991 -22.2028 -22.2011 -14.6286 -14.6286 -6.4091 -6.4060 -6.1764 -6.1743 -5.1013 -5.0731 -4.3935 -4.3603 -2.4162 -2.3700 -1.7379 -1.6828 5.4115 5.4117 6.0616 6.0676 6.3630 6.3677 7.9205 7.9264 8.3684 8.3692 9.7132 9.7149 9.8489 9.8496 9.9716 9.9730 10.6478 10.6481 12.7026 12.7213 12.8788 12.8926 14.2475 14.2546 15.5977 15.6333 k = 0.3240 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3949 -46.3949 -25.3444 -25.3444 -22.6015 -22.6001 -22.2039 -22.2024 -14.6267 -14.6267 -6.3831 -6.3798 -6.1754 -6.1731 -5.0838 -5.0550 -4.4054 -4.3716 -2.4362 -2.3916 -1.7636 -1.7103 5.4032 5.4035 6.0094 6.0153 6.3119 6.3166 7.9624 7.9680 8.3728 8.3737 9.7452 9.7471 9.8987 9.8993 9.9681 9.9693 10.6458 10.6460 12.7315 12.7493 12.8957 12.9087 14.2752 14.2820 15.6131 15.6508 k = 0.3365 0.5000 0.4965 ( 2712 PWs) bands (ev): -46.3949 -46.3949 -25.3443 -25.3443 -22.6025 -22.6011 -22.2051 -22.2036 -14.6249 -14.6249 -6.3578 -6.3544 -6.1744 -6.1719 -5.0663 -5.0370 -4.4174 -4.3831 -2.4551 -2.4124 -1.7881 -1.7370 5.3935 5.3938 5.9607 5.9665 6.2647 6.2693 8.0006 8.0059 8.3781 8.3791 9.7759 9.7779 9.9443 9.9447 9.9665 9.9677 10.6446 10.6447 12.7592 12.7756 12.9130 12.9248 14.3025 14.3090 15.6248 15.6646 k = 0.3489 0.5000 0.4965 ( 2710 PWs) bands (ev): -46.3949 -46.3949 -25.3440 -25.3440 -22.6033 -22.6021 -22.2061 -22.2047 -14.6232 -14.6232 -6.3335 -6.3299 -6.1734 -6.1706 -5.0489 -5.0193 -4.4293 -4.3948 -2.4730 -2.4325 -1.8112 -1.7625 5.3822 5.3825 5.9162 5.9218 6.2214 6.2258 8.0347 8.0398 8.3845 8.3856 9.8052 9.8073 9.9644 9.9651 9.9882 9.9888 10.6444 10.6445 12.7856 12.8004 12.9306 12.9411 14.3293 14.3356 15.6334 15.6752 k = 0.3614 0.5000 0.4965 ( 2714 PWs) bands (ev): -46.3948 -46.3948 -25.3439 -25.3439 -22.6042 -22.6030 -22.2071 -22.2057 -14.6216 -14.6215 -6.3104 -6.3066 -6.1724 -6.1694 -5.0317 -5.0021 -4.4410 -4.4066 -2.4897 -2.4515 -1.8328 -1.7869 5.3694 5.3697 5.8762 5.8816 6.1817 6.1860 8.0648 8.0695 8.3919 8.3929 9.8329 9.8350 9.9655 9.9662 10.0262 10.0267 10.6451 10.6451 12.8103 12.8233 12.9483 12.9572 14.3554 14.3614 15.6392 15.6829 k = 0.3739 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3948 -46.3948 -25.3437 -25.3437 -22.6049 -22.6038 -22.2079 -22.2067 -14.6200 -14.6200 -6.2886 -6.2846 -6.1715 -6.1682 -5.0149 -4.9855 -4.4525 -4.4185 -2.5051 -2.4695 -1.8528 -1.8098 5.3552 5.3555 5.8411 5.8461 6.1457 6.1497 8.0908 8.0951 8.4001 8.4011 9.8588 9.8610 9.9675 9.9680 10.0607 10.0611 10.6467 10.6467 12.8333 12.8444 12.9659 12.9731 14.3806 14.3863 15.6426 15.6881 k = 0.3863 0.5000 0.4965 ( 2708 PWs) bands (ev): -46.3948 -46.3948 -25.3436 -25.3436 -22.6056 -22.6046 -22.2087 -22.2076 -14.6186 -14.6186 -6.2684 -6.2640 -6.1706 -6.1669 -4.9986 -4.9697 -4.4635 -4.4303 -2.5192 -2.4864 -1.8710 -1.8314 5.3399 5.3401 5.8108 5.8154 6.1131 6.1169 8.1128 8.1167 8.4089 8.4098 9.8828 9.8849 9.9704 9.9707 10.0913 10.0916 10.6491 10.6492 12.8544 12.8636 12.9830 12.9886 14.4046 14.4099 15.6441 15.6908 k = 0.3988 0.5000 0.4965 ( 2716 PWs) bands (ev): -46.3947 -46.3947 -25.3435 -25.3435 -22.6063 -22.6053 -22.2095 -22.2084 -14.6173 -14.6173 -6.2500 -6.2452 -6.1697 -6.1656 -4.9829 -4.9549 -4.4739 -4.4420 -2.5318 -2.5020 -1.8873 -1.8513 5.3238 5.3239 5.7852 5.7895 6.0841 6.0875 8.1312 8.1347 8.4180 8.4188 9.9046 9.9067 9.9740 9.9742 10.1179 10.1182 10.6522 10.6523 12.8735 12.8809 12.9994 13.0035 14.4272 14.4321 15.6441 15.6912 k = 0.4112 0.5000 0.4965 ( 2720 PWs) bands (ev): -46.3947 -46.3947 -25.3434 -25.3434 -22.6069 -22.6060 -22.2101 -22.2092 -14.6162 -14.6162 -6.2334 -6.2283 -6.1688 -6.1642 -4.9679 -4.9414 -4.4835 -4.4533 -2.5429 -2.5163 -1.9017 -1.8694 5.3075 5.3076 5.7642 5.7681 6.0584 6.0616 8.1463 8.1493 8.4271 8.4278 9.9242 9.9262 9.9780 9.9781 10.1408 10.1410 10.6559 10.6559 12.8906 12.8963 13.0147 13.0174 14.4481 14.4526 15.6430 15.6892 k = 0.4237 0.5000 0.4965 ( 2718 PWs) bands (ev): -46.3947 -46.3947 -25.3433 -25.3433 -22.6073 -22.6066 -22.2107 -22.2099 -14.6151 -14.6151 -6.2191 -6.2135 -6.1677 -6.1626 -4.9538 -4.9293 -4.4921 -4.4643 -2.5524 -2.5292 -1.9140 -1.8858 5.2918 5.2918 5.7473 5.7506 6.0362 6.0389 8.1585 8.1610 8.4357 8.4363 9.9413 9.9432 9.9823 9.9824 10.1601 10.1603 10.6598 10.6599 12.9055 12.9098 13.0286 13.0302 14.4671 14.4711 15.6413 15.6848 k = 0.4362 0.5000 0.4965 ( 2722 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6078 -22.6071 -22.2112 -22.2105 -14.6143 -14.6142 -6.2070 -6.2012 -6.1663 -6.1609 -4.9409 -4.9189 -4.4994 -4.4746 -2.5603 -2.5405 -1.9242 -1.9002 5.2771 5.2771 5.7339 5.7368 6.0173 6.0197 8.1681 8.1702 8.4436 8.4441 9.9558 9.9576 9.9867 9.9868 10.1759 10.1761 10.6638 10.6638 12.9182 12.9213 13.0408 13.0417 14.4839 14.4873 15.6392 15.6782 k = 0.4486 0.5000 0.4965 ( 2724 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6081 -22.6076 -22.2115 -22.2110 -14.6135 -14.6135 -6.1975 -6.1917 -6.1644 -6.1589 -4.9294 -4.9105 -4.5052 -4.4840 -2.5664 -2.5503 -1.9323 -1.9126 5.2641 5.2641 5.7238 5.7261 6.0017 6.0037 8.1755 8.1772 8.4505 8.4509 9.9676 9.9691 9.9910 9.9912 10.1886 10.1887 10.6675 10.6675 12.9288 12.9309 13.0512 13.0515 14.4981 14.5010 15.6374 15.6701 k = 0.4611 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6084 -22.6080 -22.2118 -22.2114 -14.6129 -14.6129 -6.1903 -6.1852 -6.1618 -6.1569 -4.9194 -4.9042 -4.5094 -4.4924 -2.5709 -2.5585 -1.9381 -1.9230 5.2533 5.2533 5.7163 5.7182 5.9896 5.9911 8.1811 8.1824 8.4561 8.4564 9.9765 9.9776 9.9951 9.9953 10.1982 10.1983 10.6707 10.6708 12.9370 12.9385 13.0595 13.0595 14.5097 14.5119 15.6362 15.6616 k = 0.4736 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6085 -22.6082 -22.2120 -22.2117 -14.6125 -14.6125 -6.1854 -6.1816 -6.1588 -6.1551 -4.9111 -4.9003 -4.5117 -4.4996 -2.5736 -2.5650 -1.9417 -1.9312 5.2452 5.2452 5.7113 5.7126 5.9808 5.9819 8.1850 8.1859 8.4603 8.4605 9.9826 9.9834 9.9987 9.9988 10.2050 10.2051 10.6732 10.6733 12.9431 12.9439 13.0654 13.0656 14.5184 14.5199 15.6361 15.6537 k = 0.4860 0.5000 0.4965 ( 2726 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3431 -22.6086 -22.6084 -22.2121 -22.2119 -14.6123 -14.6123 -6.1823 -6.1801 -6.1561 -6.1541 -4.9050 -4.8988 -4.5121 -4.5052 -2.5745 -2.5697 -1.9430 -1.9372 5.2401 5.2401 5.7085 5.7092 5.9754 5.9761 8.1874 8.1879 8.4630 8.4631 9.9862 9.9867 10.0012 10.0013 10.2092 10.2092 10.6749 10.6749 12.9469 12.9473 13.0693 13.0694 14.5239 14.5248 15.6373 15.6471 k = 0.4985 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6085 -22.2121 -22.2120 -14.6122 -14.6122 -6.1807 -6.1802 -6.1544 -6.1540 -4.9010 -4.8998 -4.5105 -4.5091 -2.5737 -2.5728 -1.9421 -1.9409 5.2381 5.2381 5.7076 5.7078 5.9735 5.9736 8.1885 8.1886 8.4640 8.4640 9.9878 9.9879 10.0021 10.0021 10.2108 10.2108 10.6755 10.6755 12.9484 12.9485 13.0708 13.0708 14.5263 14.5265 15.6401 15.6421 k = 0.4985 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6085 -22.2121 -22.2120 -14.6122 -14.6122 -6.1807 -6.1802 -6.1544 -6.1540 -4.9010 -4.8998 -4.5105 -4.5091 -2.5737 -2.5728 -1.9421 -1.9409 5.2381 5.2381 5.7076 5.7078 5.9735 5.9736 8.1885 8.1886 8.4640 8.4640 9.9878 9.9879 10.0021 10.0021 10.2108 10.2108 10.6755 10.6755 12.9484 12.9485 13.0708 13.0708 14.5263 14.5265 15.6401 15.6421 k = 0.4896 0.4911 0.4965 ( 2736 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6087 -22.6085 -22.2121 -22.2119 -14.6123 -14.6123 -6.1825 -6.1796 -6.1568 -6.1540 -4.9062 -4.8979 -4.5132 -4.5039 -2.5753 -2.5688 -1.9439 -1.9360 5.2403 5.2403 5.7082 5.7091 5.9759 5.9767 8.1873 8.1879 8.4628 8.4630 9.9851 9.9857 10.0021 10.0021 10.2090 10.2090 10.6748 10.6748 12.9467 12.9473 13.0689 13.0691 14.5235 14.5246 15.6358 15.6491 k = 0.4807 0.4821 0.4965 ( 2748 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6087 -22.6083 -22.2122 -22.2118 -14.6125 -14.6125 -6.1854 -6.1798 -6.1609 -6.1556 -4.9136 -4.8986 -4.5138 -4.4970 -2.5750 -2.5630 -1.9434 -1.9288 5.2457 5.2457 5.7102 5.7119 5.9824 5.9839 8.1847 8.1859 8.4600 8.4602 9.9788 9.9798 10.0018 10.0020 10.2047 10.2047 10.6730 10.6731 12.9430 12.9441 13.0644 13.0646 14.5172 14.5193 15.6334 15.6581 k = 0.4718 0.4732 0.4965 ( 2736 PWs) bands (ev): -46.3947 -46.3947 -25.3431 -25.3431 -22.6085 -22.6079 -22.2120 -22.2113 -14.6130 -14.6130 -6.1895 -6.1808 -6.1668 -6.1585 -4.9229 -4.9017 -4.5124 -4.4887 -2.5729 -2.5554 -1.9406 -1.9193 5.2543 5.2543 5.7137 5.7162 5.9929 5.9951 8.1808 8.1824 8.4556 8.4557 9.9691 9.9706 10.0015 10.0018 10.1978 10.1979 10.6702 10.6703 12.9371 12.9389 13.0573 13.0575 14.5075 14.5106 15.6328 15.6692 k = 0.4629 0.4643 0.4965 ( 2728 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6082 -22.6075 -22.2117 -22.2108 -14.6136 -14.6136 -6.1951 -6.1832 -6.1738 -6.1625 -4.9339 -4.9073 -4.5091 -4.4792 -2.5690 -2.5462 -1.9354 -1.9077 5.2661 5.2662 5.7189 5.7220 6.0075 6.0102 8.1756 8.1775 8.4495 8.4496 9.9562 9.9581 10.0011 10.0014 10.1885 10.1886 10.6664 10.6665 12.9292 12.9317 13.0478 13.0478 14.4946 14.4986 15.6336 15.6821 k = 0.4540 0.4554 0.4965 ( 2724 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6079 -22.6070 -22.2113 -22.2103 -14.6144 -14.6143 -6.2024 -6.1889 -6.1802 -6.1672 -4.9463 -4.9150 -4.5040 -4.4688 -2.5636 -2.5355 -1.9280 -1.8938 5.2810 5.2812 5.7257 5.7294 6.0259 6.0291 8.1689 8.1709 8.4415 8.4421 9.9405 9.9426 10.0006 10.0010 10.1767 10.1768 10.6616 10.6617 12.9190 12.9226 13.0357 13.0361 14.4784 14.4833 15.6358 15.6968 k = 0.4451 0.4464 0.4965 ( 2720 PWs) bands (ev): -46.3947 -46.3947 -25.3433 -25.3433 -22.6074 -22.6064 -22.2108 -22.2096 -14.6153 -14.6153 -6.2117 -6.1991 -6.1843 -6.1724 -4.9597 -4.9246 -4.4975 -4.4577 -2.5565 -2.5233 -1.9182 -1.8778 5.2990 5.2993 5.7343 5.7385 6.0480 6.0517 8.1608 8.1628 8.4317 8.4331 9.9223 9.9246 10.0000 10.0005 10.1625 10.1626 10.6558 10.6559 12.9068 12.9115 13.0212 13.0222 14.4592 14.4650 15.6391 15.7128 k = 0.4362 0.4375 0.4965 ( 2720 PWs) bands (ev): -46.3947 -46.3947 -25.3434 -25.3434 -22.6069 -22.6057 -22.2103 -22.2089 -14.6164 -14.6164 -6.2231 -6.2123 -6.1879 -6.1779 -4.9738 -4.9356 -4.4897 -4.4462 -2.5481 -2.5099 -1.9062 -1.8598 5.3201 5.3204 5.7448 5.7493 6.0738 6.0778 8.1513 8.1530 8.4201 8.4227 9.9021 9.9043 9.9994 9.9999 10.1461 10.1462 10.6490 10.6492 12.8925 12.8987 13.0046 13.0066 14.4371 14.4437 15.6431 15.7290 k = 0.4273 0.4286 0.4965 ( 2716 PWs) bands (ev): -46.3947 -46.3947 -25.3435 -25.3435 -22.6063 -22.6049 -22.2096 -22.2081 -14.6176 -14.6176 -6.2365 -6.2274 -6.1918 -6.1836 -4.9885 -4.9479 -4.4809 -4.4345 -2.5383 -2.4953 -1.8919 -1.8399 5.3440 5.3445 5.7571 5.7620 6.1031 6.1075 8.1401 8.1413 8.4069 8.4110 9.8804 9.8824 9.9987 9.9993 10.1275 10.1276 10.6414 10.6416 12.8760 12.8840 12.9859 12.9892 14.4123 14.4196 15.6478 15.7390 k = 0.4184 0.4196 0.4965 ( 2714 PWs) bands (ev): -46.3948 -46.3948 -25.3437 -25.3436 -22.6057 -22.6041 -22.2089 -22.2072 -14.6190 -14.6190 -6.2520 -6.2442 -6.1961 -6.1895 -5.0034 -4.9610 -4.4713 -4.4225 -2.5274 -2.4799 -1.8755 -1.8181 5.3708 5.3714 5.7715 5.7767 6.1359 6.1406 8.1273 8.1279 8.3921 8.3979 9.8576 9.8593 9.9979 9.9986 10.1069 10.1070 10.6329 10.6331 12.8576 12.8676 12.9655 12.9704 14.3848 14.3928 15.6528 15.7433 k = 0.4095 0.4107 0.4965 ( 2714 PWs) bands (ev): -46.3948 -46.3948 -25.3438 -25.3438 -22.6049 -22.6032 -22.2080 -22.2062 -14.6206 -14.6205 -6.2692 -6.2627 -6.2008 -6.1956 -5.0185 -4.9747 -4.4612 -4.4106 -2.5154 -2.4636 -1.8571 -1.7946 5.4003 5.4011 5.7879 5.7932 6.1720 6.1769 8.1124 8.1128 8.3758 8.3837 9.8342 9.8353 9.9972 9.9979 10.0843 10.0844 10.6236 10.6239 12.8372 12.8496 12.9435 12.9504 14.3548 14.3635 15.6580 15.7466 k = 0.4006 0.4018 0.4965 ( 2710 PWs) bands (ev): -46.3948 -46.3948 -25.3440 -25.3440 -22.6040 -22.6022 -22.2071 -22.2051 -14.6223 -14.6222 -6.2882 -6.2827 -6.2061 -6.2019 -5.0334 -4.9886 -4.4507 -4.3988 -2.5025 -2.4467 -1.8367 -1.7695 5.4325 5.4335 5.8063 5.8118 6.2113 6.2164 8.0950 8.0964 8.3581 8.3684 9.8106 9.8111 9.9964 9.9971 10.0600 10.0601 10.6136 10.6139 12.8150 12.8300 12.9201 12.9292 14.3225 14.3317 15.6630 15.7496 k = 0.3917 0.3929 0.4965 ( 2714 PWs) bands (ev): -46.3949 -46.3949 -25.3442 -25.3442 -22.6032 -22.6012 -22.2062 -22.2040 -14.6241 -14.6241 -6.3087 -6.3041 -6.2117 -6.2086 -5.0480 -5.0026 -4.4400 -4.3871 -2.4887 -2.4294 -1.8145 -1.7430 5.4671 5.4684 5.8269 5.8324 6.2537 6.2591 8.0756 8.0781 8.3393 8.3522 9.7871 9.7874 9.9956 9.9963 10.0340 10.0341 10.6028 10.6031 12.7911 12.8089 12.8954 12.9070 14.2879 14.2977 15.6676 15.7522 k = 0.3828 0.3839 0.4965 ( 2710 PWs) bands (ev): -46.3949 -46.3949 -25.3444 -25.3444 -22.6022 -22.6001 -22.2051 -22.2027 -14.6261 -14.6260 -6.3307 -6.3268 -6.2178 -6.2155 -5.0622 -5.0164 -4.4292 -4.3756 -2.4743 -2.4116 -1.7907 -1.7152 5.5042 5.5057 5.8495 5.8551 6.2992 6.3048 8.0541 8.0578 8.3196 8.3352 9.7637 9.7649 9.9947 9.9952 10.0068 10.0069 10.5915 10.5918 12.7656 12.7864 12.8697 12.8840 14.2512 14.2615 15.6717 15.7541 k = 0.3739 0.3750 0.4965 ( 2714 PWs) bands (ev): -46.3950 -46.3950 -25.3446 -25.3446 -22.6012 -22.5989 -22.2039 -22.2015 -14.6282 -14.6282 -6.3539 -6.3507 -6.2243 -6.2227 -5.0759 -5.0299 -4.4184 -4.3645 -2.4593 -2.3937 -1.7654 -1.6864 5.5435 5.5453 5.8742 5.8798 6.3476 6.3534 8.0306 8.0354 8.2991 8.3174 9.7412 9.7435 9.9771 9.9774 9.9945 9.9955 10.5795 10.5798 12.7387 12.7627 12.8430 12.8602 14.2124 14.2232 15.6749 15.7551 k = 0.3650 0.3661 0.4965 ( 2714 PWs) bands (ev): -46.3950 -46.3950 -25.3448 -25.3448 -22.6000 -22.5977 -22.2027 -22.2001 -14.6305 -14.6304 -6.3783 -6.3757 -6.2311 -6.2302 -5.0888 -5.0429 -4.4077 -4.3536 -2.4438 -2.3755 -1.7389 -1.6567 5.5849 5.5871 5.9009 5.9065 6.3990 6.4050 8.0053 8.0111 8.2782 8.2991 9.7200 9.7234 9.9474 9.9475 9.9937 9.9945 10.5670 10.5674 12.7106 12.7377 12.8157 12.8357 14.1717 14.1830 15.6772 15.7551 k = 0.3561 0.3571 0.4965 ( 2718 PWs) bands (ev): -46.3951 -46.3951 -25.3451 -25.3451 -22.5989 -22.5964 -22.2014 -22.1987 -14.6328 -14.6328 -6.4037 -6.4016 -6.2383 -6.2380 -5.1009 -5.0551 -4.3971 -4.3431 -2.4279 -2.3573 -1.7114 -1.6264 5.6283 5.6308 5.9297 5.9352 6.4531 6.4593 7.9782 7.9848 8.2570 8.2804 9.7003 9.7048 9.9164 9.9165 9.9930 9.9938 10.5541 10.5544 12.6815 12.7118 12.7877 12.8107 14.1291 14.1408 15.6781 15.7537 k = 0.3472 0.3482 0.4965 ( 2726 PWs) bands (ev): -46.3951 -46.3951 -25.3454 -25.3454 -22.5977 -22.5951 -22.2001 -22.1973 -14.6353 -14.6353 -6.4301 -6.4284 -6.2461 -6.2458 -5.1122 -5.0666 -4.3868 -4.3330 -2.4117 -2.3391 -1.6831 -1.5957 5.6735 5.6764 5.9604 5.9659 6.5100 6.5164 7.9497 7.9568 8.2357 8.2612 9.6824 9.6881 9.8846 9.8846 9.9924 9.9932 10.5407 10.5410 12.6515 12.6849 12.7593 12.7851 14.0847 14.0969 15.6776 15.7508 k = 0.3383 0.3393 0.4965 ( 2722 PWs) bands (ev): -46.3952 -46.3952 -25.3456 -25.3456 -22.5964 -22.5937 -22.1987 -22.1957 -14.6379 -14.6379 -6.4573 -6.4560 -6.2544 -6.2536 -5.1224 -5.0771 -4.3768 -4.3232 -2.3953 -2.3210 -1.6542 -1.5648 5.7204 5.7236 5.9932 5.9986 6.5695 6.5761 7.9200 7.9273 8.2144 8.2416 9.6663 9.6731 9.8521 9.8521 9.9918 9.9925 10.5270 10.5273 12.6208 12.6572 12.7306 12.7591 14.0386 14.0512 15.6753 15.7460 k = 0.3294 0.3304 0.4965 ( 2718 PWs) bands (ev): -46.3952 -46.3952 -25.3459 -25.3459 -22.5950 -22.5922 -22.1972 -22.1941 -14.6406 -14.6406 -6.4851 -6.4842 -6.2629 -6.2617 -5.1315 -5.0866 -4.3671 -4.3139 -2.3787 -2.3029 -1.6251 -1.5340 5.7688 5.7724 6.0278 6.0332 6.6315 6.6383 7.8894 7.8967 8.1932 8.2218 9.6523 9.6602 9.8191 9.8192 9.9912 9.9919 10.5130 10.5133 12.5896 12.6289 12.7017 12.7328 13.9909 14.0038 15.6711 15.7391 k = 0.3204 0.3214 0.4965 ( 2718 PWs) bands (ev): -46.3953 -46.3953 -25.3462 -25.3462 -22.5936 -22.5908 -22.1956 -22.1925 -14.6435 -14.6434 -6.5136 -6.5130 -6.2716 -6.2700 -5.1395 -5.0950 -4.3577 -4.3050 -2.3619 -2.2850 -1.5959 -1.5034 5.8186 5.8225 6.0643 6.0697 6.6960 6.7030 7.8582 7.8652 8.1721 8.2017 9.6403 9.6492 9.7857 9.7859 9.9905 9.9912 10.4987 10.4990 12.5582 12.6000 12.6727 12.7063 13.9416 13.9549 15.6646 15.7299 k = 0.3115 0.3125 0.4965 ( 2722 PWs) bands (ev): -46.3954 -46.3954 -25.3465 -25.3465 -22.5922 -22.5893 -22.1941 -22.1909 -14.6464 -14.6463 -6.5425 -6.5422 -6.2805 -6.2786 -5.1463 -5.1023 -4.3487 -4.2965 -2.3451 -2.2672 -1.5670 -1.4734 5.8695 5.8737 6.1026 6.1079 6.7628 6.7701 7.8270 7.8334 8.1511 8.1814 9.6304 9.6401 9.7523 9.7525 9.9899 9.9906 10.4843 10.4845 12.5265 12.5709 12.6438 12.6797 13.8908 13.9045 15.6558 15.7181 k = 0.3026 0.3036 0.4965 ( 2714 PWs) bands (ev): -46.3954 -46.3954 -25.3467 -25.3467 -22.5907 -22.5877 -22.1924 -22.1892 -14.6493 -14.6493 -6.5718 -6.5717 -6.2895 -6.2873 -5.1518 -5.1083 -4.3400 -4.2885 -2.3283 -2.2497 -1.5385 -1.4440 5.9214 5.9260 6.1426 6.1479 6.8319 6.8394 7.7959 7.8017 8.1302 8.1609 9.6225 9.6329 9.7189 9.7192 9.9891 9.9899 10.4696 10.4698 12.4949 12.5414 12.6152 12.6530 13.8387 13.8527 15.6443 15.7036 k = 0.2937 0.2946 0.4965 ( 2714 PWs) bands (ev): -46.3955 -46.3955 -25.3470 -25.3470 -22.5892 -22.5862 -22.1908 -22.1875 -14.6524 -14.6523 -6.6015 -6.6014 -6.2986 -6.2962 -5.1561 -5.1131 -4.3318 -4.2809 -2.3116 -2.2324 -1.5107 -1.4156 5.9742 5.9790 6.1842 6.1895 6.9031 6.9108 7.7655 7.7704 8.1094 8.1401 9.6165 9.6276 9.6857 9.6861 9.9883 9.9891 10.4549 10.4550 12.4635 12.5120 12.5869 12.6264 13.7853 13.7996 15.6301 15.6861 k = 0.2848 0.2857 0.4965 ( 2712 PWs) bands (ev): -46.3955 -46.3955 -25.3473 -25.3473 -22.5876 -22.5845 -22.1891 -22.1857 -14.6555 -14.6555 -6.6315 -6.6312 -6.3079 -6.3052 -5.1590 -5.1165 -4.3240 -4.2738 -2.2950 -2.2155 -1.4837 -1.3882 6.0278 6.0328 6.2273 6.2327 6.9763 6.9842 7.7360 7.7400 8.0887 8.1192 9.6124 9.6240 9.6532 9.6536 9.9874 9.9882 10.4400 10.4400 12.4324 12.4825 12.5590 12.6000 13.7306 13.7453 15.6129 15.6656 k = 0.2759 0.2768 0.4965 ( 2714 PWs) bands (ev): -46.3956 -46.3956 -25.3477 -25.3476 -22.5860 -22.5829 -22.1874 -22.1840 -14.6587 -14.6586 -6.6615 -6.6610 -6.3172 -6.3143 -5.1606 -5.1186 -4.3167 -4.2671 -2.2786 -2.1988 -1.4578 -1.3621 6.0819 6.0870 6.2717 6.2773 7.0514 7.0595 7.7079 7.7108 8.0680 8.0981 9.6086 9.6181 9.6226 9.6256 9.9863 9.9871 10.4250 10.4250 12.4018 12.4532 12.5318 12.5740 13.6749 13.6898 15.5927 15.6418 k = 0.2670 0.2679 0.4965 ( 2714 PWs) bands (ev): -46.3957 -46.3957 -25.3480 -25.3479 -22.5844 -22.5813 -22.1856 -22.1822 -14.6619 -14.6619 -6.6914 -6.6908 -6.3265 -6.3234 -5.1608 -5.1193 -4.3098 -4.2609 -2.2624 -2.1826 -1.4332 -1.3375 6.1363 6.1415 6.3174 6.3231 7.1282 7.1365 7.6813 7.6832 8.0474 8.0769 9.5874 9.5891 9.6121 9.6231 9.9851 9.9860 10.4100 10.4100 12.3718 12.4243 12.5052 12.5483 13.6181 13.6334 15.5692 15.6147 k = 0.2581 0.2589 0.4965 ( 2722 PWs) bands (ev): -46.3958 -46.3958 -25.3483 -25.3483 -22.5829 -22.5798 -22.1839 -22.1805 -14.6652 -14.6651 -6.7213 -6.7205 -6.3359 -6.3327 -5.1597 -5.1187 -4.3034 -4.2552 -2.2465 -2.1668 -1.4098 -1.3144 6.1911 6.1963 6.3642 6.3701 7.2066 7.2151 7.6567 7.6575 8.0269 8.0556 9.5574 9.5588 9.6129 9.6245 9.9836 9.9846 10.3948 10.3950 12.3425 12.3957 12.4795 12.5232 13.5604 13.5760 15.5425 15.5843 k = 0.2492 0.2500 0.4965 ( 2718 PWs) bands (ev): -46.3958 -46.3958 -25.3486 -25.3486 -22.5812 -22.5781 -22.1821 -22.1787 -14.6685 -14.6684 -6.7509 -6.7500 -6.3452 -6.3419 -5.1572 -5.1168 -4.2974 -4.2500 -2.2309 -2.1515 -1.3880 -1.2930 6.2461 6.2512 6.4118 6.4180 7.2865 7.2951 7.6340 7.6341 8.0064 8.0343 9.5280 9.5294 9.6159 9.6274 9.9819 9.9830 10.3797 10.3799 12.3141 12.3677 12.4548 12.4987 13.5020 13.5178 15.5125 15.5506 k = 0.2403 0.2411 0.4965 ( 2710 PWs) bands (ev): -46.3959 -46.3959 -25.3489 -25.3489 -22.5795 -22.5764 -22.1803 -22.1768 -14.6718 -14.6718 -6.7802 -6.7792 -6.3545 -6.3510 -5.1534 -5.1135 -4.2919 -4.2453 -2.2157 -2.1368 -1.3677 -1.2732 6.3010 6.3060 6.4601 6.4667 7.3677 7.3764 7.6127 7.6138 7.9860 8.0129 9.4997 9.5013 9.6204 9.6318 9.9799 9.9812 10.3645 10.3649 12.2867 12.3404 12.4312 12.4750 13.4429 13.4590 15.4791 15.5135 k = 0.2314 0.2321 0.4965 ( 2714 PWs) bands (ev): -46.3959 -46.3959 -25.3492 -25.3492 -22.5779 -22.5749 -22.1785 -22.1751 -14.6751 -14.6751 -6.8091 -6.8080 -6.3637 -6.3602 -5.1482 -5.1089 -4.2869 -4.2410 -2.2010 -2.1226 -1.3490 -1.2553 6.3559 6.3606 6.5089 6.5158 7.4500 7.4588 7.5940 7.5960 7.9658 7.9916 9.4728 9.4745 9.6264 9.6374 9.9777 9.9791 10.3493 10.3497 12.2605 12.3139 12.4088 12.4522 13.3834 13.3996 15.4424 15.4731 k = 0.2225 0.2232 0.4965 ( 2714 PWs) bands (ev): -46.3960 -46.3960 -25.3495 -25.3495 -22.5763 -22.5733 -22.1767 -22.1733 -14.6785 -14.6784 -6.8376 -6.8365 -6.3728 -6.3692 -5.1418 -5.1031 -4.2823 -4.2373 -2.1869 -2.1091 -1.3319 -1.2392 6.4106 6.4150 6.5580 6.5652 7.5332 7.5419 7.5779 7.5807 7.9457 7.9703 9.4473 9.4492 9.6337 9.6443 9.9751 9.9767 10.3339 10.3346 12.2354 12.2882 12.3877 12.4304 13.3235 13.3399 15.4024 15.4296 k = 0.2136 0.2143 0.4965 ( 2712 PWs) bands (ev): -46.3961 -46.3961 -25.3499 -25.3499 -22.5747 -22.5717 -22.1749 -22.1716 -14.6818 -14.6817 -6.8656 -6.8643 -6.3818 -6.3782 -5.1342 -5.0960 -4.2783 -4.2340 -2.1733 -2.0964 -1.3165 -1.2250 6.4650 6.4691 6.6070 6.6145 7.5640 7.5676 7.6176 7.6262 7.9257 7.9492 9.4235 9.4256 9.6422 9.6522 9.9722 9.9741 10.3186 10.3193 12.2117 12.2635 12.3680 12.4096 13.2634 13.2801 15.3594 15.3832 k = 0.2047 0.2054 0.4965 ( 2720 PWs) bands (ev): -46.3961 -46.3961 -25.3502 -25.3502 -22.5731 -22.5702 -22.1732 -22.1699 -14.6850 -14.6850 -6.8930 -6.8917 -6.3906 -6.3870 -5.1254 -5.0877 -4.2747 -4.2313 -2.1603 -2.0845 -1.3027 -1.2125 6.5190 6.5227 6.6557 6.6636 7.5532 7.5575 7.7022 7.7107 7.9061 7.9284 9.4015 9.4038 9.6518 9.6611 9.9690 9.9712 10.3030 10.3039 12.1894 12.2399 12.3497 12.3901 13.2033 13.2202 15.3133 15.3340 k = 0.1958 0.1964 0.4965 ( 2724 PWs) bands (ev): -46.3962 -46.3962 -25.3506 -25.3506 -22.5716 -22.5687 -22.1715 -22.1683 -14.6883 -14.6882 -6.9196 -6.9183 -6.3993 -6.3956 -5.1155 -5.0784 -4.2716 -4.2290 -2.1480 -2.0734 -1.2904 -1.2018 6.5724 6.5758 6.7039 6.7121 7.5448 7.5497 7.7872 7.7956 7.8867 7.9078 9.3813 9.3840 9.6623 9.6708 9.9654 9.9680 10.2873 10.2884 12.1685 12.2175 12.3329 12.3717 13.1434 13.1605 15.2646 15.2823 k = 0.1869 0.1875 0.4965 ( 2724 PWs) bands (ev): -46.3963 -46.3963 -25.3509 -25.3508 -22.5700 -22.5672 -22.1698 -22.1667 -14.6915 -14.6914 -6.9456 -6.9442 -6.4077 -6.4041 -5.1045 -5.0680 -4.2690 -4.2272 -2.1364 -2.0633 -1.2795 -1.1928 6.6253 6.6283 6.7514 6.7597 7.5390 7.5445 7.8671 7.8711 7.8812 7.8890 9.3631 9.3661 9.6737 9.6814 9.9616 9.9645 10.2714 10.2727 12.1492 12.1963 12.3177 12.3547 13.0840 13.1011 15.2135 15.2286 k = 0.1780 0.1786 0.4965 ( 2720 PWs) bands (ev): -46.3963 -46.3963 -25.3511 -25.3511 -22.5685 -22.5657 -22.1681 -22.1650 -14.6946 -14.6945 -6.9707 -6.9694 -6.4159 -6.4124 -5.0925 -5.0567 -4.2668 -4.2260 -2.1257 -2.0541 -1.2701 -1.1854 6.6773 6.6799 6.7977 6.8062 7.5356 7.5415 7.8488 7.8670 7.9588 7.9659 9.3470 9.3503 9.6858 9.6925 9.9574 9.9607 10.2552 10.2566 12.1315 12.1765 12.3041 12.3390 13.0252 13.0424 15.1602 15.1730 k = 0.1691 0.1696 0.4965 ( 2720 PWs) bands (ev): -46.3964 -46.3964 -25.3514 -25.3514 -22.5670 -22.5643 -22.1665 -22.1635 -14.6977 -14.6976 -6.9950 -6.9937 -6.4239 -6.4204 -5.0797 -5.0445 -4.2652 -4.2252 -2.1157 -2.0460 -1.2619 -1.1795 6.7285 6.7307 6.8428 6.8514 7.5344 7.5407 7.8306 7.8476 8.0440 8.0508 9.3329 9.3367 9.6984 9.7042 9.9530 9.9568 10.2386 10.2402 12.1154 12.1581 12.2921 12.3248 12.9673 12.9846 15.1052 15.1159 k = 0.1602 0.1607 0.4965 ( 2722 PWs) bands (ev): -46.3965 -46.3965 -25.3517 -25.3517 -22.5655 -22.5629 -22.1649 -22.1620 -14.7007 -14.7006 -7.0184 -7.0171 -6.4316 -6.4281 -5.0660 -5.0316 -4.2639 -4.2250 -2.1066 -2.0389 -1.2548 -1.1750 6.7786 6.7805 6.8863 6.8949 7.5352 7.5419 7.8129 7.8287 8.1291 8.1353 9.3209 9.3252 9.7116 9.7163 9.9483 9.9526 10.2215 10.2233 12.1009 12.1411 12.2817 12.3121 12.9106 12.9279 15.0488 15.0579 k = 0.1513 0.1518 0.4965 ( 2722 PWs) bands (ev): -46.3965 -46.3965 -25.3520 -25.3520 -22.5641 -22.5616 -22.1634 -22.1606 -14.7035 -14.7035 -7.0408 -7.0395 -6.4389 -6.4356 -5.0517 -5.0181 -4.2631 -4.2252 -2.0983 -2.0329 -1.2487 -1.1718 6.8274 6.8290 6.9281 6.9367 7.5380 7.5448 7.7957 7.8103 8.2137 8.2191 9.3111 9.3159 9.7250 9.7286 9.9434 9.9484 10.2038 10.2058 12.0881 12.1256 12.2729 12.3008 12.8553 12.8725 14.9917 14.9993 k = 0.1424 0.1429 0.4965 ( 2722 PWs) bands (ev): -46.3966 -46.3966 -25.3522 -25.3522 -22.5628 -22.5604 -22.1619 -22.1592 -14.7063 -14.7063 -7.0622 -7.0609 -6.4460 -6.4428 -5.0369 -5.0041 -4.2627 -4.2259 -2.0909 -2.0280 -1.2435 -1.1696 6.8749 6.8762 6.9680 6.9763 7.5423 7.5494 7.7792 7.7926 8.2977 8.3022 9.3032 9.3086 9.7386 9.7410 9.9384 9.9440 10.1854 10.1876 12.0768 12.1115 12.2656 12.2910 12.8017 12.8188 14.9340 14.9405 k = 0.1335 0.1339 0.4965 ( 2726 PWs) bands (ev): -46.3966 -46.3966 -25.3525 -25.3525 -22.5615 -22.5592 -22.1605 -22.1579 -14.7090 -14.7090 -7.0825 -7.0813 -6.4527 -6.4497 -5.0216 -4.9897 -4.2627 -4.2271 -2.0843 -2.0241 -1.2389 -1.1684 6.9208 6.9219 7.0058 7.0139 7.5480 7.5552 7.7634 7.7756 8.3808 8.3843 9.2974 9.3034 9.7523 9.7534 9.9333 9.9396 10.1662 10.1685 12.0671 12.0989 12.2599 12.2827 12.7501 12.7670 14.8765 14.8819 k = 0.1246 0.1250 0.4965 ( 2726 PWs) bands (ev): -46.3967 -46.3967 -25.3527 -25.3527 -22.5602 -22.5581 -22.1591 -22.1567 -14.7116 -14.7115 -7.1018 -7.1006 -6.4591 -6.4562 -5.0059 -4.9751 -4.2631 -4.2287 -2.0785 -2.0214 -1.2350 -1.1681 6.9649 6.9658 7.0413 7.0491 7.5549 7.5621 7.7484 7.7593 8.4628 8.4652 9.2933 9.3002 9.7656 9.7658 9.9282 9.9353 10.1460 10.1485 12.0588 12.0878 12.2555 12.2759 12.7007 12.7173 14.8194 14.8241 k = 0.1157 0.1161 0.4965 ( 2730 PWs) bands (ev): -46.3967 -46.3967 -25.3530 -25.3529 -22.5591 -22.5570 -22.1578 -22.1556 -14.7140 -14.7139 -7.1198 -7.1187 -6.4651 -6.4623 -4.9902 -4.9605 -4.2637 -4.2307 -2.0736 -2.0196 -1.2316 -1.1685 7.0070 7.0078 7.0746 7.0819 7.5626 7.5699 7.7342 7.7439 8.5436 8.5446 9.2910 9.2987 9.7774 9.7790 9.9232 9.9311 10.1248 10.1274 12.0520 12.0781 12.2526 12.2704 12.6539 12.6701 14.7634 14.7674 k = 0.1068 0.1071 0.4965 ( 2730 PWs) bands (ev): -46.3968 -46.3968 -25.3532 -25.3532 -22.5579 -22.5560 -22.1566 -22.1545 -14.7163 -14.7162 -7.1367 -7.1356 -6.4707 -6.4681 -4.9744 -4.9460 -4.2646 -4.2332 -2.0694 -2.0188 -1.2285 -1.1694 7.0469 7.0476 7.1054 7.1123 7.5708 7.5781 7.7210 7.7294 8.6224 8.6228 9.2902 9.2989 9.7888 9.7918 9.9183 9.9271 10.1023 10.1050 12.0464 12.0697 12.2508 12.2663 12.6099 12.6256 14.7089 14.7123 k = 0.0979 0.0982 0.4965 ( 2730 PWs) bands (ev): -46.3968 -46.3968 -25.3534 -25.3534 -22.5569 -22.5551 -22.1554 -22.1535 -14.7184 -14.7183 -7.1524 -7.1514 -6.4759 -6.4735 -4.9588 -4.9318 -4.2658 -4.2359 -2.0658 -2.0189 -1.2257 -1.1709 7.0842 7.0849 7.1340 7.1402 7.5793 7.5867 7.7087 7.7160 8.6983 8.7004 9.2906 9.3004 9.7995 9.8039 9.9137 9.9234 10.0786 10.0813 12.0420 12.0625 12.2502 12.2634 12.5690 12.5841 14.6563 14.6593 k = 0.0890 0.0893 0.4965 ( 2726 PWs) bands (ev): -46.3968 -46.3968 -25.3535 -25.3535 -22.5559 -22.5543 -22.1543 -22.1525 -14.7204 -14.7203 -7.1668 -7.1658 -6.4807 -6.4785 -4.9435 -4.9180 -4.2670 -4.2390 -2.0629 -2.0197 -1.2230 -1.1727 7.1188 7.1196 7.1603 7.1657 7.5879 7.5952 7.6976 7.7036 8.7720 8.7758 9.2922 9.3032 9.8094 9.8152 9.9094 9.9201 10.0536 10.0562 12.0386 12.0565 12.2505 12.2617 12.5314 12.5457 14.6062 14.6088 k = 0.0801 0.0804 0.4965 ( 2730 PWs) bands (ev): -46.3969 -46.3969 -25.3537 -25.3537 -22.5550 -22.5535 -22.1533 -22.1517 -14.7222 -14.7221 -7.1799 -7.1790 -6.4851 -6.4830 -4.9287 -4.9050 -4.2684 -4.2423 -2.0604 -2.0212 -1.2205 -1.1748 7.1501 7.1512 7.1845 7.1891 7.5961 7.6034 7.6877 7.6924 8.8432 8.8489 9.2946 9.3071 9.8183 9.8256 9.9057 9.9172 10.0272 10.0298 12.0361 12.0515 12.2516 12.2609 12.4972 12.5107 14.5590 14.5613 k = 0.0712 0.0714 0.4965 ( 2722 PWs) bands (ev): -46.3969 -46.3969 -25.3538 -25.3538 -22.5541 -22.5528 -22.1524 -22.1509 -14.7238 -14.7238 -7.1917 -7.1909 -6.4890 -6.4872 -4.9146 -4.8928 -4.2697 -4.2458 -2.0584 -2.0232 -1.2180 -1.1771 7.1777 7.1792 7.2070 7.2105 7.6037 7.6110 7.6792 7.6826 8.9113 8.9192 9.2976 9.3117 9.8262 9.8346 9.9027 9.9149 9.9997 10.0021 12.0344 12.0474 12.2533 12.2610 12.4667 12.4791 14.5152 14.5173 k = 0.0623 0.0625 0.4965 ( 2722 PWs) bands (ev): -46.3969 -46.3969 -25.3539 -25.3539 -22.5534 -22.5522 -22.1515 -22.1503 -14.7253 -14.7252 -7.2021 -7.2015 -6.4925 -6.4908 -4.9013 -4.8816 -4.2709 -4.2494 -2.0566 -2.0256 -1.2156 -1.1795 7.2011 7.2032 7.2282 7.2305 7.6103 7.6176 7.6723 7.6744 8.9759 8.9861 9.3010 9.3169 9.8329 9.8422 9.9005 9.9131 9.9712 9.9734 12.0333 12.0442 12.2555 12.2616 12.4399 12.4511 14.4753 14.4771 k = 0.0534 0.0536 0.4965 ( 2726 PWs) bands (ev): -46.3969 -46.3969 -25.3541 -25.3541 -22.5527 -22.5517 -22.1508 -22.1497 -14.7265 -14.7265 -7.2113 -7.2107 -6.4955 -6.4941 -4.8892 -4.8717 -4.2720 -4.2530 -2.0551 -2.0284 -1.2132 -1.1821 7.2203 7.2227 7.2479 7.2492 7.6155 7.6227 7.6672 7.6681 9.0361 9.0488 9.3047 9.3226 9.8384 9.8480 9.8994 9.9118 9.9423 9.9441 12.0327 12.0416 12.2579 12.2628 12.4170 12.4268 14.4397 14.4412 k = 0.0445 0.0446 0.4965 ( 2728 PWs) bands (ev): -46.3970 -46.3970 -25.3542 -25.3542 -22.5522 -22.5513 -22.1502 -22.1493 -14.7276 -14.7276 -7.2190 -7.2185 -6.4980 -6.4968 -4.8782 -4.8633 -4.2728 -4.2566 -2.0536 -2.0312 -1.2107 -1.1847 7.2355 7.2380 7.2657 7.2663 7.6191 7.6258 7.6640 7.6640 9.0910 9.1063 9.3088 9.3286 9.8426 9.8519 9.8994 9.9104 9.9137 9.9156 12.0324 12.0395 12.2603 12.2641 12.3978 12.4061 14.4087 14.4100 k = 0.0356 0.0357 0.4965 ( 2728 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5517 -22.5510 -22.1497 -22.1489 -14.7285 -14.7285 -7.2253 -7.2249 -6.5001 -6.4991 -4.8686 -4.8565 -4.2732 -4.2600 -2.0522 -2.0342 -1.2082 -1.1873 7.2474 7.2497 7.2810 7.2812 7.6211 7.6269 7.6622 7.6626 9.1393 9.1568 9.3133 9.3347 9.8456 9.8536 9.8862 9.8870 9.9008 9.9108 12.0324 12.0379 12.2625 12.2654 12.3824 12.3892 14.3829 14.3840 k = 0.0267 0.0268 0.4965 ( 2724 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5512 -22.5507 -22.1492 -22.1486 -14.7292 -14.7292 -7.2302 -7.2299 -6.5017 -6.5009 -4.8606 -4.8513 -4.2733 -4.2632 -2.0506 -2.0371 -1.2057 -1.1900 7.2565 7.2582 7.2933 7.2933 7.6220 7.6265 7.6621 7.6625 9.1797 9.1979 9.3191 9.3404 9.8460 9.8510 9.8638 9.8648 9.9025 9.9103 12.0327 12.0366 12.2645 12.2666 12.3707 12.3758 14.3625 14.3633 k = 0.0178 0.0179 0.4965 ( 2720 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5509 -22.5506 -22.1488 -22.1485 -14.7297 -14.7297 -7.2337 -7.2335 -6.5028 -6.5023 -4.8544 -4.8481 -4.2728 -4.2660 -2.0489 -2.0399 -1.2031 -1.1927 7.2629 7.2641 7.3022 7.3022 7.6222 7.6252 7.6627 7.6630 9.2107 9.2265 9.3268 9.3450 9.8361 9.8369 9.8550 9.8584 9.9045 9.9098 12.0330 12.0356 12.2661 12.2674 12.3627 12.3662 14.3477 14.3483 k = 0.0089 0.0089 0.4965 ( 2724 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5507 -22.5505 -22.1486 -22.1484 -14.7300 -14.7300 -7.2358 -7.2357 -6.5034 -6.5031 -4.8499 -4.8467 -4.2719 -4.2684 -2.0470 -2.0425 -1.2006 -1.1953 7.2668 7.2674 7.3076 7.3076 7.6224 7.6239 7.6634 7.6635 9.2315 9.2408 9.3361 9.3466 9.8238 9.8240 9.8550 9.8570 9.9064 9.9091 12.0335 12.0348 12.2672 12.2679 12.3583 12.3600 14.3388 14.3391 k = 0.0000 0.0000 0.4965 ( 2730 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5506 -22.5506 -22.1485 -22.1485 -14.7301 -14.7301 -7.2365 -7.2365 -6.5035 -6.5035 -4.8473 -4.8473 -4.2704 -4.2704 -2.0449 -2.0449 -1.1980 -1.1980 7.2683 7.2683 7.3094 7.3094 7.6230 7.6230 7.6637 7.6637 9.2418 9.2418 9.3436 9.3436 9.8193 9.8193 9.8560 9.8560 9.9079 9.9079 12.0341 12.0341 12.2678 12.2678 12.3574 12.3574 14.3360 14.3360 k = 0.0000 0.0000 0.4965 ( 2730 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5506 -22.5506 -22.1485 -22.1485 -14.7301 -14.7301 -7.2365 -7.2365 -6.5035 -6.5035 -4.8473 -4.8473 -4.2704 -4.2704 -2.0449 -2.0449 -1.1980 -1.1980 7.2683 7.2683 7.3094 7.3094 7.6230 7.6230 7.6637 7.6637 9.2418 9.2418 9.3436 9.3436 9.8193 9.8193 9.8560 9.8560 9.9079 9.9079 12.0341 12.0341 12.2678 12.2678 12.3574 12.3574 14.3360 14.3360 k = 0.0000 0.0000 0.4840 ( 2730 PWs) bands (ev): -46.3970 -46.3970 -25.3537 -25.3535 -22.5507 -22.5506 -22.1486 -22.1486 -14.7343 -14.7338 -7.2359 -7.2358 -6.5035 -6.5035 -4.8492 -4.8462 -4.2723 -4.2588 -2.0485 -2.0379 -1.1972 -1.1971 7.2682 7.2686 7.3092 7.3097 7.6237 7.6244 7.6633 7.6638 9.2405 9.2407 9.3423 9.3423 9.8202 9.8211 9.8571 9.8582 9.9094 9.9095 12.0245 12.0286 12.2593 12.2609 12.3564 12.3573 14.3357 14.3365 k = 0.0000 0.0000 0.4716 ( 2734 PWs) bands (ev): -46.3970 -46.3970 -25.3517 -25.3512 -22.5509 -22.5506 -22.1487 -22.1487 -14.7463 -14.7453 -7.2339 -7.2339 -6.5037 -6.5037 -4.8515 -4.8457 -4.2644 -4.2377 -2.0487 -2.0276 -1.1947 -1.1946 7.2683 7.2690 7.3090 7.3100 7.6268 7.6281 7.6626 7.6635 9.2368 9.2371 9.3385 9.3385 9.8239 9.8256 9.8615 9.8637 9.9139 9.9141 12.0000 12.0082 12.2359 12.2385 12.3544 12.3560 14.3358 14.3374 k = 0.0000 0.0000 0.4592 ( 2736 PWs) bands (ev): -46.3970 -46.3969 -25.3482 -25.3475 -22.5512 -22.5506 -22.1488 -22.1488 -14.7659 -14.7645 -7.2308 -7.2307 -6.5040 -6.5040 -4.8541 -4.8459 -4.2471 -4.2075 -2.0455 -2.0138 -1.1906 -1.1904 7.2687 7.2697 7.3089 7.3104 7.6320 7.6340 7.6616 7.6630 9.2308 9.2312 9.3322 9.3323 9.8303 9.8328 9.8690 9.8723 9.9213 9.9215 11.9612 11.9734 12.1978 12.2011 12.3518 12.3536 14.3361 14.3384 k = 0.0000 0.0000 0.4468 ( 2740 PWs) bands (ev): -46.3969 -46.3969 -25.3432 -25.3424 -22.5514 -22.5507 -22.1491 -22.1491 -14.7930 -14.7912 -7.2266 -7.2264 -6.5043 -6.5043 -4.8566 -4.8465 -4.2207 -4.1686 -2.0390 -1.9965 -1.1849 -1.1847 7.2693 7.2707 7.3089 7.3109 7.6394 7.6419 7.6604 7.6622 9.2227 9.2233 9.3239 9.3239 9.8393 9.8426 9.8795 9.8838 9.9314 9.9317 11.9091 11.9249 12.1459 12.1496 12.3485 12.3503 14.3365 14.3394 k = 0.0000 0.0000 0.4344 ( 2738 PWs) bands (ev): -46.3969 -46.3968 -25.3369 -25.3358 -22.5517 -22.5508 -22.1494 -22.1494 -14.8273 -14.8251 -7.2214 -7.2212 -6.5048 -6.5048 -4.8588 -4.8473 -4.1856 -4.1215 -2.0289 -1.9757 -1.1776 -1.1773 7.2702 7.2718 7.3091 7.3115 7.6488 7.6513 7.6595 7.6612 9.2127 9.2134 9.3136 9.3137 9.8510 9.8551 9.8925 9.8978 9.9438 9.9442 11.8446 11.8638 12.0813 12.0851 12.3444 12.3460 14.3368 14.3402 k = 0.0000 0.0000 0.4220 ( 2740 PWs) bands (ev): -46.3968 -46.3967 -25.3291 -25.3278 -22.5521 -22.5510 -22.1497 -22.1497 -14.8684 -14.8659 -7.2155 -7.2152 -6.5054 -6.5053 -4.8604 -4.8480 -4.1426 -4.0670 -2.0152 -1.9512 -1.1688 -1.1684 7.2714 7.2733 7.3095 7.3123 7.6556 7.6587 7.6618 7.6656 9.2011 9.2019 9.3018 9.3019 9.8652 9.8700 9.9078 9.9141 9.9584 9.9588 11.7690 11.7912 12.0052 12.0090 12.3395 12.3409 14.3368 14.3407 k = 0.0000 0.0000 0.4096 ( 2732 PWs) bands (ev): -46.3967 -46.3966 -25.3199 -25.3184 -22.5525 -22.5512 -22.1501 -22.1501 -14.9160 -14.9131 -7.2089 -7.2086 -6.5060 -6.5060 -4.8613 -4.8483 -4.0924 -4.0055 -1.9977 -1.9229 -1.1584 -1.1579 7.2729 7.2749 7.3102 7.3134 7.6542 7.6585 7.6743 7.6791 9.1882 9.1891 9.2888 9.2889 9.8818 9.8875 9.9250 9.9323 9.9748 9.9753 11.6836 11.7086 11.9189 11.9227 12.3338 12.3351 14.3364 14.3406 k = 0.0000 0.0000 0.3972 ( 2732 PWs) bands (ev): -46.3966 -46.3965 -25.3095 -25.3077 -22.5529 -22.5514 -22.1506 -22.1506 -14.9695 -14.9663 -7.2021 -7.2016 -6.5067 -6.5067 -4.8613 -4.8482 -4.0355 -3.9377 -1.9764 -1.8906 -1.1466 -1.1459 7.2747 7.2769 7.3113 7.3148 7.6523 7.6573 7.6896 7.6948 9.1743 9.1752 9.2747 9.2748 9.9006 9.9072 9.9438 9.9522 9.9926 9.9932 11.5897 11.6171 11.8239 11.8276 12.3273 12.3285 14.3354 14.3398 k = 0.0000 0.0000 0.3848 ( 2740 PWs) bands (ev): -46.3965 -46.3964 -25.2979 -25.2959 -22.5534 -22.5517 -22.1511 -22.1511 -15.0285 -15.0250 -7.1950 -7.1944 -6.5076 -6.5076 -4.8605 -4.8474 -3.9728 -3.8643 -1.9510 -1.8544 -1.1333 -1.1325 7.2769 7.2791 7.3129 7.3166 7.6504 7.6562 7.7067 7.7124 9.1594 9.1604 9.2599 9.2600 9.9215 9.9292 9.9639 9.9735 10.0117 10.0123 11.4887 11.5181 11.7214 11.7250 12.3202 12.3212 14.3336 14.3382 k = 0.0000 0.0000 0.3723 ( 2740 PWs) bands (ev): -46.3963 -46.3963 -25.2849 -25.2828 -22.5539 -22.5521 -22.1517 -22.1517 -15.0924 -15.0887 -7.1880 -7.1873 -6.5085 -6.5085 -4.8588 -4.8458 -3.9050 -3.7861 -1.9212 -1.8138 -1.1187 -1.1177 7.2795 7.2817 7.3149 7.3189 7.6485 7.6553 7.7255 7.7316 9.1440 9.1450 9.2446 9.2447 9.9441 9.9532 9.9850 9.9961 10.0316 10.0324 11.3817 11.4128 11.6127 11.6162 12.3124 12.3133 14.3293 14.3357 k = 0.0000 0.0000 0.3599 ( 2736 PWs) bands (ev): -46.3962 -46.3961 -25.2707 -25.2684 -22.5544 -22.5524 -22.1524 -22.1523 -15.1608 -15.1569 -7.1811 -7.1803 -6.5095 -6.5095 -4.8561 -4.8435 -3.8329 -3.7040 -1.8868 -1.7688 -1.1027 -1.1016 7.2826 7.2847 7.3175 7.3217 7.6467 7.6547 7.7459 7.7523 9.1282 9.1291 9.2289 9.2290 9.9684 9.9792 10.0068 10.0197 10.0522 10.0531 11.2700 11.3024 11.4991 11.5025 12.3040 12.3048 14.2211 14.2567 k = 0.0000 0.0000 0.3475 ( 2728 PWs) bands (ev): -46.3961 -46.3960 -25.2554 -25.2529 -22.5549 -22.5528 -22.1530 -22.1530 -15.2329 -15.2289 -7.1745 -7.1736 -6.5105 -6.5105 -4.8527 -4.8405 -3.7573 -3.6187 -1.8474 -1.7193 -1.0856 -1.0843 7.2863 7.2881 7.3207 7.3251 7.6452 7.6546 7.7677 7.7745 9.1120 9.1130 9.2131 9.2132 9.9938 10.0068 10.0290 10.0443 10.0732 10.0742 11.1545 11.1880 11.3817 11.3850 12.2951 12.2958 14.0956 14.1340 k = 0.0000 0.0000 0.3351 ( 2728 PWs) bands (ev): -46.3959 -46.3958 -25.2391 -25.2365 -22.5555 -22.5533 -22.1538 -22.1537 -15.3084 -15.3043 -7.1683 -7.1673 -6.5116 -6.5116 -4.8485 -4.8367 -3.6790 -3.5314 -1.8027 -1.6649 -1.0672 -1.0657 7.2905 7.2919 7.3245 7.3291 7.6441 7.6549 7.7907 7.7979 9.0958 9.0967 9.1972 9.1973 10.0199 10.0359 10.0515 10.0698 10.0944 10.0954 11.0365 11.0705 11.2616 11.2648 12.2858 12.2863 13.9625 14.0035 k = 0.0000 0.0000 0.3227 ( 2724 PWs) bands (ev): -46.3957 -46.3956 -25.2219 -25.2192 -22.5561 -22.5537 -22.1545 -22.1545 -15.3866 -15.3824 -7.1626 -7.1615 -6.5128 -6.5128 -4.8435 -4.8323 -3.5989 -3.4430 -1.7524 -1.6057 -1.0478 -1.0459 7.2953 7.2962 7.3291 7.3339 7.6434 7.6559 7.8149 7.8225 9.0796 9.0805 9.1814 9.1815 10.0462 10.0660 10.0738 10.0959 10.1157 10.1166 10.9168 10.9511 11.1398 11.1430 12.2760 12.2765 13.8226 13.8662 k = 0.0000 0.0000 0.3103 ( 2714 PWs) bands (ev): -46.3956 -46.3955 -25.2039 -25.2010 -22.5566 -22.5541 -22.1552 -22.1552 -15.4669 -15.4627 -7.1575 -7.1562 -6.5140 -6.5140 -4.8380 -4.8273 -3.5178 -3.3545 -1.6960 -1.5415 -1.0274 -1.0251 7.3009 7.3010 7.3345 7.3395 7.6432 7.6576 7.8401 7.8481 9.0635 9.0644 9.1658 9.1659 10.0718 10.0950 10.0972 10.1218 10.1377 10.1377 10.7965 10.8308 11.0176 11.0207 12.2659 12.2663 13.6769 13.7228 k = 0.0000 0.0000 0.2979 ( 2717 PWs) bands (ev): -46.3954 -46.3953 -25.1851 -25.1821 -22.5572 -22.5546 -22.1560 -22.1560 -15.5489 -15.5447 -7.1529 -7.1516 -6.5152 -6.5152 -4.8319 -4.8217 -3.4366 -3.2672 -1.6333 -1.4722 -1.0061 -1.0032 7.3063 7.3072 7.3407 7.3460 7.6436 7.6602 7.8662 7.8745 9.0476 9.0484 9.1504 9.1505 10.0957 10.1158 10.1263 10.1447 10.1592 10.1625 10.6771 10.7109 10.8961 10.8993 12.2556 12.2558 13.5261 13.5741 k = 0.0000 0.0000 0.2855 ( 2713 PWs) bands (ev): -46.3952 -46.3951 -25.1655 -25.1624 -22.5578 -22.5551 -22.1569 -22.1568 -15.6320 -15.6278 -7.1490 -7.1476 -6.5165 -6.5165 -4.8254 -4.8157 -3.3560 -3.1819 -1.5641 -1.3982 -0.9839 -0.9802 7.3123 7.3144 7.3478 7.3533 7.6448 7.6638 7.8929 7.9016 9.0320 9.0328 9.1353 9.1355 10.1163 10.1335 10.1511 10.1622 10.1833 10.1916 10.5605 10.5932 10.7772 10.7805 12.2450 12.2451 13.3710 13.4209 k = 0.0000 0.0000 0.2731 ( 2713 PWs) bands (ev): -46.3950 -46.3949 -25.1455 -25.1423 -22.5584 -22.5556 -22.1577 -22.1577 -15.7157 -15.7115 -7.1456 -7.1442 -6.5178 -6.5178 -4.8185 -4.8093 -3.2768 -3.0996 -1.4883 -1.3196 -0.9609 -0.9559 7.3189 7.3224 7.3558 7.3617 7.6467 7.6685 7.9201 7.9292 9.0167 9.0175 9.1206 9.1208 10.1302 10.1442 10.1670 10.1735 10.2121 10.2234 10.4510 10.4811 10.6637 10.6672 12.2343 12.2344 13.2123 13.2639 k = 0.0000 0.0000 0.2606 ( 2713 PWs) bands (ev): -46.3948 -46.3947 -25.1250 -25.1217 -22.5590 -22.5561 -22.1586 -22.1586 -15.7994 -15.7953 -7.1428 -7.1414 -6.5191 -6.5191 -4.8113 -4.8026 -3.1995 -3.0211 -1.4061 -1.2370 -0.9371 -0.9301 7.3262 7.3315 7.3648 7.3712 7.6494 7.6743 7.9476 7.9572 9.0019 9.0027 9.1064 9.1065 10.1288 10.1365 10.1716 10.1757 10.2425 10.2565 10.3607 10.3832 10.5609 10.5644 12.2234 12.2236 13.0508 13.1039 k = 0.0000 0.0000 0.2482 ( 2717 PWs) bands (ev): -46.3946 -46.3945 -25.1042 -25.1009 -22.5596 -22.5566 -22.1595 -22.1594 -15.8827 -15.8788 -7.1406 -7.1392 -6.5204 -6.5204 -4.8039 -4.7957 -3.1249 -2.9469 -1.3180 -1.1519 -0.9123 -0.9019 7.3341 7.3416 7.3749 7.3819 7.6531 7.6814 7.9752 7.9852 8.9875 8.9883 9.0925 9.0927 10.0903 10.0943 10.1558 10.1592 10.2669 10.2886 10.3177 10.3204 10.4783 10.4816 12.2125 12.2128 12.8873 12.9417 k = 0.0000 0.0000 0.2358 ( 2717 PWs) bands (ev): -46.3944 -46.3944 -25.0831 -25.0798 -22.5601 -22.5571 -22.1603 -22.1603 -15.9652 -15.9613 -7.1389 -7.1375 -6.5218 -6.5218 -4.7963 -4.7887 -3.0532 -2.8775 -1.2249 -1.0666 -0.8864 -0.8695 7.3428 7.3528 7.3862 7.3938 7.6578 7.6898 8.0025 8.0130 8.9737 8.9744 9.0792 9.0793 10.0057 10.0187 10.1074 10.1113 10.2778 10.2938 10.3295 10.3314 10.4267 10.4293 12.2014 12.2019 12.7224 12.7780 k = 0.0000 0.0000 0.2234 ( 2713 PWs) bands (ev): -46.3943 -46.3942 -25.0620 -25.0586 -22.5606 -22.5576 -22.1612 -22.1611 -16.0463 -16.0426 -7.1377 -7.1363 -6.5231 -6.5231 -4.7887 -4.7816 -2.9848 -2.8132 -1.1284 -0.9867 -0.8583 -0.8280 7.3523 7.3653 7.3986 7.4070 7.6634 7.6997 8.0294 8.0404 8.9603 8.9611 9.0664 9.0665 9.9045 9.9203 10.0297 10.0343 10.2902 10.2991 10.3629 10.3637 10.4053 10.4071 12.1901 12.1910 12.5571 12.6137 k = 0.0000 0.0000 0.2110 ( 2717 PWs) bands (ev): -46.3941 -46.3940 -25.0409 -25.0376 -22.5611 -22.5581 -22.1620 -22.1620 -16.1257 -16.1221 -7.1368 -7.1355 -6.5244 -6.5244 -4.7811 -4.7744 -2.9200 -2.7539 -1.0317 -0.9212 -0.8261 -0.7693 7.3626 7.3789 7.4123 7.4217 7.6700 7.7109 8.0556 8.0671 8.9475 8.9483 9.0541 9.0542 9.7991 9.8144 9.9357 9.9411 10.3059 10.3122 10.3969 10.3975 10.4028 10.4049 12.1780 12.1793 12.3928 12.4501 k = 0.0000 0.0000 0.1986 ( 2709 PWs) bands (ev): -46.3939 -46.3938 -25.0199 -25.0166 -22.5615 -22.5585 -22.1628 -22.1628 -16.2029 -16.1995 -7.1364 -7.1351 -6.5256 -6.5256 -4.7736 -4.7674 -2.8588 -2.6995 -0.9420 -0.8742 -0.7837 -0.6903 7.3738 7.3940 7.4272 7.4379 7.6777 7.7236 8.0806 8.0927 8.9353 8.9361 9.0423 9.0425 9.6940 9.7073 9.8353 9.8417 10.3228 10.3282 10.4083 10.4087 10.4325 10.4346 12.1610 12.1616 12.2362 12.2918 k = 0.0000 0.0000 0.1862 ( 2709 PWs) bands (ev): -46.3937 -46.3936 -24.9993 -24.9960 -22.5620 -22.5590 -22.1636 -22.1636 -16.2776 -16.2743 -7.1363 -7.1351 -6.5269 -6.5269 -4.7662 -4.7604 -2.8014 -2.6500 -0.8719 -0.8394 -0.7198 -0.5982 7.3859 7.4104 7.4436 7.4556 7.6863 7.7377 8.1040 8.1169 8.9237 8.9245 9.0310 9.0313 9.5910 9.6014 9.7339 9.7412 10.3399 10.3450 10.4188 10.4189 10.4672 10.4690 12.0538 12.0961 12.1704 12.1841 k = 0.0000 0.0000 0.1738 ( 2705 PWs) bands (ev): -46.3935 -46.3934 -24.9791 -24.9759 -22.5623 -22.5594 -22.1644 -22.1644 -16.3493 -16.3463 -7.1365 -7.1353 -6.5281 -6.5281 -4.7590 -4.7537 -2.7478 -2.6051 -0.8256 -0.8110 -0.6315 -0.5002 7.3990 7.4283 7.4612 7.4750 7.6958 7.7529 8.1256 8.1391 8.9126 8.9135 9.0203 9.0206 9.4914 9.4982 9.6341 9.6425 10.3566 10.3618 10.4310 10.4311 10.5012 10.5029 11.8969 11.9486 12.1572 12.1612 k = 0.0000 0.0000 0.1613 ( 2713 PWs) bands (ev): -46.3934 -46.3933 -24.9596 -24.9565 -22.5627 -22.5599 -22.1652 -22.1652 -16.4178 -16.4149 -7.1369 -7.1358 -6.5292 -6.5292 -4.7521 -4.7471 -2.6979 -2.5645 -0.7932 -0.7859 -0.5303 -0.4004 7.4130 7.4476 7.4803 7.4961 7.7060 7.7693 8.1447 8.1590 8.9021 8.9031 9.0102 9.0105 9.3958 9.3986 9.5377 9.5472 10.3726 10.3781 10.4438 10.4440 10.5342 10.5357 11.7404 11.7931 12.1474 12.1496 k = 0.0000 0.0000 0.1489 ( 2713 PWs) bands (ev): -46.3932 -46.3931 -24.9407 -24.9378 -22.5630 -22.5602 -22.1659 -22.1659 -16.4826 -16.4799 -7.1374 -7.1364 -6.5303 -6.5303 -4.7454 -4.7409 -2.6517 -2.5281 -0.7672 -0.7632 -0.4249 -0.3012 7.4281 7.4686 7.5008 7.5190 7.7167 7.7864 8.1608 8.1759 8.8920 8.8933 9.0005 9.0009 9.3033 9.3049 9.4461 9.4566 10.3877 10.3937 10.4566 10.4570 10.5660 10.5672 11.5877 11.6400 12.1387 12.1402 k = 0.0000 0.0000 0.1365 ( 2717 PWs) bands (ev): -46.3931 -46.3930 -24.9228 -24.9199 -22.5633 -22.5607 -22.1666 -22.1666 -16.5434 -16.5410 -7.1381 -7.1372 -6.5314 -6.5314 -4.7391 -4.7350 -2.6092 -2.4956 -0.7446 -0.7422 -0.3199 -0.2042 7.4442 7.4911 7.5226 7.5436 7.7278 7.8040 8.1734 8.1894 8.8823 8.8840 8.9914 8.9919 9.2132 9.2191 9.3602 9.3716 10.4019 10.4085 10.4690 10.4696 10.5963 10.5973 11.4402 11.4914 12.1306 12.1317 k = 0.0000 0.0000 0.1241 ( 2717 PWs) bands (ev): -46.3929 -46.3928 -24.9058 -24.9031 -22.5635 -22.5610 -22.1672 -22.1672 -16.6001 -16.5978 -7.1389 -7.1380 -6.5323 -6.5323 -4.7332 -4.7295 -2.5701 -2.4668 -0.7243 -0.7229 -0.2175 -0.1111 7.4614 7.5152 7.5457 7.5700 7.7389 7.8214 8.1818 8.1986 8.8728 8.8751 8.9827 8.9833 9.1292 9.1392 9.2812 9.2932 10.4148 10.4221 10.4806 10.4815 10.6249 10.6256 11.2992 11.3488 12.1232 12.1241 k = 0.0000 0.0000 0.1117 ( 2721 PWs) bands (ev): -46.3928 -46.3927 -24.8900 -24.8875 -22.5637 -22.5614 -22.1678 -22.1678 -16.6522 -16.6501 -7.1397 -7.1389 -6.5332 -6.5332 -4.7277 -4.7244 -2.5345 -2.4416 -0.7061 -0.7052 -0.1195 -0.0229 7.4797 7.5410 7.5697 7.5981 7.7497 7.8381 8.1855 8.2031 8.8630 8.8663 8.9743 8.9749 9.0527 9.0658 9.2099 9.2221 10.4265 10.4347 10.4913 10.4925 10.6515 10.6519 11.1659 11.2135 12.1165 12.1172 k = 0.0000 0.0000 0.0993 ( 2721 PWs) bands (ev): -46.3927 -46.3926 -24.8754 -24.8731 -22.5638 -22.5617 -22.1684 -22.1684 -16.6995 -16.6977 -7.1405 -7.1398 -6.5340 -6.5340 -4.7227 -4.7198 -2.5023 -2.4198 -0.6897 -0.6891 -0.0274 0.0590 7.4990 7.5682 7.5943 7.6279 7.7600 7.8531 8.1840 8.2024 8.8517 8.8571 8.9650 8.9659 8.9873 9.0002 9.1474 9.1592 10.4367 10.4460 10.5008 10.5024 10.6759 10.6760 11.0418 11.0868 12.1104 12.1109 k = 0.0000 0.0000 0.0869 ( 2737 PWs) bands (ev): -46.3926 -46.3925 -24.8624 -24.8604 -22.5640 -22.5621 -22.1689 -22.1689 -16.7418 -16.7402 -7.1413 -7.1407 -6.5348 -6.5348 -4.7182 -4.7157 -2.4734 -2.4014 -0.6751 -0.6747 0.0575 0.1335 7.5192 7.5969 7.6188 7.6591 7.7696 7.8655 8.1771 8.1959 8.8359 8.8460 8.9275 8.9419 8.9601 8.9627 9.0942 9.1050 10.4453 10.4559 10.5089 10.5111 10.6975 10.6980 10.9285 10.9704 12.1049 12.1054 k = 0.0000 0.0000 0.0745 ( 2745 PWs) bands (ev): -46.3925 -46.3924 -24.8507 -24.8490 -22.5641 -22.5624 -22.1694 -22.1694 -16.7789 -16.7775 -7.1421 -7.1416 -6.5354 -6.5354 -4.7142 -4.7120 -2.4478 -2.3862 -0.6623 -0.6620 0.1343 0.1996 7.5403 7.6269 7.6421 7.6914 7.7790 7.8742 8.1649 8.1838 8.8110 8.8290 8.8920 8.9002 8.9512 8.9546 9.0510 9.0600 10.4520 10.4642 10.5152 10.5182 10.7159 10.7176 10.8285 10.8661 12.1002 12.1006 k = 0.0000 0.0000 0.0621 ( 2741 PWs) bands (ev): -46.3924 -46.3924 -24.8406 -24.8391 -22.5641 -22.5627 -22.1698 -22.1698 -16.8106 -16.8094 -7.1428 -7.1423 -6.5360 -6.5360 -4.7108 -4.7090 -2.4255 -2.3742 -0.6513 -0.6512 0.2019 0.2565 7.5618 7.6579 7.6623 7.7244 7.7889 7.8782 8.1481 8.1665 8.7788 8.8025 8.8732 8.8756 8.9427 8.9470 9.0180 9.0246 10.4565 10.4704 10.5191 10.5237 10.7224 10.7344 10.7524 10.7758 12.0961 12.0964 k = 0.0000 0.0000 0.0496 ( 2741 PWs) bands (ev): -46.3923 -46.3923 -24.8322 -24.8310 -22.5641 -22.5629 -22.1701 -22.1701 -16.8367 -16.8358 -7.1433 -7.1430 -6.5364 -6.5364 -4.7079 -4.7064 -2.4063 -2.3653 -0.6423 -0.6422 0.2594 0.3032 7.5837 7.6769 7.6897 7.7572 7.8006 7.8765 8.1279 8.1450 8.7480 8.7720 8.8633 8.8637 8.9337 8.9389 8.9947 8.9986 10.4581 10.4737 10.5200 10.5269 10.6695 10.7020 10.7484 10.7511 12.0928 12.0930 k = 0.0000 0.0000 0.0372 ( 2741 PWs) bands (ev): -46.3923 -46.3922 -24.8255 -24.8246 -22.5640 -22.5631 -22.1703 -22.1703 -16.8572 -16.8565 -7.1438 -7.1435 -6.5368 -6.5368 -4.7056 -4.7045 -2.3903 -2.3596 -0.6352 -0.6351 0.3062 0.3391 7.6053 7.6840 7.7217 7.7886 7.8149 7.8687 8.1064 8.1212 8.7238 8.7445 8.8574 8.8575 8.9249 8.9302 8.9798 8.9815 10.4564 10.4717 10.5178 10.5274 10.6240 10.6473 10.7595 10.7607 12.0902 12.0904 k = 0.0000 0.0000 0.0248 ( 2739 PWs) bands (ev): -46.3922 -46.3922 -24.8207 -24.8201 -22.5639 -22.5633 -22.1705 -22.1705 -16.8718 -16.8713 -7.1441 -7.1439 -6.5371 -6.5371 -4.7039 -4.7032 -2.3774 -2.3569 -0.6301 -0.6301 0.3416 0.3635 7.6261 7.6830 7.7531 7.8161 7.8302 7.8548 8.0866 8.0980 8.7078 8.7229 8.8537 8.8539 8.9178 8.9221 8.9711 8.9716 10.4515 10.4628 10.5152 10.5250 10.5993 10.6126 10.7675 10.7682 12.0883 12.0885 k = 0.0000 0.0000 0.0124 ( 2743 PWs) bands (ev): -46.3922 -46.3922 -24.8178 -24.8175 -22.5638 -22.5635 -22.1706 -22.1706 -16.8806 -16.8803 -7.1443 -7.1442 -6.5372 -6.5372 -4.7028 -4.7024 -2.3676 -2.3574 -0.6270 -0.6270 0.3652 0.3762 7.6454 7.6752 7.7832 7.8341 7.8375 7.8422 8.0729 8.0792 8.7001 8.7081 8.8518 8.8519 8.9136 8.9159 8.9665 8.9666 10.4462 10.4517 10.5152 10.5210 10.5895 10.5950 10.7724 10.7727 12.0872 12.0873 k = 0.0000 0.0000 0.0000 ( 2741 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5637 -22.5637 -22.1706 -22.1706 -16.8834 -16.8834 -7.1443 -7.1443 -6.5373 -6.5373 -4.7023 -4.7023 -2.3610 -2.3610 -0.6260 -0.6260 0.3768 0.3768 7.6621 7.6621 7.8109 7.8109 7.8455 7.8455 8.0699 8.0699 8.7003 8.7003 8.8513 8.8513 8.9130 8.9130 8.9651 8.9651 10.4454 10.4454 10.5173 10.5173 10.5885 10.5885 10.7741 10.7741 12.0869 12.0869 k = 0.0000 0.0000 0.0000 ( 2741 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5637 -22.5637 -22.1706 -22.1706 -16.8834 -16.8834 -7.1443 -7.1443 -6.5373 -6.5373 -4.7023 -4.7023 -2.3610 -2.3610 -0.6260 -0.6260 0.3768 0.3768 7.6621 7.6621 7.8109 7.8109 7.8455 7.8455 8.0699 8.0699 8.7003 8.7003 8.8513 8.8513 8.9130 8.9130 8.9651 8.9651 10.4454 10.4454 10.5173 10.5173 10.5885 10.5885 10.7741 10.7741 12.0869 12.0869 k =-0.0089 0.0089 0.0000 ( 2743 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5637 -22.5637 -22.1706 -22.1706 -16.8833 -16.8833 -7.1438 -7.1438 -6.5371 -6.5371 -4.7029 -4.7029 -2.3605 -2.3605 -0.6256 -0.6256 0.3770 0.3770 7.6583 7.6583 7.8068 7.8068 7.8437 7.8437 8.0629 8.0629 8.7067 8.7067 8.8480 8.8480 8.9205 8.9205 8.9640 8.9640 10.4309 10.4309 10.5185 10.5185 10.6005 10.6005 10.7737 10.7737 12.0902 12.0902 k =-0.0179 0.0178 0.0000 ( 2751 PWs) bands (ev): -46.3922 -46.3922 -24.8167 -24.8167 -22.5639 -22.5639 -22.1709 -22.1709 -16.8830 -16.8830 -7.1424 -7.1424 -6.5366 -6.5366 -4.7045 -4.7045 -2.3593 -2.3593 -0.6246 -0.6246 0.3778 0.3778 7.6467 7.6467 7.7945 7.7945 7.8387 7.8387 8.0425 8.0425 8.7253 8.7253 8.8382 8.8382 8.9424 8.9424 8.9607 8.9607 10.3977 10.3977 10.5192 10.5192 10.6290 10.6290 10.7727 10.7727 12.1001 12.1001 k =-0.0268 0.0267 0.0000 ( 2743 PWs) bands (ev): -46.3922 -46.3922 -24.8166 -24.8166 -22.5641 -22.5641 -22.1711 -22.1711 -16.8825 -16.8825 -7.1399 -7.1399 -6.5357 -6.5357 -4.7072 -4.7072 -2.3572 -2.3572 -0.6228 -0.6228 0.3790 0.3790 7.6276 7.6276 7.7749 7.7749 7.8307 7.8307 8.0107 8.0107 8.7550 8.7550 8.8219 8.8219 8.9554 8.9554 8.9769 8.9769 10.3565 10.3565 10.5185 10.5185 10.6641 10.6641 10.7710 10.7710 12.1165 12.1165 k =-0.0357 0.0356 0.0000 ( 2737 PWs) bands (ev): -46.3922 -46.3922 -24.8165 -24.8165 -22.5644 -22.5644 -22.1714 -22.1714 -16.8818 -16.8818 -7.1364 -7.1364 -6.5346 -6.5346 -4.7110 -4.7110 -2.3543 -2.3543 -0.6205 -0.6205 0.3808 0.3808 7.6010 7.6010 7.7492 7.7492 7.8201 7.8201 7.9698 7.9698 8.7940 8.7940 8.7996 8.7996 8.9484 8.9484 9.0214 9.0214 10.3117 10.3117 10.5166 10.5166 10.7012 10.7012 10.7691 10.7691 12.1390 12.1390 k =-0.0446 0.0445 0.0000 ( 2721 PWs) bands (ev): -46.3921 -46.3921 -24.8165 -24.8165 -22.5647 -22.5647 -22.1718 -22.1718 -16.8809 -16.8809 -7.1320 -7.1320 -6.5330 -6.5330 -4.7158 -4.7158 -2.3508 -2.3508 -0.6174 -0.6174 0.3831 0.3831 7.5677 7.5677 7.7183 7.7183 7.8068 7.8068 7.9221 7.9221 8.7709 8.7709 8.8411 8.8411 8.9402 8.9402 9.0739 9.0739 10.2647 10.2647 10.5141 10.5141 10.7365 10.7365 10.7687 10.7687 12.1673 12.1673 k =-0.0536 0.0534 0.0000 ( 2719 PWs) bands (ev): -46.3921 -46.3921 -24.8164 -24.8164 -22.5652 -22.5652 -22.1723 -22.1723 -16.8799 -16.8799 -7.1267 -7.1267 -6.5312 -6.5312 -4.7214 -4.7214 -2.3466 -2.3466 -0.6139 -0.6139 0.3858 0.3858 7.5286 7.5286 7.6829 7.6829 7.7908 7.7908 7.8695 7.8695 8.7367 8.7367 8.8939 8.8939 8.9314 8.9314 9.1324 9.1324 10.2165 10.2165 10.5109 10.5109 10.7536 10.7536 10.7857 10.7857 12.2009 12.2009 k =-0.0625 0.0623 0.0000 ( 2723 PWs) bands (ev): -46.3921 -46.3921 -24.8164 -24.8164 -22.5659 -22.5659 -22.1730 -22.1730 -16.8786 -16.8786 -7.1203 -7.1203 -6.5290 -6.5290 -4.7279 -4.7279 -2.3418 -2.3418 -0.6097 -0.6097 0.3891 0.3891 7.4849 7.4849 7.6434 7.6434 7.7714 7.7714 7.8141 7.8141 8.6971 8.6971 8.9209 8.9209 8.9530 8.9530 9.1955 9.1955 10.1675 10.1675 10.5071 10.5071 10.7518 10.7518 10.8205 10.8205 12.2394 12.2394 k =-0.0714 0.0712 0.0000 ( 2719 PWs) bands (ev): -46.3921 -46.3921 -24.8164 -24.8164 -22.5665 -22.5665 -22.1737 -22.1737 -16.8772 -16.8772 -7.1131 -7.1131 -6.5266 -6.5266 -4.7352 -4.7352 -2.3365 -2.3365 -0.6052 -0.6052 0.3928 0.3928 7.4375 7.4375 7.6000 7.6000 7.7431 7.7431 7.7622 7.7622 8.6526 8.6526 8.9122 8.9122 9.0144 9.0144 9.2619 9.2619 10.1180 10.1180 10.5029 10.5029 10.7469 10.7469 10.8571 10.8571 12.2822 12.2822 k =-0.0804 0.0801 0.0000 ( 2709 PWs) bands (ev): -46.3920 -46.3920 -24.8163 -24.8163 -22.5672 -22.5672 -22.1745 -22.1745 -16.8756 -16.8756 -7.1049 -7.1049 -6.5238 -6.5238 -4.7431 -4.7431 -2.3309 -2.3309 -0.6002 -0.6002 0.3969 0.3969 7.3876 7.3876 7.5530 7.5530 7.6899 7.6899 7.7305 7.7305 8.6035 8.6035 8.9040 8.9040 9.0792 9.0792 9.3310 9.3310 10.0683 10.0683 10.4983 10.4983 10.7410 10.7410 10.8935 10.8935 12.3290 12.3290 k =-0.0893 0.0890 0.0000 ( 2705 PWs) bands (ev): -46.3920 -46.3920 -24.8162 -24.8162 -22.5681 -22.5681 -22.1754 -22.1754 -16.8738 -16.8738 -7.0958 -7.0958 -6.5207 -6.5207 -4.7516 -4.7516 -2.3250 -2.3250 -0.5949 -0.5949 0.4015 0.4015 7.3358 7.3358 7.5026 7.5026 7.6294 7.6294 7.7017 7.7017 8.5502 8.5502 8.8970 8.8970 9.1462 9.1462 9.4020 9.4020 10.0188 10.0188 10.4933 10.4933 10.7343 10.7343 10.9293 10.9293 12.3792 12.3792 k =-0.0982 0.0979 0.0000 ( 2705 PWs) bands (ev): -46.3919 -46.3919 -24.8161 -24.8161 -22.5690 -22.5690 -22.1765 -22.1765 -16.8719 -16.8719 -7.0858 -7.0858 -6.5173 -6.5173 -4.7605 -4.7605 -2.3189 -2.3189 -0.5894 -0.5894 0.4064 0.4064 7.2829 7.2829 7.4493 7.4493 7.5676 7.5676 7.6701 7.6701 8.4932 8.4932 8.8918 8.8918 9.2150 9.2150 9.4745 9.4745 9.9697 9.9697 10.4880 10.4880 10.7270 10.7270 10.9644 10.9644 12.4323 12.4323 k =-0.1071 0.1068 0.0000 ( 2713 PWs) bands (ev): -46.3919 -46.3919 -24.8161 -24.8161 -22.5701 -22.5701 -22.1776 -22.1776 -16.8698 -16.8698 -7.0750 -7.0750 -6.5137 -6.5137 -4.7697 -4.7697 -2.3127 -2.3127 -0.5838 -0.5838 0.4118 0.4118 7.2293 7.2293 7.3934 7.3934 7.5053 7.5053 7.6351 7.6351 8.4329 8.4329 8.8889 8.8889 9.2850 9.2850 9.5480 9.5480 9.9213 9.9213 10.4825 10.4825 10.7192 10.7192 10.9986 10.9986 12.4879 12.4879 k =-0.1161 0.1157 0.0000 ( 2716 PWs) bands (ev): -46.3919 -46.3919 -24.8160 -24.8160 -22.5712 -22.5712 -22.1788 -22.1788 -16.8676 -16.8676 -7.0632 -7.0632 -6.5098 -6.5098 -4.7793 -4.7793 -2.3065 -2.3065 -0.5782 -0.5782 0.4175 0.4175 7.1754 7.1754 7.3352 7.3352 7.4431 7.4431 7.5965 7.5965 8.3697 8.3697 8.8884 8.8884 9.3557 9.3557 9.6222 9.6222 9.8739 9.8739 10.4769 10.4769 10.7110 10.7110 11.0319 11.0319 12.5457 12.5457 k =-0.1250 0.1246 0.0000 ( 2712 PWs) bands (ev): -46.3918 -46.3918 -24.8159 -24.8159 -22.5723 -22.5723 -22.1801 -22.1801 -16.8652 -16.8652 -7.0507 -7.0507 -6.5056 -6.5056 -4.7889 -4.7889 -2.3005 -2.3005 -0.5726 -0.5726 0.4235 0.4235 7.1215 7.1215 7.2752 7.2752 7.3810 7.3810 7.5542 7.5543 8.3040 8.3040 8.8907 8.8907 9.4269 9.4269 9.6968 9.6968 9.8280 9.8280 10.4711 10.4711 10.7026 10.7026 11.0643 11.0643 12.6052 12.6052 k =-0.1339 0.1335 0.0000 ( 2712 PWs) bands (ev): -46.3918 -46.3918 -24.8158 -24.8158 -22.5735 -22.5735 -22.1814 -22.1814 -16.8627 -16.8627 -7.0374 -7.0374 -6.5012 -6.5012 -4.7986 -4.7986 -2.2946 -2.2946 -0.5672 -0.5672 0.4299 0.4299 7.0678 7.0678 7.2136 7.2136 7.3194 7.3194 7.5086 7.5086 8.2362 8.2362 8.8958 8.8958 9.4979 9.4979 9.7669 9.7669 9.7883 9.7883 10.4653 10.4653 10.6940 10.6940 11.0957 11.0957 12.6661 12.6661 k =-0.1429 0.1424 0.0000 ( 2714 PWs) bands (ev): -46.3917 -46.3917 -24.8157 -24.8157 -22.5748 -22.5748 -22.1829 -22.1829 -16.8600 -16.8600 -7.0232 -7.0232 -6.4966 -6.4966 -4.8083 -4.8083 -2.2890 -2.2890 -0.5621 -0.5621 0.4364 0.4364 7.0145 7.0145 7.1510 7.1510 7.2584 7.2584 7.4596 7.4596 8.1666 8.1666 8.9039 8.9039 9.5684 9.5684 9.7390 9.7390 9.8488 9.8488 10.4595 10.4595 10.6856 10.6856 11.1261 11.1261 12.7282 12.7282 k =-0.1518 0.1513 0.0000 ( 2710 PWs) bands (ev): -46.3917 -46.3917 -24.8156 -24.8156 -22.5762 -22.5762 -22.1843 -22.1843 -16.8573 -16.8573 -7.0083 -7.0083 -6.4918 -6.4918 -4.8178 -4.8178 -2.2837 -2.2837 -0.5574 -0.5574 0.4432 0.4432 6.9617 6.9617 7.0876 7.0876 7.1981 7.1981 7.4077 7.4077 8.0957 8.0957 8.9148 8.9148 9.6365 9.6365 9.7002 9.7002 9.9236 9.9236 10.4537 10.4537 10.6775 10.6775 11.1554 11.1554 12.7911 12.7911 k =-0.1607 0.1602 0.0000 ( 2714 PWs) bands (ev): -46.3916 -46.3916 -24.8156 -24.8156 -22.5776 -22.5776 -22.1859 -22.1859 -16.8545 -16.8545 -6.9927 -6.9927 -6.4867 -6.4867 -4.8271 -4.8271 -2.2789 -2.2789 -0.5532 -0.5532 0.4502 0.4502 6.9096 6.9096 7.0238 7.0238 7.1386 7.1386 7.3530 7.3530 8.0238 8.0238 8.9286 8.9286 9.6541 9.6541 9.7126 9.7126 9.9985 9.9985 10.4480 10.4480 10.6700 10.6700 11.1837 11.1837 12.8547 12.8547 k =-0.1696 0.1691 0.0000 ( 2714 PWs) bands (ev): -46.3915 -46.3915 -24.8155 -24.8155 -22.5790 -22.5790 -22.1874 -22.1874 -16.8515 -16.8515 -6.9764 -6.9764 -6.4815 -6.4815 -4.8362 -4.8362 -2.2745 -2.2745 -0.5496 -0.5496 0.4573 0.4573 6.8579 6.8579 6.9599 6.9599 7.0800 7.0800 7.2959 7.2959 7.9512 7.9512 8.9452 8.9452 9.6198 9.6198 9.7776 9.7776 10.0732 10.0732 10.4425 10.4425 10.6635 10.6635 11.2109 11.2109 12.9185 12.9185 k =-0.1786 0.1780 0.0000 ( 2714 PWs) bands (ev): -46.3915 -46.3915 -24.8153 -24.8153 -22.5805 -22.5805 -22.1891 -22.1891 -16.8485 -16.8485 -6.9594 -6.9594 -6.4761 -6.4761 -4.8449 -4.8449 -2.2707 -2.2707 -0.5467 -0.5467 0.4646 0.4646 6.8067 6.8067 6.8964 6.8964 7.0225 7.0225 7.2368 7.2368 7.8785 7.8785 8.9643 8.9643 9.5862 9.5862 9.8423 9.8423 10.1474 10.1474 10.4370 10.4370 10.6585 10.6585 11.2369 11.2369 12.9826 12.9826 k =-0.1875 0.1869 0.0000 ( 2718 PWs) bands (ev): -46.3914 -46.3914 -24.8152 -24.8152 -22.5821 -22.5821 -22.1908 -22.1908 -16.8454 -16.8454 -6.9418 -6.9418 -6.4706 -6.4706 -4.8532 -4.8532 -2.2674 -2.2674 -0.5446 -0.5446 0.4718 0.4718 6.7557 6.7557 6.8338 6.8338 6.9660 6.9660 7.1759 7.1759 7.8057 7.8057 8.9859 8.9859 9.5550 9.5550 9.9042 9.9042 10.2211 10.2211 10.4317 10.4317 10.6556 10.6556 11.2619 11.2619 13.0466 13.0466 k =-0.1964 0.1958 0.0000 ( 2714 PWs) bands (ev): -46.3914 -46.3914 -24.8150 -24.8150 -22.5837 -22.5837 -22.1925 -22.1925 -16.8423 -16.8423 -6.9236 -6.9236 -6.4649 -6.4649 -4.8610 -4.8610 -2.2647 -2.2647 -0.5433 -0.5433 0.4791 0.4791 6.7043 6.7043 6.7728 6.7728 6.9106 6.9106 7.1137 7.1137 7.7334 7.7334 9.0097 9.0097 9.5268 9.5268 9.9623 9.9623 10.2941 10.2941 10.4266 10.4266 10.6557 10.6557 11.2857 11.2857 13.1105 13.1105 k =-0.2054 0.2047 0.0000 ( 2714 PWs) bands (ev): -46.3913 -46.3913 -24.8149 -24.8149 -22.5852 -22.5852 -22.1943 -22.1943 -16.8391 -16.8391 -6.9048 -6.9048 -6.4591 -6.4591 -4.8684 -4.8684 -2.2626 -2.2626 -0.5430 -0.5430 0.4864 0.4864 6.6516 6.6516 6.7146 6.7146 6.8564 6.8564 7.0503 7.0503 7.6618 7.6618 9.0356 9.0356 9.5017 9.5017 10.0156 10.0156 10.3663 10.3663 10.4217 10.4217 10.6597 10.6597 11.3084 11.3084 13.1740 13.1740 k =-0.2143 0.2136 0.0000 ( 2718 PWs) bands (ev): -46.3912 -46.3912 -24.8148 -24.8148 -22.5869 -22.5869 -22.1960 -22.1960 -16.8358 -16.8358 -6.8855 -6.8855 -6.4532 -6.4532 -4.8753 -4.8753 -2.2611 -2.2611 -0.5436 -0.5436 0.4937 0.4937 6.5966 6.5966 6.6601 6.6601 6.8034 6.8034 6.9862 6.9862 7.5913 7.5913 9.0634 9.0634 9.4800 9.4800 10.0628 10.0628 10.4168 10.4168 10.4377 10.4377 10.6686 10.6686 11.3299 11.3299 13.2369 13.2369 k =-0.2232 0.2225 0.0000 ( 2714 PWs) bands (ev): -46.3912 -46.3912 -24.8147 -24.8147 -22.5885 -22.5885 -22.1978 -22.1978 -16.8326 -16.8326 -6.8657 -6.8657 -6.4472 -6.4472 -4.8817 -4.8817 -2.2603 -2.2603 -0.5453 -0.5453 0.5008 0.5008 6.5391 6.5391 6.6098 6.6098 6.7518 6.7518 6.9217 6.9217 7.5221 7.5221 9.0929 9.0929 9.4618 9.4618 10.1028 10.1028 10.4124 10.4124 10.5078 10.5078 10.6835 10.6835 11.3503 11.3503 13.2993 13.2993 k =-0.2321 0.2314 0.0000 ( 2716 PWs) bands (ev): -46.3911 -46.3911 -24.8146 -24.8146 -22.5902 -22.5902 -22.1996 -22.1996 -16.8293 -16.8293 -6.8454 -6.8454 -6.4412 -6.4412 -4.8875 -4.8875 -2.2601 -2.2601 -0.5479 -0.5479 0.5079 0.5079 6.4796 6.4796 6.5633 6.5633 6.7014 6.7014 6.8569 6.8569 7.4544 7.4544 9.1240 9.1240 9.4472 9.4472 10.1348 10.1348 10.4082 10.4082 10.5769 10.5769 10.7052 10.7052 11.3695 11.3695 13.3608 13.3608 k =-0.2411 0.2403 0.0000 ( 2716 PWs) bands (ev): -46.3910 -46.3910 -24.8144 -24.8144 -22.5918 -22.5918 -22.2015 -22.2015 -16.8260 -16.8260 -6.8247 -6.8247 -6.4351 -6.4351 -4.8928 -4.8928 -2.2605 -2.2605 -0.5517 -0.5517 0.5148 0.5148 6.4189 6.4189 6.5197 6.5197 6.6524 6.6524 6.7922 6.7922 7.3886 7.3886 9.1565 9.1565 9.4364 9.4364 10.1584 10.1584 10.4042 10.4042 10.6446 10.6446 10.7340 10.7340 11.3875 11.3875 13.4215 13.4215 k =-0.2500 0.2492 0.0000 ( 2712 PWs) bands (ev): -46.3909 -46.3909 -24.8143 -24.8143 -22.5935 -22.5935 -22.2033 -22.2033 -16.8227 -16.8227 -6.8036 -6.8036 -6.4289 -6.4289 -4.8976 -4.8976 -2.2616 -2.2616 -0.5564 -0.5564 0.5216 0.5216 6.3577 6.3577 6.4785 6.4785 6.6048 6.6048 6.7279 6.7279 7.3249 7.3249 9.1902 9.1902 9.4295 9.4295 10.1740 10.1740 10.4005 10.4005 10.7107 10.7107 10.7697 10.7697 11.4044 11.4044 13.4812 13.4812 k =-0.2589 0.2581 0.0000 ( 2708 PWs) bands (ev): -46.3909 -46.3909 -24.8141 -24.8141 -22.5951 -22.5951 -22.2051 -22.2051 -16.8194 -16.8194 -6.7822 -6.7822 -6.4228 -6.4228 -4.9020 -4.9020 -2.2634 -2.2634 -0.5622 -0.5622 0.5282 0.5282 6.2963 6.2963 6.4394 6.4394 6.5586 6.5586 6.6640 6.6640 7.2634 7.2634 9.2250 9.2250 9.4265 9.4265 10.1826 10.1826 10.3969 10.3969 10.7747 10.7747 10.8118 10.8118 11.4202 11.4202 13.5397 13.5397 k =-0.2679 0.2670 0.0000 ( 2714 PWs) bands (ev): -46.3908 -46.3908 -24.8140 -24.8140 -22.5968 -22.5968 -22.2069 -22.2069 -16.8162 -16.8162 -6.7606 -6.7606 -6.4167 -6.4167 -4.9058 -4.9058 -2.2657 -2.2657 -0.5689 -0.5689 0.5346 0.5346 6.2349 6.2349 6.4020 6.4020 6.5138 6.5138 6.6010 6.6010 7.2043 7.2043 9.2606 9.2606 9.4276 9.4276 10.1851 10.1851 10.3934 10.3934 10.8355 10.8355 10.8601 10.8601 11.4348 11.4348 13.5971 13.5971 k =-0.2768 0.2759 0.0000 ( 2710 PWs) bands (ev): -46.3907 -46.3907 -24.8139 -24.8139 -22.5984 -22.5984 -22.2087 -22.2087 -16.8129 -16.8129 -6.7387 -6.7387 -6.4106 -6.4106 -4.9092 -4.9092 -2.2686 -2.2686 -0.5766 -0.5766 0.5409 0.5409 6.1739 6.1739 6.3664 6.3664 6.4705 6.4705 6.5389 6.5389 7.1478 7.1478 9.2968 9.2968 9.4327 9.4327 10.1829 10.1829 10.3900 10.3900 10.8919 10.8919 10.9144 10.9144 11.4482 11.4482 13.6530 13.6530 k =-0.2857 0.2848 0.0000 ( 2714 PWs) bands (ev): -46.3907 -46.3907 -24.8138 -24.8138 -22.6001 -22.6001 -22.2105 -22.2105 -16.8098 -16.8098 -6.7166 -6.7166 -6.4045 -6.4045 -4.9122 -4.9122 -2.2721 -2.2721 -0.5851 -0.5851 0.5469 0.5469 6.1133 6.1133 6.3323 6.3323 6.4286 6.4286 6.4781 6.4781 7.0938 7.0938 9.3335 9.3335 9.4419 9.4419 10.1770 10.1770 10.3866 10.3866 10.9456 10.9456 10.9719 10.9719 11.4605 11.4605 13.7076 13.7076 k =-0.2946 0.2937 0.0000 ( 2714 PWs) bands (ev): -46.3906 -46.3906 -24.8136 -24.8136 -22.6017 -22.6017 -22.2122 -22.2122 -16.8066 -16.8066 -6.6945 -6.6945 -6.3985 -6.3985 -4.9148 -4.9148 -2.2761 -2.2761 -0.5944 -0.5944 0.5528 0.5528 6.0534 6.0534 6.2996 6.2996 6.3879 6.3879 6.4191 6.4191 7.0425 7.0425 9.3704 9.3704 9.4553 9.4553 10.1684 10.1684 10.3832 10.3832 10.9985 10.9985 11.0297 11.0297 11.4716 11.4716 13.7606 13.7606 k =-0.3036 0.3026 0.0000 ( 2714 PWs) bands (ev): -46.3905 -46.3905 -24.8135 -24.8135 -22.6032 -22.6032 -22.2140 -22.2140 -16.8036 -16.8036 -6.6722 -6.6722 -6.3926 -6.3926 -4.9171 -4.9171 -2.2807 -2.2807 -0.6044 -0.6044 0.5584 0.5584 5.9941 5.9941 6.2684 6.2684 6.3472 6.3472 6.3631 6.3631 6.9939 6.9939 9.4069 9.4069 9.4731 9.4731 10.1576 10.1576 10.3796 10.3796 11.0512 11.0512 11.0863 11.0863 11.4816 11.4816 13.8120 13.8120 k =-0.3125 0.3115 0.0000 ( 2702 PWs) bands (ev): -46.3905 -46.3905 -24.8133 -24.8133 -22.6047 -22.6047 -22.2156 -22.2156 -16.8006 -16.8006 -6.6501 -6.6501 -6.3867 -6.3867 -4.9191 -4.9191 -2.2856 -2.2856 -0.6150 -0.6150 0.5639 0.5639 5.9358 5.9358 6.2383 6.2383 6.3000 6.3000 6.3172 6.3172 6.9479 6.9479 9.4427 9.4427 9.4954 9.4954 10.1454 10.1454 10.3759 10.3759 11.1034 11.1034 11.1414 11.1414 11.4905 11.4905 13.8617 13.8617 k =-0.3214 0.3204 0.0000 ( 2698 PWs) bands (ev): -46.3904 -46.3904 -24.8132 -24.8132 -22.6062 -22.6062 -22.2172 -22.2172 -16.7977 -16.7977 -6.6280 -6.6280 -6.3809 -6.3809 -4.9208 -4.9208 -2.2910 -2.2910 -0.6260 -0.6260 0.5692 0.5692 5.8785 5.8785 6.2087 6.2087 6.2484 6.2484 6.2801 6.2801 6.9046 6.9046 9.4772 9.4772 9.5224 9.5224 10.1320 10.1320 10.3719 10.3719 11.1548 11.1548 11.1947 11.1947 11.4982 11.4982 13.9096 13.9096 k =-0.3304 0.3293 0.0000 ( 2696 PWs) bands (ev): -46.3903 -46.3903 -24.8130 -24.8130 -22.6077 -22.6077 -22.2188 -22.2188 -16.7949 -16.7949 -6.6061 -6.6061 -6.3753 -6.3753 -4.9224 -4.9224 -2.2967 -2.2967 -0.6374 -0.6374 0.5743 0.5743 5.8225 5.8225 6.1763 6.1763 6.2016 6.2016 6.2460 6.2460 6.8638 6.8638 9.5105 9.5105 9.5538 9.5538 10.1180 10.1180 10.3677 10.3677 11.2050 11.2050 11.2461 11.2461 11.5049 11.5049 13.9557 13.9557 k =-0.3393 0.3383 0.0000 ( 2700 PWs) bands (ev): -46.3903 -46.3903 -24.8130 -24.8130 -22.6091 -22.6091 -22.2204 -22.2204 -16.7921 -16.7921 -6.5845 -6.5845 -6.3698 -6.3698 -4.9238 -4.9238 -2.3027 -2.3027 -0.6490 -0.6490 0.5791 0.5791 5.7678 5.7678 6.1346 6.1346 6.1673 6.1673 6.2138 6.2138 6.8256 6.8256 9.5433 9.5433 9.5884 9.5884 10.1035 10.1035 10.3632 10.3632 11.2539 11.2539 11.2953 11.2953 11.5105 11.5105 13.9997 13.9997 k =-0.3482 0.3472 0.0000 ( 2708 PWs) bands (ev): -46.3902 -46.3902 -24.8129 -24.8129 -22.6105 -22.6105 -22.2219 -22.2219 -16.7895 -16.7895 -6.5632 -6.5632 -6.3644 -6.3644 -4.9251 -4.9251 -2.3090 -2.3090 -0.6608 -0.6608 0.5837 0.5837 5.7148 5.7148 6.0881 6.0881 6.1411 6.1411 6.1834 6.1834 6.7899 6.7899 9.5764 9.5764 9.6249 9.6249 10.0888 10.0888 10.3582 10.3582 11.3010 11.3010 11.3424 11.3424 11.5151 11.5151 14.0417 14.0417 k =-0.3571 0.3561 0.0000 ( 2712 PWs) bands (ev): -46.3902 -46.3902 -24.8128 -24.8128 -22.6119 -22.6119 -22.2234 -22.2234 -16.7870 -16.7870 -6.5424 -6.5424 -6.3591 -6.3591 -4.9263 -4.9263 -2.3155 -2.3155 -0.6726 -0.6726 0.5882 0.5882 5.6636 5.6636 6.0422 6.0422 6.1178 6.1178 6.1549 6.1549 6.7566 6.7566 9.6103 9.6103 9.6624 9.6624 10.0742 10.0742 10.3529 10.3529 11.3461 11.3461 11.3872 11.3872 11.5189 11.5189 14.0816 14.0816 k =-0.3661 0.3650 0.0000 ( 2712 PWs) bands (ev): -46.3901 -46.3901 -24.8127 -24.8127 -22.6131 -22.6131 -22.2248 -22.2248 -16.7846 -16.7846 -6.5222 -6.5222 -6.3539 -6.3539 -4.9274 -4.9274 -2.3220 -2.3220 -0.6842 -0.6842 0.5924 0.5924 5.6144 5.6144 5.9981 5.9981 6.0964 6.0964 6.1282 6.1282 6.7256 6.7256 9.6450 9.6450 9.7005 9.7005 10.0597 10.0597 10.3470 10.3470 11.3888 11.3888 11.4296 11.4296 11.5221 11.5221 14.1193 14.1193 k =-0.3750 0.3739 0.0000 ( 2714 PWs) bands (ev): -46.3901 -46.3901 -24.8126 -24.8126 -22.6143 -22.6143 -22.2261 -22.2261 -16.7824 -16.7824 -6.5027 -6.5027 -6.3489 -6.3489 -4.9285 -4.9285 -2.3286 -2.3286 -0.6956 -0.6956 0.5964 0.5964 5.5673 5.5673 5.9562 5.9562 6.0763 6.0763 6.1035 6.1035 6.6969 6.6969 9.6803 9.6803 9.7386 9.7386 10.0456 10.0456 10.3406 10.3406 11.4287 11.4287 11.4692 11.4692 11.5254 11.5254 14.1548 14.1548 k =-0.3839 0.3828 0.0000 ( 2708 PWs) bands (ev): -46.3900 -46.3900 -24.8125 -24.8125 -22.6154 -22.6154 -22.2273 -22.2273 -16.7802 -16.7802 -6.4841 -6.4841 -6.3440 -6.3440 -4.9296 -4.9296 -2.3352 -2.3352 -0.7067 -0.7067 0.6002 0.6002 5.5227 5.5227 5.9167 5.9167 6.0574 6.0574 6.0808 6.0808 6.6704 6.6704 9.7159 9.7159 9.7767 9.7767 10.0320 10.0320 10.3335 10.3335 11.4642 11.4642 11.5048 11.5048 11.5313 11.5313 14.1880 14.1880 k =-0.3929 0.3917 0.0000 ( 2706 PWs) bands (ev): -46.3900 -46.3900 -24.8124 -24.8124 -22.6165 -22.6165 -22.2284 -22.2284 -16.7782 -16.7782 -6.4663 -6.4663 -6.3392 -6.3392 -4.9307 -4.9307 -2.3416 -2.3416 -0.7173 -0.7173 0.6037 0.6037 5.4806 5.4806 5.8797 5.8797 6.0394 6.0394 6.0603 6.0603 6.6461 6.6461 9.7514 9.7514 9.8144 9.8144 10.0190 10.0190 10.3258 10.3258 11.4909 11.4909 11.5307 11.5307 11.5498 11.5498 14.2188 14.2188 k =-0.4018 0.4006 0.0000 ( 2704 PWs) bands (ev): -46.3899 -46.3899 -24.8123 -24.8123 -22.6174 -22.6174 -22.2295 -22.2295 -16.7764 -16.7764 -6.4497 -6.4497 -6.3345 -6.3345 -4.9319 -4.9319 -2.3479 -2.3479 -0.7274 -0.7274 0.6070 0.6070 5.4411 5.4411 5.8454 5.8454 6.0224 6.0224 6.0420 6.0420 6.6238 6.6238 9.7864 9.7864 9.8515 9.8515 10.0068 10.0068 10.3174 10.3174 11.5029 11.5029 11.5544 11.5544 11.5793 11.5793 14.2472 14.2472 k =-0.4107 0.4095 0.0000 ( 2706 PWs) bands (ev): -46.3899 -46.3899 -24.8122 -24.8122 -22.6184 -22.6184 -22.2305 -22.2305 -16.7747 -16.7747 -6.4343 -6.4343 -6.3299 -6.3299 -4.9330 -4.9330 -2.3539 -2.3539 -0.7369 -0.7369 0.6100 0.6100 5.4046 5.4046 5.8138 5.8138 6.0062 6.0062 6.0260 6.0260 6.6036 6.6036 9.8205 9.8205 9.8877 9.8877 9.9956 9.9956 10.3083 10.3083 11.5055 11.5055 11.5816 11.5816 11.6087 11.6087 14.2732 14.2732 k =-0.4196 0.4184 0.0000 ( 2706 PWs) bands (ev): -46.3899 -46.3899 -24.8121 -24.8121 -22.6192 -22.6192 -22.2315 -22.2315 -16.7731 -16.7731 -6.4203 -6.4203 -6.3253 -6.3253 -4.9341 -4.9341 -2.3596 -2.3596 -0.7458 -0.7458 0.6128 0.6128 5.3711 5.3711 5.7850 5.7850 5.9910 5.9910 6.0121 6.0121 6.5854 6.5854 9.8533 9.8533 9.9221 9.9221 9.9859 9.9859 10.2983 10.2983 11.5048 11.5048 11.6085 11.6085 11.6358 11.6358 14.2968 14.2968 k =-0.4286 0.4273 0.0000 ( 2698 PWs) bands (ev): -46.3898 -46.3898 -24.8121 -24.8121 -22.6199 -22.6199 -22.2322 -22.2322 -16.7717 -16.7717 -6.4077 -6.4077 -6.3208 -6.3208 -4.9352 -4.9352 -2.3649 -2.3649 -0.7538 -0.7538 0.6153 0.6153 5.3408 5.3408 5.7591 5.7591 5.9770 5.9770 6.0001 6.0001 6.5692 6.5692 9.8846 9.8846 9.9516 9.9516 9.9807 9.9807 10.2876 10.2876 11.5026 11.5026 11.6334 11.6334 11.6604 11.6604 14.3179 14.3179 k =-0.4375 0.4362 0.0000 ( 2696 PWs) bands (ev): -46.3898 -46.3898 -24.8120 -24.8120 -22.6206 -22.6206 -22.2329 -22.2329 -16.7704 -16.7704 -6.3968 -6.3968 -6.3165 -6.3165 -4.9362 -4.9362 -2.3698 -2.3698 -0.7610 -0.7610 0.6175 0.6175 5.3137 5.3137 5.7360 5.7360 5.9644 5.9644 5.9898 5.9898 6.5550 6.5550 9.9140 9.9140 9.9596 9.9596 9.9964 9.9964 10.2760 10.2760 11.4996 11.4996 11.6558 11.6558 11.6822 11.6822 14.3366 14.3366 k =-0.4464 0.4451 0.0000 ( 2700 PWs) bands (ev): -46.3898 -46.3898 -24.8120 -24.8120 -22.6212 -22.6212 -22.2336 -22.2336 -16.7694 -16.7694 -6.3875 -6.3875 -6.3122 -6.3122 -4.9372 -4.9372 -2.3741 -2.3741 -0.7674 -0.7674 0.6195 0.6195 5.2900 5.2900 5.7160 5.7160 5.9534 5.9534 5.9810 5.9810 6.5427 6.5427 9.9410 9.9410 9.9546 9.9546 10.0240 10.0240 10.2637 10.2637 11.4964 11.4964 11.6754 11.6754 11.7013 11.7013 14.3527 14.3527 k =-0.4554 0.4540 0.0000 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8119 -24.8119 -22.6217 -22.6217 -22.2342 -22.2342 -16.7684 -16.7684 -6.3798 -6.3798 -6.3083 -6.3083 -4.9381 -4.9381 -2.3779 -2.3779 -0.7729 -0.7729 0.6212 0.6212 5.2698 5.2698 5.6989 5.6989 5.9440 5.9440 5.9736 5.9736 6.5323 6.5323 9.9482 9.9482 9.9661 9.9661 10.0511 10.0511 10.2506 10.2506 11.4932 11.4932 11.6921 11.6921 11.7176 11.7176 14.3663 14.3663 k =-0.4643 0.4629 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8119 -24.8119 -22.6221 -22.6221 -22.2346 -22.2346 -16.7677 -16.7677 -6.3736 -6.3736 -6.3047 -6.3047 -4.9389 -4.9389 -2.3810 -2.3810 -0.7774 -0.7774 0.6225 0.6225 5.2531 5.2531 5.6849 5.6849 5.9362 5.9362 5.9676 5.9676 6.5238 6.5238 9.9432 9.9432 9.9876 9.9876 10.0759 10.0759 10.2370 10.2370 11.4901 11.4901 11.7058 11.7058 11.7309 11.7309 14.3775 14.3775 k =-0.4732 0.4718 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8119 -24.8119 -22.6224 -22.6224 -22.2350 -22.2350 -16.7671 -16.7671 -6.3690 -6.3690 -6.3017 -6.3017 -4.9395 -4.9395 -2.3835 -2.3835 -0.7809 -0.7809 0.6236 0.6236 5.2401 5.2401 5.6740 5.6740 5.9302 5.9302 5.9630 5.9630 6.5173 6.5173 9.9390 9.9390 10.0055 10.0055 10.0981 10.0981 10.2231 10.2231 11.4875 11.4875 11.7166 11.7166 11.7414 11.7414 14.3862 14.3862 k =-0.4821 0.4807 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6226 -22.6226 -22.2352 -22.2352 -16.7667 -16.7667 -6.3658 -6.3658 -6.2995 -6.2995 -4.9399 -4.9399 -2.3853 -2.3853 -0.7835 -0.7835 0.6244 0.6244 5.2308 5.2308 5.6662 5.6662 5.9258 5.9258 5.9598 5.9598 6.5126 6.5126 9.9360 9.9360 10.0190 10.0190 10.1172 10.1172 10.2095 10.2095 11.4855 11.4855 11.7243 11.7243 11.7489 11.7489 14.3924 14.3924 k =-0.4911 0.4896 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6228 -22.2354 -22.2354 -16.7664 -16.7664 -6.3639 -6.3639 -6.2980 -6.2980 -4.9402 -4.9402 -2.3864 -2.3864 -0.7850 -0.7850 0.6248 0.6248 5.2251 5.2251 5.6615 5.6615 5.9232 5.9232 5.9578 5.9578 6.5097 6.5097 9.9342 9.9342 10.0275 10.0275 10.1317 10.1317 10.1980 10.1980 11.4843 11.4843 11.7289 11.7289 11.7534 11.7534 14.3961 14.3961 k =-0.5000 0.4985 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3633 -6.3633 -6.2976 -6.2976 -4.9403 -4.9403 -2.3868 -2.3868 -0.7855 -0.7855 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9224 5.9224 5.9572 5.9572 6.5088 6.5088 9.9336 9.9336 10.0304 10.0304 10.1378 10.1378 10.1929 10.1929 11.4839 11.4839 11.7304 11.7304 11.7549 11.7549 14.3973 14.3973 k =-0.5000 0.4985 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3633 -6.3633 -6.2976 -6.2976 -4.9403 -4.9403 -2.3868 -2.3868 -0.7855 -0.7855 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9224 5.9224 5.9572 5.9572 6.5088 6.5088 9.9336 9.9336 10.0304 10.0304 10.1378 10.1378 10.1929 10.1929 11.4839 11.4839 11.7304 11.7304 11.7549 11.7549 14.3973 14.3973 k =-0.4985 0.5000-0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3636 -6.3631 -6.2978 -6.2973 -4.9404 -4.9403 -2.3871 -2.3864 -0.7858 -0.7852 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9223 5.9224 5.9571 5.9572 6.5088 6.5088 9.9336 9.9336 10.0299 10.0307 10.1375 10.1378 10.1928 10.1934 11.4838 11.4839 11.7301 11.7307 11.7545 11.7551 14.3972 14.3973 k =-0.4985 0.5000-0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6229 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3636 -6.3631 -6.2978 -6.2973 -4.9404 -4.9403 -2.3871 -2.3864 -0.7858 -0.7852 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9223 5.9224 5.9571 5.9572 6.5088 6.5088 9.9336 9.9336 10.0299 10.0307 10.1375 10.1378 10.1928 10.1934 11.4838 11.4839 11.7301 11.7307 11.7545 11.7551 14.3972 14.3973 k =-0.4985 0.5000 0.0124 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8129 -24.8126 -22.6230 -22.6227 -22.2354 -22.2354 -16.7635 -16.7632 -6.3633 -6.3628 -6.2976 -6.2971 -4.9403 -4.9402 -2.3936 -2.3846 -0.7880 -0.7874 0.6119 0.6233 5.2230 5.2235 5.6599 5.6601 5.9260 5.9265 5.9608 5.9617 6.5078 6.5079 9.9346 9.9350 10.0281 10.0310 10.1365 10.1372 10.1928 10.1934 11.4894 11.4930 11.7290 11.7369 11.7560 11.7572 14.3974 14.3975 k =-0.4985 0.5000 0.0248 ( 2704 PWs) bands (ev): -46.3898 -46.3897 -24.8159 -24.8152 -22.6231 -22.6225 -22.2353 -22.2353 -16.7547 -16.7542 -6.3626 -6.3621 -6.2970 -6.2965 -4.9401 -4.9400 -2.4049 -2.3870 -0.7947 -0.7941 0.5842 0.6069 5.2226 5.2235 5.6597 5.6603 5.9373 5.9383 5.9727 5.9742 6.5050 6.5051 9.9378 9.9388 10.0245 10.0299 10.1337 10.1350 10.1929 10.1934 11.5084 11.5168 11.7326 11.7482 11.7622 11.7633 14.3980 14.3982 k =-0.4985 0.5000 0.0372 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8207 -24.8197 -22.6232 -22.6223 -22.2351 -22.2351 -16.7401 -16.7394 -6.3615 -6.3609 -6.2961 -6.2956 -4.9398 -4.9397 -2.4207 -2.3939 -0.8057 -0.8051 0.5423 0.5762 5.2222 5.2234 5.6597 5.6605 5.9561 5.9577 5.9928 5.9947 6.5002 6.5004 9.9432 9.9448 10.0196 10.0273 10.1293 10.1312 10.1930 10.1935 11.5385 11.5537 11.7409 11.7596 11.7744 11.7801 14.3990 14.3993 k =-0.4985 0.5000 0.0496 ( 2704 PWs) bands (ev): -46.3899 -46.3898 -24.8272 -24.8260 -22.6232 -22.6220 -22.2349 -22.2348 -16.7197 -16.7187 -6.3598 -6.3593 -6.2947 -6.2942 -4.9393 -4.9392 -2.4410 -2.4054 -0.8210 -0.8203 0.4867 0.5314 5.2217 5.2233 5.6597 5.6607 5.9821 5.9845 6.0209 6.0230 6.4937 6.4939 9.9507 9.9530 10.0136 10.0230 10.1232 10.1258 10.1932 10.1936 11.5754 11.5999 11.7536 11.7696 11.7948 11.8147 14.4005 14.4008 k =-0.4985 0.5000 0.0621 ( 2704 PWs) bands (ev): -46.3899 -46.3899 -24.8355 -24.8340 -22.6232 -22.6218 -22.2345 -22.2345 -16.6936 -16.6924 -6.3578 -6.3571 -6.2930 -6.2925 -4.9388 -4.9386 -2.4657 -2.4213 -0.8403 -0.8396 0.4181 0.4734 5.2212 5.2231 5.6600 5.6610 6.0152 6.0184 6.0570 6.0589 6.4853 6.4856 9.9599 9.9633 10.0067 10.0172 10.1157 10.1189 10.1934 10.1937 11.6139 11.6477 11.7689 11.7811 11.8328 11.8678 14.4023 14.4027 k =-0.4985 0.5000 0.0745 ( 2718 PWs) bands (ev): -46.3900 -46.3900 -24.8457 -24.8439 -22.6232 -22.6215 -22.2342 -22.2341 -16.6619 -16.6605 -6.3552 -6.3546 -6.2909 -6.2904 -4.9381 -4.9379 -2.4947 -2.4415 -0.8634 -0.8627 0.3374 0.4029 5.2207 5.2229 5.6604 5.6615 6.0551 6.0589 6.1006 6.1022 6.4753 6.4757 9.9697 9.9752 10.0000 10.0105 10.1066 10.1108 10.1936 10.1939 11.6498 11.6884 11.7852 11.7946 11.8979 11.9422 14.4045 14.4050 k =-0.4985 0.5000 0.0869 ( 2720 PWs) bands (ev): -46.3901 -46.3901 -24.8572 -24.8551 -22.6231 -22.6212 -22.2337 -22.2337 -16.6249 -16.6232 -6.3522 -6.3515 -6.2884 -6.2879 -4.9372 -4.9371 -2.5279 -2.4660 -0.8902 -0.8894 0.2457 0.3209 5.2203 5.2227 5.6610 5.6621 6.1014 6.1058 6.1516 6.1525 6.4637 6.4643 9.9755 9.9863 9.9978 10.0053 10.0962 10.1017 10.1940 10.1942 11.6818 11.7203 11.8026 11.8102 11.9909 12.0380 14.4071 14.4077 k =-0.4985 0.5000 0.0993 ( 2720 PWs) bands (ev): -46.3902 -46.3902 -24.8702 -24.8679 -22.6230 -22.6209 -22.2332 -22.2332 -16.5826 -16.5806 -6.3488 -6.3481 -6.2856 -6.2851 -4.9363 -4.9361 -2.5651 -2.4947 -0.9204 -0.9195 0.1439 0.2285 5.2201 5.2226 5.6618 5.6629 6.1540 6.1587 6.2094 6.2096 6.4507 6.4516 9.9708 9.9851 10.0064 10.0129 10.0845 10.0923 10.1943 10.1946 11.7109 11.7471 11.8214 11.8279 12.1064 12.1532 14.4101 14.4107 k =-0.4985 0.5000 0.1117 ( 2720 PWs) bands (ev): -46.3903 -46.3903 -24.8845 -24.8820 -22.6229 -22.6205 -22.2327 -22.2326 -16.5353 -16.5331 -6.3450 -6.3442 -6.2824 -6.2819 -4.9353 -4.9351 -2.6063 -2.5275 -0.9537 -0.9527 0.0333 0.1267 5.2200 5.2226 5.6627 5.6639 6.2124 6.2171 6.2728 6.2737 6.4365 6.4380 9.9611 9.9754 10.0188 10.0297 10.0718 10.0841 10.1947 10.1949 11.7385 11.7722 11.8418 11.8475 12.2398 12.2852 14.4134 14.4141 k =-0.4985 0.5000 0.1241 ( 2720 PWs) bands (ev): -46.3905 -46.3904 -24.9001 -24.8974 -22.6227 -22.6201 -22.2320 -22.2320 -16.4832 -16.4808 -6.3408 -6.3399 -6.2789 -6.2784 -4.9341 -4.9339 -2.6514 -2.5643 -0.9897 -0.9886 -0.0849 0.0169 5.2200 5.2226 5.6639 5.6650 6.2761 6.2806 6.3404 6.3436 6.4217 6.4249 9.9498 9.9637 10.0279 10.0492 10.0584 10.0810 10.1952 10.1954 11.7657 11.7970 11.8639 11.8691 12.3881 12.4318 14.4170 14.4178 k =-0.4985 0.5000 0.1365 ( 2716 PWs) bands (ev): -46.3906 -46.3905 -24.9168 -24.9139 -22.6224 -22.6197 -22.2314 -22.2313 -16.4266 -16.4239 -6.3362 -6.3353 -6.2751 -6.2746 -4.9329 -4.9327 -2.7001 -2.6049 -1.0283 -1.0270 -0.2095 -0.0998 5.2201 5.2228 5.6651 5.6662 6.3438 6.3482 6.3910 6.4008 6.4251 6.4341 9.9377 9.9511 10.0274 10.0435 10.0714 10.0886 10.1957 10.1959 11.7932 11.8225 11.8877 11.8925 12.5491 12.5913 14.4210 14.4219 k =-0.4985 0.5000 0.1489 ( 2714 PWs) bands (ev): -46.3908 -46.3907 -24.9345 -24.9314 -22.6221 -22.6193 -22.2306 -22.2306 -16.3657 -16.3629 -6.3312 -6.3302 -6.2710 -6.2705 -4.9315 -4.9313 -2.7524 -2.6494 -1.0690 -1.0676 -0.3392 -0.2221 5.2204 5.2230 5.6666 5.6676 6.3792 6.3805 6.4232 6.4252 6.5027 6.5054 9.9254 9.9381 10.0189 10.0288 10.0946 10.1055 10.1962 10.1964 11.8212 11.8491 11.9132 11.9177 12.7213 12.7620 14.4252 14.4262 k =-0.4985 0.5000 0.1613 ( 2712 PWs) bands (ev): -46.3909 -46.3909 -24.9531 -24.9499 -22.6217 -22.6188 -22.2298 -22.2298 -16.3009 -16.2978 -6.3258 -6.3248 -6.2667 -6.2662 -4.9301 -4.9299 -2.8083 -2.6977 -1.1117 -1.1100 -0.4726 -0.3487 5.2208 5.2234 5.6681 5.6691 6.3633 6.3644 6.4992 6.5008 6.5881 6.5895 9.9129 9.9249 10.0067 10.0136 10.1191 10.1269 10.1968 10.1970 11.8502 11.8768 11.9402 11.9445 12.9034 12.9426 14.4297 14.4307 k =-0.4985 0.5000 0.1738 ( 2712 PWs) bands (ev): -46.3911 -46.3910 -24.9724 -24.9691 -22.6213 -22.6184 -22.2290 -22.2290 -16.2324 -16.2292 -6.3201 -6.3192 -6.2621 -6.2616 -4.9287 -4.9284 -2.8675 -2.7497 -1.1562 -1.1539 -0.6085 -0.4784 5.2212 5.2238 5.6698 5.6707 6.3447 6.3455 6.5804 6.5813 6.6777 6.6786 9.9006 9.9118 9.9931 9.9985 10.1447 10.1509 10.1974 10.1976 11.8802 11.9058 11.9688 11.9729 13.0940 13.1319 14.4344 14.4355 k =-0.4985 0.5000 0.1862 ( 2704 PWs) bands (ev): -46.3913 -46.3912 -24.9921 -24.9888 -22.6209 -22.6179 -22.2282 -22.2282 -16.1607 -16.1572 -6.3142 -6.3132 -6.2573 -6.2568 -4.9272 -4.9269 -2.9300 -2.8054 -1.2022 -1.1992 -0.7453 -0.6099 5.2218 5.2243 5.6716 5.6724 6.3250 6.3257 6.6646 6.6658 6.7708 6.7716 9.8887 9.8990 9.9791 9.9835 10.1713 10.1764 10.1981 10.1982 11.9113 11.9360 11.9990 12.0030 13.2920 13.3288 14.4393 14.4405 k =-0.4985 0.5000 0.1986 ( 2712 PWs) bands (ev): -46.3915 -46.3914 -25.0126 -25.0092 -22.6205 -22.6174 -22.2274 -22.2273 -16.0860 -16.0823 -6.3079 -6.3069 -6.2522 -6.2517 -4.9256 -4.9253 -2.9957 -2.8649 -1.2499 -1.2455 -0.8814 -0.7420 5.2225 5.2249 5.6734 5.6742 6.3048 6.3053 6.7510 6.7534 6.8669 6.8677 9.8775 9.8869 9.9651 9.9688 10.1982 10.1987 10.1992 10.2031 11.9436 11.9677 12.0308 12.0346 13.4964 13.5320 14.4444 14.4457 k =-0.4985 0.5000 0.2110 ( 2710 PWs) bands (ev): -46.3916 -46.3916 -25.0332 -25.0298 -22.6200 -22.6169 -22.2265 -22.2264 -16.0087 -16.0049 -6.3015 -6.3004 -6.2470 -6.2465 -4.9240 -4.9237 -3.0645 -2.9282 -1.2998 -1.2929 -1.0150 -0.8733 5.2232 5.2256 5.6753 5.6761 6.2841 6.2846 6.8395 6.8432 6.9653 6.9661 9.8671 9.8756 9.9516 9.9548 10.1994 10.1995 10.2266 10.2304 11.9771 12.0006 12.0641 12.0678 13.7061 13.7406 14.4497 14.4511 k =-0.4985 0.5000 0.2234 ( 2706 PWs) bands (ev): -46.3918 -46.3917 -25.0540 -25.0506 -22.6194 -22.6163 -22.2256 -22.2255 -15.9293 -15.9253 -6.2948 -6.2937 -6.2417 -6.2412 -4.9224 -4.9220 -3.1363 -2.9953 -1.3532 -1.3413 -1.1429 -1.0025 5.2240 5.2262 5.6773 5.6780 6.2633 6.2637 6.9296 6.9345 7.0654 7.0662 9.8578 9.8654 9.9387 9.9416 10.2001 10.2002 10.2549 10.2584 12.0119 12.0350 12.0989 12.1025 13.9201 13.9536 14.4551 14.4567 k =-0.4985 0.5000 0.2358 ( 2706 PWs) bands (ev): -46.3920 -46.3919 -25.0749 -25.0714 -22.6188 -22.6158 -22.2246 -22.2246 -15.8481 -15.8440 -6.2879 -6.2868 -6.2362 -6.2357 -4.9207 -4.9203 -3.2109 -3.0662 -1.4145 -1.3912 -1.2596 -1.1278 5.2249 5.2270 5.6793 5.6800 6.2424 6.2428 7.0205 7.0268 7.1666 7.1674 9.8497 9.8565 9.9269 9.9294 10.2008 10.2009 10.2835 10.2866 12.0480 12.0708 12.1354 12.1389 14.1372 14.1698 14.4608 14.4627 k =-0.4985 0.5000 0.2482 ( 2707 PWs) bands (ev): -46.3922 -46.3921 -25.0957 -25.0923 -22.6183 -22.6152 -22.2237 -22.2237 -15.7656 -15.7613 -6.2809 -6.2798 -6.2307 -6.2302 -4.9191 -4.9186 -3.2882 -3.1409 -1.4922 -1.4440 -1.3551 -1.2467 5.2257 5.2277 5.6813 5.6820 6.2216 6.2219 7.1118 7.1193 7.2682 7.2689 9.8432 9.8492 9.9162 9.9185 10.2015 10.2016 10.3123 10.3151 12.0855 12.1081 12.1735 12.1770 14.3546 14.3864 14.4687 14.4707 k =-0.4985 0.5000 0.2606 ( 2706 PWs) bands (ev): -46.3924 -46.3923 -25.1162 -25.1129 -22.6176 -22.6147 -22.2228 -22.2228 -15.6822 -15.6778 -6.2737 -6.2727 -6.2251 -6.2246 -4.9174 -4.9170 -3.3679 -3.2193 -1.5886 -1.5031 -1.4260 -1.3545 5.2266 5.2285 5.6833 5.6839 6.2010 6.2013 7.2028 7.2114 7.3694 7.3702 9.8384 9.8435 9.9069 9.9090 10.2023 10.2023 10.3409 10.3435 12.1245 12.1469 12.2133 12.2168 14.4683 14.4688 14.5840 14.6122 k =-0.4985 0.5000 0.2731 ( 2698 PWs) bands (ev): -46.3926 -46.3925 -25.1364 -25.1331 -22.6170 -22.6141 -22.2219 -22.2218 -15.5984 -15.5939 -6.2665 -6.2656 -6.2194 -6.2190 -4.9158 -4.9153 -3.4497 -3.3012 -1.6931 -1.5753 -1.4819 -1.4437 5.2275 5.2293 5.6854 5.6859 6.1807 6.1810 7.2929 7.3024 7.4697 7.4704 9.8354 9.8398 9.8992 9.9011 10.2030 10.2031 10.3693 10.3717 12.1650 12.1873 12.2550 12.2583 14.4753 14.4764 14.8034 14.8322 k =-0.4985 0.5000 0.2855 ( 2692 PWs) bands (ev): -46.3928 -46.3927 -25.1561 -25.1529 -22.6163 -22.6135 -22.2209 -22.2209 -15.5147 -15.5101 -6.2593 -6.2584 -6.2138 -6.2134 -4.9142 -4.9137 -3.5332 -3.3863 -1.7966 -1.6624 -1.5308 -1.5114 5.2284 5.2301 5.6874 5.6879 6.1609 6.1612 7.3813 7.3917 7.5681 7.5688 9.8345 9.8382 9.8933 9.8951 10.2037 10.2038 10.3973 10.3995 12.2072 12.2293 12.2984 12.3018 14.4808 14.4822 15.0242 15.0525 k =-0.4985 0.5000 0.2979 ( 2702 PWs) bands (ev): -46.3930 -46.3929 -25.1755 -25.1724 -22.6157 -22.6130 -22.2201 -22.2201 -15.4315 -15.4270 -6.2522 -6.2513 -6.2083 -6.2078 -4.9127 -4.9121 -3.6179 -3.4741 -1.8955 -1.7566 -1.5757 -1.5649 5.2293 5.2309 5.6893 5.6899 6.1417 6.1419 7.4674 7.4785 7.6642 7.6648 9.8358 9.8387 9.8894 9.8910 10.2044 10.2044 10.4247 10.4267 12.2510 12.2731 12.3438 12.3471 14.4861 14.4877 15.2435 15.2713 k =-0.4985 0.5000 0.3103 ( 2700 PWs) bands (ev): -46.3931 -46.3931 -25.1940 -25.1910 -22.6151 -22.6125 -22.2193 -22.2192 -15.3495 -15.3449 -6.2451 -6.2442 -6.2028 -6.2024 -4.9112 -4.9105 -3.7033 -3.5640 -1.9880 -1.8503 -1.6178 -1.6111 5.2302 5.2316 5.6913 5.6918 6.1231 6.1233 7.5507 7.5622 7.7570 7.7576 9.8392 9.8415 9.8875 9.8891 10.2051 10.2051 10.4514 10.4533 12.2966 12.3186 12.3912 12.3944 14.4912 14.4929 15.4597 15.4871 k =-0.4985 0.5000 0.3227 ( 2706 PWs) bands (ev): -46.3933 -46.3932 -25.2119 -25.2091 -22.6145 -22.6120 -22.2184 -22.2184 -15.2690 -15.2645 -6.2381 -6.2373 -6.1975 -6.1970 -4.9098 -4.9091 -3.7887 -3.6552 -2.0735 -1.9401 -1.6575 -1.6530 5.2311 5.2324 5.6931 5.6936 6.1053 6.1054 7.6303 7.6422 7.8459 7.8465 9.8449 9.8467 9.8878 9.8893 10.2057 10.2058 10.4773 10.4790 12.3440 12.3659 12.4405 12.4437 14.4960 14.4979 15.6707 15.6980 k =-0.4985 0.5000 0.3351 ( 2710 PWs) bands (ev): -46.3935 -46.3934 -25.2289 -25.2262 -22.6138 -22.6115 -22.2176 -22.2176 -15.1908 -15.1863 -6.2313 -6.2306 -6.1923 -6.1918 -4.9084 -4.9076 -3.8732 -3.7467 -2.1517 -2.0246 -1.6948 -1.6916 5.2319 5.2331 5.6950 5.6954 6.0883 6.0884 7.7058 7.7179 7.9303 7.9309 9.8527 9.8540 9.8903 9.8917 10.2064 10.2064 10.5021 10.5036 12.3931 12.4149 12.4918 12.4950 14.5006 14.5026 15.8736 15.9013 k =-0.4985 0.5000 0.3475 ( 2708 PWs) bands (ev): -46.3936 -46.3936 -25.2450 -25.2424 -22.6132 -22.6110 -22.2169 -22.2168 -15.1153 -15.1109 -6.2247 -6.2240 -6.1873 -6.1868 -4.9072 -4.9063 -3.9561 -3.8375 -2.2226 -2.1032 -1.7299 -1.7274 5.2327 5.2338 5.6967 5.6971 6.0722 6.0724 7.7767 7.7887 8.0095 8.0101 9.8625 9.8634 9.8950 9.8963 10.2070 10.2070 10.5257 10.5271 12.4439 12.4655 12.5450 12.5481 14.5049 14.5070 16.0630 16.0923 k =-0.4985 0.5000 0.3599 ( 2708 PWs) bands (ev): -46.3938 -46.3937 -25.2600 -25.2577 -22.6126 -22.6106 -22.2161 -22.2161 -15.0430 -15.0388 -6.2184 -6.2178 -6.1825 -6.1821 -4.9060 -4.9051 -4.0364 -3.9265 -2.2863 -2.1756 -1.7625 -1.7606 5.2335 5.2345 5.6983 5.6987 6.0571 6.0573 7.8425 7.8542 8.0831 8.0836 9.8741 9.8747 9.9018 9.9030 10.2075 10.2075 10.5480 10.5493 12.4962 12.5175 12.5999 12.6029 14.5089 14.5110 16.2258 16.2599 k =-0.4985 0.5000 0.3723 ( 2708 PWs) bands (ev): -46.3939 -46.3939 -25.2740 -25.2718 -22.6120 -22.6102 -22.2155 -22.2154 -14.9747 -14.9706 -6.2124 -6.2118 -6.1780 -6.1776 -4.9050 -4.9040 -4.1132 -4.0126 -2.3430 -2.2416 -1.7928 -1.7911 5.2342 5.2351 5.6998 5.7002 6.0431 6.0433 7.9029 7.9142 8.1505 8.1509 9.8872 9.8875 9.9104 9.9115 10.2081 10.2081 10.5689 10.5701 12.5497 12.5706 12.6561 12.6590 14.5125 14.5147 16.3288 16.3734 k =-0.4985 0.5000 0.3848 ( 2704 PWs) bands (ev): -46.3941 -46.3940 -25.2868 -25.2848 -22.6115 -22.6098 -22.2148 -22.2148 -14.9107 -14.9069 -6.2068 -6.2063 -6.1738 -6.1734 -4.9041 -4.9030 -4.1857 -4.0947 -2.3930 -2.3013 -1.8204 -1.8190 5.2349 5.2357 5.7013 5.7016 6.0303 6.0304 7.9575 7.9682 8.2115 8.2118 9.9012 9.9013 9.9206 9.9216 10.2086 10.2086 10.5882 10.5893 12.6040 12.6243 12.7132 12.7160 14.5157 14.5179 16.3266 16.3758 k =-0.4985 0.5000 0.3972 ( 2704 PWs) bands (ev): -46.3942 -46.3941 -25.2984 -25.2966 -22.6109 -22.6094 -22.2142 -22.2142 -14.8517 -14.8482 -6.2016 -6.2011 -6.1700 -6.1696 -4.9033 -4.9021 -4.2528 -4.1718 -2.4364 -2.3549 -1.8454 -1.8441 5.2355 5.2362 5.7026 5.7028 6.0187 6.0188 8.0063 8.0162 8.2658 8.2661 9.9156 9.9157 9.9321 9.9330 10.2090 10.2090 10.6059 10.6068 12.6584 12.6779 12.7704 12.7731 14.5185 14.5207 16.2419 16.2781 k =-0.4985 0.5000 0.4096 ( 2696 PWs) bands (ev): -46.3943 -46.3942 -25.3086 -25.3070 -22.6105 -22.6091 -22.2137 -22.2137 -14.7981 -14.7950 -6.1969 -6.1965 -6.1665 -6.1661 -4.9026 -4.9014 -4.3137 -4.2429 -2.4737 -2.4023 -1.8677 -1.8665 5.2361 5.2367 5.7037 5.7040 6.0083 6.0084 8.0492 8.0581 8.3133 8.3136 9.9298 9.9300 9.9443 9.9451 10.2094 10.2094 10.6217 10.6226 12.7121 12.7305 12.8269 12.8294 14.5208 14.5230 16.1286 16.1542 k =-0.4985 0.5000 0.4220 ( 2694 PWs) bands (ev): -46.3944 -46.3943 -25.3176 -25.3163 -22.6100 -22.6089 -22.2133 -22.2132 -14.7506 -14.7478 -6.1927 -6.1923 -6.1634 -6.1630 -4.9021 -4.9008 -4.3677 -4.3070 -2.5049 -2.4438 -1.8872 -1.8860 5.2366 5.2371 5.7047 5.7050 5.9991 5.9993 8.0861 8.0940 8.3541 8.3543 9.9435 9.9437 9.9568 9.9575 10.2098 10.2098 10.6357 10.6364 12.7639 12.7809 12.8813 12.8837 14.5226 14.5247 16.0137 16.0330 k =-0.4985 0.5000 0.4344 ( 2688 PWs) bands (ev): -46.3944 -46.3944 -25.3253 -25.3241 -22.6096 -22.6086 -22.2128 -22.2128 -14.7094 -14.7070 -6.1891 -6.1887 -6.1607 -6.1603 -4.9017 -4.9004 -4.4138 -4.3634 -2.5302 -2.4794 -1.9039 -1.9027 5.2370 5.2374 5.7056 5.7058 5.9914 5.9915 8.1172 8.1240 8.3882 8.3884 9.9559 9.9561 9.9689 9.9695 10.2101 10.2101 10.6477 10.6483 12.8125 12.8277 12.9323 12.9344 14.5240 14.5259 15.9076 15.9226 k =-0.4985 0.5000 0.4468 ( 2684 PWs) bands (ev): -46.3945 -46.3945 -25.3316 -25.3307 -22.6093 -22.6085 -22.2125 -22.2125 -14.6751 -14.6731 -6.1861 -6.1857 -6.1585 -6.1581 -4.9014 -4.9001 -4.4516 -4.4114 -2.5499 -2.5093 -1.9175 -1.9164 5.2374 5.2377 5.7063 5.7065 5.9850 5.9851 8.1426 8.1480 8.4158 8.4160 9.9668 9.9670 9.9800 9.9804 10.2103 10.2103 10.6576 10.6581 12.8563 12.8692 12.9780 12.9798 14.5249 14.5266 15.8153 15.8270 k =-0.4985 0.5000 0.4592 ( 2696 PWs) bands (ev): -46.3945 -46.3945 -25.3367 -25.3360 -22.6090 -22.6084 -22.2122 -22.2122 -14.6480 -14.6465 -6.1837 -6.1833 -6.1567 -6.1563 -4.9012 -4.8999 -4.4805 -4.4504 -2.5639 -2.5336 -1.9282 -1.9271 5.2377 5.2379 5.7069 5.7071 5.9800 5.9801 8.1622 8.1664 8.4370 8.4372 9.9757 9.9758 9.9893 9.9895 10.2105 10.2105 10.6654 10.6657 12.8934 12.9036 13.0165 13.0179 14.5255 14.5269 15.7402 15.7489 k =-0.4985 0.5000 0.4716 ( 2704 PWs) bands (ev): -46.3946 -46.3946 -25.3403 -25.3399 -22.6087 -22.6083 -22.2121 -22.2120 -14.6283 -14.6273 -6.1820 -6.1816 -6.1555 -6.1551 -4.9011 -4.8998 -4.5000 -4.4800 -2.5725 -2.5523 -1.9359 -1.9348 5.2379 5.2381 5.7073 5.7075 5.9764 5.9765 8.1764 8.1792 8.4521 8.4521 9.9823 9.9824 9.9963 9.9964 10.2107 10.2107 10.6710 10.6712 12.9221 12.9292 13.0459 13.0468 14.5259 14.5269 15.6849 15.6907 k =-0.4985 0.5000 0.4840 ( 2726 PWs) bands (ev): -46.3946 -46.3946 -25.3425 -25.3423 -22.6087 -22.6085 -22.2121 -22.2121 -14.6163 -14.6158 -6.1810 -6.1806 -6.1547 -6.1543 -4.9010 -4.8998 -4.5099 -4.4998 -2.5756 -2.5655 -1.9405 -1.9394 5.2380 5.2381 5.7076 5.7077 5.9742 5.9743 8.1851 8.1865 8.4610 8.4611 9.9864 9.9865 10.0006 10.0007 10.2107 10.2107 10.6744 10.6745 12.9408 12.9444 13.0643 13.0648 14.5261 14.5267 15.6512 15.6546 k =-0.4985 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6085 -22.2121 -22.2120 -14.6122 -14.6122 -6.1807 -6.1802 -6.1544 -6.1540 -4.9010 -4.8998 -4.5105 -4.5091 -2.5737 -2.5728 -1.9421 -1.9409 5.2381 5.2381 5.7076 5.7078 5.9735 5.9736 8.1885 8.1886 8.4640 8.4640 9.9878 9.9879 10.0021 10.0021 10.2108 10.2108 10.6755 10.6755 12.9484 12.9485 13.0708 13.0708 14.5263 14.5265 15.6401 15.6421 k =-0.4985 0.5000 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6085 -22.2121 -22.2120 -14.6122 -14.6122 -6.1807 -6.1802 -6.1544 -6.1540 -4.9010 -4.8998 -4.5105 -4.5091 -2.5737 -2.5728 -1.9421 -1.9409 5.2381 5.2381 5.7076 5.7078 5.9735 5.9736 8.1885 8.1886 8.4640 8.4640 9.9878 9.9879 10.0021 10.0021 10.2108 10.2108 10.6755 10.6755 12.9484 12.9485 13.0708 13.0708 14.5263 14.5265 15.6401 15.6421 k =-0.5000 0.4985 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6086 -22.2120 -22.2120 -14.6122 -14.6122 -6.1804 -6.1804 -6.1542 -6.1542 -4.9004 -4.9004 -4.5098 -4.5098 -2.5733 -2.5733 -1.9415 -1.9415 5.2380 5.2380 5.7077 5.7077 5.9735 5.9735 8.1885 8.1885 8.4640 8.4640 9.9879 9.9879 10.0021 10.0021 10.2108 10.2108 10.6756 10.6756 12.9485 12.9485 13.0709 13.0709 14.5265 14.5265 15.6411 15.6411 k =-0.5000 0.4985 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6086 -22.2120 -22.2120 -14.6122 -14.6122 -6.1804 -6.1804 -6.1542 -6.1542 -4.9004 -4.9004 -4.5098 -4.5098 -2.5733 -2.5733 -1.9415 -1.9415 5.2380 5.2380 5.7077 5.7077 5.9735 5.9735 8.1885 8.1885 8.4640 8.4640 9.9879 9.9879 10.0021 10.0021 10.2108 10.2108 10.6756 10.6756 12.9485 12.9485 13.0709 13.0709 14.5265 14.5265 15.6411 15.6411 k =-0.5000 0.4985 0.4840 ( 2724 PWs) bands (ev): -46.3946 -46.3946 -25.3425 -25.3423 -22.6087 -22.6085 -22.2121 -22.2121 -14.6163 -14.6158 -6.1808 -6.1808 -6.1545 -6.1545 -4.9005 -4.9002 -4.5099 -4.4999 -2.5756 -2.5655 -1.9400 -1.9399 5.2380 5.2381 5.7076 5.7076 5.9742 5.9742 8.1852 8.1866 8.4611 8.4611 9.9865 9.9865 10.0006 10.0007 10.2108 10.2108 10.6744 10.6745 12.9409 12.9445 13.0644 13.0649 14.5262 14.5267 15.6515 15.6542 k =-0.5000 0.4985 0.4716 ( 2708 PWs) bands (ev): -46.3946 -46.3946 -25.3404 -25.3399 -22.6088 -22.6084 -22.2121 -22.2121 -14.6283 -14.6273 -6.1818 -6.1818 -6.1552 -6.1552 -4.9007 -4.9002 -4.5000 -4.4800 -2.5725 -2.5523 -1.9354 -1.9353 5.2378 5.2380 5.7073 5.7074 5.9764 5.9764 8.1764 8.1792 8.4521 8.4522 9.9824 9.9825 9.9963 9.9964 10.2107 10.2107 10.6710 10.6712 12.9222 12.9292 13.0459 13.0469 14.5259 14.5269 15.6850 15.6905 k =-0.5000 0.4985 0.4592 ( 2696 PWs) bands (ev): -46.3945 -46.3945 -25.3367 -25.3360 -22.6090 -22.6084 -22.2122 -22.2122 -14.6480 -14.6465 -6.1835 -6.1835 -6.1565 -6.1565 -4.9008 -4.9002 -4.4805 -4.4504 -2.5640 -2.5336 -1.9278 -1.9276 5.2376 5.2379 5.7069 5.7070 5.9800 5.9800 8.1622 8.1664 8.4371 8.4372 9.9758 9.9759 9.9893 9.9895 10.2106 10.2106 10.6654 10.6657 12.8934 12.9036 13.0165 13.0179 14.5256 14.5269 15.7403 15.7487 k =-0.5000 0.4985 0.4468 ( 2680 PWs) bands (ev): -46.3945 -46.3945 -25.3316 -25.3307 -22.6092 -22.6084 -22.2125 -22.2125 -14.6751 -14.6731 -6.1859 -6.1859 -6.1582 -6.1582 -4.9011 -4.9003 -4.4516 -4.4114 -2.5499 -2.5093 -1.9172 -1.9168 5.2373 5.2377 5.7064 5.7065 5.9850 5.9850 8.1426 8.1481 8.4158 8.4160 9.9669 9.9670 9.9800 9.9804 10.2104 10.2104 10.6576 10.6581 12.8563 12.8692 12.9781 12.9798 14.5250 14.5266 15.8154 15.8269 k =-0.5000 0.4985 0.4344 ( 2688 PWs) bands (ev): -46.3944 -46.3944 -25.3253 -25.3241 -22.6096 -22.6086 -22.2128 -22.2128 -14.7094 -14.7070 -6.1889 -6.1889 -6.1605 -6.1605 -4.9014 -4.9006 -4.4139 -4.3634 -2.5302 -2.4794 -1.9035 -1.9031 5.2369 5.2374 5.7056 5.7058 5.9914 5.9914 8.1172 8.1240 8.3883 8.3884 9.9560 9.9562 9.9689 9.9695 10.2101 10.2101 10.6477 10.6483 12.8126 12.8277 12.9324 12.9344 14.5240 14.5259 15.9077 15.9226 k =-0.5000 0.4985 0.4220 ( 2696 PWs) bands (ev): -46.3944 -46.3943 -25.3176 -25.3163 -22.6100 -22.6089 -22.2133 -22.2132 -14.7506 -14.7477 -6.1925 -6.1925 -6.1632 -6.1631 -4.9019 -4.9010 -4.3677 -4.3070 -2.5049 -2.4438 -1.8869 -1.8864 5.2365 5.2370 5.7047 5.7049 5.9991 5.9992 8.0861 8.0940 8.3541 8.3543 9.9435 9.9437 9.9568 9.9575 10.2098 10.2098 10.6357 10.6364 12.7640 12.7809 12.8814 12.8837 14.5226 14.5247 16.0138 16.0329 k =-0.5000 0.4985 0.4096 ( 2696 PWs) bands (ev): -46.3943 -46.3942 -25.3086 -25.3070 -22.6105 -22.6091 -22.2137 -22.2137 -14.7981 -14.7950 -6.1967 -6.1966 -6.1663 -6.1662 -4.9024 -4.9015 -4.3138 -4.2429 -2.4737 -2.4024 -1.8675 -1.8668 5.2360 5.2366 5.7037 5.7039 6.0082 6.0083 8.0492 8.0582 8.3134 8.3136 9.9299 9.9301 9.9443 9.9451 10.2094 10.2094 10.6217 10.6226 12.7122 12.7305 12.8269 12.8295 14.5208 14.5230 16.1287 16.1541 k =-0.5000 0.4985 0.3972 ( 2704 PWs) bands (ev): -46.3942 -46.3941 -25.2984 -25.2966 -22.6110 -22.6094 -22.2142 -22.2142 -14.8517 -14.8482 -6.2014 -6.2013 -6.1698 -6.1697 -4.9031 -4.9023 -4.2528 -4.1719 -2.4365 -2.3549 -1.8452 -1.8444 5.2355 5.2362 5.7025 5.7028 6.0186 6.0187 8.0063 8.0162 8.2658 8.2660 9.9156 9.9157 9.9321 9.9330 10.2090 10.2090 10.6059 10.6068 12.6585 12.6779 12.7704 12.7731 14.5185 14.5207 16.2420 16.2781 k =-0.5000 0.4985 0.3848 ( 2704 PWs) bands (ev): -46.3941 -46.3940 -25.2868 -25.2848 -22.6115 -22.6098 -22.2148 -22.2148 -14.9107 -14.9069 -6.2066 -6.2064 -6.1736 -6.1736 -4.9039 -4.9031 -4.1857 -4.0948 -2.3930 -2.3014 -1.8203 -1.8192 5.2348 5.2356 5.7013 5.7015 6.0303 6.0304 7.9575 7.9682 8.2116 8.2118 9.9013 9.9013 9.9207 9.9216 10.2086 10.2086 10.5882 10.5893 12.6041 12.6243 12.7132 12.7160 14.5158 14.5180 16.3267 16.3758 k =-0.5000 0.4985 0.3723 ( 2704 PWs) bands (ev): -46.3939 -46.3939 -25.2740 -25.2718 -22.6120 -22.6101 -22.2154 -22.2154 -14.9747 -14.9706 -6.2122 -6.2119 -6.1778 -6.1778 -4.9048 -4.9041 -4.1133 -4.0126 -2.3430 -2.2416 -1.7926 -1.7913 5.2342 5.2351 5.6998 5.7001 6.0431 6.0432 7.9029 7.9142 8.1506 8.1508 9.8872 9.8875 9.9105 9.9115 10.2081 10.2081 10.5689 10.5701 12.5498 12.5706 12.6561 12.6591 14.5126 14.5147 16.3288 16.3735 k =-0.5000 0.4985 0.3599 ( 2704 PWs) bands (ev): -46.3938 -46.3937 -25.2600 -25.2577 -22.6126 -22.6105 -22.2161 -22.2161 -15.0430 -15.0388 -6.2182 -6.2179 -6.1823 -6.1823 -4.9059 -4.9052 -4.0364 -3.9265 -2.2863 -2.1756 -1.7625 -1.7607 5.2334 5.2345 5.6983 5.6986 6.0571 6.0572 7.8425 7.8542 8.0833 8.0834 9.8742 9.8747 9.9019 9.9030 10.2076 10.2076 10.5480 10.5493 12.4963 12.5175 12.5999 12.6029 14.5089 14.5111 16.2259 16.2599 k =-0.5000 0.4985 0.3475 ( 2712 PWs) bands (ev): -46.3936 -46.3936 -25.2450 -25.2424 -22.6132 -22.6110 -22.2169 -22.2169 -15.1153 -15.1109 -6.2246 -6.2241 -6.1871 -6.1870 -4.9070 -4.9064 -3.9561 -3.8375 -2.2226 -2.1032 -1.7298 -1.7275 5.2327 5.2338 5.6967 5.6970 6.0721 6.0723 7.7767 7.7887 8.0098 8.0099 9.8626 9.8635 9.8951 9.8963 10.2070 10.2070 10.5257 10.5271 12.4440 12.4655 12.5451 12.5482 14.5050 14.5070 16.0630 16.0924 k =-0.5000 0.4985 0.3351 ( 2712 PWs) bands (ev): -46.3935 -46.3934 -25.2289 -25.2262 -22.6138 -22.6115 -22.2176 -22.2176 -15.1908 -15.1863 -6.2312 -6.2306 -6.1921 -6.1920 -4.9083 -4.9077 -3.8732 -3.7467 -2.1517 -2.0247 -1.6948 -1.6917 5.2319 5.2331 5.6949 5.6953 6.0882 6.0884 7.7059 7.7179 7.9306 7.9306 9.8527 9.8540 9.8904 9.8917 10.2064 10.2064 10.5020 10.5036 12.3932 12.4149 12.4919 12.4950 14.5007 14.5026 15.8737 15.9014 k =-0.5000 0.4985 0.3227 ( 2708 PWs) bands (ev): -46.3933 -46.3932 -25.2119 -25.2091 -22.6145 -22.6120 -22.2184 -22.2184 -15.2690 -15.2645 -6.2380 -6.2374 -6.1972 -6.1972 -4.9097 -4.9091 -3.7887 -3.6552 -2.0735 -1.9401 -1.6575 -1.6530 5.2310 5.2324 5.6931 5.6936 6.1052 6.1054 7.6303 7.6422 7.8462 7.8462 9.8449 9.8467 9.8879 9.8893 10.2057 10.2058 10.4772 10.4790 12.3440 12.3659 12.4406 12.4438 14.4961 14.4979 15.6707 15.6980 k =-0.5000 0.4985 0.3103 ( 2700 PWs) bands (ev): -46.3931 -46.3931 -25.1940 -25.1910 -22.6151 -22.6125 -22.2193 -22.2192 -15.3494 -15.3449 -6.2450 -6.2443 -6.2026 -6.2025 -4.9111 -4.9106 -3.7033 -3.5640 -1.9880 -1.8503 -1.6178 -1.6112 5.2302 5.2316 5.6913 5.6917 6.1230 6.1232 7.5507 7.5622 7.7573 7.7573 9.8393 9.8416 9.8876 9.8891 10.2051 10.2051 10.4514 10.4533 12.2967 12.3186 12.3912 12.3945 14.4912 14.4930 15.4597 15.4871 k =-0.5000 0.4985 0.2979 ( 2700 PWs) bands (ev): -46.3930 -46.3929 -25.1754 -25.1724 -22.6157 -22.6130 -22.2201 -22.2201 -15.4315 -15.4270 -6.2521 -6.2513 -6.2081 -6.2080 -4.9126 -4.9121 -3.6180 -3.4742 -1.8955 -1.7566 -1.5757 -1.5650 5.2293 5.2308 5.6893 5.6898 6.1416 6.1419 7.4674 7.4785 7.6644 7.6645 9.8358 9.8388 9.8895 9.8911 10.2044 10.2045 10.4247 10.4267 12.2511 12.2731 12.3439 12.3471 14.4861 14.4878 15.2436 15.2713 k =-0.5000 0.4985 0.2855 ( 2692 PWs) bands (ev): -46.3928 -46.3927 -25.1561 -25.1529 -22.6163 -22.6135 -22.2209 -22.2209 -15.5147 -15.5101 -6.2593 -6.2585 -6.2136 -6.2135 -4.9141 -4.9137 -3.5332 -3.3863 -1.7966 -1.6625 -1.5308 -1.5114 5.2284 5.2300 5.6873 5.6879 6.1609 6.1611 7.3813 7.3917 7.5684 7.5686 9.8346 9.8382 9.8934 9.8951 10.2037 10.2038 10.3973 10.3995 12.2072 12.2294 12.2985 12.3018 14.4809 14.4823 15.0242 15.0525 k =-0.5000 0.4985 0.2731 ( 2700 PWs) bands (ev): -46.3926 -46.3925 -25.1364 -25.1331 -22.6170 -22.6141 -22.2219 -22.2218 -15.5984 -15.5939 -6.2665 -6.2656 -6.2192 -6.2192 -4.9157 -4.9153 -3.4497 -3.3012 -1.6930 -1.5753 -1.4820 -1.4437 5.2275 5.2293 5.6853 5.6859 6.1807 6.1810 7.2929 7.3024 7.4699 7.4701 9.8355 9.8399 9.8993 9.9012 10.2030 10.2031 10.3693 10.3717 12.1651 12.1873 12.2550 12.2584 14.4753 14.4764 14.8034 14.8322 k =-0.5000 0.4985 0.2606 ( 2708 PWs) bands (ev): -46.3924 -46.3923 -25.1162 -25.1129 -22.6176 -22.6147 -22.2228 -22.2228 -15.6822 -15.6778 -6.2737 -6.2728 -6.2249 -6.2248 -4.9173 -4.9170 -3.3679 -3.2193 -1.5886 -1.5032 -1.4261 -1.3545 5.2266 5.2285 5.6833 5.6839 6.2010 6.2013 7.2028 7.2114 7.3697 7.3699 9.8385 9.8436 9.9070 9.9090 10.2023 10.2023 10.3409 10.3435 12.1245 12.1469 12.2134 12.2168 14.4684 14.4688 14.5840 14.6122 k =-0.5000 0.4985 0.2482 ( 2706 PWs) bands (ev): -46.3922 -46.3921 -25.0957 -25.0923 -22.6182 -22.6152 -22.2237 -22.2237 -15.7656 -15.7613 -6.2808 -6.2799 -6.2305 -6.2304 -4.9190 -4.9187 -3.2882 -3.1409 -1.4922 -1.4440 -1.3552 -1.2467 5.2257 5.2277 5.6813 5.6819 6.2216 6.2219 7.1118 7.1193 7.2684 7.2687 9.8433 9.8492 9.9163 9.9185 10.2016 10.2016 10.3122 10.3151 12.0855 12.1081 12.1736 12.1770 14.3546 14.3864 14.4687 14.4708 k =-0.5000 0.4985 0.2358 ( 2706 PWs) bands (ev): -46.3920 -46.3919 -25.0749 -25.0714 -22.6188 -22.6158 -22.2246 -22.2246 -15.8481 -15.8440 -6.2878 -6.2869 -6.2360 -6.2359 -4.9206 -4.9204 -3.2109 -3.0662 -1.4145 -1.3913 -1.2596 -1.1278 5.2248 5.2269 5.6792 5.6799 6.2424 6.2427 7.0205 7.0267 7.1669 7.1671 9.8498 9.8566 9.9270 9.9294 10.2008 10.2009 10.2835 10.2866 12.0480 12.0708 12.1355 12.1389 14.1372 14.1698 14.4609 14.4627 k =-0.5000 0.4985 0.2234 ( 2706 PWs) bands (ev): -46.3918 -46.3917 -25.0540 -25.0506 -22.6194 -22.6163 -22.2255 -22.2255 -15.9293 -15.9253 -6.2947 -6.2937 -6.2415 -6.2414 -4.9223 -4.9220 -3.1363 -2.9953 -1.3532 -1.3414 -1.1429 -1.0025 5.2240 5.2262 5.6772 5.6780 6.2633 6.2637 6.9296 6.9345 7.0657 7.0659 9.8578 9.8655 9.9389 9.9416 10.2001 10.2002 10.2549 10.2583 12.0119 12.0350 12.0990 12.1026 13.9201 13.9536 14.4551 14.4568 k =-0.5000 0.4985 0.2110 ( 2710 PWs) bands (ev): -46.3916 -46.3916 -25.0332 -25.0298 -22.6200 -22.6169 -22.2265 -22.2264 -16.0087 -16.0049 -6.3014 -6.3004 -6.2468 -6.2467 -4.9239 -4.9237 -3.0645 -2.9282 -1.2997 -1.2930 -1.0150 -0.8733 5.2232 5.2255 5.6753 5.6761 6.2841 6.2846 6.8396 6.8431 6.9656 6.9657 9.8672 9.8757 9.9517 9.9548 10.1994 10.1995 10.2265 10.2304 11.9771 12.0007 12.0641 12.0678 13.7061 13.7406 14.4497 14.4512 k =-0.5000 0.4985 0.1986 ( 2712 PWs) bands (ev): -46.3915 -46.3914 -25.0126 -25.0092 -22.6205 -22.6174 -22.2273 -22.2273 -16.0860 -16.0823 -6.3079 -6.3069 -6.2520 -6.2519 -4.9255 -4.9253 -2.9957 -2.8649 -1.2499 -1.2457 -0.8814 -0.7420 5.2224 5.2249 5.6734 5.6742 6.3047 6.3053 6.7511 6.7533 6.8673 6.8673 9.8776 9.8869 9.9652 9.9689 10.1984 10.1987 10.1990 10.2030 11.9436 11.9677 12.0308 12.0346 13.4964 13.5320 14.4444 14.4458 k =-0.5000 0.4985 0.1862 ( 2704 PWs) bands (ev): -46.3913 -46.3912 -24.9921 -24.9888 -22.6209 -22.6179 -22.2282 -22.2282 -16.1607 -16.1572 -6.3141 -6.3132 -6.2570 -6.2570 -4.9271 -4.9269 -2.9300 -2.8055 -1.2021 -1.1993 -0.7453 -0.6099 5.2218 5.2243 5.6715 5.6724 6.3250 6.3257 6.6647 6.6656 6.7711 6.7713 9.8888 9.8991 9.9792 9.9835 10.1712 10.1764 10.1981 10.1982 11.9114 11.9361 11.9991 12.0030 13.2920 13.3288 14.4393 14.4406 k =-0.5000 0.4985 0.1738 ( 2712 PWs) bands (ev): -46.3911 -46.3910 -24.9724 -24.9691 -22.6213 -22.6184 -22.2290 -22.2290 -16.2324 -16.2292 -6.3201 -6.3192 -6.2619 -6.2618 -4.9286 -4.9285 -2.8675 -2.7497 -1.1560 -1.1541 -0.6085 -0.4784 5.2212 5.2238 5.6698 5.6707 6.3446 6.3455 6.5807 6.5810 6.6779 6.6784 9.9007 9.9118 9.9932 9.9985 10.1446 10.1508 10.1974 10.1975 11.8803 11.9058 11.9689 11.9729 13.0940 13.1319 14.4344 14.4356 k =-0.5000 0.4985 0.1613 ( 2712 PWs) bands (ev): -46.3909 -46.3909 -24.9531 -24.9499 -22.6217 -22.6188 -22.2298 -22.2298 -16.3009 -16.2978 -6.3257 -6.3249 -6.2665 -6.2664 -4.9301 -4.9300 -2.8083 -2.6977 -1.1116 -1.1102 -0.4727 -0.3487 5.2207 5.2233 5.6681 5.6691 6.3633 6.3644 6.4993 6.5006 6.5882 6.5893 9.9130 9.9249 10.0068 10.0137 10.1190 10.1269 10.1968 10.1969 11.8503 11.8768 11.9403 11.9445 12.9033 12.9426 14.4297 14.4308 k =-0.5000 0.4985 0.1489 ( 2712 PWs) bands (ev): -46.3908 -46.3907 -24.9345 -24.9314 -22.6221 -22.6193 -22.2306 -22.2306 -16.3657 -16.3629 -6.3311 -6.3303 -6.2708 -6.2707 -4.9315 -4.9314 -2.7524 -2.6494 -1.0688 -1.0678 -0.3392 -0.2221 5.2203 5.2230 5.6665 5.6676 6.3793 6.3804 6.4236 6.4247 6.5028 6.5053 9.9255 9.9381 10.0190 10.0288 10.0945 10.1054 10.1962 10.1964 11.8213 11.8491 11.9132 11.9177 12.7213 12.7620 14.4252 14.4262 k =-0.5000 0.4985 0.1365 ( 2716 PWs) bands (ev): -46.3906 -46.3905 -24.9168 -24.9139 -22.6224 -22.6197 -22.2313 -22.2313 -16.4266 -16.4239 -6.3361 -6.3353 -6.2749 -6.2748 -4.9328 -4.9327 -2.7001 -2.6050 -1.0281 -1.0273 -0.2095 -0.0998 5.2201 5.2227 5.6651 5.6662 6.3439 6.3481 6.3911 6.4007 6.4251 6.4340 9.9378 9.9512 10.0276 10.0436 10.0714 10.0886 10.1957 10.1958 11.7932 11.8226 11.8878 11.8925 12.5491 12.5913 14.4210 14.4219 k =-0.5000 0.4985 0.1241 ( 2720 PWs) bands (ev): -46.3905 -46.3904 -24.9001 -24.8974 -22.6227 -22.6201 -22.2320 -22.2320 -16.4832 -16.4808 -6.3407 -6.3400 -6.2787 -6.2786 -4.9341 -4.9340 -2.6514 -2.5643 -0.9895 -0.9889 -0.0849 0.0169 5.2199 5.2226 5.6638 5.6649 6.2761 6.2806 6.3403 6.3435 6.4216 6.4249 9.9499 9.9638 10.0280 10.0492 10.0585 10.0811 10.1952 10.1953 11.7658 11.7971 11.8640 11.8691 12.3881 12.4318 14.4171 14.4179 k =-0.5000 0.4985 0.1117 ( 2720 PWs) bands (ev): -46.3903 -46.3903 -24.8845 -24.8820 -22.6229 -22.6205 -22.2327 -22.2326 -16.5353 -16.5331 -6.3449 -6.3443 -6.2822 -6.2821 -4.9352 -4.9351 -2.6063 -2.5275 -0.9534 -0.9530 0.0333 0.1267 5.2199 5.2225 5.6627 5.6638 6.2124 6.2171 6.2728 6.2736 6.4365 6.4379 9.9612 9.9755 10.0189 10.0297 10.0718 10.0842 10.1947 10.1949 11.7386 11.7722 11.8419 11.8476 12.2398 12.2852 14.4134 14.4141 k =-0.5000 0.4985 0.0993 ( 2720 PWs) bands (ev): -46.3902 -46.3902 -24.8702 -24.8679 -22.6230 -22.6209 -22.2332 -22.2332 -16.5826 -16.5806 -6.3487 -6.3482 -6.2853 -6.2853 -4.9362 -4.9362 -2.5651 -2.4948 -0.9202 -0.9198 0.1439 0.2285 5.2200 5.2225 5.6617 5.6629 6.1540 6.1587 6.2094 6.2096 6.4507 6.4516 9.9709 9.9851 10.0065 10.0128 10.0846 10.0924 10.1943 10.1944 11.7109 11.7472 11.8215 11.8279 12.1064 12.1532 14.4101 14.4108 k =-0.5000 0.4985 0.0869 ( 2720 PWs) bands (ev): -46.3901 -46.3901 -24.8572 -24.8551 -22.6231 -22.6212 -22.2337 -22.2337 -16.6249 -16.6232 -6.3521 -6.3516 -6.2881 -6.2881 -4.9372 -4.9371 -2.5279 -2.4661 -0.8900 -0.8897 0.2457 0.3209 5.2203 5.2227 5.6609 5.6621 6.1014 6.1058 6.1515 6.1525 6.4637 6.4643 9.9756 9.9862 9.9980 10.0053 10.0963 10.1018 10.1939 10.1941 11.6818 11.7204 11.8027 11.8102 11.9909 12.0380 14.4072 14.4077 k =-0.5000 0.4985 0.0745 ( 2716 PWs) bands (ev): -46.3900 -46.3900 -24.8457 -24.8438 -22.6232 -22.6215 -22.2342 -22.2341 -16.6619 -16.6605 -6.3551 -6.3547 -6.2906 -6.2906 -4.9380 -4.9380 -2.4947 -2.4415 -0.8632 -0.8630 0.3374 0.4029 5.2207 5.2228 5.6603 5.6615 6.0551 6.0589 6.1006 6.1021 6.4753 6.4757 9.9697 9.9752 10.0001 10.0105 10.1067 10.1109 10.1936 10.1938 11.6498 11.6884 11.7853 11.7946 11.8979 11.9422 14.4046 14.4050 k =-0.5000 0.4985 0.0621 ( 2704 PWs) bands (ev): -46.3899 -46.3899 -24.8355 -24.8340 -22.6232 -22.6218 -22.2345 -22.2345 -16.6936 -16.6924 -6.3576 -6.3572 -6.2927 -6.2927 -4.9387 -4.9387 -2.4657 -2.4213 -0.8400 -0.8398 0.4181 0.4734 5.2211 5.2230 5.6599 5.6610 6.0152 6.0183 6.0569 6.0589 6.4853 6.4856 9.9599 9.9633 10.0068 10.0173 10.1158 10.1190 10.1934 10.1935 11.6139 11.6477 11.7689 11.7811 11.8329 11.8678 14.4023 14.4027 k =-0.5000 0.4985 0.0496 ( 2704 PWs) bands (ev): -46.3899 -46.3898 -24.8272 -24.8260 -22.6232 -22.6220 -22.2348 -22.2348 -16.7197 -16.7187 -6.3597 -6.3594 -6.2944 -6.2944 -4.9393 -4.9393 -2.4410 -2.4054 -0.8207 -0.8206 0.4867 0.5314 5.2216 5.2232 5.6597 5.6607 5.9821 5.9845 6.0209 6.0230 6.4936 6.4938 9.9507 9.9530 10.0136 10.0231 10.1234 10.1259 10.1932 10.1933 11.5754 11.5999 11.7537 11.7697 11.7948 11.8147 14.4005 14.4008 k =-0.5000 0.4985 0.0372 ( 2704 PWs) bands (ev): -46.3898 -46.3898 -24.8207 -24.8197 -22.6232 -22.6223 -22.2351 -22.2351 -16.7401 -16.7394 -6.3613 -6.3611 -6.2958 -6.2958 -4.9397 -4.9397 -2.4207 -2.3939 -0.8054 -0.8054 0.5423 0.5762 5.2221 5.2234 5.6596 5.6604 5.9561 5.9577 5.9927 5.9947 6.5002 6.5003 9.9432 9.9448 10.0197 10.0274 10.1294 10.1313 10.1931 10.1931 11.5384 11.5537 11.7410 11.7596 11.7745 11.7802 14.3991 14.3993 k =-0.5000 0.4985 0.0248 ( 2708 PWs) bands (ev): -46.3898 -46.3897 -24.8159 -24.8153 -22.6231 -22.6225 -22.2353 -22.2353 -16.7547 -16.7542 -6.3624 -6.3623 -6.2968 -6.2968 -4.9401 -4.9401 -2.4049 -2.3870 -0.7944 -0.7944 0.5842 0.6070 5.2226 5.2235 5.6597 5.6603 5.9373 5.9383 5.9727 5.9742 6.5049 6.5050 9.9378 9.9387 10.0246 10.0300 10.1339 10.1351 10.1930 10.1930 11.5084 11.5168 11.7326 11.7482 11.7623 11.7633 14.3981 14.3982 k =-0.5000 0.4985 0.0124 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8129 -24.8126 -22.6230 -22.6227 -22.2354 -22.2354 -16.7635 -16.7632 -6.3631 -6.3630 -6.2974 -6.2974 -4.9403 -4.9403 -2.3936 -2.3846 -0.7878 -0.7877 0.6119 0.6233 5.2230 5.2234 5.6598 5.6601 5.9260 5.9265 5.9608 5.9617 6.5078 6.5079 9.9345 9.9350 10.0282 10.0310 10.1367 10.1373 10.1929 10.1930 11.4894 11.4930 11.7291 11.7370 11.7561 11.7572 14.3975 14.3976 k =-0.5000 0.4985 0.0000 ( 2700 PWs) bands (ev): -46.3897 -46.3897 -24.8118 -24.8118 -22.6228 -22.6228 -22.2354 -22.2354 -16.7663 -16.7663 -6.3633 -6.3633 -6.2976 -6.2976 -4.9403 -4.9403 -2.3868 -2.3868 -0.7855 -0.7855 0.6250 0.6250 5.2233 5.2233 5.6600 5.6600 5.9224 5.9224 5.9572 5.9572 6.5088 6.5088 9.9336 9.9336 10.0304 10.0304 10.1378 10.1378 10.1929 10.1929 11.4839 11.4839 11.7304 11.7304 11.7549 11.7549 14.3973 14.3973 k = 0.0000 0.0000 0.4965 ( 2730 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5506 -22.5506 -22.1485 -22.1485 -14.7301 -14.7301 -7.2365 -7.2365 -6.5035 -6.5035 -4.8473 -4.8473 -4.2704 -4.2704 -2.0449 -2.0449 -1.1980 -1.1980 7.2683 7.2683 7.3094 7.3094 7.6230 7.6230 7.6637 7.6637 9.2418 9.2418 9.3436 9.3436 9.8193 9.8193 9.8560 9.8560 9.9079 9.9079 12.0341 12.0341 12.2678 12.2678 12.3574 12.3574 14.3360 14.3360 k =-0.0089 0.0089 0.4965 ( 2730 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5507 -22.5507 -22.1486 -22.1486 -14.7300 -14.7300 -7.2358 -7.2358 -6.5032 -6.5032 -4.8483 -4.8483 -4.2702 -4.2702 -2.0448 -2.0448 -1.1979 -1.1979 7.2665 7.2665 7.3084 7.3084 7.6236 7.6236 7.6630 7.6630 9.2346 9.2346 9.3430 9.3430 9.8231 9.8231 9.8560 9.8560 9.9078 9.9078 12.0340 12.0340 12.2677 12.2677 12.3600 12.3600 14.3387 14.3387 k =-0.0179 0.0178 0.4965 ( 2734 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5508 -22.5508 -22.1487 -22.1487 -14.7297 -14.7297 -7.2337 -7.2337 -6.5025 -6.5025 -4.8511 -4.8511 -4.2695 -4.2695 -2.0445 -2.0445 -1.1979 -1.1979 7.2613 7.2613 7.3053 7.3053 7.6256 7.6256 7.6609 7.6609 9.2134 9.2134 9.3413 9.3413 9.8337 9.8337 9.8563 9.8563 9.9073 9.9073 12.0339 12.0339 12.2674 12.2674 12.3677 12.3677 14.3469 14.3469 k =-0.0268 0.0267 0.4965 ( 2720 PWs) bands (ev): -46.3970 -46.3970 -25.3543 -25.3543 -22.5510 -22.5510 -22.1489 -22.1489 -14.7292 -14.7292 -7.2301 -7.2301 -6.5012 -6.5012 -4.8558 -4.8558 -4.2683 -4.2683 -2.0442 -2.0442 -1.1979 -1.1979 7.2525 7.2525 7.3002 7.3002 7.6289 7.6289 7.6575 7.6575 9.1798 9.1798 9.3387 9.3387 9.8462 9.8462 9.8602 9.8602 9.9067 9.9067 12.0337 12.0337 12.2670 12.2670 12.3805 12.3805 14.3604 14.3604 k =-0.0357 0.0356 0.4965 ( 2720 PWs) bands (ev): -46.3970 -46.3970 -25.3542 -25.3542 -22.5513 -22.5513 -22.1492 -22.1492 -14.7285 -14.7285 -7.2252 -7.2252 -6.4994 -6.4994 -4.8622 -4.8622 -4.2668 -4.2668 -2.0437 -2.0437 -1.1978 -1.1978 7.2401 7.2401 7.2932 7.2932 7.6334 7.6334 7.6528 7.6528 9.1357 9.1357 9.3353 9.3353 9.8492 9.8492 9.8769 9.8769 9.9062 9.9062 12.0336 12.0336 12.2665 12.2665 12.3983 12.3983 14.3791 14.3791 k =-0.0446 0.0445 0.4965 ( 2720 PWs) bands (ev): -46.3970 -46.3970 -25.3541 -25.3541 -22.5517 -22.5517 -22.1497 -22.1497 -14.7276 -14.7276 -7.2188 -7.2188 -6.4972 -6.4972 -4.8701 -4.8701 -4.2649 -4.2649 -2.0433 -2.0433 -1.1977 -1.1977 7.2242 7.2242 7.2842 7.2842 7.6387 7.6387 7.6475 7.6475 9.0830 9.0830 9.3314 9.3314 9.8475 9.8475 9.8996 9.8996 9.9063 9.9063 12.0335 12.0335 12.2660 12.2660 12.4208 12.4208 14.4030 14.4030 k =-0.0536 0.0534 0.4965 ( 2720 PWs) bands (ev): -46.3969 -46.3969 -25.3540 -25.3540 -22.5522 -22.5522 -22.1503 -22.1503 -14.7265 -14.7265 -7.2111 -7.2111 -6.4944 -6.4944 -4.8796 -4.8796 -4.2628 -4.2628 -2.0429 -2.0429 -1.1977 -1.1977 7.2048 7.2048 7.2733 7.2733 7.6384 7.6384 7.6480 7.6480 9.0232 9.0232 9.3270 9.3270 9.8441 9.8441 9.9058 9.9058 9.9254 9.9254 12.0337 12.0337 12.2656 12.2656 12.4479 12.4479 14.4317 14.4317 k =-0.0625 0.0623 0.4965 ( 2722 PWs) bands (ev): -46.3969 -46.3969 -25.3539 -25.3539 -22.5528 -22.5528 -22.1509 -22.1509 -14.7252 -14.7252 -7.2020 -7.2020 -6.4912 -6.4912 -4.8904 -4.8904 -4.2606 -4.2606 -2.0427 -2.0427 -1.1977 -1.1977 7.1820 7.1820 7.2605 7.2605 7.6310 7.6310 7.6558 7.6558 8.9575 8.9575 9.3225 9.3225 9.8391 9.8391 9.9068 9.9068 9.9510 9.9510 12.0343 12.0343 12.2656 12.2656 12.4792 12.4792 14.4650 14.4650 k =-0.0714 0.0712 0.4965 ( 2726 PWs) bands (ev): -46.3969 -46.3969 -25.3538 -25.3538 -22.5535 -22.5535 -22.1517 -22.1517 -14.7238 -14.7238 -7.1916 -7.1916 -6.4874 -6.4874 -4.9022 -4.9022 -4.2583 -4.2583 -2.0428 -2.0428 -1.1977 -1.1977 7.1560 7.1560 7.2456 7.2456 7.6224 7.6224 7.6653 7.6653 8.8869 8.8869 9.3181 9.3181 9.8328 9.8328 9.9084 9.9084 9.9765 9.9765 12.0353 12.0353 12.2660 12.2660 12.5144 12.5144 14.5028 14.5028 k =-0.0804 0.0801 0.4965 ( 2726 PWs) bands (ev): -46.3969 -46.3969 -25.3537 -25.3537 -22.5542 -22.5542 -22.1525 -22.1525 -14.7221 -14.7221 -7.1798 -7.1798 -6.4832 -6.4832 -4.9151 -4.9151 -4.2560 -4.2560 -2.0433 -2.0433 -1.1979 -1.1979 7.1269 7.1269 7.2285 7.2285 7.6132 7.6132 7.6761 7.6761 8.8122 8.8122 9.3140 9.3140 9.8252 9.8252 9.9107 9.9107 10.0017 10.0017 12.0371 12.0371 12.2671 12.2671 12.5532 12.5532 14.5446 14.5446 k =-0.0893 0.0890 0.4965 ( 2730 PWs) bands (ev): -46.3968 -46.3968 -25.3536 -25.3536 -22.5551 -22.5551 -22.1534 -22.1534 -14.7203 -14.7203 -7.1667 -7.1667 -6.4786 -6.4786 -4.9287 -4.9287 -4.2537 -4.2537 -2.0443 -2.0443 -1.1982 -1.1982 7.0949 7.0949 7.2093 7.2093 7.6036 7.6036 7.6879 7.6879 8.7340 8.7340 9.3105 9.3105 9.8164 9.8164 9.9135 9.9135 10.0261 10.0261 12.0396 12.0396 12.2689 12.2689 12.5953 12.5953 14.5901 14.5901 k =-0.0982 0.0979 0.4965 ( 2728 PWs) bands (ev): -46.3968 -46.3968 -25.3534 -25.3534 -22.5560 -22.5560 -22.1544 -22.1544 -14.7184 -14.7184 -7.1524 -7.1524 -6.4735 -6.4735 -4.9428 -4.9428 -4.2517 -4.2517 -2.0459 -2.0459 -1.1987 -1.1987 7.0603 7.0603 7.1879 7.1879 7.5939 7.5939 7.7009 7.7009 8.6528 8.6528 9.3080 9.3080 9.8066 9.8066 9.9169 9.9169 10.0498 10.0498 12.0432 12.0432 12.2717 12.2717 12.6403 12.6403 14.6390 14.6390 k =-0.1071 0.1068 0.4965 ( 2726 PWs) bands (ev): -46.3968 -46.3968 -25.3532 -25.3532 -22.5570 -22.5570 -22.1555 -22.1555 -14.7162 -14.7162 -7.1368 -7.1368 -6.4680 -6.4680 -4.9574 -4.9574 -4.2499 -4.2499 -2.0481 -2.0481 -1.1996 -1.1996 7.0231 7.0231 7.1642 7.1642 7.5843 7.5843 7.7149 7.7149 8.5691 8.5691 9.3066 9.3066 9.7959 9.7959 9.9206 9.9206 10.0727 10.0727 12.0480 12.0480 12.2755 12.2755 12.6878 12.6878 14.6909 14.6909 k =-0.1161 0.1157 0.4965 ( 2726 PWs) bands (ev): -46.3967 -46.3967 -25.3530 -25.3530 -22.5580 -22.5580 -22.1567 -22.1567 -14.7139 -14.7139 -7.1200 -7.1200 -6.4620 -6.4620 -4.9721 -4.9721 -4.2483 -4.2483 -2.0511 -2.0511 -1.2008 -1.2008 6.9836 6.9836 7.1382 7.1382 7.5750 7.5750 7.7298 7.7298 8.4832 8.4832 9.3065 9.3065 9.7846 9.7846 9.9246 9.9246 10.0948 10.0948 12.0540 12.0540 12.2805 12.2805 12.7376 12.7376 14.7455 14.7455 k =-0.1250 0.1246 0.4965 ( 2726 PWs) bands (ev): -46.3967 -46.3967 -25.3527 -25.3527 -22.5592 -22.5592 -22.1579 -22.1579 -14.7115 -14.7115 -7.1020 -7.1020 -6.4557 -6.4557 -4.9870 -4.9870 -4.2471 -4.2471 -2.0550 -2.0550 -1.2026 -1.2026 6.9420 6.9420 7.1099 7.1099 7.5665 7.5665 7.7457 7.7457 8.3956 8.3956 9.3080 9.3080 9.7728 9.7728 9.9287 9.9287 10.1161 10.1161 12.0614 12.0614 12.2868 12.2868 12.7894 12.7894 14.8023 14.8023 k =-0.1339 0.1335 0.4965 ( 2726 PWs) bands (ev): -46.3966 -46.3966 -25.3525 -25.3525 -22.5604 -22.5604 -22.1592 -22.1592 -14.7090 -14.7090 -7.0829 -7.0829 -6.4490 -6.4490 -5.0017 -5.0017 -4.2462 -4.2462 -2.0597 -2.0597 -1.2050 -1.2050 6.8985 6.8985 7.0794 7.0794 7.5588 7.5588 7.7623 7.7623 8.3066 8.3066 9.3114 9.3114 9.7606 9.7606 9.9329 9.9329 10.1367 10.1367 12.0703 12.0703 12.2943 12.2943 12.8428 12.8428 14.8609 14.8609 k =-0.1429 0.1424 0.4965 ( 2726 PWs) bands (ev): -46.3966 -46.3966 -25.3522 -25.3522 -22.5616 -22.5616 -22.1606 -22.1606 -14.7063 -14.7063 -7.0626 -7.0626 -6.4419 -6.4419 -5.0162 -5.0162 -4.2457 -4.2457 -2.0653 -2.0653 -1.2081 -1.2081 6.8532 6.8532 7.0467 7.0467 7.5523 7.5523 7.7798 7.7798 8.2165 8.2165 9.3166 9.3166 9.7482 9.7482 9.9370 9.9370 10.1567 10.1567 12.0808 12.0808 12.3032 12.3032 12.8976 12.8976 14.9209 14.9209 k =-0.1518 0.1513 0.4965 ( 2724 PWs) bands (ev): -46.3965 -46.3965 -25.3520 -25.3520 -22.5629 -22.5629 -22.1620 -22.1620 -14.7035 -14.7035 -7.0413 -7.0413 -6.4345 -6.4345 -5.0303 -5.0303 -4.2457 -4.2457 -2.0719 -2.0719 -1.2121 -1.2121 6.8064 6.8064 7.0119 7.0119 7.5472 7.5472 7.7979 7.7979 8.1256 8.1256 9.3238 9.3238 9.7358 9.7358 9.9412 9.9412 10.1761 10.1761 12.0929 12.0929 12.3136 12.3136 12.9535 12.9535 14.9819 14.9819 k =-0.1607 0.1602 0.4965 ( 2720 PWs) bands (ev): -46.3964 -46.3964 -25.3517 -25.3517 -22.5643 -22.5643 -22.1635 -22.1635 -14.7006 -14.7006 -7.0191 -7.0191 -6.4268 -6.4268 -5.0438 -5.0438 -4.2461 -4.2461 -2.0794 -2.0794 -1.2171 -1.2171 6.7582 6.7582 6.9751 6.9751 7.5438 7.5438 7.8166 7.8166 8.0343 8.0343 9.3332 9.3332 9.7234 9.7234 9.9451 9.9451 10.1950 10.1950 12.1067 12.1067 12.3254 12.3254 13.0103 13.0103 15.0434 15.0434 k =-0.1696 0.1691 0.4965 ( 2724 PWs) bands (ev): -46.3964 -46.3964 -25.3514 -25.3514 -22.5657 -22.5657 -22.1651 -22.1651 -14.6976 -14.6976 -6.9958 -6.9958 -6.4187 -6.4187 -5.0568 -5.0568 -4.2469 -4.2469 -2.0879 -2.0879 -1.2233 -1.2233 6.7089 6.7089 6.9365 6.9365 7.5423 7.5423 7.8358 7.8358 7.9427 7.9427 9.3446 9.3446 9.7113 9.7113 9.9489 9.9489 10.2135 10.2135 12.1221 12.1221 12.3386 12.3386 13.0678 13.0678 15.1049 15.1049 k =-0.1786 0.1780 0.4965 ( 2724 PWs) bands (ev): -46.3963 -46.3963 -25.3511 -25.3511 -22.5672 -22.5672 -22.1667 -22.1667 -14.6945 -14.6945 -6.9717 -6.9717 -6.4104 -6.4104 -5.0690 -5.0690 -4.2482 -4.2482 -2.0973 -2.0973 -1.2307 -1.2307 6.6584 6.6584 6.8961 6.8961 7.5428 7.5428 7.8473 7.8473 7.8594 7.8594 9.3582 9.3582 9.6995 9.6995 9.9525 9.9525 10.2316 10.2316 12.1391 12.1391 12.3532 12.3532 13.1257 13.1257 15.1660 15.1660 k =-0.1875 0.1869 0.4965 ( 2720 PWs) bands (ev): -46.3963 -46.3963 -25.3508 -25.3508 -22.5686 -22.5686 -22.1683 -22.1683 -14.6914 -14.6914 -6.9467 -6.9467 -6.4018 -6.4018 -5.0803 -5.0803 -4.2500 -4.2500 -2.1076 -2.1076 -1.2395 -1.2395 6.6071 6.6071 6.8542 6.8542 7.5456 7.5456 7.7592 7.7592 7.8764 7.8764 9.3740 9.3740 9.6883 9.6883 9.9558 9.9558 10.2494 10.2494 12.1577 12.1577 12.3693 12.3693 13.1839 13.1839 15.2262 15.2262 k =-0.1964 0.1958 0.4965 ( 2728 PWs) bands (ev): -46.3962 -46.3962 -25.3506 -25.3506 -22.5702 -22.5702 -22.1700 -22.1700 -14.6882 -14.6882 -6.9210 -6.9210 -6.3930 -6.3930 -5.0907 -5.0907 -4.2523 -4.2523 -2.1187 -2.1187 -1.2498 -1.2498 6.5551 6.5551 6.8110 6.8110 7.5508 7.5508 7.6685 7.6685 7.8969 7.8969 9.3918 9.3918 9.6777 9.6777 9.9589 9.9589 10.2670 10.2670 12.1778 12.1778 12.3868 12.3868 13.2423 13.2423 15.2850 15.2850 k =-0.2054 0.2047 0.4965 ( 2724 PWs) bands (ev): -46.3961 -46.3961 -25.3502 -25.3502 -22.5718 -22.5718 -22.1717 -22.1717 -14.6849 -14.6849 -6.8945 -6.8945 -6.3840 -6.3840 -5.1001 -5.1001 -4.2551 -4.2551 -2.1306 -2.1306 -1.2617 -1.2617 6.5025 6.5025 6.7665 6.7665 7.5582 7.5582 7.5788 7.5788 7.9178 7.9178 9.4116 9.4116 9.6679 9.6679 9.9616 9.9616 10.2843 10.2843 12.1993 12.1993 12.4057 12.4057 13.3005 13.3005 15.3419 15.3419 k =-0.2143 0.2136 0.4965 ( 2724 PWs) bands (ev): -46.3961 -46.3961 -25.3499 -25.3499 -22.5733 -22.5733 -22.1735 -22.1735 -14.6817 -14.6817 -6.8673 -6.8673 -6.3748 -6.3748 -5.1084 -5.1084 -4.2583 -4.2583 -2.1432 -2.1432 -1.2752 -1.2752 6.4494 6.4494 6.7211 6.7211 7.4893 7.4893 7.5690 7.5690 7.9389 7.9389 9.4333 9.4333 9.6589 9.6589 9.9641 9.9641 10.3014 10.3014 12.2222 12.2222 12.4258 12.4258 13.3586 13.3586 15.3965 15.3965 k =-0.2232 0.2225 0.4965 ( 2720 PWs) bands (ev): -46.3960 -46.3960 -25.3495 -25.3495 -22.5749 -22.5749 -22.1752 -22.1752 -14.6783 -14.6783 -6.8396 -6.8396 -6.3655 -6.3655 -5.1156 -5.1156 -4.2620 -4.2620 -2.1565 -2.1565 -1.2904 -1.2904 6.3959 6.3959 6.6749 6.6749 7.4015 7.4015 7.5819 7.5819 7.9602 7.9602 9.4568 9.4568 9.6510 9.6510 9.9663 9.9663 10.3183 10.3183 12.2464 12.2464 12.4472 12.4472 13.4163 13.4163 15.4482 15.4482 k =-0.2321 0.2314 0.4965 ( 2714 PWs) bands (ev): -46.3959 -46.3959 -25.3492 -25.3492 -22.5765 -22.5765 -22.1769 -22.1769 -14.6750 -14.6750 -6.8113 -6.8113 -6.3560 -6.3560 -5.1215 -5.1215 -4.2662 -4.2662 -2.1705 -2.1705 -1.3072 -1.3072 6.3423 6.3423 6.6281 6.6281 7.3151 7.3151 7.5975 7.5975 7.9817 7.9817 9.4820 9.4820 9.6442 9.6442 9.9682 9.9682 10.3351 10.3351 12.2718 12.2718 12.4697 12.4697 13.4736 13.4736 15.4967 15.4967 k =-0.2411 0.2403 0.4965 ( 2714 PWs) bands (ev): -46.3959 -46.3959 -25.3489 -25.3489 -22.5781 -22.5781 -22.1787 -22.1787 -14.6717 -14.6717 -6.7827 -6.7827 -6.3465 -6.3465 -5.1262 -5.1262 -4.2709 -4.2709 -2.1850 -2.1850 -1.3258 -1.3258 6.2885 6.2885 6.5809 6.5809 7.2303 7.2303 7.6156 7.6156 8.0032 8.0032 9.5087 9.5087 9.6386 9.6386 9.9699 9.9699 10.3518 10.3518 12.2981 12.2981 12.4932 12.4932 13.5303 13.5303 15.5415 15.5415 k =-0.2500 0.2492 0.4965 ( 2714 PWs) bands (ev): -46.3958 -46.3958 -25.3485 -25.3485 -22.5798 -22.5798 -22.1805 -22.1805 -14.6684 -14.6684 -6.7536 -6.7536 -6.3368 -6.3368 -5.1297 -5.1297 -4.2761 -4.2761 -2.2000 -2.2000 -1.3460 -1.3460 6.2347 6.2347 6.5335 6.5335 7.1474 7.1474 7.6362 7.6362 8.0247 8.0247 9.5368 9.5368 9.6344 9.6344 9.9713 9.9713 10.3683 10.3683 12.3255 12.3255 12.5177 12.5177 13.5863 13.5863 15.5823 15.5823 k =-0.2589 0.2581 0.4965 ( 2714 PWs) bands (ev): -46.3957 -46.3957 -25.3482 -25.3482 -22.5814 -22.5814 -22.1823 -22.1823 -14.6651 -14.6651 -6.7243 -6.7243 -6.3272 -6.3272 -5.1318 -5.1318 -4.2818 -4.2818 -2.2155 -2.2155 -1.3679 -1.3679 6.1810 6.1810 6.4861 6.4861 7.0664 7.0664 7.6591 7.6591 8.0463 8.0463 9.5660 9.5660 9.6316 9.6316 9.9725 9.9725 10.3847 10.3847 12.3536 12.3536 12.5430 12.5430 13.6414 13.6414 15.6189 15.6189 k =-0.2679 0.2670 0.4965 ( 2712 PWs) bands (ev): -46.3957 -46.3957 -25.3479 -25.3479 -22.5830 -22.5830 -22.1840 -22.1840 -14.6618 -14.6618 -6.6948 -6.6948 -6.3175 -6.3175 -5.1326 -5.1326 -4.2879 -4.2879 -2.2314 -2.2314 -1.3912 -1.3912 6.1275 6.1275 6.4389 6.4389 6.9878 6.9878 7.6841 7.6841 8.0677 8.0677 9.5962 9.5962 9.6306 9.6306 9.9735 9.9735 10.4010 10.4010 12.3825 12.3825 12.5691 12.5691 13.6957 13.6957 15.6510 15.6510 k =-0.2768 0.2759 0.4965 ( 2712 PWs) bands (ev): -46.3956 -46.3956 -25.3476 -25.3476 -22.5846 -22.5846 -22.1858 -22.1858 -14.6585 -14.6585 -6.6651 -6.6651 -6.3079 -6.3079 -5.1321 -5.1321 -4.2945 -4.2945 -2.2476 -2.2476 -1.4160 -1.4160 6.0744 6.0744 6.3920 6.3920 6.9114 6.9114 7.7110 7.7110 8.0891 8.0891 9.6247 9.6247 9.6338 9.6338 9.9744 9.9744 10.4172 10.4172 12.4119 12.4119 12.5957 12.5957 13.7491 13.7491 15.6785 15.6785 k =-0.2857 0.2848 0.4965 ( 2716 PWs) bands (ev): -46.3955 -46.3955 -25.3473 -25.3473 -22.5862 -22.5862 -22.1876 -22.1876 -14.6553 -14.6553 -6.6355 -6.6355 -6.2983 -6.2983 -5.1302 -5.1302 -4.3015 -4.3015 -2.2641 -2.2641 -1.4420 -1.4420 6.0216 6.0216 6.3457 6.3457 6.8376 6.8376 7.7395 7.7395 8.1104 8.1104 9.6318 9.6318 9.6608 9.6608 9.9751 9.9751 10.4332 10.4332 12.4418 12.4418 12.6228 12.6228 13.8013 13.8013 15.7015 15.7015 k =-0.2946 0.2937 0.4965 ( 2714 PWs) bands (ev): -46.3955 -46.3955 -25.3470 -25.3470 -22.5878 -22.5878 -22.1893 -22.1893 -14.6522 -14.6522 -6.6059 -6.6059 -6.2888 -6.2888 -5.1271 -5.1271 -4.3090 -4.3090 -2.2809 -2.2809 -1.4692 -1.4692 5.9694 5.9694 6.3000 6.3000 6.7665 6.7665 7.7693 7.7693 8.1315 8.1315 9.6361 9.6361 9.6932 9.6932 9.9757 9.9757 10.4491 10.4491 12.4720 12.4720 12.6501 12.6501 13.8524 13.8524 15.7201 15.7201 k =-0.3036 0.3026 0.4965 ( 2714 PWs) bands (ev): -46.3954 -46.3954 -25.3467 -25.3467 -22.5893 -22.5893 -22.1910 -22.1910 -14.6491 -14.6491 -6.5765 -6.5765 -6.2795 -6.2795 -5.1226 -5.1226 -4.3169 -4.3169 -2.2978 -2.2978 -1.4973 -1.4973 5.9178 5.9178 6.2553 6.2553 6.6982 6.6982 7.8000 7.8000 8.1526 8.1526 9.6420 9.6420 9.7261 9.7261 9.9762 9.9762 10.4647 10.4647 12.5023 12.5023 12.6777 12.6777 13.9023 13.9023 15.7346 15.7346 k =-0.3125 0.3115 0.4965 ( 2718 PWs) bands (ev): -46.3953 -46.3953 -25.3465 -25.3465 -22.5908 -22.5908 -22.1926 -22.1926 -14.6462 -14.6462 -6.5473 -6.5473 -6.2703 -6.2703 -5.1169 -5.1169 -4.3253 -4.3253 -2.3149 -2.3149 -1.5261 -1.5261 5.8669 5.8669 6.2115 6.2115 6.6328 6.6328 7.8313 7.8313 8.1734 8.1734 9.6499 9.6499 9.7593 9.7593 9.9767 9.9767 10.4802 10.4802 12.5328 12.5328 12.7053 12.7053 13.9508 13.9509 15.7451 15.7451 k =-0.3214 0.3204 0.4965 ( 2722 PWs) bands (ev): -46.3953 -46.3953 -25.3461 -25.3461 -22.5924 -22.5924 -22.1943 -22.1943 -14.6433 -14.6433 -6.5185 -6.5185 -6.2612 -6.2612 -5.1100 -5.1100 -4.3340 -4.3340 -2.3320 -2.3320 -1.5555 -1.5555 5.8169 5.8169 6.1688 6.1688 6.5704 6.5704 7.8627 7.8627 8.1941 8.1941 9.6597 9.6597 9.7925 9.7925 9.9772 9.9772 10.4954 10.4954 12.5632 12.5632 12.7328 12.7328 13.9980 13.9980 15.7519 15.7519 k =-0.3304 0.3293 0.4965 ( 2722 PWs) bands (ev): -46.3952 -46.3952 -25.3459 -25.3459 -22.5938 -22.5938 -22.1959 -22.1959 -14.6404 -14.6404 -6.4902 -6.4902 -6.2524 -6.2524 -5.1020 -5.1020 -4.3432 -4.3432 -2.3492 -2.3492 -1.5852 -1.5852 5.7680 5.7680 6.1274 6.1274 6.5111 6.5111 7.8939 7.8939 8.2147 8.2147 9.6715 9.6715 9.8257 9.8257 9.9777 9.9777 10.5103 10.5103 12.5934 12.5934 12.7601 12.7601 14.0438 14.0438 15.7556 15.7556 k =-0.3393 0.3383 0.4965 ( 2710 PWs) bands (ev): -46.3952 -46.3952 -25.3456 -25.3456 -22.5951 -22.5951 -22.1973 -22.1973 -14.6377 -14.6377 -6.4624 -6.4624 -6.2438 -6.2438 -5.0928 -5.0928 -4.3527 -4.3527 -2.3663 -2.3663 -1.6149 -1.6149 5.7203 5.7203 6.0875 6.0875 6.4549 6.4549 7.9245 7.9245 8.2351 8.2351 9.6854 9.6854 9.8585 9.8585 9.9782 9.9782 10.5249 10.5249 12.6232 12.6232 12.7870 12.7870 14.0880 14.0880 15.7564 15.7564 k =-0.3482 0.3472 0.4965 ( 2714 PWs) bands (ev): -46.3951 -46.3951 -25.3453 -25.3453 -22.5965 -22.5965 -22.1988 -22.1988 -14.6351 -14.6351 -6.4354 -6.4354 -6.2354 -6.2354 -5.0827 -5.0827 -4.3626 -4.3626 -2.3834 -2.3834 -1.6446 -1.6446 5.6739 5.6739 6.0490 6.0490 6.4018 6.4018 7.9541 7.9541 8.2553 8.2553 9.7012 9.7012 9.8908 9.8908 9.9787 9.9787 10.5391 10.5391 12.6526 12.6526 12.8133 12.8133 14.1307 14.1307 15.7546 15.7546 k =-0.3571 0.3561 0.4965 ( 2710 PWs) bands (ev): -46.3951 -46.3951 -25.3450 -25.3450 -22.5977 -22.5977 -22.2002 -22.2002 -14.6326 -14.6326 -6.4091 -6.4091 -6.2274 -6.2274 -5.0716 -5.0716 -4.3728 -4.3728 -2.4003 -2.4003 -1.6738 -1.6738 5.6289 5.6289 6.0122 6.0122 6.3519 6.3519 7.9824 7.9824 8.2752 8.2752 9.7189 9.7189 9.9224 9.9224 9.9793 9.9793 10.5529 10.5529 12.6814 12.6814 12.8390 12.8390 14.1717 14.1717 15.7508 15.7508 k =-0.3661 0.3650 0.4965 ( 2706 PWs) bands (ev): -46.3950 -46.3950 -25.3448 -25.3448 -22.5990 -22.5990 -22.2015 -22.2015 -14.6302 -14.6302 -6.3837 -6.3837 -6.2196 -6.2196 -5.0597 -5.0597 -4.3832 -4.3832 -2.4171 -2.4171 -1.7025 -1.7025 5.5857 5.5857 5.9771 5.9771 6.3053 6.3053 8.0091 8.0091 8.2948 8.2948 9.7383 9.7383 9.9531 9.9531 9.9800 9.9800 10.5663 10.5663 12.7094 12.7094 12.8640 12.8640 14.2109 14.2109 15.7452 15.7452 k =-0.3750 0.3739 0.4965 ( 2714 PWs) bands (ev): -46.3950 -46.3950 -25.3446 -25.3446 -22.6002 -22.6002 -22.2028 -22.2028 -14.6280 -14.6280 -6.3593 -6.3593 -6.2122 -6.2122 -5.0470 -5.0470 -4.3940 -4.3940 -2.4335 -2.4335 -1.7303 -1.7303 5.5442 5.5442 5.9438 5.9438 6.2617 6.2617 8.0340 8.0340 8.3139 8.3139 9.7592 9.7592 9.9792 9.9792 9.9844 9.9844 10.5791 10.5791 12.7366 12.7366 12.8880 12.8880 14.2483 14.2483 15.7383 15.7383 k =-0.3839 0.3828 0.4965 ( 2710 PWs) bands (ev): -46.3949 -46.3949 -25.3444 -25.3444 -22.6012 -22.6012 -22.2040 -22.2040 -14.6259 -14.6259 -6.3361 -6.3361 -6.2052 -6.2052 -5.0338 -5.0338 -4.4049 -4.4049 -2.4496 -2.4496 -1.7571 -1.7571 5.5048 5.5048 5.9124 5.9124 6.2214 6.2214 8.0570 8.0570 8.3325 8.3325 9.7814 9.7814 9.9810 9.9810 10.0118 10.0118 10.5913 10.5913 12.7627 12.7627 12.9110 12.9110 14.2838 14.2838 15.7302 15.7302 k =-0.3929 0.3917 0.4965 ( 2714 PWs) bands (ev): -46.3949 -46.3949 -25.3442 -25.3442 -22.6023 -22.6023 -22.2052 -22.2052 -14.6239 -14.6239 -6.3141 -6.3141 -6.1986 -6.1986 -5.0202 -5.0202 -4.4159 -4.4159 -2.4652 -2.4652 -1.7826 -1.7826 5.4675 5.4675 5.8830 5.8830 6.1842 6.1842 8.0779 8.0779 8.3504 8.3504 9.8046 9.8046 9.9818 9.9818 10.0389 10.0389 10.6029 10.6029 12.7877 12.7877 12.9329 12.9329 14.3173 14.3173 15.7213 15.7213 k =-0.4018 0.4006 0.4965 ( 2714 PWs) bands (ev): -46.3948 -46.3948 -25.3440 -25.3440 -22.6033 -22.6033 -22.2063 -22.2063 -14.6221 -14.6221 -6.2934 -6.2934 -6.1923 -6.1923 -5.0063 -5.0063 -4.4270 -4.4270 -2.4803 -2.4803 -1.8066 -1.8066 5.4326 5.4326 5.8557 5.8557 6.1501 6.1501 8.0969 8.0969 8.3674 8.3674 9.8284 9.8284 9.9825 9.9825 10.0646 10.0646 10.6139 10.6139 12.8114 12.8114 12.9535 12.9535 14.3488 14.3488 15.7120 15.7120 k =-0.4107 0.4095 0.4965 ( 2716 PWs) bands (ev): -46.3948 -46.3948 -25.3438 -25.3438 -22.6042 -22.6042 -22.2072 -22.2072 -14.6204 -14.6204 -6.2742 -6.2742 -6.1865 -6.1865 -4.9922 -4.9922 -4.4380 -4.4380 -2.4947 -2.4947 -1.8291 -1.8291 5.4001 5.4001 5.8305 5.8305 6.1192 6.1192 8.1138 8.1138 8.3834 8.3834 9.8523 9.8523 9.9833 9.9833 10.0886 10.0886 10.6240 10.6240 12.8336 12.8336 12.9727 12.9727 14.3780 14.3780 15.7024 15.7024 k =-0.4196 0.4184 0.4965 ( 2716 PWs) bands (ev): -46.3948 -46.3948 -25.3436 -25.3436 -22.6050 -22.6050 -22.2081 -22.2081 -14.6188 -14.6188 -6.2565 -6.2565 -6.1811 -6.1811 -4.9783 -4.9783 -4.4489 -4.4489 -2.5082 -2.5082 -1.8498 -1.8498 5.3703 5.3703 5.8076 5.8076 6.0912 6.0912 8.1288 8.1288 8.3982 8.3982 9.8760 9.8760 9.9840 9.9840 10.1108 10.1108 10.6334 10.6334 12.8542 12.8542 12.9905 12.9905 14.4050 14.4050 15.6929 15.6929 k =-0.4286 0.4273 0.4965 ( 2716 PWs) bands (ev): -46.3947 -46.3947 -25.3435 -25.3435 -22.6057 -22.6057 -22.2090 -22.2090 -14.6174 -14.6174 -6.2405 -6.2405 -6.1761 -6.1761 -4.9647 -4.9647 -4.4595 -4.4595 -2.5209 -2.5209 -1.8686 -1.8686 5.3432 5.3432 5.7869 5.7869 6.0664 6.0664 8.1419 8.1419 8.4117 8.4117 9.8989 9.8989 9.9848 9.9848 10.1311 10.1311 10.6420 10.6420 12.8731 12.8731 13.0067 13.0067 14.4295 14.4295 15.6835 15.6835 k =-0.4375 0.4362 0.4965 ( 2716 PWs) bands (ev): -46.3947 -46.3947 -25.3434 -25.3434 -22.6064 -22.6064 -22.2097 -22.2097 -14.6162 -14.6162 -6.2262 -6.2262 -6.1716 -6.1716 -4.9517 -4.9517 -4.4696 -4.4696 -2.5324 -2.5324 -1.8854 -1.8854 5.3190 5.3190 5.7685 5.7685 6.0445 6.0445 8.1532 8.1532 8.4237 8.4237 9.9206 9.9206 9.9855 9.9855 10.1493 10.1493 10.6497 10.6497 12.8902 12.8902 13.0213 13.0213 14.4516 14.4516 15.6747 15.6747 k =-0.4464 0.4451 0.4965 ( 2712 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6069 -22.6069 -22.2103 -22.2103 -14.6151 -14.6151 -6.2138 -6.2138 -6.1675 -6.1675 -4.9395 -4.9395 -4.4791 -4.4791 -2.5428 -2.5428 -1.9001 -1.9001 5.2979 5.2979 5.7525 5.7525 6.0256 6.0256 8.1629 8.1629 8.4343 8.4343 9.9405 9.9405 9.9861 9.9861 10.1653 10.1653 10.6564 10.6564 12.9053 12.9053 13.0342 13.0342 14.4710 14.4710 15.6665 15.6665 k =-0.4554 0.4540 0.4965 ( 2716 PWs) bands (ev): -46.3947 -46.3947 -25.3432 -25.3432 -22.6074 -22.6074 -22.2108 -22.2108 -14.6142 -14.6142 -6.2034 -6.2034 -6.1639 -6.1639 -4.9285 -4.9285 -4.4877 -4.4877 -2.5518 -2.5518 -1.9127 -1.9127 5.2798 5.2798 5.7389 5.7389 6.0096 6.0096 8.1709 8.1709 8.4434 8.4434 9.9583 9.9583 9.9867 9.9867 10.1790 10.1790 10.6622 10.6622 12.9182 12.9182 13.0452 13.0452 14.4877 14.4877 15.6592 15.6592 k =-0.4643 0.4629 0.4965 ( 2720 PWs) bands (ev): -46.3946 -46.3946 -25.3431 -25.3431 -22.6078 -22.6078 -22.2113 -22.2113 -14.6135 -14.6135 -6.1949 -6.1949 -6.1607 -6.1607 -4.9189 -4.9189 -4.4952 -4.4952 -2.5594 -2.5594 -1.9230 -1.9230 5.2648 5.2648 5.7277 5.7277 5.9966 5.9966 8.1773 8.1773 8.4508 8.4508 9.9734 9.9734 9.9872 9.9872 10.1903 10.1903 10.6670 10.6670 12.9290 12.9290 13.0543 13.0543 14.5015 14.5015 15.6529 15.6529 k =-0.4732 0.4718 0.4965 ( 2724 PWs) bands (ev): -46.3946 -46.3946 -25.3431 -25.3431 -22.6081 -22.6081 -22.2116 -22.2116 -14.6129 -14.6129 -6.1885 -6.1885 -6.1580 -6.1580 -4.9110 -4.9110 -4.5014 -4.5014 -2.5654 -2.5654 -1.9311 -1.9311 5.2532 5.2532 5.7189 5.7189 5.9865 5.9865 8.1823 8.1823 8.4566 8.4566 9.9850 9.9850 9.9882 9.9882 10.1992 10.1992 10.6707 10.6707 12.9375 12.9375 13.0615 13.0615 14.5123 14.5123 15.6478 15.6478 k =-0.4821 0.4807 0.4965 ( 2720 PWs) bands (ev): -46.3946 -46.3946 -25.3431 -25.3431 -22.6083 -22.6083 -22.2118 -22.2118 -14.6125 -14.6125 -6.1840 -6.1840 -6.1560 -6.1560 -4.9052 -4.9052 -4.5060 -4.5060 -2.5697 -2.5697 -1.9369 -1.9369 5.2448 5.2448 5.7127 5.7127 5.9793 5.9793 8.1858 8.1858 8.4607 8.4607 9.9875 9.9875 9.9950 9.9950 10.2056 10.2056 10.6734 10.6734 12.9436 12.9436 13.0667 13.0667 14.5202 14.5202 15.6441 15.6441 k =-0.4911 0.4896 0.4965 ( 2720 PWs) bands (ev): -46.3946 -46.3946 -25.3431 -25.3431 -22.6085 -22.6085 -22.2119 -22.2119 -14.6122 -14.6122 -6.1813 -6.1813 -6.1547 -6.1547 -4.9016 -4.9016 -4.5089 -4.5089 -2.5724 -2.5724 -1.9404 -1.9404 5.2397 5.2397 5.7089 5.7089 5.9749 5.9749 8.1878 8.1878 8.4632 8.4632 9.9878 9.9878 10.0003 10.0003 10.2095 10.2095 10.6750 10.6750 12.9472 12.9472 13.0698 13.0698 14.5249 14.5249 15.6418 15.6418 k =-0.5000 0.4985 0.4965 ( 2728 PWs) bands (ev): -46.3946 -46.3946 -25.3432 -25.3432 -22.6086 -22.6086 -22.2120 -22.2120 -14.6122 -14.6122 -6.1804 -6.1804 -6.1542 -6.1542 -4.9004 -4.9004 -4.5098 -4.5098 -2.5733 -2.5733 -1.9415 -1.9415 5.2380 5.2380 5.7077 5.7077 5.9735 5.9735 8.1885 8.1885 8.4640 8.4640 9.9879 9.9879 10.0021 10.0021 10.2108 10.2108 10.6756 10.6756 12.9485 12.9485 13.0709 13.0709 14.5265 14.5265 15.6411 15.6411 Writing output data file BaTiO3.save init_run : 3.63s CPU 13.30s WALL ( 1 calls) electrons : 685.60s CPU 694.75s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.38s CPU 1.57s WALL ( 1 calls) Called by electrons: c_bands : 685.58s CPU 694.39s WALL ( 1 calls) v_of_rho : 0.16s CPU 1.04s WALL ( 1 calls) v_h : 0.00s CPU 0.02s WALL ( 1 calls) v_xc : 0.16s CPU 0.64s WALL ( 1 calls) newd : 0.30s CPU 0.51s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.13s WALL ( 478 calls) cegterg : 645.79s CPU 650.62s WALL ( 1021 calls) Called by sum_band: Called by *egterg: h_psi : 261.43s CPU 271.04s WALL ( 16613 calls) s_psi : 28.85s CPU 29.28s WALL ( 16613 calls) g_psi : 0.61s CPU 0.67s WALL ( 15114 calls) cdiaghg : 259.64s CPU 255.98s WALL ( 15592 calls) cegterg:over : 61.45s CPU 58.08s WALL ( 15114 calls) cegterg:upda : 8.15s CPU 11.82s WALL ( 15114 calls) cegterg:last : 8.39s CPU 9.54s WALL ( 2977 calls) Called by h_psi: h_psi:vloc : 204.25s CPU 212.26s WALL ( 16613 calls) h_psi:vnl : 56.90s CPU 57.92s WALL ( 16613 calls) add_vuspsi : 16.98s CPU 21.41s WALL ( 16613 calls) General routines calbec : 39.86s CPU 36.39s WALL ( 16613 calls) fft : 0.27s CPU 1.13s WALL ( 19 calls) ffts : 0.09s CPU 0.09s WALL ( 4 calls) fftw : 190.76s CPU 195.15s WALL ( 1724536 calls) interpolate : 0.10s CPU 0.11s WALL ( 4 calls) davcio : 0.05s CPU 2.73s WALL ( 956 calls) Parallel routines fft_scatter : 136.55s CPU 139.67s WALL ( 1724559 calls) PWSCF : 12m24.37s CPU 13m57.93s WALL This run was terminated on: 21:36:31 9Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=