Program PWSCF v.5.1.1 starts on 21Jul2015 at 4:46:17 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: ./HfAl.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 27 20 5 775 471 75 Max 28 21 6 782 483 82 Sum 1319 965 287 37313 22951 3801 bravais-lattice index = 14 lattice parameter (alat) = 10.6854 a.u. unit-cell volume = 509.0563 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 30.00 number of Kohn-Sham states= 38 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 266.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.685418 celldm(2)= 1.000000 celldm(3)= 0.757276 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.834517 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.834517 0.550982 0.000000 ) a(3) = ( 0.000000 0.000000 0.757276 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.514600 -0.000000 ) b(2) = ( 0.000000 1.814942 -0.000000 ) b(3) = ( 0.000000 0.000000 1.320523 ) PseudoPot. # 1 for Hf read from file: /home/autes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 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 1271 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Al read from file: /home/autes/Pseudo/Al.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: d18dd1d035d87b93e5ebab176be81bd5 Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Hf 12.00 178.49000 Hf( 1.00) Al 3.00 26.98150 Al( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 446 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 2) = ( 0.0051425 0.0171221 -0.0000000), wk = 0.0022422 k( 3) = ( 0.0102849 0.0342442 -0.0000000), wk = 0.0022422 k( 4) = ( 0.0154274 0.0513663 -0.0000000), wk = 0.0022422 k( 5) = ( 0.0205699 0.0684884 -0.0000000), wk = 0.0022422 k( 6) = ( 0.0257124 0.0856104 -0.0000000), wk = 0.0022422 k( 7) = ( 0.0308549 0.1027326 -0.0000000), wk = 0.0022422 k( 8) = ( 0.0359973 0.1198547 -0.0000000), wk = 0.0022422 k( 9) = ( 0.0411398 0.1369767 -0.0000000), wk = 0.0022422 k( 10) = ( 0.0462823 0.1540988 -0.0000000), wk = 0.0022422 k( 11) = ( 0.0514248 0.1712209 -0.0000000), wk = 0.0022422 k( 12) = ( 0.0565672 0.1883430 -0.0000000), wk = 0.0022422 k( 13) = ( 0.0617097 0.2054651 -0.0000000), wk = 0.0022422 k( 14) = ( 0.0668522 0.2225872 -0.0000000), wk = 0.0022422 k( 15) = ( 0.0719947 0.2397093 -0.0000000), wk = 0.0022422 k( 16) = ( 0.0771372 0.2568314 -0.0000000), wk = 0.0022422 k( 17) = ( 0.0822796 0.2739535 -0.0000000), wk = 0.0022422 k( 18) = ( 0.0874221 0.2910756 -0.0000000), wk = 0.0022422 k( 19) = ( 0.0925646 0.3081977 -0.0000000), wk = 0.0022422 k( 20) = ( 0.0977071 0.3253198 -0.0000000), wk = 0.0022422 k( 21) = ( 0.1028495 0.3424419 -0.0000000), wk = 0.0022422 k( 22) = ( 0.1079920 0.3595639 -0.0000000), wk = 0.0022422 k( 23) = ( 0.1131345 0.3766860 -0.0000000), wk = 0.0022422 k( 24) = ( 0.1182770 0.3938081 -0.0000000), wk = 0.0022422 k( 25) = ( 0.1234194 0.4109302 -0.0000000), wk = 0.0022422 k( 26) = ( 0.1285619 0.4280523 -0.0000000), wk = 0.0022422 k( 27) = ( 0.1337044 0.4451744 -0.0000000), wk = 0.0022422 k( 28) = ( 0.1388469 0.4622965 -0.0000000), wk = 0.0022422 k( 29) = ( 0.1439893 0.4794186 -0.0000000), wk = 0.0022422 k( 30) = ( 0.1491318 0.4965407 -0.0000000), wk = 0.0022422 k( 31) = ( 0.1542743 0.5136628 -0.0000000), wk = 0.0022422 k( 32) = ( 0.1594168 0.5307849 -0.0000000), wk = 0.0022422 k( 33) = ( 0.1645593 0.5479070 -0.0000000), wk = 0.0022422 k( 34) = ( 0.1697017 0.5650290 -0.0000000), wk = 0.0022422 k( 35) = ( 0.1748442 0.5821511 -0.0000000), wk = 0.0022422 k( 36) = ( 0.1799867 0.5992732 -0.0000000), wk = 0.0022422 k( 37) = ( 0.1851292 0.6163953 -0.0000000), wk = 0.0022422 k( 38) = ( 0.1902716 0.6335174 -0.0000000), wk = 0.0022422 k( 39) = ( 0.1954141 0.6506395 -0.0000000), wk = 0.0022422 k( 40) = ( 0.2005566 0.6677616 -0.0000000), wk = 0.0022422 k( 41) = ( 0.2056991 0.6848837 -0.0000000), wk = 0.0022422 k( 42) = ( 0.2108415 0.7020058 -0.0000000), wk = 0.0022422 k( 43) = ( 0.2159840 0.7191279 -0.0000000), wk = 0.0022422 k( 44) = ( 0.2211265 0.7362500 -0.0000000), wk = 0.0022422 k( 45) = ( 0.2262690 0.7533721 -0.0000000), wk = 0.0022422 k( 46) = ( 0.2314115 0.7704942 -0.0000000), wk = 0.0022422 k( 47) = ( 0.2365539 0.7876162 -0.0000000), wk = 0.0022422 k( 48) = ( 0.2416964 0.8047383 -0.0000000), wk = 0.0022422 k( 49) = ( 0.2468389 0.8218604 -0.0000000), wk = 0.0022422 k( 50) = ( 0.2519814 0.8389825 -0.0000000), wk = 0.0022422 k( 51) = ( 0.2571238 0.8561046 -0.0000000), wk = 0.0022422 k( 52) = ( 0.2622663 0.8732267 -0.0000000), wk = 0.0022422 k( 53) = ( 0.2674088 0.8903488 -0.0000000), wk = 0.0022422 k( 54) = ( 0.2725513 0.9074709 -0.0000000), wk = 0.0022422 k( 55) = ( 0.2725513 0.9074709 -0.0000000), wk = 0.0022422 k( 56) = ( 0.2555168 0.9074709 -0.0000000), wk = 0.0022422 k( 57) = ( 0.2384824 0.9074709 -0.0000000), wk = 0.0022422 k( 58) = ( 0.2214479 0.9074709 -0.0000000), wk = 0.0022422 k( 59) = ( 0.2044134 0.9074709 -0.0000000), wk = 0.0022422 k( 60) = ( 0.1873790 0.9074709 -0.0000000), wk = 0.0022422 k( 61) = ( 0.1703445 0.9074709 -0.0000000), wk = 0.0022422 k( 62) = ( 0.1533101 0.9074709 -0.0000000), wk = 0.0022422 k( 63) = ( 0.1362756 0.9074709 -0.0000000), wk = 0.0022422 k( 64) = ( 0.1192412 0.9074709 -0.0000000), wk = 0.0022422 k( 65) = ( 0.1022067 0.9074709 -0.0000000), wk = 0.0022422 k( 66) = ( 0.0851723 0.9074709 -0.0000000), wk = 0.0022422 k( 67) = ( 0.0681378 0.9074709 -0.0000000), wk = 0.0022422 k( 68) = ( 0.0511034 0.9074709 -0.0000000), wk = 0.0022422 k( 69) = ( 0.0340689 0.9074709 -0.0000000), wk = 0.0022422 k( 70) = ( 0.0170344 0.9074709 -0.0000000), wk = 0.0022422 k( 71) = ( 0.0000000 0.9074709 -0.0000000), wk = 0.0022422 k( 72) = ( 0.0000000 0.9074709 -0.0000000), wk = 0.0022422 k( 73) = ( 0.0000000 0.9074709 0.0178449), wk = 0.0022422 k( 74) = ( 0.0000000 0.9074709 0.0356898), wk = 0.0022422 k( 75) = ( 0.0000000 0.9074709 0.0535347), wk = 0.0022422 k( 76) = ( 0.0000000 0.9074709 0.0713796), wk = 0.0022422 k( 77) = ( 0.0000000 0.9074709 0.0892245), wk = 0.0022422 k( 78) = ( 0.0000000 0.9074709 0.1070694), wk = 0.0022422 k( 79) = ( 0.0000000 0.9074709 0.1249143), wk = 0.0022422 k( 80) = ( 0.0000000 0.9074709 0.1427593), wk = 0.0022422 k( 81) = ( 0.0000000 0.9074709 0.1606042), wk = 0.0022422 k( 82) = ( 0.0000000 0.9074709 0.1784491), wk = 0.0022422 k( 83) = ( 0.0000000 0.9074709 0.1962940), wk = 0.0022422 k( 84) = ( 0.0000000 0.9074709 0.2141389), wk = 0.0022422 k( 85) = ( 0.0000000 0.9074709 0.2319838), wk = 0.0022422 k( 86) = ( 0.0000000 0.9074709 0.2498287), wk = 0.0022422 k( 87) = ( 0.0000000 0.9074709 0.2676736), wk = 0.0022422 k( 88) = ( 0.0000000 0.9074709 0.2855185), wk = 0.0022422 k( 89) = ( 0.0000000 0.9074709 0.3033634), wk = 0.0022422 k( 90) = ( 0.0000000 0.9074709 0.3212083), wk = 0.0022422 k( 91) = ( 0.0000000 0.9074709 0.3390532), wk = 0.0022422 k( 92) = ( 0.0000000 0.9074709 0.3568981), wk = 0.0022422 k( 93) = ( 0.0000000 0.9074709 0.3747430), wk = 0.0022422 k( 94) = ( 0.0000000 0.9074709 0.3925879), wk = 0.0022422 k( 95) = ( 0.0000000 0.9074709 0.4104329), wk = 0.0022422 k( 96) = ( 0.0000000 0.9074709 0.4282778), wk = 0.0022422 k( 97) = ( 0.0000000 0.9074709 0.4461227), wk = 0.0022422 k( 98) = ( 0.0000000 0.9074709 0.4639676), wk = 0.0022422 k( 99) = ( 0.0000000 0.9074709 0.4818125), wk = 0.0022422 k( 100) = ( 0.0000000 0.9074709 0.4996574), wk = 0.0022422 k( 101) = ( 0.0000000 0.9074709 0.5175023), wk = 0.0022422 k( 102) = ( 0.0000000 0.9074709 0.5353472), wk = 0.0022422 k( 103) = ( 0.0000000 0.9074709 0.5531921), wk = 0.0022422 k( 104) = ( 0.0000000 0.9074709 0.5710370), wk = 0.0022422 k( 105) = ( 0.0000000 0.9074709 0.5888819), wk = 0.0022422 k( 106) = ( 0.0000000 0.9074709 0.6067268), wk = 0.0022422 k( 107) = ( 0.0000000 0.9074709 0.6245717), wk = 0.0022422 k( 108) = ( 0.0000000 0.9074709 0.6424166), wk = 0.0022422 k( 109) = ( 0.0000000 0.9074709 0.6602615), wk = 0.0022422 k( 110) = ( 0.0000000 0.9074709 0.6602615), wk = 0.0022422 k( 111) = ( 0.0170344 0.9074709 0.6602615), wk = 0.0022422 k( 112) = ( 0.0340689 0.9074709 0.6602615), wk = 0.0022422 k( 113) = ( 0.0511034 0.9074709 0.6602615), wk = 0.0022422 k( 114) = ( 0.0681378 0.9074709 0.6602615), wk = 0.0022422 k( 115) = ( 0.0851723 0.9074709 0.6602615), wk = 0.0022422 k( 116) = ( 0.1022067 0.9074709 0.6602615), wk = 0.0022422 k( 117) = ( 0.1192412 0.9074709 0.6602615), wk = 0.0022422 k( 118) = ( 0.1362756 0.9074709 0.6602615), wk = 0.0022422 k( 119) = ( 0.1533101 0.9074709 0.6602615), wk = 0.0022422 k( 120) = ( 0.1703445 0.9074709 0.6602615), wk = 0.0022422 k( 121) = ( 0.1873790 0.9074709 0.6602615), wk = 0.0022422 k( 122) = ( 0.2044134 0.9074709 0.6602615), wk = 0.0022422 k( 123) = ( 0.2214479 0.9074709 0.6602615), wk = 0.0022422 k( 124) = ( 0.2384824 0.9074709 0.6602615), wk = 0.0022422 k( 125) = ( 0.2555168 0.9074709 0.6602615), wk = 0.0022422 k( 126) = ( 0.2725513 0.9074709 0.6602615), wk = 0.0022422 k( 127) = ( 0.2725513 0.9074709 0.6602615), wk = 0.0022422 k( 128) = ( 0.2674088 0.8903488 0.6602615), wk = 0.0022422 k( 129) = ( 0.2622663 0.8732267 0.6602615), wk = 0.0022422 k( 130) = ( 0.2571238 0.8561046 0.6602615), wk = 0.0022422 k( 131) = ( 0.2519814 0.8389825 0.6602615), wk = 0.0022422 k( 132) = ( 0.2468389 0.8218604 0.6602615), wk = 0.0022422 k( 133) = ( 0.2416964 0.8047383 0.6602615), wk = 0.0022422 k( 134) = ( 0.2365539 0.7876162 0.6602615), wk = 0.0022422 k( 135) = ( 0.2314115 0.7704942 0.6602615), wk = 0.0022422 k( 136) = ( 0.2262690 0.7533721 0.6602615), wk = 0.0022422 k( 137) = ( 0.2211265 0.7362500 0.6602615), wk = 0.0022422 k( 138) = ( 0.2159840 0.7191279 0.6602615), wk = 0.0022422 k( 139) = ( 0.2108415 0.7020058 0.6602615), wk = 0.0022422 k( 140) = ( 0.2056991 0.6848837 0.6602615), wk = 0.0022422 k( 141) = ( 0.2005566 0.6677616 0.6602615), wk = 0.0022422 k( 142) = ( 0.1954141 0.6506395 0.6602615), wk = 0.0022422 k( 143) = ( 0.1902716 0.6335174 0.6602615), wk = 0.0022422 k( 144) = ( 0.1851292 0.6163953 0.6602615), wk = 0.0022422 k( 145) = ( 0.1799867 0.5992732 0.6602615), wk = 0.0022422 k( 146) = ( 0.1748442 0.5821511 0.6602615), wk = 0.0022422 k( 147) = ( 0.1697017 0.5650290 0.6602615), wk = 0.0022422 k( 148) = ( 0.1645593 0.5479070 0.6602615), wk = 0.0022422 k( 149) = ( 0.1594168 0.5307849 0.6602615), wk = 0.0022422 k( 150) = ( 0.1542743 0.5136628 0.6602615), wk = 0.0022422 k( 151) = ( 0.1491318 0.4965407 0.6602615), wk = 0.0022422 k( 152) = ( 0.1439893 0.4794186 0.6602615), wk = 0.0022422 k( 153) = ( 0.1388469 0.4622965 0.6602615), wk = 0.0022422 k( 154) = ( 0.1337044 0.4451744 0.6602615), wk = 0.0022422 k( 155) = ( 0.1285619 0.4280523 0.6602615), wk = 0.0022422 k( 156) = ( 0.1234194 0.4109302 0.6602615), wk = 0.0022422 k( 157) = ( 0.1182770 0.3938081 0.6602615), wk = 0.0022422 k( 158) = ( 0.1131345 0.3766860 0.6602615), wk = 0.0022422 k( 159) = ( 0.1079920 0.3595639 0.6602615), wk = 0.0022422 k( 160) = ( 0.1028495 0.3424419 0.6602615), wk = 0.0022422 k( 161) = ( 0.0977071 0.3253198 0.6602615), wk = 0.0022422 k( 162) = ( 0.0925646 0.3081977 0.6602615), wk = 0.0022422 k( 163) = ( 0.0874221 0.2910756 0.6602615), wk = 0.0022422 k( 164) = ( 0.0822796 0.2739535 0.6602615), wk = 0.0022422 k( 165) = ( 0.0771372 0.2568314 0.6602615), wk = 0.0022422 k( 166) = ( 0.0719947 0.2397093 0.6602615), wk = 0.0022422 k( 167) = ( 0.0668522 0.2225872 0.6602615), wk = 0.0022422 k( 168) = ( 0.0617097 0.2054651 0.6602615), wk = 0.0022422 k( 169) = ( 0.0565672 0.1883430 0.6602615), wk = 0.0022422 k( 170) = ( 0.0514248 0.1712209 0.6602615), wk = 0.0022422 k( 171) = ( 0.0462823 0.1540988 0.6602615), wk = 0.0022422 k( 172) = ( 0.0411398 0.1369767 0.6602615), wk = 0.0022422 k( 173) = ( 0.0359973 0.1198547 0.6602615), wk = 0.0022422 k( 174) = ( 0.0308549 0.1027326 0.6602615), wk = 0.0022422 k( 175) = ( 0.0257124 0.0856104 0.6602615), wk = 0.0022422 k( 176) = ( 0.0205699 0.0684884 0.6602615), wk = 0.0022422 k( 177) = ( 0.0154274 0.0513663 0.6602615), wk = 0.0022422 k( 178) = ( 0.0102849 0.0342442 0.6602615), wk = 0.0022422 k( 179) = ( 0.0051425 0.0171221 0.6602615), wk = 0.0022422 k( 180) = ( 0.0000000 0.0000000 0.6602615), wk = 0.0022422 k( 181) = ( 0.0000000 0.0000000 0.6602615), wk = 0.0022422 k( 182) = ( 0.0000000 0.0000000 0.6424166), wk = 0.0022422 k( 183) = ( 0.0000000 0.0000000 0.6245717), wk = 0.0022422 k( 184) = ( 0.0000000 0.0000000 0.6067268), wk = 0.0022422 k( 185) = ( 0.0000000 0.0000000 0.5888819), wk = 0.0022422 k( 186) = ( 0.0000000 0.0000000 0.5710370), wk = 0.0022422 k( 187) = ( 0.0000000 0.0000000 0.5531921), wk = 0.0022422 k( 188) = ( 0.0000000 0.0000000 0.5353472), wk = 0.0022422 k( 189) = ( 0.0000000 0.0000000 0.5175023), wk = 0.0022422 k( 190) = ( 0.0000000 0.0000000 0.4996574), wk = 0.0022422 k( 191) = ( 0.0000000 0.0000000 0.4818125), wk = 0.0022422 k( 192) = ( 0.0000000 0.0000000 0.4639676), wk = 0.0022422 k( 193) = ( 0.0000000 0.0000000 0.4461227), wk = 0.0022422 k( 194) = ( 0.0000000 0.0000000 0.4282778), wk = 0.0022422 k( 195) = ( 0.0000000 0.0000000 0.4104329), wk = 0.0022422 k( 196) = ( 0.0000000 0.0000000 0.3925879), wk = 0.0022422 k( 197) = ( 0.0000000 0.0000000 0.3747430), wk = 0.0022422 k( 198) = ( 0.0000000 0.0000000 0.3568981), wk = 0.0022422 k( 199) = ( 0.0000000 0.0000000 0.3390532), wk = 0.0022422 k( 200) = ( 0.0000000 0.0000000 0.3212083), wk = 0.0022422 k( 201) = ( 0.0000000 0.0000000 0.3033634), wk = 0.0022422 k( 202) = ( 0.0000000 0.0000000 0.2855185), wk = 0.0022422 k( 203) = ( 0.0000000 0.0000000 0.2676736), wk = 0.0022422 k( 204) = ( 0.0000000 0.0000000 0.2498287), wk = 0.0022422 k( 205) = ( 0.0000000 0.0000000 0.2319838), wk = 0.0022422 k( 206) = ( 0.0000000 0.0000000 0.2141389), wk = 0.0022422 k( 207) = ( 0.0000000 0.0000000 0.1962940), wk = 0.0022422 k( 208) = ( 0.0000000 0.0000000 0.1784491), wk = 0.0022422 k( 209) = ( 0.0000000 0.0000000 0.1606042), wk = 0.0022422 k( 210) = ( 0.0000000 0.0000000 0.1427593), wk = 0.0022422 k( 211) = ( 0.0000000 0.0000000 0.1249143), wk = 0.0022422 k( 212) = ( 0.0000000 0.0000000 0.1070694), wk = 0.0022422 k( 213) = ( 0.0000000 0.0000000 0.0892245), wk = 0.0022422 k( 214) = ( 0.0000000 0.0000000 0.0713796), wk = 0.0022422 k( 215) = ( 0.0000000 0.0000000 0.0535347), wk = 0.0022422 k( 216) = ( 0.0000000 0.0000000 0.0356898), wk = 0.0022422 k( 217) = ( 0.0000000 0.0000000 0.0178449), wk = 0.0022422 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 220) = ( -0.0166667 0.0050057 -0.0000000), wk = 0.0022422 k( 221) = ( -0.0333333 0.0100114 -0.0000000), wk = 0.0022422 k( 222) = ( -0.0500000 0.0150171 -0.0000000), wk = 0.0022422 k( 223) = ( -0.0666667 0.0200228 -0.0000000), wk = 0.0022422 k( 224) = ( -0.0833333 0.0250285 -0.0000000), wk = 0.0022422 k( 225) = ( -0.1000000 0.0300342 -0.0000000), wk = 0.0022422 k( 226) = ( -0.1166667 0.0350399 -0.0000000), wk = 0.0022422 k( 227) = ( -0.1333333 0.0400455 -0.0000000), wk = 0.0022422 k( 228) = ( -0.1500000 0.0450512 -0.0000000), wk = 0.0022422 k( 229) = ( -0.1666667 0.0500569 -0.0000000), wk = 0.0022422 k( 230) = ( -0.1833333 0.0550626 -0.0000000), wk = 0.0022422 k( 231) = ( -0.2000000 0.0600683 -0.0000000), wk = 0.0022422 k( 232) = ( -0.2166667 0.0650740 -0.0000000), wk = 0.0022422 k( 233) = ( -0.2333333 0.0700797 -0.0000000), wk = 0.0022422 k( 234) = ( -0.2500000 0.0750854 -0.0000000), wk = 0.0022422 k( 235) = ( -0.2666667 0.0800911 -0.0000000), wk = 0.0022422 k( 236) = ( -0.2833333 0.0850968 -0.0000000), wk = 0.0022422 k( 237) = ( -0.3000000 0.0901025 -0.0000000), wk = 0.0022422 k( 238) = ( -0.3166667 0.0951082 -0.0000000), wk = 0.0022422 k( 239) = ( -0.3333333 0.1001139 -0.0000000), wk = 0.0022422 k( 240) = ( -0.3500000 0.1051196 -0.0000000), wk = 0.0022422 k( 241) = ( -0.3666667 0.1101253 -0.0000000), wk = 0.0022422 k( 242) = ( -0.3833333 0.1151310 -0.0000000), wk = 0.0022422 k( 243) = ( -0.4000000 0.1201366 -0.0000000), wk = 0.0022422 k( 244) = ( -0.4166667 0.1251423 -0.0000000), wk = 0.0022422 k( 245) = ( -0.4333333 0.1301480 0.0000000), wk = 0.0022422 k( 246) = ( -0.4500000 0.1351537 -0.0000000), wk = 0.0022422 k( 247) = ( -0.4666667 0.1401594 -0.0000000), wk = 0.0022422 k( 248) = ( -0.4833333 0.1451651 -0.0000000), wk = 0.0022422 k( 249) = ( -0.5000000 0.1501708 -0.0000000), wk = 0.0022422 k( 250) = ( -0.5000000 0.1501708 -0.0000000), wk = 0.0022422 k( 251) = ( -0.4948307 0.1673822 -0.0000000), wk = 0.0022422 k( 252) = ( -0.4896614 0.1845935 -0.0000000), wk = 0.0022422 k( 253) = ( -0.4844921 0.2018049 -0.0000000), wk = 0.0022422 k( 254) = ( -0.4793228 0.2190163 -0.0000000), wk = 0.0022422 k( 255) = ( -0.4741535 0.2362276 -0.0000000), wk = 0.0022422 k( 256) = ( -0.4689843 0.2534390 -0.0000000), wk = 0.0022422 k( 257) = ( -0.4638150 0.2706504 -0.0000000), wk = 0.0022422 k( 258) = ( -0.4586457 0.2878617 -0.0000000), wk = 0.0022422 k( 259) = ( -0.4534764 0.3050731 -0.0000000), wk = 0.0022422 k( 260) = ( -0.4483071 0.3222845 -0.0000000), wk = 0.0022422 k( 261) = ( -0.4431378 0.3394958 -0.0000000), wk = 0.0022422 k( 262) = ( -0.4379685 0.3567072 -0.0000000), wk = 0.0022422 k( 263) = ( -0.4327992 0.3739186 -0.0000000), wk = 0.0022422 k( 264) = ( -0.4276299 0.3911299 -0.0000000), wk = 0.0022422 k( 265) = ( -0.4224607 0.4083413 -0.0000000), wk = 0.0022422 k( 266) = ( -0.4172914 0.4255527 -0.0000000), wk = 0.0022422 k( 267) = ( -0.4121221 0.4427640 -0.0000000), wk = 0.0022422 k( 268) = ( -0.4069528 0.4599754 -0.0000000), wk = 0.0022422 k( 269) = ( -0.4017835 0.4771868 -0.0000000), wk = 0.0022422 k( 270) = ( -0.3966142 0.4943981 -0.0000000), wk = 0.0022422 k( 271) = ( -0.3914449 0.5116095 -0.0000000), wk = 0.0022422 k( 272) = ( -0.3862756 0.5288208 -0.0000000), wk = 0.0022422 k( 273) = ( -0.3811063 0.5460322 -0.0000000), wk = 0.0022422 k( 274) = ( -0.3759371 0.5632436 -0.0000000), wk = 0.0022422 k( 275) = ( -0.3707678 0.5804549 -0.0000000), wk = 0.0022422 k( 276) = ( -0.3655985 0.5976663 -0.0000000), wk = 0.0022422 k( 277) = ( -0.3604292 0.6148777 -0.0000000), wk = 0.0022422 k( 278) = ( -0.3552599 0.6320890 -0.0000000), wk = 0.0022422 k( 279) = ( -0.3500906 0.6493004 -0.0000000), wk = 0.0022422 k( 280) = ( -0.3449213 0.6665118 -0.0000000), wk = 0.0022422 k( 281) = ( -0.3397520 0.6837231 -0.0000000), wk = 0.0022422 k( 282) = ( -0.3345827 0.7009345 -0.0000000), wk = 0.0022422 k( 283) = ( -0.3294134 0.7181459 -0.0000000), wk = 0.0022422 k( 284) = ( -0.3242442 0.7353573 -0.0000000), wk = 0.0022422 k( 285) = ( -0.3190749 0.7525686 -0.0000000), wk = 0.0022422 k( 286) = ( -0.3139056 0.7697800 -0.0000000), wk = 0.0022422 k( 287) = ( -0.3087363 0.7869913 -0.0000000), wk = 0.0022422 k( 288) = ( -0.3035670 0.8042027 -0.0000000), wk = 0.0022422 k( 289) = ( -0.2983977 0.8214141 -0.0000000), wk = 0.0022422 k( 290) = ( -0.2932284 0.8386254 -0.0000000), wk = 0.0022422 k( 291) = ( -0.2880591 0.8558368 -0.0000000), wk = 0.0022422 k( 292) = ( -0.2828898 0.8730482 -0.0000000), wk = 0.0022422 k( 293) = ( -0.2777206 0.8902595 -0.0000000), wk = 0.0022422 k( 294) = ( -0.2725513 0.9074709 -0.0000000), wk = 0.0022422 k( 295) = ( -0.2725513 0.9074709 -0.0000000), wk = 0.0022422 k( 296) = ( -0.2725513 0.9074709 0.0178449), wk = 0.0022422 k( 297) = ( -0.2725513 0.9074709 0.0356898), wk = 0.0022422 k( 298) = ( -0.2725513 0.9074709 0.0535347), wk = 0.0022422 k( 299) = ( -0.2725513 0.9074709 0.0713796), wk = 0.0022422 k( 300) = ( -0.2725513 0.9074709 0.0892245), wk = 0.0022422 k( 301) = ( -0.2725513 0.9074709 0.1070694), wk = 0.0022422 k( 302) = ( -0.2725513 0.9074709 0.1249143), wk = 0.0022422 k( 303) = ( -0.2725513 0.9074709 0.1427593), wk = 0.0022422 k( 304) = ( -0.2725513 0.9074709 0.1606042), wk = 0.0022422 k( 305) = ( -0.2725513 0.9074709 0.1784491), wk = 0.0022422 k( 306) = ( -0.2725513 0.9074709 0.1962940), wk = 0.0022422 k( 307) = ( -0.2725513 0.9074709 0.2141389), wk = 0.0022422 k( 308) = ( -0.2725513 0.9074709 0.2319838), wk = 0.0022422 k( 309) = ( -0.2725513 0.9074709 0.2498287), wk = 0.0022422 k( 310) = ( -0.2725513 0.9074709 0.2676736), wk = 0.0022422 k( 311) = ( -0.2725513 0.9074709 0.2855185), wk = 0.0022422 k( 312) = ( -0.2725513 0.9074709 0.3033634), wk = 0.0022422 k( 313) = ( -0.2725513 0.9074709 0.3212083), wk = 0.0022422 k( 314) = ( -0.2725513 0.9074709 0.3390532), wk = 0.0022422 k( 315) = ( -0.2725513 0.9074709 0.3568981), wk = 0.0022422 k( 316) = ( -0.2725513 0.9074709 0.3747430), wk = 0.0022422 k( 317) = ( -0.2725513 0.9074709 0.3925879), wk = 0.0022422 k( 318) = ( -0.2725513 0.9074709 0.4104329), wk = 0.0022422 k( 319) = ( -0.2725513 0.9074709 0.4282778), wk = 0.0022422 k( 320) = ( -0.2725513 0.9074709 0.4461227), wk = 0.0022422 k( 321) = ( -0.2725513 0.9074709 0.4639676), wk = 0.0022422 k( 322) = ( -0.2725513 0.9074709 0.4818125), wk = 0.0022422 k( 323) = ( -0.2725513 0.9074709 0.4996574), wk = 0.0022422 k( 324) = ( -0.2725513 0.9074709 0.5175023), wk = 0.0022422 k( 325) = ( -0.2725513 0.9074709 0.5353472), wk = 0.0022422 k( 326) = ( -0.2725513 0.9074709 0.5531921), wk = 0.0022422 k( 327) = ( -0.2725513 0.9074709 0.5710370), wk = 0.0022422 k( 328) = ( -0.2725513 0.9074709 0.5888819), wk = 0.0022422 k( 329) = ( -0.2725513 0.9074709 0.6067268), wk = 0.0022422 k( 330) = ( -0.2725513 0.9074709 0.6245717), wk = 0.0022422 k( 331) = ( -0.2725513 0.9074709 0.6424166), wk = 0.0022422 k( 332) = ( -0.2725513 0.9074709 0.6602615), wk = 0.0022422 k( 333) = ( -0.2725513 0.9074709 0.6602615), wk = 0.0022422 k( 334) = ( -0.2777206 0.8902595 0.6602615), wk = 0.0022422 k( 335) = ( -0.2828898 0.8730482 0.6602615), wk = 0.0022422 k( 336) = ( -0.2880591 0.8558368 0.6602615), wk = 0.0022422 k( 337) = ( -0.2932284 0.8386254 0.6602615), wk = 0.0022422 k( 338) = ( -0.2983977 0.8214141 0.6602615), wk = 0.0022422 k( 339) = ( -0.3035670 0.8042027 0.6602615), wk = 0.0022422 k( 340) = ( -0.3087363 0.7869913 0.6602615), wk = 0.0022422 k( 341) = ( -0.3139056 0.7697800 0.6602615), wk = 0.0022422 k( 342) = ( -0.3190749 0.7525686 0.6602615), wk = 0.0022422 k( 343) = ( -0.3242442 0.7353573 0.6602615), wk = 0.0022422 k( 344) = ( -0.3294134 0.7181459 0.6602615), wk = 0.0022422 k( 345) = ( -0.3345827 0.7009345 0.6602615), wk = 0.0022422 k( 346) = ( -0.3397520 0.6837231 0.6602615), wk = 0.0022422 k( 347) = ( -0.3449213 0.6665118 0.6602615), wk = 0.0022422 k( 348) = ( -0.3500906 0.6493004 0.6602615), wk = 0.0022422 k( 349) = ( -0.3552599 0.6320890 0.6602615), wk = 0.0022422 k( 350) = ( -0.3604292 0.6148777 0.6602615), wk = 0.0022422 k( 351) = ( -0.3655985 0.5976663 0.6602615), wk = 0.0022422 k( 352) = ( -0.3707678 0.5804549 0.6602615), wk = 0.0022422 k( 353) = ( -0.3759371 0.5632436 0.6602615), wk = 0.0022422 k( 354) = ( -0.3811063 0.5460322 0.6602615), wk = 0.0022422 k( 355) = ( -0.3862756 0.5288208 0.6602615), wk = 0.0022422 k( 356) = ( -0.3914449 0.5116095 0.6602615), wk = 0.0022422 k( 357) = ( -0.3966142 0.4943981 0.6602615), wk = 0.0022422 k( 358) = ( -0.4017835 0.4771868 0.6602615), wk = 0.0022422 k( 359) = ( -0.4069528 0.4599754 0.6602615), wk = 0.0022422 k( 360) = ( -0.4121221 0.4427640 0.6602615), wk = 0.0022422 k( 361) = ( -0.4172914 0.4255527 0.6602615), wk = 0.0022422 k( 362) = ( -0.4224607 0.4083413 0.6602615), wk = 0.0022422 k( 363) = ( -0.4276299 0.3911299 0.6602615), wk = 0.0022422 k( 364) = ( -0.4327992 0.3739186 0.6602615), wk = 0.0022422 k( 365) = ( -0.4379685 0.3567072 0.6602615), wk = 0.0022422 k( 366) = ( -0.4431378 0.3394958 0.6602615), wk = 0.0022422 k( 367) = ( -0.4483071 0.3222845 0.6602615), wk = 0.0022422 k( 368) = ( -0.4534764 0.3050731 0.6602615), wk = 0.0022422 k( 369) = ( -0.4586457 0.2878617 0.6602615), wk = 0.0022422 k( 370) = ( -0.4638150 0.2706504 0.6602615), wk = 0.0022422 k( 371) = ( -0.4689843 0.2534390 0.6602615), wk = 0.0022422 k( 372) = ( -0.4741535 0.2362276 0.6602615), wk = 0.0022422 k( 373) = ( -0.4793228 0.2190163 0.6602615), wk = 0.0022422 k( 374) = ( -0.4844921 0.2018049 0.6602615), wk = 0.0022422 k( 375) = ( -0.4896614 0.1845935 0.6602615), wk = 0.0022422 k( 376) = ( -0.4948307 0.1673822 0.6602615), wk = 0.0022422 k( 377) = ( -0.5000000 0.1501708 0.6602615), wk = 0.0022422 k( 378) = ( -0.5000000 0.1501708 0.6602615), wk = 0.0022422 k( 379) = ( -0.5000000 0.1501708 0.6424166), wk = 0.0022422 k( 380) = ( -0.5000000 0.1501708 0.6245717), wk = 0.0022422 k( 381) = ( -0.5000000 0.1501708 0.6067268), wk = 0.0022422 k( 382) = ( -0.5000000 0.1501708 0.5888819), wk = 0.0022422 k( 383) = ( -0.5000000 0.1501708 0.5710370), wk = 0.0022422 k( 384) = ( -0.5000000 0.1501708 0.5531921), wk = 0.0022422 k( 385) = ( -0.5000000 0.1501708 0.5353472), wk = 0.0022422 k( 386) = ( -0.5000000 0.1501708 0.5175023), wk = 0.0022422 k( 387) = ( -0.5000000 0.1501708 0.4996574), wk = 0.0022422 k( 388) = ( -0.5000000 0.1501708 0.4818125), wk = 0.0022422 k( 389) = ( -0.5000000 0.1501708 0.4639676), wk = 0.0022422 k( 390) = ( -0.5000000 0.1501708 0.4461227), wk = 0.0022422 k( 391) = ( -0.5000000 0.1501708 0.4282778), wk = 0.0022422 k( 392) = ( -0.5000000 0.1501708 0.4104329), wk = 0.0022422 k( 393) = ( -0.5000000 0.1501708 0.3925879), wk = 0.0022422 k( 394) = ( -0.5000000 0.1501708 0.3747430), wk = 0.0022422 k( 395) = ( -0.5000000 0.1501708 0.3568981), wk = 0.0022422 k( 396) = ( -0.5000000 0.1501708 0.3390532), wk = 0.0022422 k( 397) = ( -0.5000000 0.1501708 0.3212083), wk = 0.0022422 k( 398) = ( -0.5000000 0.1501708 0.3033634), wk = 0.0022422 k( 399) = ( -0.5000000 0.1501708 0.2855185), wk = 0.0022422 k( 400) = ( -0.5000000 0.1501708 0.2676736), wk = 0.0022422 k( 401) = ( -0.5000000 0.1501708 0.2498287), wk = 0.0022422 k( 402) = ( -0.5000000 0.1501708 0.2319838), wk = 0.0022422 k( 403) = ( -0.5000000 0.1501708 0.2141389), wk = 0.0022422 k( 404) = ( -0.5000000 0.1501708 0.1962940), wk = 0.0022422 k( 405) = ( -0.5000000 0.1501708 0.1784491), wk = 0.0022422 k( 406) = ( -0.5000000 0.1501708 0.1606042), wk = 0.0022422 k( 407) = ( -0.5000000 0.1501708 0.1427593), wk = 0.0022422 k( 408) = ( -0.5000000 0.1501708 0.1249143), wk = 0.0022422 k( 409) = ( -0.5000000 0.1501708 0.1070694), wk = 0.0022422 k( 410) = ( -0.5000000 0.1501708 0.0892245), wk = 0.0022422 k( 411) = ( -0.5000000 0.1501708 0.0713796), wk = 0.0022422 k( 412) = ( -0.5000000 0.1501708 0.0535347), wk = 0.0022422 k( 413) = ( -0.5000000 0.1501708 0.0356898), wk = 0.0022422 k( 414) = ( -0.5000000 0.1501708 0.0178449), wk = 0.0022422 k( 415) = ( -0.5000000 0.1501708 -0.0000000), wk = 0.0022422 k( 416) = ( 0.0000000 0.0000000 0.6602615), wk = 0.0022422 k( 417) = ( -0.0166667 0.0050057 0.6602615), wk = 0.0022422 k( 418) = ( -0.0333333 0.0100114 0.6602615), wk = 0.0022422 k( 419) = ( -0.0500000 0.0150171 0.6602615), wk = 0.0022422 k( 420) = ( -0.0666667 0.0200228 0.6602615), wk = 0.0022422 k( 421) = ( -0.0833333 0.0250285 0.6602615), wk = 0.0022422 k( 422) = ( -0.1000000 0.0300342 0.6602615), wk = 0.0022422 k( 423) = ( -0.1166667 0.0350399 0.6602615), wk = 0.0022422 k( 424) = ( -0.1333333 0.0400455 0.6602615), wk = 0.0022422 k( 425) = ( -0.1500000 0.0450512 0.6602615), wk = 0.0022422 k( 426) = ( -0.1666667 0.0500569 0.6602615), wk = 0.0022422 k( 427) = ( -0.1833333 0.0550626 0.6602615), wk = 0.0022422 k( 428) = ( -0.2000000 0.0600683 0.6602615), wk = 0.0022422 k( 429) = ( -0.2166667 0.0650740 0.6602615), wk = 0.0022422 k( 430) = ( -0.2333333 0.0700797 0.6602615), wk = 0.0022422 k( 431) = ( -0.2500000 0.0750854 0.6602615), wk = 0.0022422 k( 432) = ( -0.2666667 0.0800911 0.6602615), wk = 0.0022422 k( 433) = ( -0.2833333 0.0850968 0.6602615), wk = 0.0022422 k( 434) = ( -0.3000000 0.0901025 0.6602615), wk = 0.0022422 k( 435) = ( -0.3166667 0.0951082 0.6602615), wk = 0.0022422 k( 436) = ( -0.3333333 0.1001139 0.6602615), wk = 0.0022422 k( 437) = ( -0.3500000 0.1051196 0.6602615), wk = 0.0022422 k( 438) = ( -0.3666667 0.1101253 0.6602615), wk = 0.0022422 k( 439) = ( -0.3833333 0.1151310 0.6602615), wk = 0.0022422 k( 440) = ( -0.4000000 0.1201366 0.6602615), wk = 0.0022422 k( 441) = ( -0.4166667 0.1251423 0.6602615), wk = 0.0022422 k( 442) = ( -0.4333333 0.1301480 0.6602615), wk = 0.0022422 k( 443) = ( -0.4500000 0.1351537 0.6602615), wk = 0.0022422 k( 444) = ( -0.4666667 0.1401594 0.6602615), wk = 0.0022422 k( 445) = ( -0.4833333 0.1451651 0.6602615), wk = 0.0022422 k( 446) = ( -0.5000000 0.1501708 0.6602615), wk = 0.0022422 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 2) = ( 0.0051425 0.0051425 0.0000000), wk = 0.0022422 k( 3) = ( 0.0102849 0.0102849 -0.0000000), wk = 0.0022422 k( 4) = ( 0.0154274 0.0154274 0.0000000), wk = 0.0022422 k( 5) = ( 0.0205699 0.0205699 0.0000000), wk = 0.0022422 k( 6) = ( 0.0257124 0.0257124 -0.0000000), wk = 0.0022422 k( 7) = ( 0.0308549 0.0308549 0.0000000), wk = 0.0022422 k( 8) = ( 0.0359973 0.0359973 -0.0000000), wk = 0.0022422 k( 9) = ( 0.0411398 0.0411398 0.0000000), wk = 0.0022422 k( 10) = ( 0.0462823 0.0462823 -0.0000000), wk = 0.0022422 k( 11) = ( 0.0514248 0.0514248 0.0000000), wk = 0.0022422 k( 12) = ( 0.0565672 0.0565672 0.0000000), wk = 0.0022422 k( 13) = ( 0.0617097 0.0617097 0.0000000), wk = 0.0022422 k( 14) = ( 0.0668522 0.0668522 0.0000000), wk = 0.0022422 k( 15) = ( 0.0719947 0.0719947 -0.0000000), wk = 0.0022422 k( 16) = ( 0.0771372 0.0771372 0.0000000), wk = 0.0022422 k( 17) = ( 0.0822796 0.0822796 0.0000000), wk = 0.0022422 k( 18) = ( 0.0874221 0.0874221 -0.0000000), wk = 0.0022422 k( 19) = ( 0.0925646 0.0925646 -0.0000000), wk = 0.0022422 k( 20) = ( 0.0977071 0.0977071 -0.0000000), wk = 0.0022422 k( 21) = ( 0.1028495 0.1028495 0.0000000), wk = 0.0022422 k( 22) = ( 0.1079920 0.1079920 0.0000000), wk = 0.0022422 k( 23) = ( 0.1131345 0.1131345 -0.0000000), wk = 0.0022422 k( 24) = ( 0.1182770 0.1182770 0.0000000), wk = 0.0022422 k( 25) = ( 0.1234194 0.1234194 0.0000000), wk = 0.0022422 k( 26) = ( 0.1285619 0.1285619 0.0000000), wk = 0.0022422 k( 27) = ( 0.1337044 0.1337044 0.0000000), wk = 0.0022422 k( 28) = ( 0.1388469 0.1388469 -0.0000000), wk = 0.0022422 k( 29) = ( 0.1439893 0.1439894 0.0000000), wk = 0.0022422 k( 30) = ( 0.1491318 0.1491318 0.0000000), wk = 0.0022422 k( 31) = ( 0.1542743 0.1542743 0.0000000), wk = 0.0022422 k( 32) = ( 0.1594168 0.1594168 0.0000000), wk = 0.0022422 k( 33) = ( 0.1645593 0.1645593 0.0000000), wk = 0.0022422 k( 34) = ( 0.1697017 0.1697017 0.0000000), wk = 0.0022422 k( 35) = ( 0.1748442 0.1748442 0.0000000), wk = 0.0022422 k( 36) = ( 0.1799867 0.1799867 0.0000000), wk = 0.0022422 k( 37) = ( 0.1851292 0.1851292 -0.0000000), wk = 0.0022422 k( 38) = ( 0.1902716 0.1902716 0.0000000), wk = 0.0022422 k( 39) = ( 0.1954141 0.1954141 -0.0000000), wk = 0.0022422 k( 40) = ( 0.2005566 0.2005566 -0.0000000), wk = 0.0022422 k( 41) = ( 0.2056991 0.2056991 0.0000000), wk = 0.0022422 k( 42) = ( 0.2108415 0.2108416 0.0000000), wk = 0.0022422 k( 43) = ( 0.2159840 0.2159840 0.0000000), wk = 0.0022422 k( 44) = ( 0.2211265 0.2211265 0.0000000), wk = 0.0022422 k( 45) = ( 0.2262690 0.2262690 -0.0000000), wk = 0.0022422 k( 46) = ( 0.2314115 0.2314115 -0.0000000), wk = 0.0022422 k( 47) = ( 0.2365539 0.2365539 -0.0000000), wk = 0.0022422 k( 48) = ( 0.2416964 0.2416964 -0.0000000), wk = 0.0022422 k( 49) = ( 0.2468389 0.2468389 -0.0000000), wk = 0.0022422 k( 50) = ( 0.2519814 0.2519814 0.0000000), wk = 0.0022422 k( 51) = ( 0.2571238 0.2571238 0.0000000), wk = 0.0022422 k( 52) = ( 0.2622663 0.2622663 0.0000000), wk = 0.0022422 k( 53) = ( 0.2674088 0.2674088 0.0000000), wk = 0.0022422 k( 54) = ( 0.2725513 0.2725513 0.0000000), wk = 0.0022422 k( 55) = ( 0.2725513 0.2725513 0.0000000), wk = 0.0022422 k( 56) = ( 0.2555168 0.2867668 0.0000000), wk = 0.0022422 k( 57) = ( 0.2384824 0.3009824 -0.0000000), wk = 0.0022422 k( 58) = ( 0.2214479 0.3151979 0.0000000), wk = 0.0022422 k( 59) = ( 0.2044134 0.3294135 0.0000000), wk = 0.0022422 k( 60) = ( 0.1873790 0.3436290 0.0000000), wk = 0.0022422 k( 61) = ( 0.1703445 0.3578445 0.0000000), wk = 0.0022422 k( 62) = ( 0.1533101 0.3720601 -0.0000000), wk = 0.0022422 k( 63) = ( 0.1362756 0.3862756 0.0000000), wk = 0.0022422 k( 64) = ( 0.1192412 0.4004912 0.0000000), wk = 0.0022422 k( 65) = ( 0.1022067 0.4147067 0.0000000), wk = 0.0022422 k( 66) = ( 0.0851723 0.4289223 0.0000000), wk = 0.0022422 k( 67) = ( 0.0681378 0.4431378 0.0000000), wk = 0.0022422 k( 68) = ( 0.0511034 0.4573534 0.0000000), wk = 0.0022422 k( 69) = ( 0.0340689 0.4715689 0.0000000), wk = 0.0022422 k( 70) = ( 0.0170344 0.4857845 0.0000000), wk = 0.0022422 k( 71) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022422 k( 72) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022422 k( 73) = ( 0.0000000 0.5000000 0.0135135), wk = 0.0022422 k( 74) = ( 0.0000000 0.5000000 0.0270270), wk = 0.0022422 k( 75) = ( 0.0000000 0.5000000 0.0405405), wk = 0.0022422 k( 76) = ( 0.0000000 0.5000000 0.0540540), wk = 0.0022422 k( 77) = ( 0.0000000 0.5000000 0.0675676), wk = 0.0022422 k( 78) = ( 0.0000000 0.5000000 0.0810811), wk = 0.0022422 k( 79) = ( 0.0000000 0.5000000 0.0945946), wk = 0.0022422 k( 80) = ( 0.0000000 0.5000000 0.1081081), wk = 0.0022422 k( 81) = ( 0.0000000 0.5000000 0.1216216), wk = 0.0022422 k( 82) = ( 0.0000000 0.5000000 0.1351351), wk = 0.0022422 k( 83) = ( 0.0000000 0.5000000 0.1486486), wk = 0.0022422 k( 84) = ( 0.0000000 0.5000000 0.1621622), wk = 0.0022422 k( 85) = ( 0.0000000 0.5000000 0.1756757), wk = 0.0022422 k( 86) = ( 0.0000000 0.5000000 0.1891892), wk = 0.0022422 k( 87) = ( 0.0000000 0.5000000 0.2027027), wk = 0.0022422 k( 88) = ( 0.0000000 0.5000000 0.2162162), wk = 0.0022422 k( 89) = ( 0.0000000 0.5000000 0.2297297), wk = 0.0022422 k( 90) = ( 0.0000000 0.5000000 0.2432432), wk = 0.0022422 k( 91) = ( 0.0000000 0.5000000 0.2567568), wk = 0.0022422 k( 92) = ( 0.0000000 0.5000000 0.2702703), wk = 0.0022422 k( 93) = ( 0.0000000 0.5000000 0.2837838), wk = 0.0022422 k( 94) = ( 0.0000000 0.5000000 0.2972973), wk = 0.0022422 k( 95) = ( 0.0000000 0.5000000 0.3108108), wk = 0.0022422 k( 96) = ( 0.0000000 0.5000000 0.3243243), wk = 0.0022422 k( 97) = ( 0.0000000 0.5000000 0.3378378), wk = 0.0022422 k( 98) = ( 0.0000000 0.5000000 0.3513514), wk = 0.0022422 k( 99) = ( 0.0000000 0.5000000 0.3648649), wk = 0.0022422 k( 100) = ( 0.0000000 0.5000000 0.3783784), wk = 0.0022422 k( 101) = ( 0.0000000 0.5000000 0.3918919), wk = 0.0022422 k( 102) = ( 0.0000000 0.5000000 0.4054054), wk = 0.0022422 k( 103) = ( 0.0000000 0.5000000 0.4189189), wk = 0.0022422 k( 104) = ( 0.0000000 0.5000000 0.4324324), wk = 0.0022422 k( 105) = ( 0.0000000 0.5000000 0.4459459), wk = 0.0022422 k( 106) = ( 0.0000000 0.5000000 0.4594595), wk = 0.0022422 k( 107) = ( 0.0000000 0.5000000 0.4729730), wk = 0.0022422 k( 108) = ( 0.0000000 0.5000000 0.4864865), wk = 0.0022422 k( 109) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022422 k( 110) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022422 k( 111) = ( 0.0170344 0.4857845 0.5000000), wk = 0.0022422 k( 112) = ( 0.0340689 0.4715689 0.5000000), wk = 0.0022422 k( 113) = ( 0.0511034 0.4573534 0.5000000), wk = 0.0022422 k( 114) = ( 0.0681378 0.4431378 0.5000000), wk = 0.0022422 k( 115) = ( 0.0851723 0.4289223 0.5000000), wk = 0.0022422 k( 116) = ( 0.1022067 0.4147067 0.5000000), wk = 0.0022422 k( 117) = ( 0.1192412 0.4004912 0.5000000), wk = 0.0022422 k( 118) = ( 0.1362756 0.3862756 0.5000000), wk = 0.0022422 k( 119) = ( 0.1533101 0.3720601 0.5000000), wk = 0.0022422 k( 120) = ( 0.1703445 0.3578445 0.5000000), wk = 0.0022422 k( 121) = ( 0.1873790 0.3436290 0.5000000), wk = 0.0022422 k( 122) = ( 0.2044134 0.3294135 0.5000000), wk = 0.0022422 k( 123) = ( 0.2214479 0.3151979 0.5000000), wk = 0.0022422 k( 124) = ( 0.2384824 0.3009824 0.5000000), wk = 0.0022422 k( 125) = ( 0.2555168 0.2867668 0.5000000), wk = 0.0022422 k( 126) = ( 0.2725513 0.2725513 0.5000000), wk = 0.0022422 k( 127) = ( 0.2725513 0.2725513 0.5000000), wk = 0.0022422 k( 128) = ( 0.2674088 0.2674088 0.5000000), wk = 0.0022422 k( 129) = ( 0.2622663 0.2622663 0.5000000), wk = 0.0022422 k( 130) = ( 0.2571238 0.2571238 0.5000000), wk = 0.0022422 k( 131) = ( 0.2519814 0.2519814 0.5000000), wk = 0.0022422 k( 132) = ( 0.2468389 0.2468389 0.5000000), wk = 0.0022422 k( 133) = ( 0.2416964 0.2416964 0.5000000), wk = 0.0022422 k( 134) = ( 0.2365539 0.2365539 0.5000000), wk = 0.0022422 k( 135) = ( 0.2314115 0.2314115 0.5000000), wk = 0.0022422 k( 136) = ( 0.2262690 0.2262690 0.5000000), wk = 0.0022422 k( 137) = ( 0.2211265 0.2211265 0.5000000), wk = 0.0022422 k( 138) = ( 0.2159840 0.2159840 0.5000000), wk = 0.0022422 k( 139) = ( 0.2108415 0.2108416 0.5000000), wk = 0.0022422 k( 140) = ( 0.2056991 0.2056991 0.5000000), wk = 0.0022422 k( 141) = ( 0.2005566 0.2005566 0.5000000), wk = 0.0022422 k( 142) = ( 0.1954141 0.1954141 0.5000000), wk = 0.0022422 k( 143) = ( 0.1902716 0.1902716 0.5000000), wk = 0.0022422 k( 144) = ( 0.1851292 0.1851292 0.5000000), wk = 0.0022422 k( 145) = ( 0.1799867 0.1799867 0.5000000), wk = 0.0022422 k( 146) = ( 0.1748442 0.1748442 0.5000000), wk = 0.0022422 k( 147) = ( 0.1697017 0.1697017 0.5000000), wk = 0.0022422 k( 148) = ( 0.1645593 0.1645593 0.5000000), wk = 0.0022422 k( 149) = ( 0.1594168 0.1594168 0.5000000), wk = 0.0022422 k( 150) = ( 0.1542743 0.1542743 0.5000000), wk = 0.0022422 k( 151) = ( 0.1491318 0.1491318 0.5000000), wk = 0.0022422 k( 152) = ( 0.1439893 0.1439894 0.5000000), wk = 0.0022422 k( 153) = ( 0.1388469 0.1388469 0.5000000), wk = 0.0022422 k( 154) = ( 0.1337044 0.1337044 0.5000000), wk = 0.0022422 k( 155) = ( 0.1285619 0.1285619 0.5000000), wk = 0.0022422 k( 156) = ( 0.1234194 0.1234194 0.5000000), wk = 0.0022422 k( 157) = ( 0.1182770 0.1182770 0.5000000), wk = 0.0022422 k( 158) = ( 0.1131345 0.1131345 0.5000000), wk = 0.0022422 k( 159) = ( 0.1079920 0.1079920 0.5000000), wk = 0.0022422 k( 160) = ( 0.1028495 0.1028495 0.5000000), wk = 0.0022422 k( 161) = ( 0.0977071 0.0977071 0.5000000), wk = 0.0022422 k( 162) = ( 0.0925646 0.0925646 0.5000000), wk = 0.0022422 k( 163) = ( 0.0874221 0.0874221 0.5000000), wk = 0.0022422 k( 164) = ( 0.0822796 0.0822796 0.5000000), wk = 0.0022422 k( 165) = ( 0.0771372 0.0771372 0.5000000), wk = 0.0022422 k( 166) = ( 0.0719947 0.0719947 0.5000000), wk = 0.0022422 k( 167) = ( 0.0668522 0.0668522 0.5000000), wk = 0.0022422 k( 168) = ( 0.0617097 0.0617097 0.5000000), wk = 0.0022422 k( 169) = ( 0.0565672 0.0565672 0.5000000), wk = 0.0022422 k( 170) = ( 0.0514248 0.0514248 0.5000000), wk = 0.0022422 k( 171) = ( 0.0462823 0.0462823 0.5000000), wk = 0.0022422 k( 172) = ( 0.0411398 0.0411398 0.5000000), wk = 0.0022422 k( 173) = ( 0.0359973 0.0359973 0.5000000), wk = 0.0022422 k( 174) = ( 0.0308549 0.0308549 0.5000000), wk = 0.0022422 k( 175) = ( 0.0257124 0.0257124 0.5000000), wk = 0.0022422 k( 176) = ( 0.0205699 0.0205699 0.5000000), wk = 0.0022422 k( 177) = ( 0.0154274 0.0154274 0.5000000), wk = 0.0022422 k( 178) = ( 0.0102849 0.0102849 0.5000000), wk = 0.0022422 k( 179) = ( 0.0051425 0.0051425 0.5000000), wk = 0.0022422 k( 180) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 181) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 182) = ( 0.0000000 0.0000000 0.4864865), wk = 0.0022422 k( 183) = ( 0.0000000 0.0000000 0.4729730), wk = 0.0022422 k( 184) = ( 0.0000000 0.0000000 0.4594595), wk = 0.0022422 k( 185) = ( 0.0000000 0.0000000 0.4459460), wk = 0.0022422 k( 186) = ( 0.0000000 0.0000000 0.4324324), wk = 0.0022422 k( 187) = ( 0.0000000 0.0000000 0.4189189), wk = 0.0022422 k( 188) = ( 0.0000000 0.0000000 0.4054054), wk = 0.0022422 k( 189) = ( 0.0000000 0.0000000 0.3918919), wk = 0.0022422 k( 190) = ( 0.0000000 0.0000000 0.3783784), wk = 0.0022422 k( 191) = ( 0.0000000 0.0000000 0.3648649), wk = 0.0022422 k( 192) = ( 0.0000000 0.0000000 0.3513514), wk = 0.0022422 k( 193) = ( 0.0000000 0.0000000 0.3378378), wk = 0.0022422 k( 194) = ( 0.0000000 0.0000000 0.3243243), wk = 0.0022422 k( 195) = ( 0.0000000 0.0000000 0.3108108), wk = 0.0022422 k( 196) = ( 0.0000000 0.0000000 0.2972973), wk = 0.0022422 k( 197) = ( 0.0000000 0.0000000 0.2837838), wk = 0.0022422 k( 198) = ( 0.0000000 0.0000000 0.2702703), wk = 0.0022422 k( 199) = ( 0.0000000 0.0000000 0.2567568), wk = 0.0022422 k( 200) = ( 0.0000000 0.0000000 0.2432432), wk = 0.0022422 k( 201) = ( 0.0000000 0.0000000 0.2297297), wk = 0.0022422 k( 202) = ( 0.0000000 0.0000000 0.2162162), wk = 0.0022422 k( 203) = ( 0.0000000 0.0000000 0.2027027), wk = 0.0022422 k( 204) = ( 0.0000000 0.0000000 0.1891892), wk = 0.0022422 k( 205) = ( 0.0000000 0.0000000 0.1756757), wk = 0.0022422 k( 206) = ( 0.0000000 0.0000000 0.1621622), wk = 0.0022422 k( 207) = ( 0.0000000 0.0000000 0.1486486), wk = 0.0022422 k( 208) = ( 0.0000000 0.0000000 0.1351351), wk = 0.0022422 k( 209) = ( 0.0000000 0.0000000 0.1216216), wk = 0.0022422 k( 210) = ( 0.0000000 0.0000000 0.1081081), wk = 0.0022422 k( 211) = ( 0.0000000 0.0000000 0.0945946), wk = 0.0022422 k( 212) = ( 0.0000000 0.0000000 0.0810811), wk = 0.0022422 k( 213) = ( 0.0000000 0.0000000 0.0675676), wk = 0.0022422 k( 214) = ( 0.0000000 0.0000000 0.0540540), wk = 0.0022422 k( 215) = ( 0.0000000 0.0000000 0.0405405), wk = 0.0022422 k( 216) = ( 0.0000000 0.0000000 0.0270270), wk = 0.0022422 k( 217) = ( 0.0000000 0.0000000 0.0135135), wk = 0.0022422 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 220) = ( -0.0166667 0.0166667 0.0000000), wk = 0.0022422 k( 221) = ( -0.0333333 0.0333333 0.0000000), wk = 0.0022422 k( 222) = ( -0.0500000 0.0500000 0.0000000), wk = 0.0022422 k( 223) = ( -0.0666667 0.0666667 0.0000000), wk = 0.0022422 k( 224) = ( -0.0833333 0.0833333 0.0000000), wk = 0.0022422 k( 225) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0022422 k( 226) = ( -0.1166667 0.1166667 0.0000000), wk = 0.0022422 k( 227) = ( -0.1333333 0.1333333 0.0000000), wk = 0.0022422 k( 228) = ( -0.1500000 0.1500000 0.0000000), wk = 0.0022422 k( 229) = ( -0.1666667 0.1666667 0.0000000), wk = 0.0022422 k( 230) = ( -0.1833333 0.1833333 0.0000000), wk = 0.0022422 k( 231) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0022422 k( 232) = ( -0.2166667 0.2166667 0.0000000), wk = 0.0022422 k( 233) = ( -0.2333333 0.2333333 0.0000000), wk = 0.0022422 k( 234) = ( -0.2500000 0.2500000 0.0000000), wk = 0.0022422 k( 235) = ( -0.2666667 0.2666667 0.0000000), wk = 0.0022422 k( 236) = ( -0.2833333 0.2833333 0.0000000), wk = 0.0022422 k( 237) = ( -0.3000000 0.3000000 0.0000000), wk = 0.0022422 k( 238) = ( -0.3166667 0.3166667 0.0000000), wk = 0.0022422 k( 239) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0022422 k( 240) = ( -0.3500000 0.3500000 0.0000000), wk = 0.0022422 k( 241) = ( -0.3666667 0.3666667 0.0000000), wk = 0.0022422 k( 242) = ( -0.3833333 0.3833333 -0.0000000), wk = 0.0022422 k( 243) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0022422 k( 244) = ( -0.4166667 0.4166667 0.0000000), wk = 0.0022422 k( 245) = ( -0.4333333 0.4333333 0.0000000), wk = 0.0022422 k( 246) = ( -0.4500000 0.4500000 0.0000000), wk = 0.0022422 k( 247) = ( -0.4666667 0.4666667 0.0000000), wk = 0.0022422 k( 248) = ( -0.4833333 0.4833333 0.0000000), wk = 0.0022422 k( 249) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 250) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 251) = ( -0.4948307 0.5051693 0.0000000), wk = 0.0022422 k( 252) = ( -0.4896614 0.5103386 0.0000000), wk = 0.0022422 k( 253) = ( -0.4844921 0.5155079 0.0000000), wk = 0.0022422 k( 254) = ( -0.4793228 0.5206772 0.0000000), wk = 0.0022422 k( 255) = ( -0.4741535 0.5258464 0.0000000), wk = 0.0022422 k( 256) = ( -0.4689843 0.5310157 0.0000000), wk = 0.0022422 k( 257) = ( -0.4638150 0.5361850 0.0000000), wk = 0.0022422 k( 258) = ( -0.4586457 0.5413543 0.0000000), wk = 0.0022422 k( 259) = ( -0.4534764 0.5465236 0.0000000), wk = 0.0022422 k( 260) = ( -0.4483071 0.5516929 0.0000000), wk = 0.0022422 k( 261) = ( -0.4431378 0.5568622 0.0000000), wk = 0.0022422 k( 262) = ( -0.4379685 0.5620315 0.0000000), wk = 0.0022422 k( 263) = ( -0.4327992 0.5672008 0.0000000), wk = 0.0022422 k( 264) = ( -0.4276299 0.5723700 0.0000000), wk = 0.0022422 k( 265) = ( -0.4224607 0.5775393 0.0000000), wk = 0.0022422 k( 266) = ( -0.4172914 0.5827086 0.0000000), wk = 0.0022422 k( 267) = ( -0.4121221 0.5878779 0.0000000), wk = 0.0022422 k( 268) = ( -0.4069528 0.5930472 0.0000000), wk = 0.0022422 k( 269) = ( -0.4017835 0.5982165 0.0000000), wk = 0.0022422 k( 270) = ( -0.3966142 0.6033858 0.0000000), wk = 0.0022422 k( 271) = ( -0.3914449 0.6085551 0.0000000), wk = 0.0022422 k( 272) = ( -0.3862756 0.6137244 0.0000000), wk = 0.0022422 k( 273) = ( -0.3811063 0.6188936 0.0000000), wk = 0.0022422 k( 274) = ( -0.3759371 0.6240629 0.0000000), wk = 0.0022422 k( 275) = ( -0.3707678 0.6292322 0.0000000), wk = 0.0022422 k( 276) = ( -0.3655985 0.6344015 0.0000000), wk = 0.0022422 k( 277) = ( -0.3604292 0.6395708 0.0000000), wk = 0.0022422 k( 278) = ( -0.3552599 0.6447401 0.0000000), wk = 0.0022422 k( 279) = ( -0.3500906 0.6499094 0.0000000), wk = 0.0022422 k( 280) = ( -0.3449213 0.6550787 0.0000000), wk = 0.0022422 k( 281) = ( -0.3397520 0.6602480 0.0000000), wk = 0.0022422 k( 282) = ( -0.3345827 0.6654173 0.0000000), wk = 0.0022422 k( 283) = ( -0.3294134 0.6705866 0.0000000), wk = 0.0022422 k( 284) = ( -0.3242442 0.6757558 0.0000000), wk = 0.0022422 k( 285) = ( -0.3190749 0.6809251 0.0000000), wk = 0.0022422 k( 286) = ( -0.3139056 0.6860944 -0.0000000), wk = 0.0022422 k( 287) = ( -0.3087363 0.6912637 0.0000000), wk = 0.0022422 k( 288) = ( -0.3035670 0.6964330 0.0000000), wk = 0.0022422 k( 289) = ( -0.2983977 0.7016023 0.0000000), wk = 0.0022422 k( 290) = ( -0.2932284 0.7067716 0.0000000), wk = 0.0022422 k( 291) = ( -0.2880591 0.7119409 0.0000000), wk = 0.0022422 k( 292) = ( -0.2828898 0.7171102 0.0000000), wk = 0.0022422 k( 293) = ( -0.2777206 0.7222794 0.0000000), wk = 0.0022422 k( 294) = ( -0.2725513 0.7274487 0.0000000), wk = 0.0022422 k( 295) = ( -0.2725513 0.7274487 0.0000000), wk = 0.0022422 k( 296) = ( -0.2725513 0.7274487 0.0135135), wk = 0.0022422 k( 297) = ( -0.2725513 0.7274487 0.0270270), wk = 0.0022422 k( 298) = ( -0.2725513 0.7274487 0.0405405), wk = 0.0022422 k( 299) = ( -0.2725513 0.7274487 0.0540540), wk = 0.0022422 k( 300) = ( -0.2725513 0.7274487 0.0675676), wk = 0.0022422 k( 301) = ( -0.2725513 0.7274487 0.0810811), wk = 0.0022422 k( 302) = ( -0.2725513 0.7274487 0.0945946), wk = 0.0022422 k( 303) = ( -0.2725513 0.7274487 0.1081081), wk = 0.0022422 k( 304) = ( -0.2725513 0.7274487 0.1216216), wk = 0.0022422 k( 305) = ( -0.2725513 0.7274487 0.1351351), wk = 0.0022422 k( 306) = ( -0.2725513 0.7274487 0.1486486), wk = 0.0022422 k( 307) = ( -0.2725513 0.7274487 0.1621622), wk = 0.0022422 k( 308) = ( -0.2725513 0.7274487 0.1756757), wk = 0.0022422 k( 309) = ( -0.2725513 0.7274487 0.1891892), wk = 0.0022422 k( 310) = ( -0.2725513 0.7274487 0.2027027), wk = 0.0022422 k( 311) = ( -0.2725513 0.7274487 0.2162162), wk = 0.0022422 k( 312) = ( -0.2725513 0.7274487 0.2297297), wk = 0.0022422 k( 313) = ( -0.2725513 0.7274487 0.2432432), wk = 0.0022422 k( 314) = ( -0.2725513 0.7274487 0.2567568), wk = 0.0022422 k( 315) = ( -0.2725513 0.7274487 0.2702703), wk = 0.0022422 k( 316) = ( -0.2725513 0.7274487 0.2837838), wk = 0.0022422 k( 317) = ( -0.2725513 0.7274487 0.2972973), wk = 0.0022422 k( 318) = ( -0.2725513 0.7274487 0.3108108), wk = 0.0022422 k( 319) = ( -0.2725513 0.7274487 0.3243243), wk = 0.0022422 k( 320) = ( -0.2725513 0.7274487 0.3378378), wk = 0.0022422 k( 321) = ( -0.2725513 0.7274487 0.3513514), wk = 0.0022422 k( 322) = ( -0.2725513 0.7274487 0.3648649), wk = 0.0022422 k( 323) = ( -0.2725513 0.7274487 0.3783784), wk = 0.0022422 k( 324) = ( -0.2725513 0.7274487 0.3918919), wk = 0.0022422 k( 325) = ( -0.2725513 0.7274487 0.4054054), wk = 0.0022422 k( 326) = ( -0.2725513 0.7274487 0.4189189), wk = 0.0022422 k( 327) = ( -0.2725513 0.7274487 0.4324324), wk = 0.0022422 k( 328) = ( -0.2725513 0.7274487 0.4459460), wk = 0.0022422 k( 329) = ( -0.2725513 0.7274487 0.4594595), wk = 0.0022422 k( 330) = ( -0.2725513 0.7274487 0.4729730), wk = 0.0022422 k( 331) = ( -0.2725513 0.7274487 0.4864865), wk = 0.0022422 k( 332) = ( -0.2725513 0.7274487 0.5000000), wk = 0.0022422 k( 333) = ( -0.2725513 0.7274487 0.5000000), wk = 0.0022422 k( 334) = ( -0.2777206 0.7222794 0.5000000), wk = 0.0022422 k( 335) = ( -0.2828898 0.7171102 0.5000000), wk = 0.0022422 k( 336) = ( -0.2880591 0.7119409 0.5000000), wk = 0.0022422 k( 337) = ( -0.2932284 0.7067716 0.5000000), wk = 0.0022422 k( 338) = ( -0.2983977 0.7016023 0.5000000), wk = 0.0022422 k( 339) = ( -0.3035670 0.6964330 0.5000000), wk = 0.0022422 k( 340) = ( -0.3087363 0.6912637 0.5000000), wk = 0.0022422 k( 341) = ( -0.3139056 0.6860944 0.5000000), wk = 0.0022422 k( 342) = ( -0.3190749 0.6809251 0.5000000), wk = 0.0022422 k( 343) = ( -0.3242442 0.6757558 0.5000000), wk = 0.0022422 k( 344) = ( -0.3294134 0.6705866 0.5000000), wk = 0.0022422 k( 345) = ( -0.3345827 0.6654173 0.5000000), wk = 0.0022422 k( 346) = ( -0.3397520 0.6602480 0.5000000), wk = 0.0022422 k( 347) = ( -0.3449213 0.6550787 0.5000000), wk = 0.0022422 k( 348) = ( -0.3500906 0.6499094 0.5000000), wk = 0.0022422 k( 349) = ( -0.3552599 0.6447401 0.5000000), wk = 0.0022422 k( 350) = ( -0.3604292 0.6395708 0.5000000), wk = 0.0022422 k( 351) = ( -0.3655985 0.6344015 0.5000000), wk = 0.0022422 k( 352) = ( -0.3707678 0.6292322 0.5000000), wk = 0.0022422 k( 353) = ( -0.3759371 0.6240629 0.5000000), wk = 0.0022422 k( 354) = ( -0.3811063 0.6188936 0.5000000), wk = 0.0022422 k( 355) = ( -0.3862756 0.6137244 0.5000000), wk = 0.0022422 k( 356) = ( -0.3914449 0.6085551 0.5000000), wk = 0.0022422 k( 357) = ( -0.3966142 0.6033858 0.5000000), wk = 0.0022422 k( 358) = ( -0.4017835 0.5982165 0.5000000), wk = 0.0022422 k( 359) = ( -0.4069528 0.5930472 0.5000000), wk = 0.0022422 k( 360) = ( -0.4121221 0.5878779 0.5000000), wk = 0.0022422 k( 361) = ( -0.4172914 0.5827086 0.5000000), wk = 0.0022422 k( 362) = ( -0.4224607 0.5775393 0.5000000), wk = 0.0022422 k( 363) = ( -0.4276299 0.5723700 0.5000000), wk = 0.0022422 k( 364) = ( -0.4327992 0.5672008 0.5000000), wk = 0.0022422 k( 365) = ( -0.4379685 0.5620315 0.5000000), wk = 0.0022422 k( 366) = ( -0.4431378 0.5568622 0.5000000), wk = 0.0022422 k( 367) = ( -0.4483071 0.5516929 0.5000000), wk = 0.0022422 k( 368) = ( -0.4534764 0.5465236 0.5000000), wk = 0.0022422 k( 369) = ( -0.4586457 0.5413543 0.5000000), wk = 0.0022422 k( 370) = ( -0.4638150 0.5361850 0.5000000), wk = 0.0022422 k( 371) = ( -0.4689843 0.5310157 0.5000000), wk = 0.0022422 k( 372) = ( -0.4741535 0.5258464 0.5000000), wk = 0.0022422 k( 373) = ( -0.4793228 0.5206772 0.5000000), wk = 0.0022422 k( 374) = ( -0.4844921 0.5155079 0.5000000), wk = 0.0022422 k( 375) = ( -0.4896614 0.5103386 0.5000000), wk = 0.0022422 k( 376) = ( -0.4948307 0.5051693 0.5000000), wk = 0.0022422 k( 377) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 k( 378) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 k( 379) = ( -0.5000000 0.5000000 0.4864865), wk = 0.0022422 k( 380) = ( -0.5000000 0.5000000 0.4729730), wk = 0.0022422 k( 381) = ( -0.5000000 0.5000000 0.4594595), wk = 0.0022422 k( 382) = ( -0.5000000 0.5000000 0.4459460), wk = 0.0022422 k( 383) = ( -0.5000000 0.5000000 0.4324324), wk = 0.0022422 k( 384) = ( -0.5000000 0.5000000 0.4189189), wk = 0.0022422 k( 385) = ( -0.5000000 0.5000000 0.4054054), wk = 0.0022422 k( 386) = ( -0.5000000 0.5000000 0.3918919), wk = 0.0022422 k( 387) = ( -0.5000000 0.5000000 0.3783784), wk = 0.0022422 k( 388) = ( -0.5000000 0.5000000 0.3648649), wk = 0.0022422 k( 389) = ( -0.5000000 0.5000000 0.3513514), wk = 0.0022422 k( 390) = ( -0.5000000 0.5000000 0.3378378), wk = 0.0022422 k( 391) = ( -0.5000000 0.5000000 0.3243243), wk = 0.0022422 k( 392) = ( -0.5000000 0.5000000 0.3108108), wk = 0.0022422 k( 393) = ( -0.5000000 0.5000000 0.2972973), wk = 0.0022422 k( 394) = ( -0.5000000 0.5000000 0.2837838), wk = 0.0022422 k( 395) = ( -0.5000000 0.5000000 0.2702703), wk = 0.0022422 k( 396) = ( -0.5000000 0.5000000 0.2567568), wk = 0.0022422 k( 397) = ( -0.5000000 0.5000000 0.2432432), wk = 0.0022422 k( 398) = ( -0.5000000 0.5000000 0.2297297), wk = 0.0022422 k( 399) = ( -0.5000000 0.5000000 0.2162162), wk = 0.0022422 k( 400) = ( -0.5000000 0.5000000 0.2027027), wk = 0.0022422 k( 401) = ( -0.5000000 0.5000000 0.1891892), wk = 0.0022422 k( 402) = ( -0.5000000 0.5000000 0.1756757), wk = 0.0022422 k( 403) = ( -0.5000000 0.5000000 0.1621622), wk = 0.0022422 k( 404) = ( -0.5000000 0.5000000 0.1486486), wk = 0.0022422 k( 405) = ( -0.5000000 0.5000000 0.1351351), wk = 0.0022422 k( 406) = ( -0.5000000 0.5000000 0.1216216), wk = 0.0022422 k( 407) = ( -0.5000000 0.5000000 0.1081081), wk = 0.0022422 k( 408) = ( -0.5000000 0.5000000 0.0945946), wk = 0.0022422 k( 409) = ( -0.5000000 0.5000000 0.0810811), wk = 0.0022422 k( 410) = ( -0.5000000 0.5000000 0.0675676), wk = 0.0022422 k( 411) = ( -0.5000000 0.5000000 0.0540540), wk = 0.0022422 k( 412) = ( -0.5000000 0.5000000 0.0405405), wk = 0.0022422 k( 413) = ( -0.5000000 0.5000000 0.0270270), wk = 0.0022422 k( 414) = ( -0.5000000 0.5000000 0.0135135), wk = 0.0022422 k( 415) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 416) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 417) = ( -0.0166667 0.0166667 0.5000000), wk = 0.0022422 k( 418) = ( -0.0333333 0.0333333 0.5000000), wk = 0.0022422 k( 419) = ( -0.0500000 0.0500000 0.5000000), wk = 0.0022422 k( 420) = ( -0.0666667 0.0666667 0.5000000), wk = 0.0022422 k( 421) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0022422 k( 422) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0022422 k( 423) = ( -0.1166667 0.1166667 0.5000000), wk = 0.0022422 k( 424) = ( -0.1333333 0.1333333 0.5000000), wk = 0.0022422 k( 425) = ( -0.1500000 0.1500000 0.5000000), wk = 0.0022422 k( 426) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0022422 k( 427) = ( -0.1833333 0.1833333 0.5000000), wk = 0.0022422 k( 428) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0022422 k( 429) = ( -0.2166667 0.2166667 0.5000000), wk = 0.0022422 k( 430) = ( -0.2333333 0.2333333 0.5000000), wk = 0.0022422 k( 431) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0022422 k( 432) = ( -0.2666667 0.2666667 0.5000000), wk = 0.0022422 k( 433) = ( -0.2833333 0.2833333 0.5000000), wk = 0.0022422 k( 434) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0022422 k( 435) = ( -0.3166667 0.3166667 0.5000000), wk = 0.0022422 k( 436) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0022422 k( 437) = ( -0.3500000 0.3500000 0.5000000), wk = 0.0022422 k( 438) = ( -0.3666667 0.3666667 0.5000000), wk = 0.0022422 k( 439) = ( -0.3833333 0.3833333 0.5000000), wk = 0.0022422 k( 440) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0022422 k( 441) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0022422 k( 442) = ( -0.4333333 0.4333333 0.5000000), wk = 0.0022422 k( 443) = ( -0.4500000 0.4500000 0.5000000), wk = 0.0022422 k( 444) = ( -0.4666667 0.4666667 0.5000000), wk = 0.0022422 k( 445) = ( -0.4833333 0.4833333 0.5000000), wk = 0.0022422 k( 446) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 Dense grid: 37313 G-vectors FFT dimensions: ( 60, 60, 45) Smooth grid: 22951 G-vectors FFT dimensions: ( 48, 48, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 134, 38) NL pseudopotentials 0.10 Mb ( 67, 96) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 782) G-vector shells 0.00 Mb ( 405) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.31 Mb ( 134, 152) Each subspace H/S matrix 0.35 Mb ( 152, 152) Each matrix 0.11 Mb ( 96, 2, 38) The potential is recalculated from file : ./HfAl.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.6 secs Computing kpt #: 2 total cpu time spent up to now is 42.5 secs Computing kpt #: 3 total cpu time spent up to now is 43.3 secs Computing kpt #: 4 total cpu time spent up to now is 44.1 secs Computing kpt #: 5 total cpu time spent up to now is 44.9 secs Computing kpt #: 6 total cpu time spent up to now is 45.7 secs Computing kpt #: 7 total cpu time spent up to now is 46.5 secs Computing kpt #: 8 total cpu time spent up to now is 47.3 secs Computing kpt #: 9 total cpu time spent up to now is 48.1 secs Computing kpt #: 10 total cpu time spent up to now is 48.9 secs Computing kpt #: 11 total cpu time spent up to now is 49.7 secs Computing kpt #: 12 total cpu time spent up to now is 50.5 secs Computing kpt #: 13 total cpu time spent up to now is 51.6 secs Computing kpt #: 14 total cpu time spent up to now is 52.4 secs Computing kpt #: 15 total cpu time spent up to now is 53.3 secs Computing kpt #: 16 total cpu time spent up to now is 54.2 secs Computing kpt #: 17 total cpu time spent up to now is 55.1 secs Computing kpt #: 18 total cpu time spent up to now is 56.0 secs Computing kpt #: 19 total cpu time spent up to now is 57.2 secs Computing kpt #: 20 total cpu time spent up to now is 58.2 secs Computing kpt #: 21 total cpu time spent up to now is 59.1 secs Computing kpt #: 22 total cpu time spent up to now is 60.0 secs Computing kpt #: 23 total cpu time spent up to now is 61.1 secs Computing kpt #: 24 total cpu time spent up to now is 61.9 secs Computing kpt #: 25 total cpu time spent up to now is 63.0 secs Computing kpt #: 26 total cpu time spent up to now is 63.9 secs Computing kpt #: 27 total cpu time spent up to now is 64.7 secs Computing kpt #: 28 total cpu time spent up to now is 65.6 secs Computing kpt #: 29 total cpu time spent up to now is 66.5 secs Computing kpt #: 30 total cpu time spent up to now is 67.4 secs Computing kpt #: 31 total cpu time spent up to now is 68.3 secs Computing kpt #: 32 total cpu time spent up to now is 69.3 secs Computing kpt #: 33 total cpu time spent up to now is 70.1 secs Computing kpt #: 34 total cpu time spent up to now is 71.0 secs Computing kpt #: 35 total cpu time spent up to now is 71.9 secs Computing kpt #: 36 total cpu time spent up to now is 72.8 secs Computing kpt #: 37 total cpu time spent up to now is 74.0 secs Computing kpt #: 38 total cpu time spent up to now is 75.0 secs Computing kpt #: 39 total cpu time spent up to now is 75.9 secs Computing kpt #: 40 total cpu time spent up to now is 76.8 secs Computing kpt #: 41 total cpu time spent up to now is 77.9 secs Computing kpt #: 42 total cpu time spent up to now is 79.3 secs Computing kpt #: 43 total cpu time spent up to now is 80.1 secs Computing kpt #: 44 total cpu time spent up to now is 81.0 secs Computing kpt #: 45 total cpu time spent up to now is 81.9 secs Computing kpt #: 46 total cpu time spent up to now is 83.0 secs Computing kpt #: 47 total cpu time spent up to now is 83.7 secs Computing kpt #: 48 total cpu time spent up to now is 84.4 secs Computing kpt #: 49 total cpu time spent up to now is 85.7 secs Computing kpt #: 50 total cpu time spent up to now is 86.8 secs Computing kpt #: 51 total cpu time spent up to now is 88.5 secs Computing kpt #: 52 total cpu time spent up to now is 90.1 secs Computing kpt #: 53 total cpu time spent up to now is 91.2 secs Computing kpt #: 54 total cpu time spent up to now is 92.1 secs Computing kpt #: 55 total cpu time spent up to now is 93.1 secs Computing kpt #: 56 total cpu time spent up to now is 94.5 secs Computing kpt #: 57 total cpu time spent up to now is 95.8 secs Computing kpt #: 58 total cpu time spent up to now is 96.9 secs Computing kpt #: 59 total cpu time spent up to now is 98.0 secs Computing kpt #: 60 total cpu time spent up to now is 99.1 secs Computing kpt #: 61 total cpu time spent up to now is 99.8 secs Computing kpt #: 62 total cpu time spent up to now is 100.5 secs Computing kpt #: 63 total cpu time spent up to now is 101.3 secs Computing kpt #: 64 total cpu time spent up to now is 102.0 secs Computing kpt #: 65 total cpu time spent up to now is 102.7 secs Computing kpt #: 66 total cpu time spent up to now is 103.5 secs Computing kpt #: 67 total cpu time spent up to now is 104.3 secs Computing kpt #: 68 total cpu time spent up to now is 105.0 secs Computing kpt #: 69 total cpu time spent up to now is 105.9 secs Computing kpt #: 70 total cpu time spent up to now is 106.7 secs Computing kpt #: 71 total cpu time spent up to now is 107.3 secs Computing kpt #: 72 total cpu time spent up to now is 108.0 secs Computing kpt #: 73 total cpu time spent up to now is 108.7 secs Computing kpt #: 74 total cpu time spent up to now is 109.4 secs Computing kpt #: 75 total cpu time spent up to now is 110.1 secs Computing kpt #: 76 total cpu time spent up to now is 110.8 secs Computing kpt #: 77 total cpu time spent up to now is 111.7 secs Computing kpt #: 78 total cpu time spent up to now is 112.6 secs Computing kpt #: 79 total cpu time spent up to now is 113.4 secs Computing kpt #: 80 total cpu time spent up to now is 114.3 secs Computing kpt #: 81 total cpu time spent up to now is 115.1 secs Computing kpt #: 82 total cpu time spent up to now is 115.8 secs Computing kpt #: 83 total cpu time spent up to now is 116.8 secs Computing kpt #: 84 total cpu time spent up to now is 117.5 secs Computing kpt #: 85 total cpu time spent up to now is 118.4 secs Computing kpt #: 86 total cpu time spent up to now is 119.2 secs Computing kpt #: 87 total cpu time spent up to now is 120.0 secs Computing kpt #: 88 total cpu time spent up to now is 121.0 secs Computing kpt #: 89 total cpu time spent up to now is 122.7 secs Computing kpt #: 90 total cpu time spent up to now is 124.4 secs Computing kpt #: 91 total cpu time spent up to now is 125.5 secs Computing kpt #: 92 total cpu time spent up to now is 126.9 secs Computing kpt #: 93 total cpu time spent up to now is 128.0 secs Computing kpt #: 94 total cpu time spent up to now is 129.0 secs Computing kpt #: 95 total cpu time spent up to now is 130.2 secs Computing kpt #: 96 total cpu time spent up to now is 131.2 secs Computing kpt #: 97 total cpu time spent up to now is 132.1 secs Computing kpt #: 98 total cpu time spent up to now is 133.0 secs Computing kpt #: 99 total cpu time spent up to now is 133.9 secs Computing kpt #: 100 total cpu time spent up to now is 134.7 secs Computing kpt #: 101 total cpu time spent up to now is 135.6 secs Computing kpt #: 102 total cpu time spent up to now is 136.8 secs Computing kpt #: 103 total cpu time spent up to now is 138.0 secs Computing kpt #: 104 total cpu time spent up to now is 138.9 secs Computing kpt #: 105 total cpu time spent up to now is 140.1 secs Computing kpt #: 106 total cpu time spent up to now is 141.0 secs Computing kpt #: 107 total cpu time spent up to now is 142.0 secs Computing kpt #: 108 total cpu time spent up to now is 143.1 secs Computing kpt #: 109 total cpu time spent up to now is 144.0 secs Computing kpt #: 110 total cpu time spent up to now is 144.8 secs Computing kpt #: 111 total cpu time spent up to now is 146.0 secs Computing kpt #: 112 total cpu time spent up to now is 147.1 secs Computing kpt #: 113 total cpu time spent up to now is 148.3 secs Computing kpt #: 114 total cpu time spent up to now is 149.2 secs Computing kpt #: 115 total cpu time spent up to now is 150.1 secs Computing kpt #: 116 total cpu time spent up to now is 151.1 secs Computing kpt #: 117 total cpu time spent up to now is 152.2 secs Computing kpt #: 118 total cpu time spent up to now is 153.1 secs Computing kpt #: 119 total cpu time spent up to now is 154.0 secs Computing kpt #: 120 total cpu time spent up to now is 155.0 secs Computing kpt #: 121 total cpu time spent up to now is 155.9 secs Computing kpt #: 122 total cpu time spent up to now is 156.7 secs Computing kpt #: 123 total cpu time spent up to now is 157.6 secs Computing kpt #: 124 total cpu time spent up to now is 158.5 secs Computing kpt #: 125 total cpu time spent up to now is 159.4 secs Computing kpt #: 126 total cpu time spent up to now is 160.2 secs Computing kpt #: 127 total cpu time spent up to now is 161.1 secs Computing kpt #: 128 total cpu time spent up to now is 162.0 secs Computing kpt #: 129 total cpu time spent up to now is 163.0 secs Computing kpt #: 130 total cpu time spent up to now is 163.8 secs Computing kpt #: 131 total cpu time spent up to now is 165.0 secs Computing kpt #: 132 total cpu time spent up to now is 166.0 secs Computing kpt #: 133 total cpu time spent up to now is 167.0 secs Computing kpt #: 134 total cpu time spent up to now is 168.1 secs Computing kpt #: 135 total cpu time spent up to now is 169.0 secs Computing kpt #: 136 total cpu time spent up to now is 170.1 secs Computing kpt #: 137 total cpu time spent up to now is 171.1 secs Computing kpt #: 138 total cpu time spent up to now is 172.1 secs Computing kpt #: 139 total cpu time spent up to now is 172.9 secs Computing kpt #: 140 total cpu time spent up to now is 174.0 secs Computing kpt #: 141 total cpu time spent up to now is 175.0 secs Computing kpt #: 142 total cpu time spent up to now is 176.1 secs Computing kpt #: 143 total cpu time spent up to now is 177.1 secs Computing kpt #: 144 total cpu time spent up to now is 178.7 secs Computing kpt #: 145 total cpu time spent up to now is 179.9 secs Computing kpt #: 146 total cpu time spent up to now is 181.1 secs Computing kpt #: 147 total cpu time spent up to now is 182.6 secs Computing kpt #: 148 total cpu time spent up to now is 183.7 secs Computing kpt #: 149 total cpu time spent up to now is 184.7 secs Computing kpt #: 150 total cpu time spent up to now is 186.0 secs Computing kpt #: 151 total cpu time spent up to now is 187.1 secs Computing kpt #: 152 total cpu time spent up to now is 188.1 secs Computing kpt #: 153 total cpu time spent up to now is 188.9 secs Computing kpt #: 154 total cpu time spent up to now is 189.8 secs Computing kpt #: 155 total cpu time spent up to now is 190.8 secs Computing kpt #: 156 total cpu time spent up to now is 191.7 secs Computing kpt #: 157 total cpu time spent up to now is 192.7 secs Computing kpt #: 158 total cpu time spent up to now is 193.8 secs Computing kpt #: 159 total cpu time spent up to now is 194.7 secs Computing kpt #: 160 total cpu time spent up to now is 195.8 secs Computing kpt #: 161 total cpu time spent up to now is 196.9 secs Computing kpt #: 162 total cpu time spent up to now is 198.0 secs Computing kpt #: 163 total cpu time spent up to now is 199.0 secs Computing kpt #: 164 total cpu time spent up to now is 199.9 secs Computing kpt #: 165 total cpu time spent up to now is 200.8 secs Computing kpt #: 166 total cpu time spent up to now is 201.7 secs Computing kpt #: 167 total cpu time spent up to now is 202.7 secs Computing kpt #: 168 total cpu time spent up to now is 203.7 secs Computing kpt #: 169 total cpu time spent up to now is 204.5 secs Computing kpt #: 170 total cpu time spent up to now is 205.6 secs Computing kpt #: 171 total cpu time spent up to now is 206.6 secs Computing kpt #: 172 total cpu time spent up to now is 207.6 secs Computing kpt #: 173 total cpu time spent up to now is 208.7 secs Computing kpt #: 174 total cpu time spent up to now is 210.0 secs Computing kpt #: 175 total cpu time spent up to now is 210.9 secs Computing kpt #: 176 total cpu time spent up to now is 211.8 secs Computing kpt #: 177 total cpu time spent up to now is 212.9 secs Computing kpt #: 178 total cpu time spent up to now is 213.7 secs Computing kpt #: 179 total cpu time spent up to now is 214.6 secs Computing kpt #: 180 total cpu time spent up to now is 215.4 secs Computing kpt #: 181 total cpu time spent up to now is 216.2 secs Computing kpt #: 182 total cpu time spent up to now is 217.0 secs Computing kpt #: 183 total cpu time spent up to now is 218.2 secs Computing kpt #: 184 total cpu time spent up to now is 219.2 secs Computing kpt #: 185 total cpu time spent up to now is 220.3 secs Computing kpt #: 186 total cpu time spent up to now is 221.5 secs Computing kpt #: 187 total cpu time spent up to now is 222.4 secs Computing kpt #: 188 total cpu time spent up to now is 223.6 secs Computing kpt #: 189 total cpu time spent up to now is 224.8 secs Computing kpt #: 190 total cpu time spent up to now is 225.8 secs Computing kpt #: 191 total cpu time spent up to now is 226.7 secs Computing kpt #: 192 total cpu time spent up to now is 227.7 secs Computing kpt #: 193 total cpu time spent up to now is 228.8 secs Computing kpt #: 194 total cpu time spent up to now is 229.6 secs Computing kpt #: 195 total cpu time spent up to now is 230.5 secs Computing kpt #: 196 total cpu time spent up to now is 231.4 secs Computing kpt #: 197 total cpu time spent up to now is 232.2 secs Computing kpt #: 198 total cpu time spent up to now is 233.1 secs Computing kpt #: 199 total cpu time spent up to now is 233.9 secs Computing kpt #: 200 total cpu time spent up to now is 235.0 secs Computing kpt #: 201 total cpu time spent up to now is 236.0 secs Computing kpt #: 202 total cpu time spent up to now is 236.9 secs Computing kpt #: 203 total cpu time spent up to now is 237.8 secs Computing kpt #: 204 total cpu time spent up to now is 238.6 secs Computing kpt #: 205 total cpu time spent up to now is 239.5 secs Computing kpt #: 206 total cpu time spent up to now is 240.4 secs Computing kpt #: 207 total cpu time spent up to now is 241.3 secs Computing kpt #: 208 total cpu time spent up to now is 242.2 secs Computing kpt #: 209 total cpu time spent up to now is 243.0 secs Computing kpt #: 210 total cpu time spent up to now is 244.1 secs Computing kpt #: 211 total cpu time spent up to now is 245.1 secs Computing kpt #: 212 total cpu time spent up to now is 246.2 secs Computing kpt #: 213 total cpu time spent up to now is 247.0 secs Computing kpt #: 214 total cpu time spent up to now is 247.9 secs Computing kpt #: 215 total cpu time spent up to now is 248.7 secs Computing kpt #: 216 total cpu time spent up to now is 249.7 secs Computing kpt #: 217 total cpu time spent up to now is 250.6 secs Computing kpt #: 218 total cpu time spent up to now is 251.3 secs Computing kpt #: 219 total cpu time spent up to now is 252.1 secs Computing kpt #: 220 total cpu time spent up to now is 252.8 secs Computing kpt #: 221 total cpu time spent up to now is 253.6 secs Computing kpt #: 222 total cpu time spent up to now is 254.6 secs Computing kpt #: 223 total cpu time spent up to now is 255.5 secs Computing kpt #: 224 total cpu time spent up to now is 256.5 secs Computing kpt #: 225 total cpu time spent up to now is 257.9 secs Computing kpt #: 226 total cpu time spent up to now is 258.7 secs Computing kpt #: 227 total cpu time spent up to now is 259.5 secs Computing kpt #: 228 total cpu time spent up to now is 260.4 secs Computing kpt #: 229 total cpu time spent up to now is 261.2 secs Computing kpt #: 230 total cpu time spent up to now is 262.0 secs Computing kpt #: 231 total cpu time spent up to now is 263.0 secs Computing kpt #: 232 total cpu time spent up to now is 263.8 secs Computing kpt #: 233 total cpu time spent up to now is 264.6 secs Computing kpt #: 234 total cpu time spent up to now is 265.4 secs Computing kpt #: 235 total cpu time spent up to now is 266.1 secs Computing kpt #: 236 total cpu time spent up to now is 266.9 secs Computing kpt #: 237 total cpu time spent up to now is 267.7 secs Computing kpt #: 238 total cpu time spent up to now is 268.5 secs Computing kpt #: 239 total cpu time spent up to now is 269.4 secs Computing kpt #: 240 total cpu time spent up to now is 270.4 secs Computing kpt #: 241 total cpu time spent up to now is 271.3 secs Computing kpt #: 242 total cpu time spent up to now is 272.3 secs Computing kpt #: 243 total cpu time spent up to now is 273.2 secs Computing kpt #: 244 total cpu time spent up to now is 274.2 secs Computing kpt #: 245 total cpu time spent up to now is 275.1 secs Computing kpt #: 246 total cpu time spent up to now is 276.0 secs Computing kpt #: 247 total cpu time spent up to now is 276.8 secs Computing kpt #: 248 total cpu time spent up to now is 277.7 secs Computing kpt #: 249 total cpu time spent up to now is 278.5 secs Computing kpt #: 250 total cpu time spent up to now is 279.3 secs Computing kpt #: 251 total cpu time spent up to now is 280.1 secs Computing kpt #: 252 total cpu time spent up to now is 281.0 secs Computing kpt #: 253 total cpu time spent up to now is 281.8 secs Computing kpt #: 254 total cpu time spent up to now is 282.7 secs Computing kpt #: 255 total cpu time spent up to now is 283.6 secs Computing kpt #: 256 total cpu time spent up to now is 284.4 secs Computing kpt #: 257 total cpu time spent up to now is 285.2 secs Computing kpt #: 258 total cpu time spent up to now is 286.0 secs Computing kpt #: 259 total cpu time spent up to now is 286.8 secs Computing kpt #: 260 total cpu time spent up to now is 287.7 secs Computing kpt #: 261 total cpu time spent up to now is 288.6 secs Computing kpt #: 262 total cpu time spent up to now is 289.9 secs Computing kpt #: 263 total cpu time spent up to now is 291.2 secs Computing kpt #: 264 total cpu time spent up to now is 292.1 secs Computing kpt #: 265 total cpu time spent up to now is 292.9 secs Computing kpt #: 266 total cpu time spent up to now is 293.8 secs Computing kpt #: 267 total cpu time spent up to now is 294.6 secs Computing kpt #: 268 total cpu time spent up to now is 295.5 secs Computing kpt #: 269 total cpu time spent up to now is 296.4 secs Computing kpt #: 270 total cpu time spent up to now is 297.4 secs Computing kpt #: 271 total cpu time spent up to now is 298.2 secs Computing kpt #: 272 total cpu time spent up to now is 299.1 secs Computing kpt #: 273 total cpu time spent up to now is 299.9 secs Computing kpt #: 274 total cpu time spent up to now is 300.8 secs Computing kpt #: 275 total cpu time spent up to now is 301.6 secs Computing kpt #: 276 total cpu time spent up to now is 302.5 secs Computing kpt #: 277 total cpu time spent up to now is 303.5 secs Computing kpt #: 278 total cpu time spent up to now is 304.6 secs Computing kpt #: 279 total cpu time spent up to now is 305.6 secs Computing kpt #: 280 total cpu time spent up to now is 306.6 secs Computing kpt #: 281 total cpu time spent up to now is 307.4 secs Computing kpt #: 282 total cpu time spent up to now is 308.3 secs Computing kpt #: 283 total cpu time spent up to now is 309.1 secs Computing kpt #: 284 total cpu time spent up to now is 310.1 secs Computing kpt #: 285 total cpu time spent up to now is 311.1 secs Computing kpt #: 286 total cpu time spent up to now is 311.9 secs Computing kpt #: 287 total cpu time spent up to now is 312.7 secs Computing kpt #: 288 total cpu time spent up to now is 313.5 secs Computing kpt #: 289 total cpu time spent up to now is 314.3 secs Computing kpt #: 290 total cpu time spent up to now is 315.1 secs Computing kpt #: 291 total cpu time spent up to now is 316.3 secs Computing kpt #: 292 total cpu time spent up to now is 317.1 secs Computing kpt #: 293 total cpu time spent up to now is 318.1 secs Computing kpt #: 294 total cpu time spent up to now is 318.9 secs Computing kpt #: 295 total cpu time spent up to now is 319.7 secs Computing kpt #: 296 total cpu time spent up to now is 320.5 secs Computing kpt #: 297 total cpu time spent up to now is 321.3 secs Computing kpt #: 298 total cpu time spent up to now is 322.6 secs Computing kpt #: 299 total cpu time spent up to now is 323.6 secs Computing kpt #: 300 total cpu time spent up to now is 324.5 secs Computing kpt #: 301 total cpu time spent up to now is 325.5 secs Computing kpt #: 302 total cpu time spent up to now is 326.4 secs Computing kpt #: 303 total cpu time spent up to now is 327.3 secs Computing kpt #: 304 total cpu time spent up to now is 328.0 secs Computing kpt #: 305 total cpu time spent up to now is 328.7 secs Computing kpt #: 306 total cpu time spent up to now is 329.5 secs Computing kpt #: 307 total cpu time spent up to now is 330.2 secs Computing kpt #: 308 total cpu time spent up to now is 330.9 secs Computing kpt #: 309 total cpu time spent up to now is 331.7 secs Computing kpt #: 310 total cpu time spent up to now is 332.4 secs Computing kpt #: 311 total cpu time spent up to now is 333.1 secs Computing kpt #: 312 total cpu time spent up to now is 333.8 secs Computing kpt #: 313 total cpu time spent up to now is 334.6 secs Computing kpt #: 314 total cpu time spent up to now is 335.4 secs Computing kpt #: 315 total cpu time spent up to now is 336.2 secs Computing kpt #: 316 total cpu time spent up to now is 337.0 secs Computing kpt #: 317 total cpu time spent up to now is 337.8 secs Computing kpt #: 318 total cpu time spent up to now is 338.6 secs Computing kpt #: 319 total cpu time spent up to now is 339.4 secs Computing kpt #: 320 total cpu time spent up to now is 340.2 secs Computing kpt #: 321 total cpu time spent up to now is 341.3 secs Computing kpt #: 322 total cpu time spent up to now is 342.1 secs Computing kpt #: 323 total cpu time spent up to now is 343.2 secs Computing kpt #: 324 total cpu time spent up to now is 344.1 secs Computing kpt #: 325 total cpu time spent up to now is 345.3 secs Computing kpt #: 326 total cpu time spent up to now is 346.1 secs Computing kpt #: 327 total cpu time spent up to now is 346.9 secs Computing kpt #: 328 total cpu time spent up to now is 347.9 secs Computing kpt #: 329 total cpu time spent up to now is 348.7 secs Computing kpt #: 330 total cpu time spent up to now is 349.6 secs Computing kpt #: 331 total cpu time spent up to now is 350.7 secs Computing kpt #: 332 total cpu time spent up to now is 351.5 secs Computing kpt #: 333 total cpu time spent up to now is 352.4 secs Computing kpt #: 334 total cpu time spent up to now is 353.2 secs Computing kpt #: 335 total cpu time spent up to now is 354.1 secs Computing kpt #: 336 total cpu time spent up to now is 355.0 secs Computing kpt #: 337 total cpu time spent up to now is 355.8 secs Computing kpt #: 338 total cpu time spent up to now is 356.7 secs Computing kpt #: 339 total cpu time spent up to now is 357.5 secs Computing kpt #: 340 total cpu time spent up to now is 358.4 secs Computing kpt #: 341 total cpu time spent up to now is 359.2 secs Computing kpt #: 342 total cpu time spent up to now is 360.0 secs Computing kpt #: 343 total cpu time spent up to now is 360.7 secs Computing kpt #: 344 total cpu time spent up to now is 361.6 secs Computing kpt #: 345 total cpu time spent up to now is 362.4 secs Computing kpt #: 346 total cpu time spent up to now is 363.3 secs Computing kpt #: 347 total cpu time spent up to now is 364.1 secs Computing kpt #: 348 total cpu time spent up to now is 364.9 secs Computing kpt #: 349 total cpu time spent up to now is 365.8 secs Computing kpt #: 350 total cpu time spent up to now is 366.6 secs Computing kpt #: 351 total cpu time spent up to now is 367.4 secs Computing kpt #: 352 total cpu time spent up to now is 368.3 secs Computing kpt #: 353 total cpu time spent up to now is 369.1 secs Computing kpt #: 354 total cpu time spent up to now is 369.9 secs Computing kpt #: 355 total cpu time spent up to now is 370.7 secs Computing kpt #: 356 total cpu time spent up to now is 371.8 secs Computing kpt #: 357 total cpu time spent up to now is 372.8 secs Computing kpt #: 358 total cpu time spent up to now is 373.7 secs Computing kpt #: 359 total cpu time spent up to now is 374.5 secs Computing kpt #: 360 total cpu time spent up to now is 375.4 secs Computing kpt #: 361 total cpu time spent up to now is 376.6 secs Computing kpt #: 362 total cpu time spent up to now is 377.7 secs Computing kpt #: 363 total cpu time spent up to now is 379.3 secs Computing kpt #: 364 total cpu time spent up to now is 380.7 secs Computing kpt #: 365 total cpu time spent up to now is 381.6 secs Computing kpt #: 366 total cpu time spent up to now is 382.5 secs Computing kpt #: 367 total cpu time spent up to now is 383.3 secs Computing kpt #: 368 total cpu time spent up to now is 384.1 secs Computing kpt #: 369 total cpu time spent up to now is 385.0 secs Computing kpt #: 370 total cpu time spent up to now is 385.8 secs Computing kpt #: 371 total cpu time spent up to now is 386.7 secs Computing kpt #: 372 total cpu time spent up to now is 388.4 secs Computing kpt #: 373 total cpu time spent up to now is 389.4 secs Computing kpt #: 374 total cpu time spent up to now is 390.3 secs Computing kpt #: 375 total cpu time spent up to now is 391.2 secs Computing kpt #: 376 total cpu time spent up to now is 392.0 secs Computing kpt #: 377 total cpu time spent up to now is 392.8 secs Computing kpt #: 378 total cpu time spent up to now is 393.6 secs Computing kpt #: 379 total cpu time spent up to now is 394.4 secs Computing kpt #: 380 total cpu time spent up to now is 395.2 secs Computing kpt #: 381 total cpu time spent up to now is 395.9 secs Computing kpt #: 382 total cpu time spent up to now is 396.7 secs Computing kpt #: 383 total cpu time spent up to now is 397.5 secs Computing kpt #: 384 total cpu time spent up to now is 398.4 secs Computing kpt #: 385 total cpu time spent up to now is 399.3 secs Computing kpt #: 386 total cpu time spent up to now is 400.4 secs Computing kpt #: 387 total cpu time spent up to now is 401.1 secs Computing kpt #: 388 total cpu time spent up to now is 401.9 secs Computing kpt #: 389 total cpu time spent up to now is 402.6 secs Computing kpt #: 390 total cpu time spent up to now is 403.5 secs Computing kpt #: 391 total cpu time spent up to now is 404.3 secs Computing kpt #: 392 total cpu time spent up to now is 405.0 secs Computing kpt #: 393 total cpu time spent up to now is 405.7 secs Computing kpt #: 394 total cpu time spent up to now is 406.4 secs Computing kpt #: 395 total cpu time spent up to now is 407.2 secs Computing kpt #: 396 total cpu time spent up to now is 407.9 secs Computing kpt #: 397 total cpu time spent up to now is 408.6 secs Computing kpt #: 398 total cpu time spent up to now is 409.6 secs Computing kpt #: 399 total cpu time spent up to now is 410.3 secs Computing kpt #: 400 total cpu time spent up to now is 411.2 secs Computing kpt #: 401 total cpu time spent up to now is 412.1 secs Computing kpt #: 402 total cpu time spent up to now is 412.8 secs Computing kpt #: 403 total cpu time spent up to now is 413.5 secs Computing kpt #: 404 total cpu time spent up to now is 414.3 secs Computing kpt #: 405 total cpu time spent up to now is 415.1 secs Computing kpt #: 406 total cpu time spent up to now is 416.1 secs Computing kpt #: 407 total cpu time spent up to now is 417.3 secs Computing kpt #: 408 total cpu time spent up to now is 418.1 secs Computing kpt #: 409 total cpu time spent up to now is 418.9 secs Computing kpt #: 410 total cpu time spent up to now is 419.7 secs Computing kpt #: 411 total cpu time spent up to now is 420.6 secs Computing kpt #: 412 total cpu time spent up to now is 421.4 secs Computing kpt #: 413 total cpu time spent up to now is 422.3 secs Computing kpt #: 414 total cpu time spent up to now is 423.3 secs Computing kpt #: 415 total cpu time spent up to now is 424.3 secs Computing kpt #: 416 total cpu time spent up to now is 425.1 secs Computing kpt #: 417 total cpu time spent up to now is 426.1 secs Computing kpt #: 418 total cpu time spent up to now is 426.9 secs Computing kpt #: 419 total cpu time spent up to now is 427.6 secs Computing kpt #: 420 total cpu time spent up to now is 428.4 secs Computing kpt #: 421 total cpu time spent up to now is 429.1 secs Computing kpt #: 422 total cpu time spent up to now is 429.8 secs Computing kpt #: 423 total cpu time spent up to now is 430.7 secs Computing kpt #: 424 total cpu time spent up to now is 431.5 secs Computing kpt #: 425 total cpu time spent up to now is 432.6 secs Computing kpt #: 426 total cpu time spent up to now is 433.6 secs Computing kpt #: 427 total cpu time spent up to now is 434.4 secs Computing kpt #: 428 total cpu time spent up to now is 435.2 secs Computing kpt #: 429 total cpu time spent up to now is 435.8 secs Computing kpt #: 430 total cpu time spent up to now is 436.5 secs Computing kpt #: 431 total cpu time spent up to now is 437.3 secs Computing kpt #: 432 total cpu time spent up to now is 438.0 secs Computing kpt #: 433 total cpu time spent up to now is 438.7 secs Computing kpt #: 434 total cpu time spent up to now is 439.5 secs Computing kpt #: 435 total cpu time spent up to now is 440.3 secs Computing kpt #: 436 total cpu time spent up to now is 441.0 secs Computing kpt #: 437 total cpu time spent up to now is 442.2 secs Computing kpt #: 438 total cpu time spent up to now is 442.9 secs Computing kpt #: 439 total cpu time spent up to now is 443.6 secs Computing kpt #: 440 total cpu time spent up to now is 444.6 secs Computing kpt #: 441 total cpu time spent up to now is 445.4 secs Computing kpt #: 442 total cpu time spent up to now is 446.1 secs Computing kpt #: 443 total cpu time spent up to now is 446.8 secs Computing kpt #: 444 total cpu time spent up to now is 447.6 secs Computing kpt #: 445 total cpu time spent up to now is 448.3 secs Computing kpt #: 446 total cpu time spent up to now is 449.1 secs ethr = 3.33E-11, avg # of iterations = 26.1 total cpu time spent up to now is 449.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2869 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1239 -24.1239 -24.0115 -24.0115 -16.5771 -16.5771 -16.3142 -16.3142 -16.3028 -16.3028 -16.1253 -16.1253 2.6664 2.6664 6.7719 6.7719 8.7622 8.7622 9.5651 9.5651 10.1103 10.1103 11.9232 11.9232 12.4616 12.4616 12.9894 12.9894 13.5345 13.5345 13.8653 13.8653 14.1320 14.1320 k = 0.0051 0.0171-0.0000 ( 2861 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1238 -24.1238 -24.0115 -24.0115 -16.5769 -16.5769 -16.3150 -16.3150 -16.3022 -16.3022 -16.1256 -16.1256 2.6682 2.6682 6.7732 6.7732 8.7628 8.7628 9.5675 9.5675 10.1114 10.1114 11.9211 11.9211 12.4577 12.4577 12.9814 12.9814 13.5274 13.5274 13.8631 13.8631 14.1401 14.1401 k = 0.0103 0.0342-0.0000 ( 2861 PWs) bands (ev): -49.7835 -49.7835 -49.7523 -49.7523 -24.1238 -24.1238 -24.0118 -24.0118 -16.5767 -16.5767 -16.3171 -16.3171 -16.3008 -16.3008 -16.1266 -16.1266 2.6735 2.6735 6.7774 6.7774 8.7644 8.7644 9.5749 9.5749 10.1144 10.1144 11.9149 11.9149 12.4460 12.4460 12.9579 12.9579 13.5066 13.5066 13.8573 13.8573 14.1633 14.1633 k = 0.0154 0.0514-0.0000 ( 2849 PWs) bands (ev): -49.7834 -49.7834 -49.7522 -49.7522 -24.1238 -24.1238 -24.0120 -24.0120 -16.5761 -16.5761 -16.3199 -16.3199 -16.2991 -16.2991 -16.1280 -16.1280 2.6824 2.6824 6.7843 6.7843 8.7672 8.7672 9.5872 9.5872 10.1195 10.1195 11.9044 11.9044 12.4268 12.4268 12.9206 12.9206 13.4731 13.4731 13.8494 13.8494 14.1998 14.1998 k = 0.0206 0.0685-0.0000 ( 2849 PWs) bands (ev): -49.7832 -49.7832 -49.7522 -49.7522 -24.1240 -24.1240 -24.0126 -24.0126 -16.5754 -16.5754 -16.3234 -16.3234 -16.2973 -16.2973 -16.1303 -16.1303 2.6949 2.6949 6.7940 6.7940 8.7709 8.7709 9.6043 9.6043 10.1266 10.1266 11.8895 11.8895 12.4005 12.4005 12.8717 12.8717 13.4282 13.4282 13.8412 13.8412 14.2469 14.2469 k = 0.0257 0.0856-0.0000 ( 2845 PWs) bands (ev): -49.7830 -49.7830 -49.7521 -49.7521 -24.1242 -24.1242 -24.0133 -24.0133 -16.5745 -16.5745 -16.3272 -16.3272 -16.2957 -16.2957 -16.1332 -16.1332 2.7109 2.7109 6.8064 6.8064 8.7756 8.7756 9.6262 9.6262 10.1356 10.1356 11.8700 11.8700 12.3677 12.3677 12.8137 12.8137 13.3738 13.3738 13.8342 13.8342 14.3020 14.3020 k = 0.0309 0.1027-0.0000 ( 2847 PWs) bands (ev): -49.7828 -49.7828 -49.7521 -49.7521 -24.1245 -24.1245 -24.0141 -24.0141 -16.5734 -16.5734 -16.3315 -16.3315 -16.2942 -16.2942 -16.1367 -16.1367 2.7304 2.7304 6.8215 6.8215 8.7811 8.7811 9.6528 9.6528 10.1466 10.1466 11.8457 11.8457 12.3289 12.3289 12.7485 12.7485 13.3114 13.3114 13.8296 13.8296 14.3630 14.3630 k = 0.0360 0.1199-0.0000 ( 2849 PWs) bands (ev): -49.7825 -49.7825 -49.7520 -49.7520 -24.1247 -24.1247 -24.0152 -24.0152 -16.5721 -16.5721 -16.3360 -16.3360 -16.2928 -16.2928 -16.1408 -16.1408 2.7534 2.7534 6.8393 6.8393 8.7873 8.7873 9.6839 9.6839 10.1595 10.1595 11.8165 11.8165 12.2849 12.2849 12.6780 12.6780 13.2428 13.2428 13.8284 13.8284 14.4281 14.4281 k = 0.0411 0.1370-0.0000 ( 2847 PWs) bands (ev): -49.7821 -49.7821 -49.7519 -49.7519 -24.1250 -24.1250 -24.0163 -24.0163 -16.5706 -16.5706 -16.3408 -16.3408 -16.2916 -16.2916 -16.1455 -16.1455 2.7799 2.7799 6.8598 6.8598 8.7940 8.7940 9.7194 9.7194 10.1742 10.1742 11.7822 11.7822 12.2363 12.2363 12.6035 12.6035 13.1693 13.1693 13.8314 13.8314 14.4959 14.4959 k = 0.0463 0.1541-0.0000 ( 2849 PWs) bands (ev): -49.7818 -49.7818 -49.7518 -49.7518 -24.1254 -24.1254 -24.0177 -24.0177 -16.5689 -16.5689 -16.3459 -16.3459 -16.2905 -16.2905 -16.1508 -16.1508 2.8099 2.8099 6.8830 6.8830 8.8010 8.8010 9.7591 9.7591 10.1907 10.1907 11.7430 11.7430 12.1839 12.1839 12.5261 12.5261 13.0920 13.0920 13.8393 13.8393 14.5653 14.5653 k = 0.0514 0.1712-0.0000 ( 2849 PWs) bands (ev): -49.7813 -49.7813 -49.7517 -49.7517 -24.1258 -24.1258 -24.0192 -24.0192 -16.5671 -16.5671 -16.3513 -16.3513 -16.2896 -16.2896 -16.1566 -16.1566 2.8432 2.8432 6.9088 6.9088 8.8081 8.8081 9.8028 9.8028 10.2088 10.2088 11.6989 11.6989 12.1285 12.1285 12.4467 12.4467 13.0117 13.0117 13.8527 13.8527 14.6353 14.6353 k = 0.0566 0.1883-0.0000 ( 2849 PWs) bands (ev): -49.7809 -49.7809 -49.7515 -49.7515 -24.1262 -24.1262 -24.0208 -24.0208 -16.5651 -16.5651 -16.3569 -16.3569 -16.2889 -16.2889 -16.1629 -16.1629 2.8799 2.8799 6.9371 6.9371 8.8150 8.8150 9.8503 9.8503 10.2284 10.2284 11.6503 11.6503 12.0707 12.0707 12.3661 12.3661 12.9293 12.9293 13.8720 13.8720 14.7052 14.7052 k = 0.0617 0.2055-0.0000 ( 2853 PWs) bands (ev): -49.7804 -49.7804 -49.7514 -49.7514 -24.1267 -24.1267 -24.0225 -24.0225 -16.5629 -16.5629 -16.3628 -16.3628 -16.2883 -16.2883 -16.1697 -16.1697 2.9200 2.9200 6.9680 6.9680 8.8214 8.8214 9.9012 9.9012 10.2495 10.2495 11.5975 11.5975 12.0113 12.0113 12.2847 12.2847 12.8453 12.8453 13.8976 13.8976 14.7744 14.7744 k = 0.0669 0.2226-0.0000 ( 2849 PWs) bands (ev): -49.7799 -49.7799 -49.7513 -49.7513 -24.1270 -24.1270 -24.0244 -24.0244 -16.5606 -16.5606 -16.3688 -16.3688 -16.2878 -16.2878 -16.1769 -16.1769 2.9634 2.9634 7.0014 7.0014 8.8270 8.8270 9.9552 9.9552 10.2718 10.2718 11.5413 11.5413 11.9508 11.9508 12.2030 12.2030 12.7602 12.7602 13.9299 13.9299 14.8423 14.8423 k = 0.0720 0.2397-0.0000 ( 2857 PWs) bands (ev): -49.7793 -49.7793 -49.7511 -49.7511 -24.1275 -24.1275 -24.0265 -24.0265 -16.5581 -16.5581 -16.3750 -16.3750 -16.2875 -16.2875 -16.1846 -16.1846 3.0100 3.0100 7.0373 7.0373 8.8314 8.8314 10.0116 10.0116 10.2953 10.2953 11.4823 11.4823 11.8900 11.8900 12.1215 12.1215 12.6745 12.6745 13.9691 13.9691 14.9082 14.9082 k = 0.0771 0.2568-0.0000 ( 2849 PWs) bands (ev): -49.7787 -49.7787 -49.7510 -49.7510 -24.1279 -24.1279 -24.0286 -24.0286 -16.5555 -16.5555 -16.3813 -16.3813 -16.2873 -16.2873 -16.1925 -16.1925 3.0599 3.0599 7.0756 7.0756 8.8342 8.8342 10.0701 10.0701 10.3196 10.3196 11.4215 11.4215 11.8294 11.8294 12.0404 12.0404 12.5885 12.5885 14.0152 14.0152 14.9716 14.9716 k = 0.0823 0.2740-0.0000 ( 2837 PWs) bands (ev): -49.7781 -49.7781 -49.7508 -49.7508 -24.1283 -24.1283 -24.0307 -24.0307 -16.5527 -16.5527 -16.3878 -16.3878 -16.2871 -16.2871 -16.2008 -16.2008 3.1129 3.1129 7.1163 7.1163 8.8348 8.8348 10.1296 10.1296 10.3448 10.3448 11.3599 11.3599 11.7699 11.7699 11.9600 11.9600 12.5026 12.5026 14.0682 14.0682 15.0315 15.0315 k = 0.0874 0.2911-0.0000 ( 2841 PWs) bands (ev): -49.7774 -49.7774 -49.7506 -49.7506 -24.1288 -24.1288 -24.0331 -24.0331 -16.5499 -16.5499 -16.3945 -16.3945 -16.2872 -16.2872 -16.2094 -16.2094 3.1691 3.1691 7.1594 7.1594 8.8329 8.8329 10.1889 10.1889 10.3709 10.3709 11.2984 11.2984 11.7119 11.7119 11.8806 11.8806 12.4172 12.4172 14.1282 14.1282 15.0863 15.0863 k = 0.0926 0.3082-0.0000 ( 2841 PWs) bands (ev): -49.7767 -49.7767 -49.7505 -49.7505 -24.1293 -24.1293 -24.0356 -24.0356 -16.5470 -16.5470 -16.4013 -16.4013 -16.2874 -16.2874 -16.2182 -16.2182 3.2283 3.2283 7.2047 7.2047 8.8279 8.8279 10.2461 10.2461 10.3985 10.3985 11.2383 11.2383 11.6565 11.6565 11.8024 11.8024 12.3328 12.3328 14.1950 14.1950 15.1265 15.1265 k = 0.0977 0.3253-0.0000 ( 2841 PWs) bands (ev): -49.7760 -49.7760 -49.7503 -49.7503 -24.1298 -24.1298 -24.0381 -24.0381 -16.5441 -16.5441 -16.4081 -16.4081 -16.2878 -16.2878 -16.2272 -16.2272 3.2905 3.2905 7.2523 7.2523 8.8192 8.8192 10.2980 10.2980 10.4288 10.4288 11.1807 11.1807 11.6041 11.6041 11.7259 11.7259 12.2498 12.2498 14.2684 14.2684 15.0900 15.0900 k = 0.1028 0.3424-0.0000 ( 2843 PWs) bands (ev): -49.7753 -49.7753 -49.7502 -49.7502 -24.1303 -24.1303 -24.0407 -24.0407 -16.5412 -16.5412 -16.4150 -16.4150 -16.2883 -16.2883 -16.2362 -16.2362 3.3557 3.3557 7.3021 7.3021 8.8064 8.8064 10.3404 10.3404 10.4641 10.4641 11.1269 11.1269 11.5557 11.5557 11.6515 11.6515 12.1689 12.1689 14.3483 14.3483 15.0217 15.0217 k = 0.1080 0.3596-0.0000 ( 2851 PWs) bands (ev): -49.7745 -49.7745 -49.7501 -49.7501 -24.1308 -24.1308 -24.0434 -24.0434 -16.5382 -16.5382 -16.4219 -16.4219 -16.2890 -16.2890 -16.2455 -16.2455 3.4238 3.4238 7.3541 7.3541 8.7888 8.7888 10.3701 10.3701 10.5052 10.5052 11.0779 11.0779 11.5112 11.5112 11.5805 11.5805 12.0909 12.0909 14.4344 14.4344 14.9454 14.9454 k = 0.1131 0.3767-0.0000 ( 2847 PWs) bands (ev): -49.7737 -49.7737 -49.7499 -49.7499 -24.1312 -24.1312 -24.0462 -24.0462 -16.5351 -16.5351 -16.4288 -16.4288 -16.2898 -16.2898 -16.2546 -16.2546 3.4947 3.4947 7.4082 7.4082 8.7660 8.7660 10.3873 10.3873 10.5488 10.5488 11.0347 11.0347 11.4676 11.4676 11.5174 11.5174 12.0168 12.0168 14.5265 14.5265 14.8637 14.8637 k = 0.1183 0.3938-0.0000 ( 2849 PWs) bands (ev): -49.7730 -49.7730 -49.7498 -49.7498 -24.1316 -24.1316 -24.0490 -24.0490 -16.5321 -16.5321 -16.4356 -16.4356 -16.2909 -16.2909 -16.2636 -16.2636 3.5684 3.5684 7.4643 7.4643 8.7375 8.7375 10.3941 10.3941 10.5901 10.5901 10.9981 10.9981 11.4146 11.4146 11.4737 11.4737 11.9480 11.9480 14.6235 14.6235 14.7779 14.7779 k = 0.1234 0.4109-0.0000 ( 2849 PWs) bands (ev): -49.7722 -49.7722 -49.7497 -49.7497 -24.1320 -24.1320 -24.0519 -24.0519 -16.5292 -16.5292 -16.4423 -16.4423 -16.2924 -16.2924 -16.2722 -16.2722 3.6447 3.6447 7.5224 7.5224 8.7032 8.7032 10.3919 10.3919 10.6244 10.6244 10.9684 10.9684 11.3522 11.3522 11.4507 11.4507 11.8862 11.8862 14.6810 14.6810 14.7325 14.7325 k = 0.1286 0.4281-0.0000 ( 2849 PWs) bands (ev): -49.7713 -49.7713 -49.7496 -49.7496 -24.1324 -24.1324 -24.0548 -24.0548 -16.5264 -16.5264 -16.4490 -16.4490 -16.2947 -16.2947 -16.2800 -16.2800 3.7238 3.7238 7.5824 7.5824 8.6628 8.6628 10.3821 10.3821 10.6478 10.6478 10.9452 10.9452 11.2881 11.2881 11.4417 11.4417 11.8335 11.8335 14.5906 14.5906 14.8355 14.8355 k = 0.1337 0.4452-0.0000 ( 2847 PWs) bands (ev): -49.7705 -49.7705 -49.7495 -49.7495 -24.1327 -24.1327 -24.0577 -24.0577 -16.5236 -16.5236 -16.4554 -16.4554 -16.2988 -16.2988 -16.2860 -16.2860 3.8054 3.8054 7.6443 7.6443 8.6162 8.6162 10.3658 10.3658 10.6581 10.6581 10.9271 10.9271 11.2250 11.2250 11.4442 11.4442 11.7921 11.7921 14.4934 14.4934 14.9438 14.9438 k = 0.1388 0.4623-0.0000 ( 2847 PWs) bands (ev): -49.7697 -49.7697 -49.7494 -49.7494 -24.1329 -24.1329 -24.0607 -24.0607 -16.5211 -16.5211 -16.4617 -16.4617 -16.3049 -16.3049 -16.2897 -16.2897 3.8895 3.8895 7.7080 7.7080 8.5636 8.5636 10.3441 10.3441 10.6543 10.6543 10.9115 10.9115 11.1639 11.1639 11.4572 11.4572 11.7638 11.7638 14.3930 14.3930 15.0495 15.0495 k = 0.1440 0.4794-0.0000 ( 2853 PWs) bands (ev): -49.7688 -49.7688 -49.7493 -49.7493 -24.1332 -24.1332 -24.0638 -24.0638 -16.5189 -16.5189 -16.4677 -16.4677 -16.3122 -16.3122 -16.2922 -16.2922 3.9760 3.9760 7.7735 7.7735 8.5053 8.5053 10.3180 10.3180 10.6372 10.6372 10.8960 10.8960 11.1051 11.1051 11.4798 11.4798 11.7496 11.7496 14.2898 14.2898 15.1403 15.1403 k = 0.1491 0.4965-0.0000 ( 2849 PWs) bands (ev): -49.7680 -49.7680 -49.7493 -49.7493 -24.1333 -24.1333 -24.0667 -24.0667 -16.5169 -16.5169 -16.4735 -16.4735 -16.3195 -16.3195 -16.2942 -16.2942 4.0648 4.0648 7.8406 7.8406 8.4416 8.4416 10.2883 10.2883 10.6077 10.6077 10.8797 10.8797 11.0489 11.0489 11.5107 11.5107 11.7490 11.7490 14.1843 14.1843 15.2011 15.2011 k = 0.1543 0.5137-0.0000 ( 2841 PWs) bands (ev): -49.7671 -49.7671 -49.7492 -49.7492 -24.1334 -24.1334 -24.0696 -24.0696 -16.5152 -16.5152 -16.4789 -16.4789 -16.3267 -16.3267 -16.2959 -16.2959 4.1558 4.1558 7.9092 7.9092 8.3729 8.3729 10.2558 10.2558 10.5662 10.5662 10.8634 10.8634 10.9955 10.9955 11.5489 11.5489 11.7603 11.7603 14.0766 14.0766 15.2378 15.2378 k = 0.1594 0.5308-0.0000 ( 2849 PWs) bands (ev): -49.7663 -49.7663 -49.7492 -49.7492 -24.1335 -24.1335 -24.0726 -24.0726 -16.5141 -16.5141 -16.4840 -16.4840 -16.3335 -16.3335 -16.2978 -16.2978 4.2490 4.2490 7.9794 7.9794 8.2999 8.2999 10.2207 10.2207 10.5132 10.5132 10.8493 10.8493 10.9449 10.9449 11.5930 11.5930 11.7811 11.7811 13.9671 13.9671 15.2674 15.2674 k = 0.1646 0.5479-0.0000 ( 2845 PWs) bands (ev): -49.7654 -49.7654 -49.7492 -49.7492 -24.1335 -24.1335 -24.0756 -24.0756 -16.5135 -16.5135 -16.4886 -16.4886 -16.3398 -16.3398 -16.2996 -16.2996 4.3441 4.3441 8.0509 8.0509 8.2231 8.2231 10.1834 10.1834 10.4500 10.4500 10.8384 10.8384 10.8977 10.8977 11.6417 11.6417 11.8092 11.8092 13.8561 13.8561 15.2985 15.2985 k = 0.1697 0.5650-0.0000 ( 2843 PWs) bands (ev): -49.7646 -49.7646 -49.7493 -49.7493 -24.1333 -24.1333 -24.0785 -24.0785 -16.5136 -16.5136 -16.4926 -16.4926 -16.3454 -16.3454 -16.3015 -16.3015 4.4411 4.4411 8.1237 8.1237 8.1432 8.1432 10.1438 10.1438 10.3785 10.3785 10.8284 10.8284 10.8570 10.8570 11.6935 11.6935 11.8430 11.8430 13.7439 13.7439 15.3341 15.3341 k = 0.1748 0.5822-0.0000 ( 2843 PWs) bands (ev): -49.7638 -49.7638 -49.7493 -49.7493 -24.1331 -24.1331 -24.0815 -24.0815 -16.5143 -16.5143 -16.4961 -16.4961 -16.3503 -16.3503 -16.3035 -16.3035 4.5399 4.5399 8.0606 8.0606 8.1977 8.1977 10.1012 10.1012 10.3014 10.3014 10.8016 10.8016 10.8405 10.8405 11.7466 11.7466 11.8819 11.8819 13.6306 13.6306 15.3747 15.3747 k = 0.1800 0.5993-0.0000 ( 2831 PWs) bands (ev): -49.7629 -49.7629 -49.7494 -49.7494 -24.1328 -24.1328 -24.0842 -24.0842 -16.5157 -16.5157 -16.4989 -16.4989 -16.3544 -16.3544 -16.3055 -16.3055 4.6401 4.6401 7.9761 7.9761 8.2726 8.2726 10.0538 10.0538 10.2226 10.2226 10.7641 10.7641 10.8420 10.8420 11.7987 11.7987 11.9265 11.9265 13.5167 13.5167 15.4194 15.4194 k = 0.1851 0.6164-0.0000 ( 2835 PWs) bands (ev): -49.7621 -49.7621 -49.7495 -49.7495 -24.1324 -24.1324 -24.0871 -24.0871 -16.5176 -16.5176 -16.5015 -16.5015 -16.3579 -16.3579 -16.3077 -16.3077 4.7417 4.7417 7.8904 7.8904 8.3482 8.3482 9.9979 9.9979 10.1475 10.1475 10.7276 10.7276 10.8493 10.8493 11.8472 11.8472 11.9780 11.9780 13.4023 13.4023 15.4655 15.4655 k = 0.1903 0.6335-0.0000 ( 2835 PWs) bands (ev): -49.7613 -49.7613 -49.7496 -49.7496 -24.1320 -24.1320 -24.0899 -24.0899 -16.5197 -16.5197 -16.5039 -16.5039 -16.3605 -16.3605 -16.3100 -16.3100 4.8443 4.8443 7.8039 7.8039 8.4243 8.4243 9.9289 9.9289 10.0823 10.0823 10.6936 10.6936 10.8604 10.8604 11.8908 11.8908 12.0370 12.0370 13.2877 13.2877 15.5083 15.5083 k = 0.1954 0.6506-0.0000 ( 2837 PWs) bands (ev): -49.7606 -49.7606 -49.7498 -49.7498 -24.1315 -24.1315 -24.0927 -24.0927 -16.5219 -16.5219 -16.5062 -16.5062 -16.3624 -16.3624 -16.3123 -16.3123 4.9477 4.9477 7.7175 7.7175 8.5004 8.5004 9.8460 9.8460 10.0290 10.0290 10.6623 10.6623 10.8749 10.8749 11.9298 11.9298 12.1027 12.1027 13.1733 13.1733 15.5413 15.5413 k = 0.2006 0.6678-0.0000 ( 2841 PWs) bands (ev): -49.7598 -49.7598 -49.7500 -49.7500 -24.1309 -24.1309 -24.0953 -24.0953 -16.5241 -16.5241 -16.5087 -16.5087 -16.3636 -16.3636 -16.3147 -16.3147 5.0513 5.0513 7.6317 7.6317 8.5761 8.5761 9.7537 9.7537 9.9845 9.9845 10.6340 10.6340 10.8922 10.8922 11.9655 11.9655 12.1734 12.1734 13.0594 13.0594 15.5588 15.5588 k = 0.2057 0.6849-0.0000 ( 2837 PWs) bands (ev): -49.7591 -49.7591 -49.7502 -49.7502 -24.1301 -24.1301 -24.0979 -24.0979 -16.5259 -16.5259 -16.5112 -16.5112 -16.3641 -16.3641 -16.3172 -16.3172 5.1547 5.1547 7.5474 7.5474 8.6504 8.6504 9.6568 9.6568 9.9456 9.9456 10.6086 10.6086 10.9119 10.9119 11.9992 11.9992 12.2474 12.2474 12.9467 12.9467 15.5601 15.5601 k = 0.2108 0.7020-0.0000 ( 2841 PWs) bands (ev): -49.7584 -49.7584 -49.7505 -49.7505 -24.1293 -24.1293 -24.1005 -24.1005 -16.5275 -16.5275 -16.5138 -16.5138 -16.3641 -16.3641 -16.3197 -16.3197 5.2572 5.2572 7.4656 7.4656 8.7217 8.7217 9.5593 9.5593 9.9104 9.9104 10.5862 10.5862 10.9338 10.9338 12.0318 12.0318 12.3228 12.3228 12.8364 12.8364 15.5483 15.5483 k = 0.2160 0.7191-0.0000 ( 2837 PWs) bands (ev): -49.7577 -49.7577 -49.7508 -49.7508 -24.1283 -24.1283 -24.1028 -24.1028 -16.5287 -16.5287 -16.5164 -16.5164 -16.3635 -16.3635 -16.3223 -16.3223 5.3579 5.3579 7.3872 7.3872 8.7868 8.7868 9.4655 9.4655 9.8781 9.8781 10.5669 10.5669 10.9577 10.9577 12.0641 12.0641 12.3956 12.3956 12.7320 12.7320 15.5270 15.5270 k = 0.2211 0.7362-0.0000 ( 2845 PWs) bands (ev): -49.7570 -49.7570 -49.7511 -49.7511 -24.1273 -24.1273 -24.1053 -24.1053 -16.5296 -16.5296 -16.5191 -16.5191 -16.3625 -16.3625 -16.3250 -16.3250 5.4555 5.4555 7.3138 7.3138 8.8394 8.8394 9.3825 9.3825 9.8482 9.8482 10.5507 10.5507 10.9832 10.9832 12.0965 12.0965 12.4504 12.4504 12.6487 12.6487 15.4987 15.4987 k = 0.2263 0.7534-0.0000 ( 2849 PWs) bands (ev): -49.7564 -49.7564 -49.7514 -49.7514 -24.1262 -24.1262 -24.1075 -24.1075 -16.5301 -16.5301 -16.5217 -16.5217 -16.3611 -16.3611 -16.3277 -16.3277 5.5484 5.5484 7.2470 7.2470 8.8669 8.8669 9.3233 9.3233 9.8206 9.8206 10.5376 10.5376 11.0104 11.0104 12.1291 12.1291 12.4333 12.4333 12.6406 12.6406 15.4649 15.4649 k = 0.2314 0.7705-0.0000 ( 2853 PWs) bands (ev): -49.7557 -49.7557 -49.7518 -49.7518 -24.1249 -24.1249 -24.1098 -24.1098 -16.5302 -16.5302 -16.5242 -16.5242 -16.3594 -16.3594 -16.3304 -16.3304 5.6344 5.6344 7.1893 7.1893 8.8535 8.8535 9.3042 9.3042 9.7952 9.7952 10.5276 10.5276 11.0389 11.0389 12.1602 12.1602 12.3523 12.3523 12.7018 12.7018 15.4267 15.4267 k = 0.2366 0.7876-0.0000 ( 2857 PWs) bands (ev): -49.7552 -49.7552 -49.7522 -49.7522 -24.1235 -24.1235 -24.1119 -24.1119 -16.5299 -16.5299 -16.5265 -16.5265 -16.3574 -16.3574 -16.3331 -16.3331 5.7107 5.7107 7.1434 7.1434 8.7972 8.7972 9.3273 9.3273 9.7719 9.7719 10.5207 10.5207 11.0687 11.0687 12.1753 12.1753 12.2733 12.2733 12.7808 12.7808 15.3850 15.3850 k = 0.2417 0.8047-0.0000 ( 2861 PWs) bands (ev): -49.7546 -49.7546 -49.7527 -49.7527 -24.1221 -24.1221 -24.1139 -24.1139 -16.5298 -16.5298 -16.5280 -16.5280 -16.3553 -16.3553 -16.3358 -16.3358 5.7739 5.7739 7.1129 7.1129 8.7127 8.7127 9.3780 9.3780 9.7507 9.7507 10.5169 10.5169 11.0996 11.0996 12.1161 12.1161 12.2677 12.2677 12.8646 12.8646 15.3403 15.3403 k = 0.2468 0.8219-0.0000 ( 2859 PWs) bands (ev): -49.7541 -49.7541 -49.7531 -49.7531 -24.1205 -24.1205 -24.1157 -24.1157 -16.5308 -16.5308 -16.5275 -16.5275 -16.3532 -16.3532 -16.3384 -16.3384 5.8206 5.8206 7.1011 7.1011 8.6133 8.6133 9.4430 9.4430 9.7318 9.7318 10.5163 10.5163 11.1314 11.1314 12.0189 12.0189 12.3026 12.3026 12.9500 12.9500 15.2930 15.2930 k = 0.2520 0.8390-0.0000 ( 2855 PWs) bands (ev): -49.7536 -49.7536 -49.7535 -49.7535 -24.1187 -24.1187 -24.1174 -24.1174 -16.5321 -16.5321 -16.5261 -16.5261 -16.3510 -16.3510 -16.3407 -16.3407 5.8482 5.8482 7.1108 7.1108 8.5064 8.5064 9.5149 9.5149 9.7154 9.7154 10.5188 10.5188 11.1639 11.1639 11.9171 11.9171 12.3459 12.3459 13.0354 13.0354 15.2436 15.2436 k = 0.2571 0.8561-0.0000 ( 2859 PWs) bands (ev): -49.7541 -49.7541 -49.7531 -49.7531 -24.1192 -24.1192 -24.1169 -24.1169 -16.5332 -16.5332 -16.5243 -16.5243 -16.3493 -16.3493 -16.3425 -16.3425 5.8555 5.8555 7.1431 7.1431 8.3954 8.3954 9.5888 9.5888 9.7029 9.7029 10.5244 10.5244 11.1966 11.1966 11.8157 11.8157 12.3935 12.3935 13.1199 13.1199 15.1925 15.1925 k = 0.2623 0.8732-0.0000 ( 2865 PWs) bands (ev): -49.7547 -49.7547 -49.7526 -49.7526 -24.1208 -24.1208 -24.1150 -24.1150 -16.5340 -16.5340 -16.5222 -16.5222 -16.3490 -16.3490 -16.3427 -16.3427 5.8435 5.8435 7.1969 7.1969 8.2823 8.2823 9.6514 9.6514 9.7057 9.7057 10.5330 10.5330 11.2289 11.2289 11.7165 11.7165 12.4448 12.4448 13.2026 13.2026 15.1400 15.1400 k = 0.2674 0.8903-0.0000 ( 2859 PWs) bands (ev): -49.7553 -49.7553 -49.7522 -49.7522 -24.1222 -24.1222 -24.1129 -24.1129 -16.5344 -16.5344 -16.5197 -16.5197 -16.3503 -16.3503 -16.3411 -16.3411 5.8151 5.8151 7.2692 7.2692 8.1682 8.1682 9.6628 9.6628 9.7628 9.7628 10.5448 10.5448 11.2588 11.2588 11.6217 11.6217 12.4995 12.4995 13.2824 13.2824 15.0865 15.0865 k = 0.2726 0.9075-0.0000 ( 2855 PWs) bands (ev): -49.7559 -49.7559 -49.7518 -49.7518 -24.1235 -24.1235 -24.1107 -24.1107 -16.5344 -16.5344 -16.5170 -16.5170 -16.3520 -16.3520 -16.3387 -16.3387 5.7736 5.7736 7.3565 7.3565 8.0542 8.0542 9.6566 9.6566 9.8399 9.8399 10.5596 10.5596 11.2816 11.2816 11.5364 11.5364 12.5574 12.5574 13.3585 13.3585 15.0324 15.0324 k = 0.2726 0.9075-0.0000 ( 2855 PWs) bands (ev): -49.7559 -49.7559 -49.7518 -49.7518 -24.1235 -24.1235 -24.1107 -24.1107 -16.5344 -16.5344 -16.5170 -16.5170 -16.3520 -16.3520 -16.3387 -16.3387 5.7736 5.7736 7.3565 7.3565 8.0542 8.0542 9.6566 9.6566 9.8399 9.8399 10.5596 10.5596 11.2816 11.2816 11.5364 11.5364 12.5574 12.5574 13.3585 13.3585 15.0324 15.0324 k = 0.2555 0.9075-0.0000 ( 2859 PWs) bands (ev): -49.7557 -49.7557 -49.7519 -49.7519 -24.1231 -24.1231 -24.1114 -24.1114 -16.5344 -16.5344 -16.5178 -16.5178 -16.3516 -16.3516 -16.3394 -16.3394 5.7857 5.7857 7.3298 7.3298 8.0885 8.0885 9.6591 9.6591 9.8183 9.8183 10.5546 10.5546 11.2755 11.2755 11.5539 11.5539 12.5463 12.5463 13.3402 13.3402 15.0256 15.0256 k = 0.2385 0.9075-0.0000 ( 2858 PWs) bands (ev): -49.7556 -49.7556 -49.7521 -49.7521 -24.1228 -24.1228 -24.1119 -24.1119 -16.5344 -16.5344 -16.5186 -16.5186 -16.3512 -16.3512 -16.3399 -16.3399 5.7962 5.7962 7.3015 7.3015 8.1283 8.1283 9.6625 9.6625 9.7968 9.7968 10.5484 10.5484 11.2665 11.2665 11.5632 11.5632 12.5460 12.5460 13.3260 13.3260 14.9842 14.9842 k = 0.2214 0.9075-0.0000 ( 2856 PWs) bands (ev): -49.7554 -49.7554 -49.7521 -49.7521 -24.1224 -24.1224 -24.1124 -24.1124 -16.5343 -16.5343 -16.5193 -16.5193 -16.3509 -16.3509 -16.3403 -16.3403 5.8053 5.8053 7.2727 7.2727 8.1721 8.1721 9.6667 9.6667 9.7758 9.7758 10.5411 10.5411 11.2551 11.2551 11.5639 11.5639 12.5562 12.5562 13.3162 13.3162 14.9233 14.9233 k = 0.2044 0.9075-0.0000 ( 2860 PWs) bands (ev): -49.7552 -49.7552 -49.7523 -49.7523 -24.1221 -24.1221 -24.1130 -24.1130 -16.5342 -16.5342 -16.5201 -16.5201 -16.3508 -16.3508 -16.3406 -16.3406 5.8132 5.8132 7.2441 7.2441 8.2187 8.2187 9.6713 9.6713 9.7556 9.7556 10.5328 10.5328 11.2420 11.2420 11.5564 11.5564 12.5761 12.5761 13.3108 13.3108 14.8534 14.8534 k = 0.1874 0.9075-0.0000 ( 2862 PWs) bands (ev): -49.7551 -49.7551 -49.7524 -49.7524 -24.1218 -24.1218 -24.1135 -24.1135 -16.5341 -16.5341 -16.5209 -16.5209 -16.3507 -16.3507 -16.3407 -16.3407 5.8200 5.8200 7.2164 7.2164 8.2671 8.2671 9.6754 9.6754 9.7370 9.7370 10.5236 10.5236 11.2276 11.2276 11.5419 11.5419 12.6040 12.6040 13.3099 13.3099 14.7799 14.7799 k = 0.1703 0.9075-0.0000 ( 2862 PWs) bands (ev): -49.7549 -49.7549 -49.7525 -49.7525 -24.1215 -24.1215 -24.1140 -24.1140 -16.5339 -16.5339 -16.5217 -16.5217 -16.3508 -16.3508 -16.3408 -16.3408 5.8259 5.8259 7.1900 7.1900 8.3162 8.3162 9.6768 9.6768 9.7219 9.7219 10.5138 10.5138 11.2125 11.2125 11.5224 11.5224 12.6378 12.6378 13.3132 13.3132 14.7058 14.7058 k = 0.1533 0.9075-0.0000 ( 2862 PWs) bands (ev): -49.7548 -49.7548 -49.7526 -49.7526 -24.1213 -24.1213 -24.1144 -24.1144 -16.5336 -16.5336 -16.5225 -16.5225 -16.3509 -16.3509 -16.3407 -16.3407 5.8308 5.8308 7.1653 7.1653 8.3652 8.3652 9.6715 9.6715 9.7145 9.7145 10.5035 10.5035 11.1971 11.1971 11.4993 11.4993 12.6755 12.6755 13.3205 13.3205 14.6330 14.6330 k = 0.1363 0.9075-0.0000 ( 2866 PWs) bands (ev): -49.7546 -49.7546 -49.7527 -49.7527 -24.1210 -24.1210 -24.1149 -24.1149 -16.5334 -16.5334 -16.5232 -16.5232 -16.3510 -16.3510 -16.3407 -16.3407 5.8350 5.8350 7.1426 7.1426 8.4131 8.4131 9.6586 9.6586 9.7153 9.7153 10.4931 10.4931 11.1820 11.1820 11.4745 11.4745 12.7151 12.7151 13.3314 13.3314 14.5628 14.5628 k = 0.1192 0.9075-0.0000 ( 2862 PWs) bands (ev): -49.7545 -49.7545 -49.7528 -49.7528 -24.1207 -24.1207 -24.1152 -24.1152 -16.5330 -16.5330 -16.5240 -16.5240 -16.3511 -16.3511 -16.3405 -16.3405 5.8384 5.8384 7.1221 7.1221 8.4589 8.4589 9.6426 9.6426 9.7200 9.7200 10.4827 10.4827 11.1675 11.1675 11.4494 11.4494 12.7547 12.7547 13.3451 13.3451 14.4963 14.4963 k = 0.1022 0.9075-0.0000 ( 2861 PWs) bands (ev): -49.7544 -49.7544 -49.7529 -49.7529 -24.1204 -24.1204 -24.1156 -24.1156 -16.5327 -16.5327 -16.5247 -16.5247 -16.3513 -16.3513 -16.3404 -16.3404 5.8413 5.8413 7.1041 7.1041 8.5016 8.5016 9.6261 9.6261 9.7259 9.7259 10.4728 10.4728 11.1541 11.1541 11.4252 11.4252 12.7927 12.7927 13.3609 13.3609 14.4347 14.4347 k = 0.0852 0.9075-0.0000 ( 2861 PWs) bands (ev): -49.7542 -49.7542 -49.7530 -49.7530 -24.1201 -24.1201 -24.1160 -24.1160 -16.5323 -16.5323 -16.5253 -16.5253 -16.3514 -16.3514 -16.3403 -16.3403 5.8436 5.8436 7.0886 7.0886 8.5404 8.5404 9.6103 9.6103 9.7319 9.7319 10.4637 10.4637 11.1422 11.1422 11.4030 11.4030 12.8276 12.8276 13.3778 13.3778 14.3789 14.3789 k = 0.0681 0.9075-0.0000 ( 2865 PWs) bands (ev): -49.7541 -49.7541 -49.7531 -49.7531 -24.1199 -24.1199 -24.1163 -24.1163 -16.5320 -16.5320 -16.5260 -16.5260 -16.3516 -16.3516 -16.3402 -16.3402 5.8455 5.8455 7.0757 7.0757 8.5740 8.5740 9.5960 9.5960 9.7375 9.7375 10.4557 10.4557 11.1321 11.1321 11.3836 11.3836 12.8582 12.8582 13.3947 13.3947 14.3304 14.3304 k = 0.0511 0.9075-0.0000 ( 2869 PWs) bands (ev): -49.7540 -49.7540 -49.7532 -49.7532 -24.1198 -24.1198 -24.1166 -24.1166 -16.5316 -16.5316 -16.5266 -16.5266 -16.3518 -16.3518 -16.3400 -16.3400 5.8469 5.8469 7.0657 7.0657 8.6016 8.6016 9.5840 9.5840 9.7422 9.7422 10.4491 10.4491 11.1239 11.1239 11.3678 11.3678 12.8832 12.8832 13.4101 13.4101 14.2904 14.2904 k = 0.0341 0.9075-0.0000 ( 2867 PWs) bands (ev): -49.7539 -49.7539 -49.7533 -49.7533 -24.1196 -24.1196 -24.1168 -24.1168 -16.5313 -16.5313 -16.5270 -16.5270 -16.3519 -16.3519 -16.3400 -16.3400 5.8478 5.8478 7.0585 7.0585 8.6221 8.6221 9.5749 9.5749 9.7457 9.7457 10.4442 10.4442 11.1180 11.1180 11.3561 11.3561 12.9018 12.9018 13.4225 13.4225 14.2605 14.2605 k = 0.0170 0.9075-0.0000 ( 2871 PWs) bands (ev): -49.7538 -49.7538 -49.7534 -49.7534 -24.1195 -24.1195 -24.1169 -24.1169 -16.5311 -16.5311 -16.5273 -16.5273 -16.3520 -16.3520 -16.3399 -16.3399 5.8484 5.8484 7.0541 7.0541 8.6348 8.6348 9.5691 9.5691 9.7479 9.7479 10.4411 10.4411 11.1144 11.1144 11.3489 11.3489 12.9133 12.9133 13.4306 13.4306 14.2419 14.2419 k = 0.0000 0.9075-0.0000 ( 2870 PWs) bands (ev): -49.7538 -49.7538 -49.7534 -49.7534 -24.1195 -24.1195 -24.1169 -24.1169 -16.5310 -16.5310 -16.5274 -16.5274 -16.3520 -16.3520 -16.3399 -16.3399 5.8486 5.8486 7.0526 7.0526 8.6390 8.6390 9.5672 9.5672 9.7487 9.7487 10.4401 10.4401 11.1132 11.1132 11.3465 11.3465 12.9171 12.9171 13.4334 13.4334 14.2355 14.2355 k = 0.0000 0.9075-0.0000 ( 2870 PWs) bands (ev): -49.7538 -49.7538 -49.7534 -49.7534 -24.1195 -24.1195 -24.1169 -24.1169 -16.5310 -16.5310 -16.5274 -16.5274 -16.3520 -16.3520 -16.3399 -16.3399 5.8486 5.8486 7.0526 7.0526 8.6390 8.6390 9.5672 9.5672 9.7487 9.7487 10.4401 10.4401 11.1132 11.1132 11.3465 11.3465 12.9171 12.9171 13.4334 13.4334 14.2355 14.2355 k = 0.0000 0.9075 0.0178 ( 2870 PWs) bands (ev): -49.7538 -49.7538 -49.7534 -49.7534 -24.1195 -24.1195 -24.1170 -24.1170 -16.5329 -16.5329 -16.5254 -16.5254 -16.3529 -16.3529 -16.3391 -16.3391 5.8494 5.8494 7.0539 7.0539 8.6405 8.6405 9.5482 9.5482 9.7661 9.7661 10.4387 10.4387 11.1127 11.1127 11.3447 11.3447 12.9159 12.9159 13.4354 13.4354 14.2418 14.2418 k = 0.0000 0.9075 0.0357 ( 2872 PWs) bands (ev): -49.7538 -49.7538 -49.7534 -49.7534 -24.1196 -24.1196 -24.1169 -24.1169 -16.5360 -16.5360 -16.5222 -16.5222 -16.3552 -16.3552 -16.3371 -16.3371 5.8520 5.8520 7.0576 7.0576 8.6450 8.6450 9.5044 9.5044 9.8055 9.8055 10.4348 10.4348 11.1112 11.1112 11.3393 11.3393 12.9122 12.9122 13.4415 13.4415 14.2602 14.2602 k = 0.0000 0.9075 0.0535 ( 2868 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1195 -24.1195 -24.1170 -24.1170 -16.5390 -16.5390 -16.5188 -16.5188 -16.3582 -16.3582 -16.3347 -16.3347 5.8562 5.8562 7.0639 7.0639 8.6525 8.6525 9.4503 9.4503 9.8520 9.8520 10.4283 10.4283 11.1087 11.1087 11.3303 11.3303 12.9068 12.9068 13.4517 13.4517 14.2902 14.2902 k = 0.0000 0.9075 0.0714 ( 2862 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1195 -24.1195 -24.1170 -24.1170 -16.5419 -16.5419 -16.5154 -16.5154 -16.3614 -16.3614 -16.3321 -16.3321 5.8621 5.8621 7.0725 7.0725 8.6628 8.6628 9.3919 9.3919 9.8996 9.8996 10.4196 10.4196 11.1055 11.1055 11.3178 11.3178 12.9002 12.9002 13.4662 13.4662 14.3307 14.3307 k = 0.0000 0.9075 0.0892 ( 2860 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1195 -24.1195 -24.1169 -24.1169 -16.5448 -16.5448 -16.5119 -16.5119 -16.3649 -16.3649 -16.3296 -16.3296 5.8696 5.8696 7.0834 7.0834 8.6760 8.6760 9.3316 9.3316 9.9457 9.9457 10.4088 10.4088 11.1016 11.1016 11.3019 11.3019 12.8935 12.8935 13.4853 13.4853 14.3804 14.3804 k = 0.0000 0.9075 0.1071 ( 2858 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1195 -24.1195 -24.1170 -24.1170 -16.5476 -16.5476 -16.5085 -16.5085 -16.3684 -16.3684 -16.3272 -16.3272 5.8788 5.8788 7.0965 7.0965 8.6919 8.6919 9.2705 9.2705 9.9888 9.9888 10.3964 10.3964 11.0973 11.0973 11.2827 11.2827 12.8876 12.8876 13.5089 13.5089 14.4379 14.4379 k = 0.0000 0.9075 0.1249 ( 2860 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1196 -24.1196 -24.1171 -24.1171 -16.5502 -16.5502 -16.5051 -16.5051 -16.3720 -16.3720 -16.3249 -16.3249 5.8897 5.8897 7.1117 7.1117 8.7103 8.7103 9.2093 9.2093 10.0281 10.0281 10.3828 10.3828 11.0927 11.0927 11.2603 11.2603 12.8835 12.8835 13.5370 13.5370 14.5019 14.5019 k = 0.0000 0.9075 0.1428 ( 2862 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1196 -24.1196 -24.1172 -24.1172 -16.5527 -16.5527 -16.5019 -16.5019 -16.3756 -16.3756 -16.3228 -16.3228 5.9022 5.9022 7.1288 7.1288 8.7313 8.7313 9.1486 9.1486 10.0625 10.0625 10.3684 10.3684 11.0883 11.0883 11.2353 11.2353 12.8822 12.8822 13.5694 13.5694 14.5710 14.5710 k = 0.0000 0.9075 0.1606 ( 2860 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1197 -24.1197 -24.1172 -24.1172 -16.5550 -16.5550 -16.4987 -16.4987 -16.3790 -16.3790 -16.3208 -16.3208 5.9163 5.9163 7.1476 7.1476 8.7544 8.7544 9.0888 9.0888 10.0914 10.0914 10.3536 10.3536 11.0842 11.0842 11.2079 11.2079 12.8844 12.8844 13.6058 13.6058 14.6438 14.6438 k = 0.0000 0.9075 0.1784 ( 2864 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1197 -24.1197 -24.1174 -24.1174 -16.5572 -16.5572 -16.4957 -16.4957 -16.3824 -16.3824 -16.3191 -16.3191 5.9320 5.9320 7.1677 7.1677 8.7796 8.7796 9.0303 9.0303 10.1140 10.1140 10.3391 10.3391 11.0805 11.0805 11.1788 11.1788 12.8908 12.8908 13.6459 13.6459 14.7190 14.7190 k = 0.0000 0.9075 0.1963 ( 2866 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1198 -24.1198 -24.1175 -24.1175 -16.5593 -16.5593 -16.4930 -16.4930 -16.3856 -16.3856 -16.3175 -16.3175 5.9493 5.9493 7.1890 7.1890 8.8066 8.8066 8.9736 8.9736 10.1296 10.1296 10.3254 10.3254 11.0769 11.0769 11.1493 11.1493 12.9018 12.9018 13.6891 13.6891 14.7953 14.7953 k = 0.0000 0.9075 0.2141 ( 2864 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1199 -24.1199 -24.1176 -24.1176 -16.5611 -16.5611 -16.4905 -16.4905 -16.3885 -16.3885 -16.3161 -16.3161 5.9682 5.9682 7.2109 7.2109 8.8348 8.8348 8.9194 8.9194 10.1379 10.1379 10.3128 10.3128 11.0712 11.0712 11.1223 11.1223 12.9179 12.9179 13.7349 13.7349 14.8712 14.8712 k = 0.0000 0.9075 0.2320 ( 2864 PWs) bands (ev): -49.7537 -49.7537 -49.7534 -49.7534 -24.1199 -24.1199 -24.1177 -24.1177 -16.5628 -16.5628 -16.4884 -16.4884 -16.3911 -16.3911 -16.3149 -16.3149 5.9886 5.9886 7.2332 7.2332 8.8575 8.8575 8.8746 8.8746 10.1388 10.1388 10.3013 10.3013 11.0570 11.0570 11.1049 11.1049 12.9393 12.9393 13.7826 13.7826 14.9451 14.9451 k = 0.0000 0.9075 0.2498 ( 2854 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1199 -24.1199 -24.1177 -24.1177 -16.5642 -16.5642 -16.4866 -16.4866 -16.3932 -16.3932 -16.3138 -16.3138 6.0105 6.0105 7.2553 7.2553 8.8165 8.8165 8.8976 8.8976 10.1330 10.1330 10.2905 10.2905 11.0319 11.0319 11.1005 11.1005 12.9661 12.9661 13.8315 13.8315 15.0155 15.0155 k = 0.0000 0.9075 0.2677 ( 2856 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1200 -24.1200 -24.1178 -24.1178 -16.5656 -16.5656 -16.4854 -16.4854 -16.3950 -16.3950 -16.3131 -16.3131 6.0339 6.0339 7.2765 7.2765 8.7717 8.7717 8.9287 8.9287 10.1214 10.1214 10.2796 10.2796 11.0028 11.0028 11.1028 11.1028 12.9982 12.9982 13.8805 13.8805 15.0804 15.0804 k = 0.0000 0.9075 0.2855 ( 2854 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1201 -24.1201 -24.1179 -24.1179 -16.5667 -16.5667 -16.4847 -16.4847 -16.3962 -16.3962 -16.3125 -16.3125 6.0588 6.0588 7.2964 7.2964 8.7309 8.7309 8.9605 8.9605 10.1049 10.1049 10.2679 10.2679 10.9740 10.9740 11.1085 11.1085 13.0356 13.0356 13.9286 13.9286 15.1374 15.1374 k = 0.0000 0.9075 0.3034 ( 2850 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1201 -24.1201 -24.1180 -24.1180 -16.5676 -16.5676 -16.4846 -16.4846 -16.3967 -16.3967 -16.3121 -16.3121 6.0851 6.0851 7.3141 7.3141 8.6949 8.6949 8.9923 8.9923 10.0846 10.0846 10.2545 10.2545 10.9476 10.9476 11.1163 11.1163 13.0780 13.0780 13.9745 13.9745 15.1800 15.1800 k = 0.0000 0.9075 0.3212 ( 2852 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1202 -24.1202 -24.1182 -24.1182 -16.5683 -16.5683 -16.4851 -16.4851 -16.3968 -16.3968 -16.3119 -16.3119 6.1128 6.1128 7.3289 7.3289 8.6645 8.6645 9.0239 9.0239 10.0610 10.0610 10.2389 10.2389 10.9249 10.9249 11.1256 11.1256 13.1251 13.1251 14.0166 14.0166 15.1605 15.1605 k = 0.0000 0.9075 0.3391 ( 2852 PWs) bands (ev): -49.7536 -49.7536 -49.7534 -49.7534 -24.1203 -24.1203 -24.1183 -24.1183 -16.5689 -16.5689 -16.4861 -16.4861 -16.3962 -16.3962 -16.3119 -16.3119 6.1419 6.1419 7.3401 7.3401 8.6404 8.6404 9.0548 9.0548 10.0347 10.0347 10.2206 10.2206 10.9071 10.9071 11.1361 11.1361 13.1767 13.1767 14.0531 14.0531 15.0914 15.0914 k = 0.0000 0.9075 0.3569 ( 2854 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1204 -24.1204 -24.1184 -24.1184 -16.5692 -16.5692 -16.4878 -16.4878 -16.3952 -16.3952 -16.3121 -16.3121 6.1723 6.1723 7.3469 7.3469 8.6232 8.6232 9.0848 9.0848 10.0060 10.0060 10.1992 10.1992 10.8952 10.8952 11.1475 11.1475 13.2323 13.2323 14.0819 14.0819 15.0239 15.0239 k = 0.0000 0.9075 0.3747 ( 2852 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1203 -24.1203 -24.1186 -24.1186 -16.5693 -16.5693 -16.4898 -16.4898 -16.3935 -16.3935 -16.3125 -16.3125 6.2040 6.2040 7.3488 7.3488 8.6134 8.6134 9.1136 9.1136 9.9753 9.9753 10.1744 10.1744 10.8901 10.8901 11.1595 11.1595 13.2915 13.2915 14.1006 14.1006 14.9654 14.9654 k = 0.0000 0.9075 0.3926 ( 2848 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1203 -24.1203 -24.1187 -24.1187 -16.5692 -16.5692 -16.4923 -16.4923 -16.3915 -16.3915 -16.3131 -16.3131 6.2369 6.2369 7.3454 7.3454 8.6112 8.6112 9.1412 9.1412 9.9429 9.9429 10.1462 10.1462 10.8921 10.8921 11.1721 11.1721 13.3538 13.3538 14.1074 14.1074 14.9186 14.9186 k = 0.0000 0.9075 0.4104 ( 2848 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1204 -24.1204 -24.1188 -24.1188 -16.5689 -16.5689 -16.4952 -16.4952 -16.3891 -16.3891 -16.3140 -16.3140 6.2711 6.2711 7.3365 7.3365 8.6166 8.6166 9.1673 9.1673 9.9090 9.9090 10.1147 10.1147 10.9012 10.9012 11.1850 11.1850 13.4185 13.4185 14.1016 14.1016 14.8848 14.8848 k = 0.0000 0.9075 0.4283 ( 2848 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1204 -24.1204 -24.1190 -24.1190 -16.5685 -16.5685 -16.4983 -16.4983 -16.3865 -16.3865 -16.3150 -16.3150 6.3064 6.3064 7.3221 7.3221 8.6294 8.6294 9.1919 9.1919 9.8741 9.8741 10.0802 10.0802 10.9170 10.9170 11.1982 11.1982 13.4849 13.4849 14.0839 14.0839 14.8631 14.8631 k = 0.0000 0.9075 0.4461 ( 2850 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1205 -24.1205 -24.1191 -24.1191 -16.5678 -16.5678 -16.5017 -16.5017 -16.3835 -16.3835 -16.3162 -16.3162 6.3428 6.3428 7.3026 7.3026 8.6493 8.6493 9.2149 9.2149 9.8382 9.8382 10.0432 10.0432 10.9390 10.9390 11.2115 11.2115 13.5523 13.5523 14.0572 14.0572 14.8508 14.8508 k = 0.0000 0.9075 0.4640 ( 2854 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1205 -24.1205 -24.1193 -24.1193 -16.5669 -16.5669 -16.5052 -16.5052 -16.3804 -16.3804 -16.3176 -16.3176 6.3803 6.3803 7.2783 7.2783 8.6756 8.6756 9.2362 9.2362 9.8018 9.8018 10.0042 10.0042 10.9662 10.9662 11.2248 11.2248 13.6191 13.6191 14.0254 14.0254 14.8433 14.8433 k = 0.0000 0.9075 0.4818 ( 2864 PWs) bands (ev): -49.7535 -49.7535 -49.7533 -49.7533 -24.1207 -24.1207 -24.1195 -24.1195 -16.5659 -16.5659 -16.5089 -16.5089 -16.3772 -16.3772 -16.3192 -16.3192 6.4189 6.4189 7.2498 7.2498 8.7075 8.7075 9.2557 9.2557 9.7653 9.7653 9.9639 9.9639 10.9974 10.9974 11.2378 11.2378 13.6835 13.6835 13.9932 13.9932 14.8343 14.8343 k = 0.0000 0.9075 0.4997 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1197 -24.1197 -16.5646 -16.5646 -16.5126 -16.5126 -16.3739 -16.3739 -16.3210 -16.3210 6.4583 6.4583 7.2177 7.2177 8.7443 8.7443 9.2732 9.2732 9.7289 9.7289 9.9230 9.9230 11.0316 11.0316 11.2505 11.2505 13.7415 13.7415 13.9664 13.9664 14.8123 14.8123 k = 0.0000 0.9075 0.5175 ( 2870 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1198 -24.1198 -16.5631 -16.5631 -16.5164 -16.5164 -16.3705 -16.3705 -16.3229 -16.3229 6.4987 6.4987 7.1826 7.1826 8.7852 8.7852 9.2882 9.2882 9.6935 9.6935 9.8820 9.8820 11.0675 11.0675 11.2625 11.2625 13.7853 13.7853 13.9536 13.9536 14.7638 14.7638 k = 0.0000 0.9075 0.5353 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1199 -24.1199 -16.5613 -16.5613 -16.5201 -16.5201 -16.3671 -16.3671 -16.3250 -16.3250 6.5399 6.5399 7.1449 7.1449 8.8294 8.8294 9.2998 9.2998 9.6601 9.6601 9.8416 9.8416 11.1039 11.1039 11.2735 11.2735 13.8060 13.8060 13.9633 13.9633 14.6975 14.6975 k = 0.0000 0.9075 0.5532 ( 2870 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1201 -24.1201 -16.5594 -16.5594 -16.5238 -16.5238 -16.3636 -16.3636 -16.3273 -16.3273 6.5819 6.5819 7.1052 7.1052 8.8761 8.8761 9.3066 9.3066 9.6301 9.6301 9.8024 9.8024 11.1394 11.1394 11.2832 11.2832 13.8085 13.8085 13.9883 13.9883 14.6332 14.6332 k = 0.0000 0.9075 0.5710 ( 2866 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1201 -24.1201 -16.5573 -16.5573 -16.5274 -16.5274 -16.3601 -16.3601 -16.3297 -16.3297 6.6246 6.6246 7.0639 7.0639 8.9248 8.9248 9.3066 9.3066 9.6060 9.6060 9.7648 9.7648 11.1731 11.1731 11.2911 11.2911 13.8067 13.8067 14.0102 14.0102 14.5840 14.5840 k = 0.0000 0.9075 0.5889 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1203 -24.1203 -16.5550 -16.5550 -16.5310 -16.5310 -16.3567 -16.3567 -16.3322 -16.3322 6.6678 6.6678 7.0214 7.0214 8.9745 8.9745 9.2975 9.2975 9.5901 9.5901 9.7294 9.7294 11.2039 11.2039 11.2967 11.2967 13.8091 13.8091 14.0160 14.0160 14.5584 14.5584 k = 0.0000 0.9075 0.6067 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1207 -24.1207 -24.1203 -24.1203 -16.5526 -16.5526 -16.5344 -16.5344 -16.3534 -16.3534 -16.3349 -16.3349 6.7116 6.7116 6.9780 6.9780 9.0247 9.0247 9.2781 9.2781 9.5839 9.5839 9.6964 9.6964 11.2310 11.2310 11.2994 11.2994 13.8189 13.8189 14.0019 14.0019 14.5590 14.5590 k = 0.0000 0.9075 0.6246 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7533 -49.7533 -24.1206 -24.1206 -24.1204 -24.1204 -16.5499 -16.5499 -16.5378 -16.5378 -16.3501 -16.3501 -16.3377 -16.3377 6.7558 6.7558 6.9339 6.9339 9.0746 9.0746 9.2490 9.2490 9.5874 9.5874 9.6663 9.6663 11.2538 11.2538 11.2988 11.2988 13.8372 13.8372 13.9723 13.9723 14.5813 14.5813 k = 0.0000 0.9075 0.6424 ( 2876 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1207 -24.1207 -24.1205 -24.1205 -16.5472 -16.5472 -16.5411 -16.5411 -16.3469 -16.3469 -16.3407 -16.3407 6.8003 6.8003 6.8895 6.8895 9.1232 9.1232 9.2120 9.2120 9.5989 9.5989 9.6395 9.6395 11.2720 11.2720 11.2943 11.2943 13.8638 13.8638 13.9351 13.9351 14.6171 14.6171 k = 0.0000 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1206 -24.1206 -16.5442 -16.5442 -16.5442 -16.5442 -16.3437 -16.3437 -16.3437 -16.3437 6.8449 6.8449 6.8449 6.8449 9.1695 9.1695 9.1695 9.1695 9.6168 9.6168 9.6168 9.6168 11.2854 11.2854 11.2854 11.2854 13.8974 13.8974 13.8974 13.8974 14.6594 14.6594 k = 0.0000 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1206 -24.1206 -16.5442 -16.5442 -16.5442 -16.5442 -16.3437 -16.3437 -16.3437 -16.3437 6.8449 6.8449 6.8449 6.8449 9.1695 9.1695 9.1695 9.1695 9.6168 9.6168 9.6168 9.6168 11.2854 11.2854 11.2854 11.2854 13.8974 13.8974 13.8974 13.8974 14.6594 14.6594 k = 0.0170 0.9075 0.6603 ( 2878 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1206 -24.1206 -16.5454 -16.5454 -16.5430 -16.5430 -16.3450 -16.3450 -16.3425 -16.3425 6.8427 6.8427 6.8482 6.8482 9.1505 9.1505 9.1767 9.1767 9.6038 9.6038 9.6422 9.6422 11.2836 11.2836 11.2850 11.2850 13.8961 13.8961 13.8995 13.8995 14.6418 14.6418 k = 0.0341 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1206 -24.1206 -16.5465 -16.5465 -16.5417 -16.5417 -16.3463 -16.3463 -16.3412 -16.3412 6.8418 6.8418 6.8527 6.8527 9.1228 9.1228 9.1705 9.1705 9.6048 9.6048 9.6769 9.6769 11.2795 11.2795 11.2823 11.2823 13.8955 13.8955 13.9022 13.9022 14.6138 14.6138 k = 0.0511 0.9075 0.6603 ( 2878 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1206 -24.1206 -16.5476 -16.5476 -16.5405 -16.5405 -16.3475 -16.3475 -16.3400 -16.3400 6.8419 6.8419 6.8582 6.8582 9.0895 9.0895 9.1520 9.1520 9.6188 9.6188 9.7179 9.7179 11.2731 11.2731 11.2776 11.2776 13.8956 13.8956 13.9057 13.9057 14.5778 14.5778 k = 0.0681 0.9075 0.6603 ( 2872 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1205 -24.1205 -24.1205 -24.1205 -16.5486 -16.5486 -16.5392 -16.5392 -16.3487 -16.3487 -16.3387 -16.3387 6.8432 6.8432 6.8648 6.8648 9.0528 9.0528 9.1240 9.1240 9.6428 9.6428 9.7628 9.7628 11.2646 11.2646 11.2708 11.2708 13.8965 13.8965 13.9098 13.9098 14.5363 14.5363 k = 0.0852 0.9075 0.6603 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1205 -24.1205 -24.1204 -24.1204 -16.5496 -16.5496 -16.5379 -16.5379 -16.3499 -16.3499 -16.3375 -16.3375 6.8454 6.8454 6.8723 6.8723 9.0145 9.0145 9.0900 9.0900 9.6733 9.6733 9.8096 9.8096 11.2541 11.2541 11.2622 11.2622 13.8982 13.8982 13.9145 13.9145 14.4917 14.4917 k = 0.1022 0.9075 0.6603 ( 2862 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1204 -24.1204 -24.1203 -24.1203 -16.5506 -16.5506 -16.5365 -16.5365 -16.3510 -16.3510 -16.3362 -16.3362 6.8485 6.8485 6.8806 6.8806 8.9759 8.9759 9.0526 9.0526 9.7076 9.7076 9.8570 9.8570 11.2417 11.2417 11.2520 11.2520 13.9007 13.9007 13.9198 13.9198 14.4460 14.4460 k = 0.1192 0.9075 0.6603 ( 2860 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1203 -24.1203 -24.1202 -24.1202 -16.5515 -16.5515 -16.5352 -16.5352 -16.3522 -16.3522 -16.3350 -16.3350 6.8524 6.8524 6.8894 6.8894 8.9378 8.9378 9.0139 9.0139 9.7435 9.7435 9.9041 9.9041 11.2278 11.2278 11.2404 11.2404 13.9041 13.9041 13.9257 13.9257 14.4007 14.4007 k = 0.1363 0.9075 0.6603 ( 2860 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1203 -24.1203 -24.1202 -24.1202 -16.5524 -16.5524 -16.5339 -16.5339 -16.3534 -16.3534 -16.3339 -16.3339 6.8568 6.8568 6.8986 6.8986 8.9009 8.9009 8.9753 8.9753 9.7795 9.7795 9.9498 9.9498 11.2126 11.2126 11.2279 11.2279 13.9085 13.9085 13.9321 13.9321 14.3572 14.3572 k = 0.1533 0.9075 0.6603 ( 2864 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1202 -24.1202 -24.1201 -24.1201 -16.5532 -16.5532 -16.5326 -16.5326 -16.3545 -16.3545 -16.3328 -16.3328 6.8616 6.8616 6.9080 6.9080 8.8658 8.8658 8.9378 8.9378 9.8144 9.8144 9.9933 9.9933 11.1966 11.1966 11.2147 11.2147 13.9139 13.9139 13.9391 13.9391 14.3163 14.3163 k = 0.1703 0.9075 0.6603 ( 2862 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1202 -24.1202 -24.1200 -24.1200 -16.5540 -16.5540 -16.5312 -16.5312 -16.3556 -16.3556 -16.3316 -16.3316 6.8665 6.8665 6.9172 6.9172 8.8331 8.8331 8.9023 8.9023 9.8473 9.8473 10.0339 10.0339 11.1802 11.1802 11.2013 11.2013 13.9204 13.9204 13.9464 13.9464 14.2787 14.2787 k = 0.1874 0.9075 0.6603 ( 2866 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1201 -24.1201 -24.1200 -24.1200 -16.5547 -16.5547 -16.5299 -16.5299 -16.3567 -16.3567 -16.3306 -16.3306 6.8714 6.8714 6.9259 6.9259 8.8031 8.8031 8.8695 8.8695 9.8773 9.8773 10.0707 10.0707 11.1639 11.1639 11.1881 11.1881 13.9282 13.9282 13.9541 13.9541 14.2449 14.2449 k = 0.2044 0.9075 0.6603 ( 2864 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1200 -24.1200 -24.1199 -24.1199 -16.5553 -16.5553 -16.5286 -16.5286 -16.3577 -16.3577 -16.3295 -16.3295 6.8759 6.8759 6.9340 6.9340 8.7763 8.7763 8.8400 8.8400 9.9039 9.9039 10.1031 10.1031 11.1485 11.1485 11.1755 11.1755 13.9375 13.9375 13.9620 13.9620 14.2151 14.2151 k = 0.2214 0.9075 0.6603 ( 2870 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1200 -24.1200 -24.1198 -24.1198 -16.5560 -16.5560 -16.5273 -16.5273 -16.3587 -16.3587 -16.3285 -16.3285 6.8797 6.8797 6.9409 6.9409 8.7530 8.7530 8.8143 8.8143 9.9264 9.9264 10.1304 10.1304 11.1344 11.1344 11.1640 11.1640 13.9484 13.9484 13.9700 13.9700 14.1895 14.1895 k = 0.2385 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7536 -49.7536 -49.7536 -49.7536 -24.1199 -24.1199 -24.1198 -24.1198 -16.5565 -16.5565 -16.5260 -16.5260 -16.3597 -16.3597 -16.3276 -16.3276 6.8827 6.8827 6.9463 6.9463 8.7337 8.7337 8.7929 8.7929 9.9445 9.9445 10.1519 10.1519 11.1224 11.1224 11.1539 11.1539 13.9610 13.9610 13.9779 13.9779 14.1681 14.1681 k = 0.2555 0.9075 0.6603 ( 2874 PWs) bands (ev): -49.7536 -49.7536 -49.7536 -49.7536 -24.1198 -24.1198 -24.1196 -24.1196 -16.5570 -16.5570 -16.5247 -16.5247 -16.3606 -16.3606 -16.3266 -16.3266 6.8845 6.8845 6.9500 6.9500 8.7185 8.7185 8.7762 8.7762 9.9578 9.9578 10.1673 10.1673 11.1129 11.1129 11.1456 11.1456 13.9751 13.9751 13.9854 13.9854 14.1510 14.1510 k = 0.2726 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7537 -49.7537 -49.7537 -49.7537 -24.1197 -24.1197 -24.1195 -24.1195 -16.5574 -16.5574 -16.5234 -16.5234 -16.3615 -16.3615 -16.3257 -16.3257 6.8848 6.8848 6.9516 6.9516 8.7079 8.7079 8.7646 8.7646 9.9663 9.9663 10.1761 10.1761 11.1064 11.1064 11.1393 11.1393 13.9905 13.9905 13.9922 13.9922 14.1386 14.1386 k = 0.2726 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7537 -49.7537 -49.7537 -49.7537 -24.1197 -24.1197 -24.1195 -24.1195 -16.5574 -16.5574 -16.5234 -16.5234 -16.3615 -16.3615 -16.3257 -16.3257 6.8848 6.8848 6.9516 6.9516 8.7079 8.7079 8.7646 8.7646 9.9663 9.9663 10.1761 10.1761 11.1064 11.1064 11.1393 11.1393 13.9905 13.9905 13.9922 13.9922 14.1386 14.1386 k = 0.2674 0.8903 0.6603 ( 2868 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1200 -24.1200 -24.1199 -24.1199 -16.5559 -16.5559 -16.5279 -16.5279 -16.3584 -16.3584 -16.3289 -16.3289 6.8835 6.8835 6.9469 6.9469 8.7398 8.7398 8.7984 8.7984 9.9461 9.9461 10.1568 10.1568 11.1260 11.1260 11.1599 11.1599 13.9275 13.9275 13.9572 13.9572 14.1788 14.1788 k = 0.2623 0.8732 0.6603 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1203 -24.1203 -24.1202 -24.1202 -16.5540 -16.5540 -16.5320 -16.5320 -16.3553 -16.3553 -16.3321 -16.3321 6.8760 6.8760 6.9359 6.9359 8.7751 8.7751 8.8348 8.8348 9.9291 9.9291 10.1396 10.1396 11.1479 11.1479 11.1829 11.1829 13.8594 13.8594 13.9051 13.9051 14.2217 14.2217 k = 0.2571 0.8561 0.6603 ( 2868 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1205 -24.1205 -24.1204 -24.1204 -16.5518 -16.5518 -16.5357 -16.5357 -16.3522 -16.3522 -16.3352 -16.3352 6.8625 6.8625 6.9188 6.9188 8.8142 8.8142 8.8741 8.8741 9.9151 9.9151 10.1246 10.1246 11.1713 11.1713 11.2075 11.2075 13.7903 13.7903 13.8440 13.8440 14.2640 14.2640 k = 0.2520 0.8390 0.6603 ( 2870 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1206 -24.1206 -24.1205 -24.1205 -16.5492 -16.5492 -16.5390 -16.5390 -16.3491 -16.3491 -16.3384 -16.3384 6.8432 6.8432 6.8958 6.8958 8.8571 8.8571 8.9165 8.9165 9.9042 9.9042 10.1118 10.1118 11.1953 11.1953 11.2328 11.2328 13.7219 13.7219 13.7789 13.7789 14.3050 14.3050 k = 0.2468 0.8219 0.6603 ( 2870 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1205 -24.1205 -24.1205 -24.1205 -16.5461 -16.5461 -16.5419 -16.5419 -16.3460 -16.3460 -16.3415 -16.3415 6.8183 6.8183 6.8673 6.8673 8.9037 8.9037 8.9618 8.9618 9.8962 9.8962 10.1014 10.1014 11.2187 11.2187 11.2577 11.2577 13.6554 13.6554 13.7130 13.7130 14.3444 14.3444 k = 0.2417 0.8047 0.6603 ( 2862 PWs) bands (ev): -49.7534 -49.7534 -49.7534 -49.7534 -24.1203 -24.1203 -24.1203 -24.1203 -16.5443 -16.5443 -16.5427 -16.5427 -16.3445 -16.3445 -16.3429 -16.3429 6.7884 6.7884 6.8337 6.8337 8.9537 8.9537 9.0099 9.0099 9.8913 9.8913 10.0934 10.0934 11.2406 11.2406 11.2810 11.2810 13.5923 13.5923 13.6484 13.6484 14.3820 14.3820 k = 0.2366 0.7876 0.6603 ( 2870 PWs) bands (ev): -49.7535 -49.7535 -49.7535 -49.7535 -24.1202 -24.1202 -24.1202 -24.1202 -16.5465 -16.5465 -16.5389 -16.5389 -16.3476 -16.3476 -16.3397 -16.3397 6.7538 6.7538 6.7954 6.7954 9.0070 9.0070 9.0607 9.0607 9.8895 9.8895 10.0880 10.0880 11.2596 11.2596 11.3014 11.3014 13.5337 13.5337 13.5869 13.5869 14.4177 14.4177 k = 0.2314 0.7705 0.6603 ( 2870 PWs) bands (ev): -49.7536 -49.7536 -49.7536 -49.7536 -24.1199 -24.1199 -24.1198 -24.1198 -16.5482 -16.5482 -16.5348 -16.5348 -16.3507 -16.3507 -16.3365 -16.3365 6.7151 6.7151 6.7530 6.7530 9.0632 9.0632 9.1136 9.1136 9.8909 9.8909 10.0853 10.0853 11.2745 11.2745 11.3177 11.3177 13.4810 13.4810 13.5300 13.5300 14.4514 14.4514 k = 0.2263 0.7534 0.6603 ( 2870 PWs) bands (ev): -49.7537 -49.7537 -49.7537 -49.7537 -24.1195 -24.1195 -24.1194 -24.1194 -16.5496 -16.5496 -16.5302 -16.5302 -16.3537 -16.3537 -16.3333 -16.3333 6.6727 6.6727 6.7070 6.7070 9.1219 9.1219 9.1682 9.1682 9.8957 9.8957 10.0854 10.0854 11.2841 11.2841 11.3283 11.3283 13.4356 13.4356 13.4792 13.4792 14.4833 14.4833 k = 0.2211 0.7362 0.6603 ( 2866 PWs) bands (ev): -49.7538 -49.7538 -49.7538 -49.7538 -24.1189 -24.1189 -24.1188 -24.1188 -16.5506 -16.5506 -16.5252 -16.5252 -16.3567 -16.3567 -16.3300 -16.3300 6.6270 6.6270 6.6578 6.6578 9.1825 9.1825 9.2241 9.2241 9.9043 9.9043 10.0884 10.0884 11.2872 11.2872 11.3321 11.3321 13.3986 13.3986 13.4357 13.4357 14.5131 14.5131 k = 0.2160 0.7191 0.6603 ( 2870 PWs) bands (ev): -49.7540 -49.7540 -49.7540 -49.7540 -24.1184 -24.1184 -24.1182 -24.1182 -16.5514 -16.5514 -16.5199 -16.5199 -16.3597 -16.3597 -16.3267 -16.3267 6.5786 6.5786 6.6060 6.6060 9.2447 9.2447 9.2804 9.2804 9.9169 9.9169 10.0947 10.0947 11.2827 11.2827 11.3278 11.3278 13.3709 13.3709 13.4007 13.4007 14.5411 14.5411 k = 0.2108 0.7020 0.6603 ( 2870 PWs) bands (ev): -49.7542 -49.7542 -49.7542 -49.7542 -24.1177 -24.1177 -24.1174 -24.1174 -16.5518 -16.5518 -16.5141 -16.5141 -16.3627 -16.3627 -16.3232 -16.3232 6.5279 6.5279 6.5518 6.5518 9.3077 9.3077 9.3364 9.3364 9.9342 9.9342 10.1045 10.1045 11.2698 11.2698 11.3147 11.3147 13.3534 13.3534 13.3748 13.3748 14.5672 14.5672 k = 0.2057 0.6849 0.6603 ( 2878 PWs) bands (ev): -49.7545 -49.7545 -49.7545 -49.7545 -24.1169 -24.1169 -24.1167 -24.1167 -16.5519 -16.5519 -16.5081 -16.5081 -16.3657 -16.3657 -16.3198 -16.3198 6.4752 6.4752 6.4958 6.4958 9.3710 9.3710 9.3912 9.3912 9.9567 9.9567 10.1181 10.1181 11.2480 11.2480 11.2923 11.2923 13.3463 13.3463 13.3584 13.3584 14.5916 14.5916 k = 0.2006 0.6678 0.6603 ( 2878 PWs) bands (ev): -49.7547 -49.7547 -49.7547 -49.7547 -24.1160 -24.1160 -24.1158 -24.1158 -16.5517 -16.5517 -16.5017 -16.5017 -16.3686 -16.3686 -16.3162 -16.3162 6.4209 6.4209 6.4383 6.4383 9.4337 9.4337 9.4438 9.4438 9.9852 9.9852 10.1358 10.1358 11.2172 11.2172 11.2605 11.2605 13.3494 13.3494 13.3517 13.3517 14.6143 14.6143 k = 0.1954 0.6506 0.6603 ( 2874 PWs) bands (ev): -49.7550 -49.7550 -49.7550 -49.7550 -24.1150 -24.1150 -24.1147 -24.1147 -16.5512 -16.5512 -16.4949 -16.4949 -16.3715 -16.3715 -16.3126 -16.3126 6.3653 6.3653 6.3797 6.3797 9.4932 9.4932 9.4952 9.4952 10.0202 10.0202 10.1582 10.1582 11.1777 11.1777 11.2197 11.2197 13.3541 13.3541 13.3621 13.3621 14.6355 14.6355 k = 0.1903 0.6335 0.6603 ( 2878 PWs) bands (ev): -49.7553 -49.7553 -49.7553 -49.7553 -24.1140 -24.1140 -24.1137 -24.1137 -16.5506 -16.5506 -16.4879 -16.4879 -16.3744 -16.3744 -16.3088 -16.3088 6.3088 6.3088 6.3201 6.3201 9.5387 9.5387 9.5545 9.5545 10.0623 10.0623 10.1857 10.1857 11.1304 11.1304 11.1706 11.1706 13.3649 13.3649 13.3833 13.3833 14.6553 14.6553 k = 0.1851 0.6164 0.6603 ( 2862 PWs) bands (ev): -49.7556 -49.7556 -49.7556 -49.7556 -24.1127 -24.1127 -24.1124 -24.1124 -16.5496 -16.5496 -16.4805 -16.4805 -16.3770 -16.3770 -16.3049 -16.3049 6.2515 6.2515 6.2600 6.2600 9.5797 9.5797 9.6107 9.6107 10.1117 10.1117 10.2184 10.2184 11.0762 11.0762 11.1142 11.1142 13.3829 13.3829 13.4117 13.4117 14.6740 14.6740 k = 0.1800 0.5993 0.6603 ( 2858 PWs) bands (ev): -49.7560 -49.7560 -49.7560 -49.7560 -24.1115 -24.1115 -24.1111 -24.1111 -16.5485 -16.5485 -16.4730 -16.4730 -16.3797 -16.3797 -16.3009 -16.3009 6.1938 6.1938 6.1996 6.1996 9.6161 9.6161 9.6631 9.6631 10.1681 10.1681 10.2565 10.2565 11.0167 11.0167 11.0518 11.0518 13.4066 13.4066 13.4459 13.4459 14.6916 14.6916 k = 0.1748 0.5822 0.6603 ( 2862 PWs) bands (ev): -49.7563 -49.7563 -49.7563 -49.7563 -24.1103 -24.1103 -24.1099 -24.1099 -16.5472 -16.5472 -16.4654 -16.4654 -16.3822 -16.3822 -16.2969 -16.2969 6.1358 6.1358 6.1391 6.1391 9.6479 9.6479 9.7110 9.7110 10.2310 10.2310 10.2994 10.2994 10.9539 10.9539 10.9845 10.9845 13.4348 13.4348 13.4840 13.4840 14.7084 14.7084 k = 0.1697 0.5650 0.6603 ( 2862 PWs) bands (ev): -49.7567 -49.7567 -49.7567 -49.7567 -24.1089 -24.1089 -24.1085 -24.1085 -16.5458 -16.5458 -16.4578 -16.4578 -16.3844 -16.3844 -16.2927 -16.2927 6.0777 6.0777 6.0786 6.0786 9.6755 9.6755 9.7542 9.7542 10.2995 10.2995 10.3452 10.3452 10.8907 10.8907 10.9140 10.9140 13.4657 13.4657 13.5245 13.5245 14.7244 14.7244 k = 0.1646 0.5479 0.6603 ( 2862 PWs) bands (ev): -49.7571 -49.7571 -49.7571 -49.7571 -24.1076 -24.1076 -24.1071 -24.1071 -16.5443 -16.5443 -16.4503 -16.4503 -16.3862 -16.3862 -16.2884 -16.2884 6.0185 6.0185 6.0198 6.0198 9.6991 9.6991 9.7924 9.7924 10.3723 10.3723 10.3900 10.3900 10.8321 10.8321 10.8419 10.8419 13.4980 13.4980 13.5656 13.5656 14.7396 14.7396 k = 0.1594 0.5308 0.6603 ( 2860 PWs) bands (ev): -49.7575 -49.7575 -49.7575 -49.7575 -24.1061 -24.1061 -24.1056 -24.1056 -16.5427 -16.5427 -16.4432 -16.4432 -16.3875 -16.3875 -16.2839 -16.2839 5.9588 5.9588 5.9622 5.9622 9.7189 9.7189 9.8256 9.8256 10.4252 10.4252 10.4474 10.4474 10.7707 10.7707 10.7873 10.7873 13.5301 13.5301 13.6058 13.6058 14.7539 14.7539 k = 0.1543 0.5137 0.6603 ( 2860 PWs) bands (ev): -49.7580 -49.7580 -49.7580 -49.7580 -24.1046 -24.1046 -24.1042 -24.1042 -16.5410 -16.5410 -16.4368 -16.4368 -16.3878 -16.3878 -16.2794 -16.2794 5.8997 5.8997 5.9051 5.9051 9.7348 9.7348 9.8539 9.8539 10.4366 10.4366 10.5186 10.5186 10.7073 10.7073 10.7711 10.7711 13.5609 13.5609 13.6438 13.6438 14.7671 14.7671 k = 0.1491 0.4965 0.6603 ( 2860 PWs) bands (ev): -49.7584 -49.7584 -49.7584 -49.7584 -24.1031 -24.1031 -24.1026 -24.1026 -16.5393 -16.5393 -16.4316 -16.4316 -16.3867 -16.3867 -16.2748 -16.2748 5.8414 5.8414 5.8486 5.8486 9.7466 9.7466 9.8768 9.8768 10.4154 10.4154 10.5538 10.5538 10.6847 10.6847 10.7932 10.7932 13.5892 13.5892 13.6781 13.6781 14.7788 14.7788 k = 0.1440 0.4794 0.6603 ( 2856 PWs) bands (ev): -49.7588 -49.7588 -49.7588 -49.7588 -24.1015 -24.1015 -24.1011 -24.1011 -16.5374 -16.5374 -16.4281 -16.4281 -16.3837 -16.3837 -16.2700 -16.2700 5.7840 5.7840 5.7928 5.7928 9.7534 9.7534 9.8934 9.8934 10.3711 10.3711 10.5167 10.5167 10.7403 10.7403 10.8458 10.8458 13.6140 13.6140 13.7080 13.7080 14.7885 14.7885 k = 0.1388 0.4623 0.6603 ( 2864 PWs) bands (ev): -49.7593 -49.7593 -49.7593 -49.7593 -24.1001 -24.1001 -24.0996 -24.0996 -16.5357 -16.5357 -16.4265 -16.4265 -16.3789 -16.3789 -16.2653 -16.2653 5.7276 5.7276 5.7379 5.7379 9.7544 9.7544 9.9017 9.9017 10.3185 10.3185 10.4595 10.4595 10.8233 10.8233 10.9161 10.9161 13.6347 13.6347 13.7326 13.7326 14.7958 14.7958 k = 0.1337 0.4452 0.6603 ( 2856 PWs) bands (ev): -49.7598 -49.7598 -49.7598 -49.7598 -24.0984 -24.0984 -24.0979 -24.0979 -16.5337 -16.5337 -16.4263 -16.4263 -16.3723 -16.3723 -16.2603 -16.2603 5.6724 5.6724 5.6839 5.6839 9.7482 9.7482 9.8985 9.8985 10.2690 10.2690 10.4041 10.4041 10.9133 10.9133 10.9964 10.9964 13.6508 13.6508 13.7516 13.7516 14.8001 14.8001 k = 0.1286 0.4281 0.6603 ( 2864 PWs) bands (ev): -49.7602 -49.7602 -49.7602 -49.7602 -24.0969 -24.0969 -24.0964 -24.0964 -16.5319 -16.5319 -16.4272 -16.4272 -16.3647 -16.3647 -16.2555 -16.2555 5.6184 5.6184 5.6311 5.6311 9.7334 9.7334 9.8798 9.8798 10.2305 10.2305 10.3557 10.3557 11.0067 11.0067 11.0829 11.0829 13.6621 13.6621 13.7649 13.7649 14.8013 14.8013 k = 0.1234 0.4109 0.6603 ( 2868 PWs) bands (ev): -49.7607 -49.7607 -49.7607 -49.7607 -24.0953 -24.0953 -24.0948 -24.0948 -16.5301 -16.5301 -16.4288 -16.4288 -16.3563 -16.3563 -16.2505 -16.2505 5.5657 5.5657 5.5794 5.5794 9.7091 9.7091 9.8438 9.8438 10.2071 10.2071 10.3167 10.3167 11.1021 11.1021 11.1736 11.1736 13.6686 13.6686 13.7725 13.7725 14.7995 14.7995 k = 0.1183 0.3938 0.6603 ( 2864 PWs) bands (ev): -49.7612 -49.7612 -49.7612 -49.7612 -24.0937 -24.0937 -24.0932 -24.0932 -16.5282 -16.5282 -16.4309 -16.4309 -16.3474 -16.3474 -16.2455 -16.2455 5.5145 5.5145 5.5290 5.5290 9.6753 9.6753 9.7929 9.7929 10.1978 10.1978 10.2879 10.2879 11.1989 11.1989 11.2671 11.2671 13.6705 13.6705 13.7749 13.7749 14.7949 14.7949 k = 0.1131 0.3767 0.6603 ( 2866 PWs) bands (ev): -49.7616 -49.7616 -49.7616 -49.7616 -24.0922 -24.0922 -24.0917 -24.0917 -16.5264 -16.5264 -16.4333 -16.4333 -16.3382 -16.3382 -16.2405 -16.2405 5.4648 5.4648 5.4800 5.4800 9.6327 9.6327 9.7319 9.7319 10.1986 10.1986 10.2689 10.2689 11.2968 11.2968 11.3628 11.3628 13.6680 13.6680 13.7724 13.7724 14.7880 14.7880 k = 0.1080 0.3596 0.6603 ( 2866 PWs) bands (ev): -49.7621 -49.7621 -49.7621 -49.7621 -24.0906 -24.0906 -24.0901 -24.0901 -16.5246 -16.5246 -16.4358 -16.4358 -16.3289 -16.3289 -16.2356 -16.2356 5.4167 5.4167 5.4325 5.4325 9.5831 9.5831 9.6651 9.6651 10.2058 10.2058 10.2584 10.2584 11.3952 11.3952 11.4600 11.4600 13.6616 13.6616 13.7657 13.7657 14.7795 14.7795 k = 0.1028 0.3424 0.6603 ( 2870 PWs) bands (ev): -49.7625 -49.7625 -49.7625 -49.7625 -24.0891 -24.0891 -24.0886 -24.0886 -16.5228 -16.5228 -16.4384 -16.4384 -16.3196 -16.3196 -16.2307 -16.2307 5.3703 5.3703 5.3865 5.3865 9.5285 9.5285 9.5959 9.5959 10.2166 10.2166 10.2546 10.2546 11.4940 11.4940 11.5581 11.5581 13.6517 13.6517 13.7553 13.7553 14.7697 14.7697 k = 0.0977 0.3253 0.6603 ( 2874 PWs) bands (ev): -49.7630 -49.7630 -49.7630 -49.7630 -24.0876 -24.0876 -24.0872 -24.0872 -16.5210 -16.5210 -16.4411 -16.4411 -16.3102 -16.3102 -16.2259 -16.2259 5.3257 5.3257 5.3421 5.3421 9.4708 9.4708 9.5261 9.5261 10.2295 10.2295 10.2559 10.2559 11.5928 11.5928 11.6567 11.6567 13.6388 13.6388 13.7418 13.7418 14.7594 14.7594 k = 0.0926 0.3082 0.6603 ( 2878 PWs) bands (ev): -49.7634 -49.7634 -49.7634 -49.7634 -24.0862 -24.0862 -24.0857 -24.0857 -16.5193 -16.5193 -16.4439 -16.4439 -16.3010 -16.3010 -16.2213 -16.2213 5.2829 5.2829 5.2994 5.2994 9.4115 9.4115 9.4570 9.4570 10.2435 10.2435 10.2608 10.2608 11.6912 11.6912 11.7554 11.7554 13.6234 13.6234 13.7257 13.7257 14.7489 14.7489 k = 0.0874 0.2911 0.6603 ( 2874 PWs) bands (ev): -49.7638 -49.7638 -49.7638 -49.7638 -24.0847 -24.0847 -24.0843 -24.0843 -16.5176 -16.5176 -16.4466 -16.4466 -16.2918 -16.2918 -16.2167 -16.2167 5.2421 5.2421 5.2585 5.2585 9.3521 9.3521 9.3895 9.3895 10.2579 10.2579 10.2683 10.2683 11.7889 11.7889 11.8537 11.8537 13.6059 13.6059 13.7077 13.7077 14.7386 14.7386 k = 0.0823 0.2740 0.6603 ( 2870 PWs) bands (ev): -49.7642 -49.7642 -49.7642 -49.7642 -24.0833 -24.0833 -24.0829 -24.0829 -16.5159 -16.5159 -16.4494 -16.4494 -16.2828 -16.2828 -16.2123 -16.2123 5.2033 5.2033 5.2195 5.2195 9.2933 9.2933 9.3243 9.3243 10.2724 10.2724 10.2775 10.2775 11.8855 11.8855 11.9513 11.9513 13.5869 13.5869 13.6881 13.6881 14.7288 14.7288 k = 0.0771 0.2568 0.6603 ( 2870 PWs) bands (ev): -49.7646 -49.7646 -49.7646 -49.7646 -24.0820 -24.0820 -24.0816 -24.0816 -16.5142 -16.5142 -16.4521 -16.4521 -16.2740 -16.2740 -16.2081 -16.2081 5.1665 5.1665 5.1824 5.1824 9.2360 9.2360 9.2616 9.2616 10.2866 10.2866 10.2878 10.2878 11.9807 11.9807 12.0476 12.0476 13.5668 13.5668 13.6675 13.6675 14.7196 14.7196 k = 0.0720 0.2397 0.6603 ( 2868 PWs) bands (ev): -49.7650 -49.7650 -49.7650 -49.7650 -24.0807 -24.0807 -24.0803 -24.0803 -16.5125 -16.5125 -16.4548 -16.4548 -16.2655 -16.2655 -16.2041 -16.2041 5.1318 5.1318 5.1473 5.1473 9.1808 9.1808 9.2020 9.2020 10.2987 10.2987 10.3004 10.3004 12.0740 12.0740 12.1423 12.1423 13.5460 13.5460 13.6463 13.6463 14.7112 14.7112 k = 0.0669 0.2226 0.6603 ( 2856 PWs) bands (ev): -49.7653 -49.7653 -49.7653 -49.7653 -24.0794 -24.0794 -24.0790 -24.0790 -16.5108 -16.5108 -16.4575 -16.4575 -16.2572 -16.2572 -16.2004 -16.2004 5.0993 5.0993 5.1142 5.1142 9.1281 9.1281 9.1456 9.1456 10.3098 10.3098 10.3136 10.3136 12.1650 12.1650 12.2348 12.2348 13.5248 13.5248 13.6246 13.6246 14.7036 14.7036 k = 0.0617 0.2055 0.6603 ( 2864 PWs) bands (ev): -49.7657 -49.7657 -49.7657 -49.7657 -24.0783 -24.0783 -24.0780 -24.0780 -16.5092 -16.5092 -16.4602 -16.4602 -16.2494 -16.2494 -16.1971 -16.1971 5.0690 5.0690 5.0833 5.0833 9.0783 9.0783 9.0928 9.0928 10.3209 10.3209 10.3261 10.3261 12.2533 12.2533 12.3246 12.3246 13.5035 13.5035 13.6029 13.6029 14.6969 14.6969 k = 0.0566 0.1883 0.6603 ( 2872 PWs) bands (ev): -49.7660 -49.7660 -49.7660 -49.7660 -24.0773 -24.0773 -24.0770 -24.0770 -16.5076 -16.5076 -16.4628 -16.4628 -16.2419 -16.2419 -16.1940 -16.1940 5.0411 5.0411 5.0545 5.0545 9.0316 9.0316 9.0436 9.0436 10.3317 10.3317 10.3378 10.3378 12.3384 12.3384 12.4111 12.4111 13.4824 13.4824 13.5813 13.5813 14.6911 14.6911 k = 0.0514 0.1712 0.6603 ( 2876 PWs) bands (ev): -49.7663 -49.7663 -49.7663 -49.7663 -24.0764 -24.0764 -24.0761 -24.0761 -16.5060 -16.5060 -16.4654 -16.4654 -16.2348 -16.2348 -16.1913 -16.1913 5.0154 5.0154 5.0280 5.0280 8.9884 8.9884 8.9983 8.9983 10.3421 10.3421 10.3486 10.3486 12.4199 12.4199 12.4938 12.4938 13.4619 13.4619 13.5599 13.5599 14.6862 14.6862 k = 0.0463 0.1541 0.6603 ( 2872 PWs) bands (ev): -49.7666 -49.7666 -49.7666 -49.7666 -24.0754 -24.0754 -24.0751 -24.0751 -16.5043 -16.5043 -16.4679 -16.4679 -16.2280 -16.2280 -16.1890 -16.1890 4.9922 4.9922 5.0037 5.0037 8.9489 8.9489 8.9569 8.9569 10.3518 10.3518 10.3585 10.3585 12.4971 12.4971 12.5719 12.5719 13.4422 13.4422 13.5389 13.5389 14.6821 14.6821 k = 0.0411 0.1370 0.6603 ( 2872 PWs) bands (ev): -49.7668 -49.7668 -49.7668 -49.7668 -24.0746 -24.0746 -24.0743 -24.0743 -16.5026 -16.5026 -16.4704 -16.4704 -16.2216 -16.2216 -16.1870 -16.1870 4.9713 4.9713 4.9818 4.9818 8.9131 8.9131 8.9196 8.9196 10.3608 10.3608 10.3674 10.3674 12.5698 12.5698 12.6447 12.6447 13.4235 13.4235 13.5183 13.5183 14.6787 14.6787 k = 0.0360 0.1199 0.6603 ( 2868 PWs) bands (ev): -49.7670 -49.7670 -49.7670 -49.7670 -24.0738 -24.0738 -24.0736 -24.0736 -16.5009 -16.5009 -16.4728 -16.4728 -16.2157 -16.2157 -16.1855 -16.1855 4.9529 4.9529 4.9623 4.9623 8.8813 8.8813 8.8865 8.8865 10.3691 10.3691 10.3752 10.3752 12.6372 12.6372 12.7114 12.7114 13.4064 13.4064 13.4981 13.4981 14.6761 14.6761 k = 0.0309 0.1027 0.6603 ( 2872 PWs) bands (ev): -49.7672 -49.7672 -49.7672 -49.7672 -24.0732 -24.0732 -24.0730 -24.0730 -16.4992 -16.4992 -16.4751 -16.4751 -16.2103 -16.2103 -16.1844 -16.1844 4.9370 4.9370 4.9452 4.9452 8.8535 8.8535 8.8576 8.8576 10.3764 10.3764 10.3820 10.3820 12.6991 12.6991 12.7710 12.7710 13.3912 13.3912 13.4783 13.4783 14.6741 14.6741 k = 0.0257 0.0856 0.6603 ( 2874 PWs) bands (ev): -49.7674 -49.7674 -49.7674 -49.7674 -24.0727 -24.0727 -24.0725 -24.0725 -16.4975 -16.4975 -16.4775 -16.4775 -16.2054 -16.2054 -16.1838 -16.1838 4.9236 4.9236 4.9305 4.9305 8.8298 8.8298 8.8331 8.8331 10.3828 10.3828 10.3877 10.3877 12.7549 12.7549 12.8224 12.8224 13.3785 13.3785 13.4589 13.4589 14.6728 14.6728 k = 0.0206 0.0685 0.6603 ( 2882 PWs) bands (ev): -49.7675 -49.7675 -49.7675 -49.7675 -24.0723 -24.0723 -24.0721 -24.0721 -16.4957 -16.4957 -16.4797 -16.4797 -16.2010 -16.2010 -16.1838 -16.1838 4.9127 4.9127 4.9183 4.9183 8.8104 8.8104 8.8129 8.8129 10.3882 10.3882 10.3922 10.3922 12.8040 12.8040 12.8645 12.8645 13.3692 13.3692 13.4401 13.4401 14.6720 14.6720 k = 0.0154 0.0514 0.6603 ( 2874 PWs) bands (ev): -49.7676 -49.7676 -49.7676 -49.7676 -24.0718 -24.0718 -24.0717 -24.0717 -16.4939 -16.4939 -16.4819 -16.4819 -16.1969 -16.1969 -16.1840 -16.1840 4.9044 4.9044 4.9087 4.9087 8.7953 8.7953 8.7971 8.7971 10.3926 10.3926 10.3957 10.3957 12.8459 12.8459 12.8960 12.8960 13.3639 13.3639 13.4219 13.4219 14.6717 14.6717 k = 0.0103 0.0342 0.6603 ( 2858 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0714 -24.0714 -24.0714 -24.0714 -16.4918 -16.4918 -16.4839 -16.4839 -16.1934 -16.1934 -16.1848 -16.1848 4.8987 4.8987 4.9015 4.9015 8.7846 8.7846 8.7857 8.7857 10.3959 10.3959 10.3980 10.3980 12.8798 12.8798 12.9160 12.9160 13.3633 13.3633 13.4048 13.4048 14.6718 14.6718 k = 0.0051 0.0171 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4900 -16.4900 -16.4860 -16.4860 -16.1905 -16.1905 -16.1862 -16.1862 4.8956 4.8956 4.8970 4.8970 8.7782 8.7782 8.7788 8.7788 10.3981 10.3981 10.3992 10.3992 12.9048 12.9048 12.9239 12.9239 13.3677 13.3677 13.3894 13.3894 14.6724 14.6724 k = 0.0000 0.0000 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4880 -16.4880 -16.4880 -16.4880 -16.1881 -16.1881 -16.1881 -16.1881 4.8950 4.8950 4.8950 4.8950 8.7763 8.7763 8.7763 8.7763 10.3992 10.3992 10.3992 10.3992 12.9199 12.9199 12.9199 12.9199 13.3767 13.3767 13.3767 13.3767 14.6732 14.6733 k = 0.0000 0.0000 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4880 -16.4880 -16.4880 -16.4880 -16.1881 -16.1881 -16.1881 -16.1881 4.8950 4.8950 4.8950 4.8950 8.7763 8.7763 8.7763 8.7763 10.3992 10.3992 10.3992 10.3992 12.9199 12.9199 12.9199 12.9199 13.3767 13.3767 13.3767 13.3767 14.6732 14.6733 k = 0.0000 0.0000 0.6424 ( 2862 PWs) bands (ev): -49.7684 -49.7684 -49.7671 -49.7671 -24.0736 -24.0736 -24.0688 -24.0688 -16.4927 -16.4927 -16.4832 -16.4832 -16.1909 -16.1909 -16.1853 -16.1853 4.7894 4.7894 5.0017 5.0017 8.7295 8.7295 8.8217 8.8217 10.3876 10.3876 10.4125 10.4125 12.9055 12.9055 12.9335 12.9335 13.3292 13.3292 13.4262 13.4262 14.6627 14.6627 k = 0.0000 0.0000 0.6246 ( 2864 PWs) bands (ev): -49.7691 -49.7691 -49.7664 -49.7664 -24.0760 -24.0760 -24.0665 -24.0665 -16.4973 -16.4973 -16.4784 -16.4784 -16.1938 -16.1938 -16.1826 -16.1826 4.6852 4.6852 5.1094 5.1094 8.6820 8.6820 8.8653 8.8653 10.3782 10.3782 10.4269 10.4269 12.8909 12.8909 12.9451 12.9451 13.2859 13.2859 13.4758 13.4758 14.6540 14.6540 k = 0.0000 0.0000 0.6067 ( 2864 PWs) bands (ev): -49.7697 -49.7697 -49.7657 -49.7657 -24.0783 -24.0783 -24.0641 -24.0641 -16.5017 -16.5017 -16.4735 -16.4735 -16.1966 -16.1966 -16.1799 -16.1799 4.5825 4.5825 5.2178 5.2178 8.6343 8.6343 8.9064 8.9064 10.3717 10.3717 10.4421 10.4421 12.8761 12.8761 12.9526 12.9526 13.2501 13.2501 13.5245 13.5245 14.6467 14.6467 k = 0.0000 0.0000 0.5889 ( 2864 PWs) bands (ev): -49.7704 -49.7704 -49.7651 -49.7651 -24.0806 -24.0806 -24.0617 -24.0617 -16.5060 -16.5060 -16.4686 -16.4686 -16.1995 -16.1995 -16.1772 -16.1772 4.4814 4.4814 5.3268 5.3268 8.5868 8.5868 8.9445 8.9445 10.3686 10.3686 10.4575 10.4575 12.8605 12.8605 12.9535 12.9535 13.2259 13.2259 13.5713 13.5713 14.6407 14.6407 k = 0.0000 0.0000 0.5710 ( 2862 PWs) bands (ev): -49.7710 -49.7710 -49.7644 -49.7644 -24.0828 -24.0828 -24.0593 -24.0593 -16.5103 -16.5103 -16.4635 -16.4635 -16.2025 -16.2025 -16.1745 -16.1745 4.3822 4.3822 5.4359 5.4359 8.5401 8.5401 8.9790 8.9790 10.3695 10.3695 10.4729 10.4729 12.8426 12.8426 12.9470 12.9470 13.2161 13.2161 13.6153 13.6153 14.6355 14.6355 k = 0.0000 0.0000 0.5532 ( 2866 PWs) bands (ev): -49.7717 -49.7717 -49.7638 -49.7638 -24.0852 -24.0852 -24.0569 -24.0569 -16.5145 -16.5145 -16.4584 -16.4584 -16.2054 -16.2054 -16.1719 -16.1719 4.2849 4.2849 5.5449 5.5449 8.4947 8.4947 9.0093 9.0093 10.3750 10.3750 10.4880 10.4880 12.8203 12.8203 12.9357 12.9357 13.2209 13.2209 13.6558 13.6558 14.6307 14.6307 k = 0.0000 0.0000 0.5353 ( 2870 PWs) bands (ev): -49.7723 -49.7723 -49.7632 -49.7632 -24.0874 -24.0874 -24.0546 -24.0546 -16.5185 -16.5185 -16.4532 -16.4532 -16.2085 -16.2085 -16.1694 -16.1694 4.1896 4.1896 5.6534 5.6534 8.4511 8.4511 9.0350 9.0350 10.3857 10.3857 10.5024 10.5024 12.7919 12.7919 12.9245 12.9245 13.2374 13.2374 13.6924 13.6924 14.6259 14.6259 k = 0.0000 0.0000 0.5175 ( 2864 PWs) bands (ev): -49.7730 -49.7730 -49.7625 -49.7625 -24.0896 -24.0896 -24.0521 -24.0521 -16.5224 -16.5224 -16.4480 -16.4480 -16.2114 -16.2114 -16.1668 -16.1668 4.0965 4.0965 5.7610 5.7610 8.4098 8.4098 9.0559 9.0559 10.4018 10.4018 10.5159 10.5159 12.7578 12.7578 12.9169 12.9169 13.2625 13.2625 13.7246 13.7246 14.6206 14.6206 k = 0.0000 0.0000 0.4997 ( 2866 PWs) bands (ev): -49.7736 -49.7736 -49.7619 -49.7619 -24.0918 -24.0918 -24.0498 -24.0498 -16.5262 -16.5262 -16.4427 -16.4427 -16.2145 -16.2145 -16.1644 -16.1644 4.0056 4.0056 5.8671 5.8671 8.3715 8.3715 9.0716 9.0716 10.4237 10.4237 10.5283 10.5283 12.7195 12.7195 12.9137 12.9137 13.2936 13.2936 13.7519 13.7519 14.6143 14.6143 k = 0.0000 0.0000 0.4818 ( 2870 PWs) bands (ev): -49.7742 -49.7742 -49.7613 -49.7613 -24.0940 -24.0940 -24.0474 -24.0474 -16.5299 -16.5299 -16.4375 -16.4375 -16.2175 -16.2175 -16.1619 -16.1619 3.9170 3.9170 5.9711 5.9711 8.3368 8.3368 9.0823 9.0823 10.4514 10.4514 10.5394 10.5394 12.6794 12.6794 12.9147 12.9147 13.3292 13.3292 13.7744 13.7744 14.6065 14.6065 k = 0.0000 0.0000 0.4640 ( 2870 PWs) bands (ev): -49.7748 -49.7748 -49.7607 -49.7607 -24.0960 -24.0960 -24.0452 -24.0452 -16.5334 -16.5334 -16.4322 -16.4322 -16.2205 -16.2205 -16.1596 -16.1596 3.8310 3.8310 6.0725 6.0725 8.3065 8.3065 9.0880 9.0880 10.4846 10.4846 10.5493 10.5493 12.6391 12.6391 12.9192 12.9192 13.3683 13.3683 13.7918 13.7918 14.5967 14.5967 k = 0.0000 0.0000 0.4461 ( 2880 PWs) bands (ev): -49.7754 -49.7754 -49.7602 -49.7602 -24.0981 -24.0981 -24.0430 -24.0430 -16.5369 -16.5369 -16.4270 -16.4270 -16.2236 -16.2236 -16.1573 -16.1573 3.7474 3.7474 6.1704 6.1704 8.2813 8.2813 9.0892 9.0892 10.5223 10.5223 10.5585 10.5585 12.5998 12.5998 12.9269 12.9269 13.4100 13.4100 13.8043 13.8043 14.5844 14.5844 k = 0.0000 0.0000 0.4283 ( 2880 PWs) bands (ev): -49.7760 -49.7760 -49.7596 -49.7596 -24.1000 -24.1000 -24.0408 -24.0408 -16.5402 -16.5402 -16.4218 -16.4218 -16.2267 -16.2267 -16.1550 -16.1550 3.6665 3.6665 6.2639 6.2639 8.2621 8.2621 9.0862 9.0862 10.5544 10.5544 10.5766 10.5766 12.5624 12.5624 12.9376 12.9376 13.4537 13.4537 13.8122 13.8122 14.5692 14.5692 k = 0.0000 0.0000 0.4104 ( 2872 PWs) bands (ev): -49.7766 -49.7766 -49.7591 -49.7591 -24.1018 -24.1018 -24.0386 -24.0386 -16.5432 -16.5432 -16.4165 -16.4165 -16.2297 -16.2297 -16.1528 -16.1528 3.5883 3.5883 6.3521 6.3521 8.2499 8.2499 9.0796 9.0796 10.5631 10.5631 10.6208 10.6208 12.5275 12.5275 12.9509 12.9509 13.4987 13.4987 13.8160 13.8160 14.5506 14.5506 k = 0.0000 0.0000 0.3926 ( 2864 PWs) bands (ev): -49.7771 -49.7771 -49.7585 -49.7585 -24.1034 -24.1034 -24.0365 -24.0365 -16.5461 -16.5461 -16.4112 -16.4112 -16.2328 -16.2328 -16.1506 -16.1506 3.5128 3.5128 6.4339 6.4339 8.2456 8.2456 9.0699 9.0699 10.5657 10.5657 10.6733 10.6733 12.4954 12.4954 12.9667 12.9667 13.5437 13.5437 13.8168 13.8168 14.5284 14.5284 k = 0.0000 0.0000 0.3747 ( 2858 PWs) bands (ev): -49.7776 -49.7776 -49.7580 -49.7580 -24.1051 -24.1051 -24.0344 -24.0344 -16.5489 -16.5489 -16.4059 -16.4059 -16.2359 -16.2359 -16.1485 -16.1485 3.4402 3.4402 6.5084 6.5084 8.2501 8.2501 9.0576 9.0576 10.5656 10.5656 10.7301 10.7301 12.4664 12.4664 12.9849 12.9849 13.5869 13.5869 13.8166 13.8166 14.5021 14.5021 k = 0.0000 0.0000 0.3569 ( 2854 PWs) bands (ev): -49.7781 -49.7781 -49.7575 -49.7575 -24.1068 -24.1068 -24.0324 -24.0324 -16.5515 -16.5515 -16.4007 -16.4007 -16.2390 -16.2390 -16.1465 -16.1465 3.3705 3.3705 6.5748 6.5748 8.2642 8.2642 9.0434 9.0434 10.5630 10.5630 10.7903 10.7903 12.4409 12.4409 13.0052 13.0052 13.6245 13.6245 13.8191 13.8191 14.4718 14.4718 k = 0.0000 0.0000 0.3391 ( 2858 PWs) bands (ev): -49.7787 -49.7787 -49.7570 -49.7570 -24.1084 -24.1084 -24.0306 -24.0306 -16.5541 -16.5541 -16.3956 -16.3956 -16.2421 -16.2421 -16.1446 -16.1446 3.3038 3.3038 6.6323 6.6323 8.2884 8.2884 9.0278 9.0278 10.5579 10.5579 10.8534 10.8534 12.4189 12.4189 13.0277 13.0277 13.6503 13.6503 13.8307 13.8307 14.4371 14.4371 k = 0.0000 0.0000 0.3212 ( 2846 PWs) bands (ev): -49.7791 -49.7791 -49.7565 -49.7565 -24.1098 -24.1098 -24.0286 -24.0286 -16.5563 -16.5563 -16.3904 -16.3904 -16.2452 -16.2452 -16.1427 -16.1427 3.2401 3.2401 6.6806 6.6806 8.3229 8.3229 9.0112 9.0112 10.5504 10.5504 10.9189 10.9189 12.4004 12.4004 13.0520 13.0520 13.6589 13.6589 13.8570 13.8570 14.3983 14.3983 k = 0.0000 0.0000 0.3034 ( 2846 PWs) bands (ev): -49.7796 -49.7796 -49.7561 -49.7561 -24.1112 -24.1112 -24.0269 -24.0269 -16.5586 -16.5586 -16.3853 -16.3853 -16.2484 -16.2484 -16.1409 -16.1409 3.1795 3.1795 6.7198 6.7198 8.3673 8.3673 8.9942 8.9942 10.5405 10.5405 10.9863 10.9863 12.3856 12.3856 13.0779 13.0779 13.6515 13.6515 13.8969 13.8969 14.3553 14.3553 k = 0.0000 0.0000 0.2855 ( 2844 PWs) bands (ev): -49.7800 -49.7800 -49.7557 -49.7557 -24.1126 -24.1126 -24.0251 -24.0251 -16.5607 -16.5607 -16.3803 -16.3803 -16.2516 -16.2516 -16.1392 -16.1392 3.1221 3.1221 6.7503 6.7503 8.4209 8.4209 8.9773 8.9773 10.5281 10.5281 11.0552 11.0552 12.3742 12.3742 13.1050 13.1050 13.6338 13.6338 13.9454 13.9454 14.3085 14.3085 k = 0.0000 0.0000 0.2677 ( 2846 PWs) bands (ev): -49.7804 -49.7804 -49.7553 -49.7553 -24.1139 -24.1139 -24.0235 -24.0235 -16.5628 -16.5628 -16.3753 -16.3753 -16.2549 -16.2549 -16.1376 -16.1376 3.0679 3.0679 6.7730 6.7730 8.4823 8.4823 8.9612 8.9612 10.5131 10.5131 11.1252 11.1252 12.3664 12.3664 13.1327 13.1327 13.6099 13.6099 13.9984 13.9984 14.2582 14.2582 k = 0.0000 0.0000 0.2498 ( 2842 PWs) bands (ev): -49.7808 -49.7808 -49.7549 -49.7549 -24.1151 -24.1151 -24.0220 -24.0220 -16.5646 -16.5646 -16.3704 -16.3704 -16.2581 -16.2581 -16.1360 -16.1360 3.0169 3.0169 6.7889 6.7889 8.5497 8.5497 8.9467 8.9467 10.4958 10.4958 11.1960 11.1960 12.3618 12.3618 13.1603 13.1603 13.5829 13.5829 14.0537 14.0537 14.2049 14.2049 k = 0.0000 0.0000 0.2320 ( 2846 PWs) bands (ev): -49.7812 -49.7812 -49.7545 -49.7545 -24.1163 -24.1163 -24.0206 -24.0206 -16.5663 -16.5663 -16.3656 -16.3656 -16.2614 -16.2614 -16.1346 -16.1346 2.9693 2.9693 6.7990 6.7990 8.6204 8.6204 8.9354 8.9354 10.4759 10.4759 11.2670 11.2670 12.3604 12.3604 13.1862 13.1862 13.5554 13.5554 14.1095 14.1095 14.1495 14.1495 k = 0.0000 0.0000 0.2141 ( 2858 PWs) bands (ev): -49.7816 -49.7816 -49.7542 -49.7542 -24.1175 -24.1175 -24.0194 -24.0194 -16.5680 -16.5680 -16.3609 -16.3609 -16.2648 -16.2648 -16.1333 -16.1333 2.9250 2.9250 6.8044 6.8044 8.6899 8.6899 8.9306 8.9306 10.4535 10.4535 11.3380 11.3380 12.3619 12.3619 13.2082 13.2082 13.5305 13.5305 14.0910 14.0910 14.1666 14.1666 k = 0.0000 0.0000 0.1963 ( 2860 PWs) bands (ev): -49.7819 -49.7819 -49.7539 -49.7539 -24.1184 -24.1184 -24.0182 -24.0182 -16.5695 -16.5695 -16.3562 -16.3562 -16.2681 -16.2681 -16.1321 -16.1321 2.8840 2.8840 6.8062 6.8062 8.7491 8.7491 8.9403 8.9403 10.4288 10.4288 11.4084 11.4084 12.3660 12.3660 13.2227 13.2227 13.5122 13.5122 14.0328 14.0328 14.2214 14.2214 k = 0.0000 0.0000 0.1784 ( 2860 PWs) bands (ev): -49.7822 -49.7822 -49.7536 -49.7536 -24.1193 -24.1193 -24.0171 -24.0171 -16.5708 -16.5708 -16.3516 -16.3516 -16.2714 -16.2714 -16.1310 -16.1310 2.8466 2.8466 6.8053 6.8053 8.7854 8.7854 8.9758 8.9758 10.4016 10.4016 11.4777 11.4777 12.3725 12.3725 13.2257 13.2257 13.5048 13.5048 13.9747 13.9747 14.2738 14.2738 k = 0.0000 0.0000 0.1606 ( 2866 PWs) bands (ev): -49.7825 -49.7825 -49.7534 -49.7534 -24.1202 -24.1202 -24.0161 -24.0161 -16.5721 -16.5721 -16.3470 -16.3470 -16.2749 -16.2749 -16.1299 -16.1299 2.8125 2.8125 6.8025 6.8025 8.7976 8.7976 9.0371 9.0371 10.3721 10.3721 11.5454 11.5454 12.3810 12.3810 13.2149 13.2149 13.5107 13.5107 13.9182 13.9182 14.3217 14.3217 k = 0.0000 0.0000 0.1428 ( 2868 PWs) bands (ev): -49.7827 -49.7827 -49.7532 -49.7532 -24.1210 -24.1210 -24.0151 -24.0151 -16.5732 -16.5732 -16.3426 -16.3426 -16.2783 -16.2783 -16.1290 -16.1290 2.7820 2.7820 6.7985 6.7985 8.7973 8.7973 9.1116 9.1116 10.3404 10.3404 11.6108 11.6108 12.3911 12.3911 13.1923 13.1923 13.5277 13.5277 13.8652 13.8652 14.3606 14.3606 k = 0.0000 0.0000 0.1249 ( 2868 PWs) bands (ev): -49.7829 -49.7829 -49.7530 -49.7530 -24.1217 -24.1217 -24.0143 -24.0143 -16.5741 -16.5741 -16.3382 -16.3382 -16.2818 -16.2818 -16.1281 -16.1281 2.7550 2.7550 6.7938 6.7938 8.7922 8.7922 9.1903 9.1903 10.3067 10.3067 11.6731 11.6731 12.4023 12.4023 13.1618 13.1618 13.5505 13.5505 13.8187 13.8187 14.3800 14.3800 k = 0.0000 0.0000 0.1071 ( 2860 PWs) bands (ev): -49.7831 -49.7831 -49.7528 -49.7528 -24.1222 -24.1222 -24.0134 -24.0134 -16.5749 -16.5749 -16.3339 -16.3339 -16.2852 -16.2852 -16.1272 -16.1272 2.7316 2.7316 6.7890 6.7890 8.7857 8.7857 9.2687 9.2687 10.2715 10.2715 11.7314 11.7314 12.4142 12.4142 13.1275 13.1275 13.5720 13.5720 13.7835 13.7835 14.3659 14.3659 k = 0.0000 0.0000 0.0892 ( 2867 PWs) bands (ev): -49.7832 -49.7832 -49.7527 -49.7527 -24.1228 -24.1228 -24.0129 -24.0129 -16.5756 -16.5756 -16.3298 -16.3298 -16.2888 -16.2888 -16.1267 -16.1267 2.7117 2.7117 6.7843 6.7843 8.7792 8.7792 9.3438 9.3438 10.2354 10.2354 11.7845 11.7845 12.4261 12.4261 13.0926 13.0926 13.5832 13.5832 13.7675 13.7675 14.3251 14.3251 k = 0.0000 0.0000 0.0714 ( 2871 PWs) bands (ev): -49.7834 -49.7834 -49.7525 -49.7525 -24.1232 -24.1232 -24.0123 -24.0123 -16.5762 -16.5762 -16.3258 -16.3258 -16.2923 -16.2923 -16.1261 -16.1261 2.6954 2.6954 6.7801 6.7801 8.7734 8.7734 9.4131 9.4131 10.1995 10.1995 11.8311 11.8311 12.4373 12.4373 13.0597 13.0597 13.5786 13.5786 13.7751 13.7751 14.2747 14.2747 k = 0.0000 0.0000 0.0535 ( 2871 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1235 -24.1235 -24.0119 -24.0119 -16.5766 -16.5766 -16.3219 -16.3219 -16.2957 -16.2957 -16.1257 -16.1257 2.6827 2.6827 6.7766 6.7766 8.7686 8.7686 9.4737 9.4737 10.1659 10.1659 11.8697 11.8697 12.4472 12.4472 13.0310 13.0310 13.5643 13.5643 13.7996 13.7996 14.2240 14.2240 k = 0.0000 0.0000 0.0357 ( 2875 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1238 -24.1238 -24.0117 -24.0117 -16.5770 -16.5770 -16.3184 -16.3184 -16.2989 -16.2989 -16.1255 -16.1255 2.6737 2.6737 6.7740 6.7740 8.7651 8.7651 9.5221 9.5221 10.1373 10.1373 11.8988 11.8988 12.4549 12.4549 13.0086 13.0086 13.5490 13.5490 13.8296 13.8296 14.1785 14.1785 k = 0.0000 0.0000 0.0178 ( 2879 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1240 -24.1240 -24.0116 -24.0116 -16.5772 -16.5772 -16.3155 -16.3155 -16.3017 -16.3017 -16.1253 -16.1253 2.6682 2.6682 6.7724 6.7724 8.7629 8.7629 9.5539 9.5539 10.1175 10.1175 11.9170 11.9170 12.4599 12.4599 12.9944 12.9944 13.5383 13.5383 13.8550 13.8550 14.1449 14.1449 k = 0.0000 0.0000 0.0000 ( 2869 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1239 -24.1239 -24.0115 -24.0115 -16.5771 -16.5771 -16.3142 -16.3142 -16.3028 -16.3028 -16.1253 -16.1253 2.6664 2.6664 6.7719 6.7719 8.7622 8.7622 9.5651 9.5651 10.1103 10.1103 11.9232 11.9232 12.4616 12.4616 12.9894 12.9894 13.5345 13.5345 13.8653 13.8653 14.1320 14.1320 k = 0.0000 0.0000 0.0000 ( 2869 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1239 -24.1239 -24.0115 -24.0115 -16.5771 -16.5771 -16.3142 -16.3142 -16.3028 -16.3028 -16.1253 -16.1253 2.6664 2.6664 6.7719 6.7719 8.7622 8.7622 9.5651 9.5651 10.1103 10.1103 11.9232 11.9232 12.4616 12.4616 12.9894 12.9894 13.5345 13.5345 13.8653 13.8653 14.1320 14.1320 k =-0.0167 0.0050-0.0000 ( 2875 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1239 -24.1239 -24.0115 -24.0115 -16.5772 -16.5772 -16.3142 -16.3142 -16.3029 -16.3029 -16.1253 -16.1253 2.6681 2.6681 6.7676 6.7676 8.7598 8.7598 9.5700 9.5700 10.1093 10.1093 11.9210 11.9210 12.4603 12.4603 12.9936 12.9936 13.5377 13.5377 13.8662 13.8662 14.1317 14.1317 k =-0.0333 0.0100-0.0000 ( 2871 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1238 -24.1238 -24.0115 -24.0115 -16.5770 -16.5770 -16.3142 -16.3142 -16.3030 -16.3030 -16.1253 -16.1253 2.6733 2.6733 6.7547 6.7547 8.7529 8.7529 9.5842 9.5842 10.1063 10.1063 11.9146 11.9146 12.4565 12.4565 13.0057 13.0057 13.5471 13.5471 13.8691 13.8691 14.1307 14.1307 k =-0.0500 0.0150-0.0000 ( 2867 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1237 -24.1237 -24.0116 -24.0116 -16.5768 -16.5768 -16.3141 -16.3141 -16.3032 -16.3032 -16.1254 -16.1254 2.6819 2.6819 6.7333 6.7333 8.7427 8.7427 9.6067 9.6067 10.1014 10.1014 11.9040 11.9040 12.4506 12.4506 13.0255 13.0255 13.5622 13.5622 13.8739 13.8739 14.1290 14.1290 k =-0.0667 0.0200-0.0000 ( 2867 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1237 -24.1237 -24.0116 -24.0116 -16.5765 -16.5765 -16.3142 -16.3142 -16.3034 -16.3034 -16.1254 -16.1254 2.6938 2.6938 6.7036 6.7036 8.7305 8.7305 9.6358 9.6358 10.0946 10.0946 11.8895 11.8895 12.4431 12.4431 13.0523 13.0523 13.5820 13.5820 13.8810 13.8810 14.1268 14.1268 k =-0.0833 0.0250-0.0000 ( 2867 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1236 -24.1236 -24.0117 -24.0117 -16.5762 -16.5762 -16.3142 -16.3142 -16.3038 -16.3038 -16.1255 -16.1255 2.7092 2.7092 6.6658 6.6658 8.7181 8.7181 9.6698 9.6698 10.0860 10.0860 11.8713 11.8713 12.4345 12.4345 13.0853 13.0853 13.6053 13.6053 13.8906 13.8906 14.1239 14.1239 k =-0.1000 0.0300-0.0000 ( 2857 PWs) bands (ev): -49.7836 -49.7836 -49.7523 -49.7523 -24.1235 -24.1235 -24.0117 -24.0117 -16.5757 -16.5757 -16.3142 -16.3142 -16.3041 -16.3041 -16.1255 -16.1255 2.7280 2.7280 6.6200 6.6200 8.7068 8.7068 9.7069 9.7069 10.0760 10.0760 11.8496 11.8496 12.4253 12.4253 13.1239 13.1239 13.6305 13.6305 13.9031 13.9031 14.1206 14.1206 k =-0.1167 0.0350-0.0000 ( 2851 PWs) bands (ev): -49.7835 -49.7835 -49.7523 -49.7523 -24.1233 -24.1233 -24.0117 -24.0117 -16.5753 -16.5753 -16.3142 -16.3142 -16.3044 -16.3044 -16.1256 -16.1256 2.7501 2.7501 6.5668 6.5668 8.6977 8.6977 9.7456 9.7456 10.0646 10.0646 11.8247 11.8247 12.4159 12.4159 13.1672 13.1672 13.6560 13.6560 13.9184 13.9184 14.1168 14.1168 k =-0.1333 0.0400-0.0000 ( 2853 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1232 -24.1232 -24.0119 -24.0119 -16.5747 -16.5747 -16.3143 -16.3143 -16.3050 -16.3050 -16.1257 -16.1257 2.7754 2.7754 6.5066 6.5066 8.6918 8.6918 9.7847 9.7847 10.0520 10.0520 11.7965 11.7965 12.4066 12.4066 13.2147 13.2147 13.6801 13.6801 13.9364 13.9364 14.1128 14.1128 k =-0.1500 0.0451-0.0000 ( 2849 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1231 -24.1231 -24.0120 -24.0120 -16.5741 -16.5741 -16.3143 -16.3143 -16.3054 -16.3054 -16.1259 -16.1259 2.8040 2.8040 6.4400 6.4400 8.6896 8.6896 9.8229 9.8229 10.0386 10.0386 11.7654 11.7654 12.3977 12.3977 13.2655 13.2655 13.7018 13.7018 13.9562 13.9562 14.1087 14.1087 k =-0.1667 0.0501-0.0000 ( 2845 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1228 -24.1228 -24.0121 -24.0121 -16.5734 -16.5734 -16.3145 -16.3145 -16.3059 -16.3059 -16.1260 -16.1260 2.8358 2.8358 6.3675 6.3675 8.6914 8.6914 9.8595 9.8595 10.0249 10.0249 11.7312 11.7312 12.3894 12.3894 13.3190 13.3190 13.7205 13.7205 13.9762 13.9762 14.1047 14.1047 k =-0.1833 0.0551-0.0000 ( 2845 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1227 -24.1227 -24.0123 -24.0123 -16.5728 -16.5728 -16.3146 -16.3146 -16.3065 -16.3065 -16.1262 -16.1262 2.8707 2.8707 6.2899 6.2899 8.6974 8.6974 9.8931 9.8931 10.0114 10.0114 11.6940 11.6940 12.3816 12.3816 13.3743 13.3743 13.7364 13.7364 13.9944 13.9944 14.1011 14.1011 k =-0.2000 0.0601-0.0000 ( 2833 PWs) bands (ev): -49.7835 -49.7835 -49.7524 -49.7524 -24.1224 -24.1224 -24.0124 -24.0124 -16.5720 -16.5720 -16.3148 -16.3148 -16.3069 -16.3069 -16.1263 -16.1263 2.9085 2.9085 6.2078 6.2078 8.7076 8.7076 9.9219 9.9219 9.9999 9.9999 11.6539 11.6539 12.3745 12.3745 13.4305 13.4305 13.7501 13.7501 14.0089 14.0089 14.0980 14.0980 k =-0.2167 0.0651-0.0000 ( 2827 PWs) bands (ev): -49.7834 -49.7834 -49.7524 -49.7524 -24.1222 -24.1222 -24.0125 -24.0125 -16.5712 -16.5712 -16.3151 -16.3151 -16.3073 -16.3073 -16.1265 -16.1265 2.9493 2.9493 6.1220 6.1220 8.7217 8.7217 9.9403 9.9403 9.9961 9.9961 11.6109 11.6109 12.3681 12.3681 13.4860 13.4860 13.7629 13.7629 14.0191 14.0191 14.0954 14.0954 k =-0.2333 0.0701-0.0000 ( 2829 PWs) bands (ev): -49.7834 -49.7834 -49.7524 -49.7524 -24.1221 -24.1221 -24.0127 -24.0127 -16.5705 -16.5705 -16.3154 -16.3154 -16.3077 -16.3077 -16.1267 -16.1267 2.9929 2.9929 6.0331 6.0331 8.7395 8.7395 9.9409 9.9409 10.0073 10.0073 11.5650 11.5650 12.3623 12.3623 13.5387 13.5387 13.7767 13.7767 14.0254 14.0254 14.0928 14.0928 k =-0.2500 0.0751-0.0000 ( 2837 PWs) bands (ev): -49.7834 -49.7834 -49.7524 -49.7524 -24.1220 -24.1220 -24.0129 -24.0129 -16.5697 -16.5697 -16.3159 -16.3159 -16.3081 -16.3081 -16.1269 -16.1269 3.0391 3.0391 5.9418 5.9418 8.7608 8.7608 9.9307 9.9307 10.0266 10.0266 11.5163 11.5163 12.3572 12.3572 13.5853 13.5853 13.7946 13.7946 14.0291 14.0291 14.0902 14.0902 k =-0.2667 0.0801-0.0000 ( 2831 PWs) bands (ev): -49.7834 -49.7834 -49.7525 -49.7525 -24.1217 -24.1217 -24.0131 -24.0131 -16.5689 -16.5689 -16.3164 -16.3164 -16.3084 -16.3084 -16.1271 -16.1271 3.0878 3.0878 5.8488 5.8488 8.7851 8.7851 9.9173 9.9173 10.0467 10.0467 11.4653 11.4653 12.3527 12.3527 13.6221 13.6221 13.8200 13.8200 14.0318 14.0318 14.0875 14.0875 k =-0.2833 0.0851-0.0000 ( 2835 PWs) bands (ev): -49.7834 -49.7834 -49.7525 -49.7525 -24.1216 -24.1216 -24.0133 -24.0133 -16.5682 -16.5682 -16.3170 -16.3170 -16.3086 -16.3086 -16.1273 -16.1273 3.1387 3.1387 5.7549 5.7549 8.8120 8.8120 9.9031 9.9031 10.0654 10.0654 11.4121 11.4121 12.3488 12.3488 13.6468 13.6468 13.8545 13.8545 14.0346 14.0346 14.0855 14.0855 k =-0.3000 0.0901-0.0000 ( 2830 PWs) bands (ev): -49.7833 -49.7833 -49.7525 -49.7525 -24.1213 -24.1213 -24.0135 -24.0135 -16.5673 -16.5673 -16.3176 -16.3176 -16.3088 -16.3088 -16.1275 -16.1275 3.1917 3.1917 5.6606 5.6606 8.8412 8.8412 9.8889 9.8889 10.0823 10.0823 11.3573 11.3573 12.3454 12.3454 13.6610 13.6610 13.8951 13.8951 14.0385 14.0385 14.0857 14.0857 k =-0.3167 0.0951-0.0000 ( 2842 PWs) bands (ev): -49.7833 -49.7833 -49.7525 -49.7525 -24.1212 -24.1212 -24.0138 -24.0138 -16.5666 -16.5666 -16.3184 -16.3184 -16.3089 -16.3089 -16.1278 -16.1278 3.2464 3.2464 5.5667 5.5667 8.8719 8.8719 9.8753 9.8753 10.0973 10.0973 11.3015 11.3015 12.3426 12.3426 13.6680 13.6680 13.9355 13.9355 14.0434 14.0434 14.0912 14.0912 k =-0.3333 0.1001-0.0000 ( 2842 PWs) bands (ev): -49.7833 -49.7833 -49.7525 -49.7525 -24.1210 -24.1210 -24.0140 -24.0140 -16.5659 -16.5659 -16.3191 -16.3191 -16.3090 -16.3090 -16.1280 -16.1280 3.3024 3.3024 5.4739 5.4739 8.9038 8.9038 9.8623 9.8623 10.1105 10.1105 11.2454 11.2454 12.3401 12.3401 13.6709 13.6709 13.9686 13.9686 14.0477 14.0477 14.1079 14.1079 k =-0.3500 0.1051-0.0000 ( 2850 PWs) bands (ev): -49.7833 -49.7833 -49.7525 -49.7525 -24.1210 -24.1210 -24.0142 -24.0142 -16.5653 -16.5653 -16.3198 -16.3198 -16.3091 -16.3091 -16.1282 -16.1282 3.3592 3.3592 5.3829 5.3829 8.9361 8.9361 9.8501 9.8501 10.1221 10.1221 11.1898 11.1898 12.3381 12.3381 13.6716 13.6716 13.9902 13.9902 14.0502 14.0502 14.1387 14.1387 k =-0.3667 0.1101-0.0000 ( 2848 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1209 -24.1209 -24.0144 -24.0144 -16.5647 -16.5647 -16.3204 -16.3204 -16.3091 -16.3091 -16.1283 -16.1283 3.4162 3.4162 5.2947 5.2947 8.9682 8.9682 9.8390 9.8390 10.1322 10.1322 11.1356 11.1356 12.3364 12.3364 13.6712 13.6712 14.0026 14.0026 14.0516 14.0516 14.1789 14.1789 k =-0.3833 0.1151-0.0000 ( 2852 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1208 -24.1208 -24.0145 -24.0145 -16.5641 -16.5641 -16.3210 -16.3210 -16.3092 -16.3092 -16.1285 -16.1285 3.4726 3.4726 5.2102 5.2102 8.9994 8.9994 9.8289 9.8289 10.1410 10.1410 11.0838 11.0838 12.3351 12.3351 13.6703 13.6703 14.0095 14.0095 14.0529 14.0529 14.2224 14.2224 k =-0.4000 0.1201-0.0000 ( 2852 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1207 -24.1207 -24.0146 -24.0146 -16.5635 -16.5635 -16.3215 -16.3215 -16.3093 -16.3093 -16.1286 -16.1286 3.5274 3.5274 5.1308 5.1308 9.0288 9.0288 9.8200 9.8200 10.1487 10.1487 11.0355 11.0355 12.3339 12.3339 13.6693 13.6693 14.0132 14.0132 14.0546 14.0546 14.2648 14.2648 k =-0.4167 0.1251-0.0000 ( 2848 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1205 -24.1205 -24.0148 -24.0148 -16.5630 -16.5630 -16.3220 -16.3220 -16.3092 -16.3092 -16.1287 -16.1287 3.5793 3.5793 5.0578 5.0578 9.0557 9.0557 9.8124 9.8124 10.1553 10.1553 10.9918 10.9918 12.3331 12.3331 13.6684 13.6684 14.0152 14.0152 14.0566 14.0566 14.3038 14.3038 k =-0.4333 0.1301 0.0000 ( 2852 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1205 -24.1205 -24.0149 -24.0149 -16.5627 -16.5627 -16.3224 -16.3224 -16.3093 -16.3093 -16.1288 -16.1288 3.6264 3.6264 4.9932 4.9932 9.0792 9.0792 9.8061 9.8061 10.1609 10.1609 10.9539 10.9539 12.3324 12.3324 13.6676 13.6676 14.0161 14.0161 14.0588 14.0588 14.3376 14.3376 k =-0.4500 0.1352-0.0000 ( 2852 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1204 -24.1204 -24.0149 -24.0149 -16.5624 -16.5624 -16.3226 -16.3226 -16.3093 -16.3093 -16.1289 -16.1289 3.6668 3.6668 4.9392 4.9392 9.0985 9.0985 9.8011 9.8011 10.1654 10.1654 10.9228 10.9228 12.3319 12.3319 13.6670 13.6670 14.0164 14.0164 14.0608 14.0608 14.3651 14.3651 k =-0.4667 0.1402-0.0000 ( 2856 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1204 -24.1204 -24.0150 -24.0150 -16.5622 -16.5622 -16.3229 -16.3229 -16.3093 -16.3093 -16.1289 -16.1289 3.6982 3.6982 4.8980 4.8980 9.1129 9.1129 9.7975 9.7975 10.1687 10.1687 10.8998 10.8998 12.3316 12.3316 13.6666 13.6666 14.0165 14.0165 14.0624 14.0624 14.3854 14.3854 k =-0.4833 0.1452-0.0000 ( 2856 PWs) bands (ev): -49.7833 -49.7833 -49.7526 -49.7526 -24.1204 -24.1204 -24.0151 -24.0151 -16.5621 -16.5621 -16.3231 -16.3231 -16.3093 -16.3093 -16.1290 -16.1290 3.7182 3.7182 4.8721 4.8721 9.1218 9.1218 9.7954 9.7954 10.1708 10.1708 10.8856 10.8856 12.3314 12.3314 13.6663 13.6663 14.0165 14.0165 14.0634 14.0634 14.3978 14.3978 k =-0.5000 0.1502-0.0000 ( 2856 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1204 -24.1204 -24.0151 -24.0151 -16.5620 -16.5620 -16.3231 -16.3231 -16.3093 -16.3093 -16.1290 -16.1290 3.7251 3.7251 4.8632 4.8632 9.1248 9.1248 9.7947 9.7947 10.1715 10.1715 10.8808 10.8808 12.3313 12.3313 13.6662 13.6662 14.0165 14.0165 14.0637 14.0637 14.4020 14.4020 k =-0.5000 0.1502-0.0000 ( 2856 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1204 -24.1204 -24.0151 -24.0151 -16.5620 -16.5620 -16.3231 -16.3231 -16.3093 -16.3093 -16.1290 -16.1290 3.7251 3.7251 4.8632 4.8632 9.1248 9.1248 9.7947 9.7947 10.1715 10.1715 10.8808 10.8808 12.3313 12.3313 13.6662 13.6662 14.0165 14.0165 14.0637 14.0637 14.4020 14.4020 k =-0.4948 0.1674-0.0000 ( 2858 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1204 -24.1204 -24.0151 -24.0151 -16.5619 -16.5619 -16.3237 -16.3237 -16.3090 -16.3090 -16.1293 -16.1293 3.7264 3.7264 4.8653 4.8653 9.1261 9.1261 9.7946 9.7946 10.1727 10.1727 10.8822 10.8822 12.3298 12.3298 13.6643 13.6643 14.0139 14.0139 14.0618 14.0618 14.3966 14.3966 k =-0.4897 0.1846-0.0000 ( 2860 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1205 -24.1205 -24.0154 -24.0154 -16.5616 -16.5616 -16.3253 -16.3253 -16.3082 -16.3082 -16.1304 -16.1304 3.7303 3.7303 4.8713 4.8713 9.1299 9.1299 9.7944 9.7944 10.1764 10.1764 10.8865 10.8865 12.3254 12.3254 13.6584 13.6584 14.0058 14.0058 14.0570 14.0570 14.3807 14.3807 k =-0.4845 0.2018-0.0000 ( 2852 PWs) bands (ev): -49.7830 -49.7830 -49.7525 -49.7525 -24.1204 -24.1204 -24.0158 -24.0158 -16.5611 -16.5611 -16.3276 -16.3276 -16.3070 -16.3070 -16.1319 -16.1319 3.7369 3.7369 4.8815 4.8815 9.1363 9.1363 9.7941 9.7941 10.1824 10.1824 10.8935 10.8935 12.3179 12.3179 13.6475 13.6475 13.9913 13.9913 14.0513 14.0513 14.3558 14.3558 k =-0.4793 0.2190-0.0000 ( 2848 PWs) bands (ev): -49.7829 -49.7829 -49.7525 -49.7525 -24.1206 -24.1206 -24.0163 -24.0163 -16.5604 -16.5604 -16.3304 -16.3304 -16.3059 -16.3059 -16.1342 -16.1342 3.7462 3.7462 4.8957 4.8957 9.1452 9.1452 9.7937 9.7937 10.1905 10.1905 10.9032 10.9032 12.3073 12.3073 13.6302 13.6302 13.9706 13.9706 14.0464 14.0464 14.3236 14.3236 k =-0.4742 0.2362-0.0000 ( 2836 PWs) bands (ev): -49.7827 -49.7827 -49.7524 -49.7524 -24.1207 -24.1207 -24.0170 -24.0170 -16.5594 -16.5594 -16.3337 -16.3337 -16.3047 -16.3047 -16.1369 -16.1369 3.7580 3.7580 4.9139 4.9139 9.1567 9.1567 9.7930 9.7930 10.2006 10.2006 10.9156 10.9156 12.2934 12.2934 13.6049 13.6049 13.9456 13.9456 14.0430 14.0430 14.2862 14.2862 k =-0.4690 0.2534-0.0000 ( 2844 PWs) bands (ev): -49.7824 -49.7824 -49.7524 -49.7524 -24.1210 -24.1210 -24.0179 -24.0179 -16.5584 -16.5584 -16.3374 -16.3374 -16.3037 -16.3037 -16.1405 -16.1405 3.7725 3.7725 4.9360 4.9360 9.1707 9.1707 9.7922 9.7922 10.2124 10.2124 10.9303 10.9303 12.2760 12.2760 13.5695 13.5695 13.9186 13.9186 14.0413 14.0413 14.2454 14.2454 k =-0.4638 0.2707-0.0000 ( 2844 PWs) bands (ev): -49.7821 -49.7821 -49.7523 -49.7523 -24.1213 -24.1213 -24.0189 -24.0189 -16.5572 -16.5572 -16.3415 -16.3415 -16.3028 -16.3028 -16.1445 -16.1445 3.7895 3.7895 4.9622 4.9622 9.1872 9.1872 9.7912 9.7912 10.2254 10.2254 10.9474 10.9474 12.2551 12.2551 13.5230 13.5230 13.8917 13.8917 14.0416 14.0416 14.2030 14.2030 k =-0.4586 0.2879-0.0000 ( 2846 PWs) bands (ev): -49.7818 -49.7818 -49.7522 -49.7522 -24.1216 -24.1216 -24.0201 -24.0201 -16.5558 -16.5558 -16.3459 -16.3459 -16.3021 -16.3021 -16.1492 -16.1492 3.8091 3.8091 4.9922 4.9922 9.2062 9.2062 9.7900 9.7900 10.2393 10.2393 10.9665 10.9665 12.2305 12.2305 13.4651 13.4651 13.8658 13.8658 14.0436 14.0436 14.1604 14.1604 k =-0.4535 0.3051-0.0000 ( 2846 PWs) bands (ev): -49.7814 -49.7814 -49.7521 -49.7521 -24.1220 -24.1220 -24.0215 -24.0215 -16.5542 -16.5542 -16.3506 -16.3506 -16.3014 -16.3014 -16.1544 -16.1544 3.8313 3.8313 5.0261 5.0261 9.2278 9.2278 9.7885 9.7885 10.2533 10.2533 10.9874 10.9874 12.2020 12.2020 13.3966 13.3966 13.8412 13.8412 14.0468 14.0468 14.1182 14.1182 k =-0.4483 0.3223-0.0000 ( 2846 PWs) bands (ev): -49.7810 -49.7810 -49.7520 -49.7520 -24.1224 -24.1224 -24.0229 -24.0229 -16.5524 -16.5524 -16.3557 -16.3557 -16.3008 -16.3008 -16.1601 -16.1601 3.8560 3.8560 5.0638 5.0638 9.2518 9.2518 9.7867 9.7867 10.2669 10.2669 11.0097 11.0097 12.1697 12.1697 13.3193 13.3193 13.8177 13.8177 14.0498 14.0498 14.0767 14.0767 k =-0.4431 0.3395-0.0000 ( 2842 PWs) bands (ev): -49.7805 -49.7805 -49.7518 -49.7518 -24.1228 -24.1228 -24.0244 -24.0244 -16.5505 -16.5505 -16.3609 -16.3609 -16.3004 -16.3004 -16.1662 -16.1662 3.8832 3.8832 5.1053 5.1053 9.2784 9.2784 9.7846 9.7846 10.2793 10.2793 11.0331 11.0331 12.1334 12.1334 13.2349 13.2349 13.7948 13.7948 14.0344 14.0344 14.0503 14.0503 k =-0.4380 0.3567-0.0000 ( 2842 PWs) bands (ev): -49.7800 -49.7800 -49.7517 -49.7517 -24.1233 -24.1233 -24.0262 -24.0262 -16.5484 -16.5484 -16.3665 -16.3665 -16.3001 -16.3001 -16.1728 -16.1728 3.9129 3.9129 5.1504 5.1504 9.3073 9.3073 9.7822 9.7822 10.2896 10.2896 11.0571 11.0571 12.0933 12.0933 13.1453 13.1453 13.7724 13.7724 13.9889 13.9889 14.0446 14.0446 k =-0.4328 0.3739-0.0000 ( 2858 PWs) bands (ev): -49.7795 -49.7795 -49.7516 -49.7516 -24.1239 -24.1239 -24.0282 -24.0282 -16.5463 -16.5463 -16.3723 -16.3723 -16.3001 -16.3001 -16.1801 -16.1801 3.9450 3.9450 5.1992 5.1992 9.3388 9.3388 9.7794 9.7794 10.2968 10.2968 11.0813 11.0813 12.0496 12.0496 13.0525 13.0525 13.7499 13.7499 13.9366 13.9366 14.0321 14.0321 k =-0.4276 0.3911-0.0000 ( 2852 PWs) bands (ev): -49.7789 -49.7789 -49.7514 -49.7514 -24.1244 -24.1244 -24.0301 -24.0301 -16.5440 -16.5440 -16.3783 -16.3783 -16.3000 -16.3000 -16.1875 -16.1875 3.9795 3.9795 5.2516 5.2516 9.3726 9.3726 9.7763 9.7763 10.2997 10.2997 11.1049 11.1049 12.0024 12.0024 12.9582 12.9582 13.7267 13.7267 13.8779 13.8779 14.0167 14.0167 k =-0.4225 0.4083-0.0000 ( 2852 PWs) bands (ev): -49.7783 -49.7783 -49.7513 -49.7513 -24.1249 -24.1249 -24.0322 -24.0322 -16.5415 -16.5415 -16.3844 -16.3844 -16.3000 -16.3000 -16.1953 -16.1953 4.0163 4.0163 5.3074 5.3074 9.4089 9.4089 9.7727 9.7727 10.2972 10.2972 11.1274 11.1274 11.9521 11.9521 12.8641 12.8641 13.7007 13.7007 13.8184 13.8184 14.0032 14.0032 k =-0.4173 0.4256-0.0000 ( 2852 PWs) bands (ev): -49.7777 -49.7777 -49.7511 -49.7511 -24.1254 -24.1254 -24.0344 -24.0344 -16.5390 -16.5390 -16.3908 -16.3908 -16.3002 -16.3002 -16.2034 -16.2034 4.0556 4.0556 5.3667 5.3667 9.4475 9.4475 9.7688 9.7688 10.2880 10.2880 11.1480 11.1480 11.8990 11.8990 12.7716 12.7716 13.6676 13.6676 13.7670 13.7670 13.9940 13.9940 k =-0.4121 0.4428-0.0000 ( 2852 PWs) bands (ev): -49.7770 -49.7770 -49.7510 -49.7510 -24.1259 -24.1259 -24.0367 -24.0367 -16.5364 -16.5364 -16.3972 -16.3972 -16.3006 -16.3006 -16.2117 -16.2117 4.0970 4.0970 5.4293 5.4293 9.4883 9.4883 9.7646 9.7646 10.2709 10.2709 11.1658 11.1658 11.8435 11.8435 12.6822 12.6822 13.6242 13.6242 13.7307 13.7307 13.9898 13.9898 k =-0.4070 0.4600-0.0000 ( 2852 PWs) bands (ev): -49.7763 -49.7763 -49.7508 -49.7508 -24.1265 -24.1265 -24.0391 -24.0391 -16.5337 -16.5337 -16.4038 -16.4038 -16.3010 -16.3010 -16.2202 -16.2202 4.1408 4.1408 5.4951 5.4951 9.5311 9.5311 9.7603 9.7603 10.2448 10.2448 11.1801 11.1801 11.7860 11.7860 12.5971 12.5971 13.5748 13.5748 13.7074 13.7074 13.9905 13.9905 k =-0.4018 0.4772-0.0000 ( 2844 PWs) bands (ev): -49.7756 -49.7756 -49.7507 -49.7507 -24.1269 -24.1269 -24.0415 -24.0415 -16.5310 -16.5310 -16.4104 -16.4104 -16.3015 -16.3015 -16.2289 -16.2289 4.1868 4.1868 5.5641 5.5641 9.5758 9.5758 9.7560 9.7560 10.2087 10.2087 11.1899 11.1899 11.7269 11.7269 12.5172 12.5172 13.5266 13.5266 13.6917 13.6917 13.9961 13.9961 k =-0.3966 0.4944-0.0000 ( 2848 PWs) bands (ev): -49.7748 -49.7748 -49.7505 -49.7505 -24.1274 -24.1274 -24.0442 -24.0442 -16.5283 -16.5283 -16.4170 -16.4170 -16.3023 -16.3023 -16.2377 -16.2377 4.2349 4.2349 5.6363 5.6363 9.6214 9.6214 9.7526 9.7526 10.1621 10.1621 11.1945 11.1945 11.6666 11.6666 12.4429 12.4429 13.4835 13.4835 13.6807 13.6807 14.0062 14.0062 k =-0.3914 0.5116-0.0000 ( 2846 PWs) bands (ev): -49.7741 -49.7741 -49.7504 -49.7504 -24.1278 -24.1278 -24.0469 -24.0469 -16.5255 -16.5255 -16.4236 -16.4236 -16.3033 -16.3033 -16.2465 -16.2465 4.2851 4.2851 5.7114 5.7114 9.6653 9.6653 9.7524 9.7524 10.1047 10.1047 11.1931 11.1931 11.6054 11.6054 12.3746 12.3746 13.4476 13.4476 13.6732 13.6732 14.0206 14.0206 k =-0.3863 0.5288-0.0000 ( 2849 PWs) bands (ev): -49.7733 -49.7733 -49.7502 -49.7502 -24.1282 -24.1282 -24.0497 -24.0497 -16.5229 -16.5229 -16.4302 -16.4302 -16.3044 -16.3044 -16.2553 -16.2553 4.3374 4.3374 5.7894 5.7894 9.6980 9.6980 9.7645 9.7645 10.0372 10.0372 11.1851 11.1851 11.5438 11.5438 12.3120 12.3120 13.4196 13.4196 13.6686 13.6686 14.0391 14.0391 k =-0.3811 0.5460-0.0000 ( 2849 PWs) bands (ev): -49.7725 -49.7725 -49.7501 -49.7501 -24.1287 -24.1287 -24.0525 -24.0525 -16.5203 -16.5203 -16.4368 -16.4368 -16.3058 -16.3058 -16.2638 -16.2638 4.3917 4.3917 5.8702 5.8702 9.7082 9.7082 9.7977 9.7977 9.9623 9.9623 11.1702 11.1702 11.4820 11.4820 12.2545 12.2545 13.3996 13.3996 13.6668 13.6668 14.0612 14.0612 k =-0.3759 0.5632-0.0000 ( 2849 PWs) bands (ev): -49.7717 -49.7717 -49.7500 -49.7500 -24.1291 -24.1291 -24.0554 -24.0554 -16.5179 -16.5179 -16.4432 -16.4432 -16.3075 -16.3075 -16.2720 -16.2720 4.4479 4.4479 5.9537 5.9537 9.7062 9.7062 9.8194 9.8194 9.9033 9.9033 11.1481 11.1481 11.4205 11.4205 12.2014 12.2014 13.3870 13.3870 13.6673 13.6673 14.0868 14.0868 k =-0.3708 0.5805-0.0000 ( 2863 PWs) bands (ev): -49.7709 -49.7709 -49.7499 -49.7499 -24.1296 -24.1296 -24.0584 -24.0584 -16.5158 -16.5158 -16.4495 -16.4495 -16.3097 -16.3097 -16.2798 -16.2798 4.5060 4.5060 6.0399 6.0399 9.6991 9.6991 9.7534 9.7534 9.9302 9.9302 11.1191 11.1191 11.3595 11.3595 12.1519 12.1519 13.3807 13.3807 13.6701 13.6701 14.1157 14.1157 k =-0.3656 0.5977-0.0000 ( 2861 PWs) bands (ev): -49.7701 -49.7701 -49.7498 -49.7498 -24.1299 -24.1299 -24.0613 -24.0613 -16.5138 -16.5138 -16.4554 -16.4554 -16.3125 -16.3125 -16.2867 -16.2867 4.5660 4.5660 6.1287 6.1287 9.6445 9.6445 9.6993 9.6993 9.9866 9.9866 11.0834 11.0834 11.2993 11.2993 12.1050 12.1050 13.3789 13.3789 13.6747 13.6747 14.1475 14.1475 k =-0.3604 0.6149-0.0000 ( 2857 PWs) bands (ev): -49.7692 -49.7692 -49.7497 -49.7497 -24.1302 -24.1302 -24.0642 -24.0642 -16.5122 -16.5122 -16.4611 -16.4611 -16.3160 -16.3160 -16.2926 -16.2926 4.6277 4.6277 6.2198 6.2198 9.5342 9.5342 9.6901 9.6901 10.0491 10.0491 11.0414 11.0414 11.2401 11.2401 12.0599 12.0599 13.3794 13.3794 13.6810 13.6810 14.1821 14.1821 k =-0.3553 0.6321-0.0000 ( 2865 PWs) bands (ev): -49.7684 -49.7684 -49.7496 -49.7496 -24.1305 -24.1305 -24.0672 -24.0672 -16.5111 -16.5111 -16.4665 -16.4665 -16.3204 -16.3204 -16.2975 -16.2975 4.6911 4.6911 6.3133 6.3133 9.4153 9.4153 9.6825 9.6825 10.1151 10.1151 10.9938 10.9938 11.1821 11.1821 12.0160 12.0160 13.3792 13.3792 13.6884 13.6884 14.2191 14.2191 k =-0.3501 0.6493-0.0000 ( 2869 PWs) bands (ev): -49.7675 -49.7675 -49.7496 -49.7496 -24.1308 -24.1308 -24.0702 -24.0702 -16.5104 -16.5104 -16.4714 -16.4714 -16.3255 -16.3255 -16.3013 -16.3013 4.7560 4.7560 6.4091 6.4091 9.2909 9.2909 9.6751 9.6751 10.1839 10.1839 10.9412 10.9412 11.1256 11.1256 11.9727 11.9727 13.3751 13.3751 13.6966 13.6966 14.2586 14.2586 k =-0.3449 0.6665-0.0000 ( 2865 PWs) bands (ev): -49.7667 -49.7667 -49.7496 -49.7496 -24.1308 -24.1308 -24.0732 -24.0732 -16.5104 -16.5104 -16.4757 -16.4757 -16.3308 -16.3308 -16.3044 -16.3044 4.8225 4.8225 6.5070 6.5070 9.1622 9.1622 9.6680 9.6680 10.2551 10.2551 10.8841 10.8841 11.0708 11.0708 11.9296 11.9296 13.3639 13.3639 13.7050 13.7050 14.3003 14.3003 k =-0.3398 0.6837-0.0000 ( 2863 PWs) bands (ev): -49.7658 -49.7658 -49.7496 -49.7496 -24.1310 -24.1310 -24.0761 -24.0761 -16.5111 -16.5111 -16.4795 -16.4795 -16.3360 -16.3360 -16.3071 -16.3071 4.8903 4.8903 6.6069 6.6069 9.0304 9.0304 9.6612 9.6612 10.3286 10.3286 10.8231 10.8231 11.0180 11.0180 11.8866 11.8866 13.3431 13.3431 13.7132 13.7132 14.3444 14.3444 k =-0.3346 0.7009-0.0000 ( 2865 PWs) bands (ev): -49.7650 -49.7650 -49.7496 -49.7496 -24.1310 -24.1310 -24.0791 -24.0791 -16.5124 -16.5124 -16.4828 -16.4828 -16.3410 -16.3410 -16.3096 -16.3096 4.9593 4.9593 6.7088 6.7088 8.8962 8.8962 9.6550 9.6550 10.4041 10.4041 10.7587 10.7587 10.9673 10.9673 11.8435 11.8435 13.3115 13.3115 13.7204 13.7204 14.3915 14.3915 k =-0.3294 0.7181-0.0000 ( 2861 PWs) bands (ev): -49.7641 -49.7641 -49.7496 -49.7496 -24.1308 -24.1308 -24.0820 -24.0820 -16.5143 -16.5143 -16.4856 -16.4856 -16.3454 -16.3454 -16.3119 -16.3119 5.0295 5.0295 6.8125 6.8125 8.7605 8.7605 9.6493 9.6493 10.4813 10.4813 10.6918 10.6918 10.9189 10.9189 11.8004 11.8004 13.2692 13.2692 13.7256 13.7256 14.4429 14.4429 k =-0.3242 0.7354-0.0000 ( 2863 PWs) bands (ev): -49.7633 -49.7633 -49.7497 -49.7497 -24.1306 -24.1306 -24.0850 -24.0850 -16.5166 -16.5166 -16.4882 -16.4882 -16.3492 -16.3492 -16.3143 -16.3143 5.1006 5.1006 6.9179 6.9179 8.6240 8.6240 9.6444 9.6444 10.5568 10.5568 10.6257 10.6257 10.8732 10.8732 11.7572 11.7572 13.2176 13.2176 13.7278 13.7278 14.4997 14.4997 k =-0.3191 0.7526-0.0000 ( 2867 PWs) bands (ev): -49.7625 -49.7625 -49.7498 -49.7498 -24.1304 -24.1304 -24.0878 -24.0878 -16.5192 -16.5192 -16.4907 -16.4907 -16.3523 -16.3523 -16.3166 -16.3166 5.1725 5.1725 7.0249 7.0249 8.4873 8.4873 9.6403 9.6403 10.5435 10.5435 10.6477 10.6477 10.8307 10.8307 11.7141 11.7141 13.1586 13.1586 13.7254 13.7254 14.5560 14.5560 k =-0.3139 0.7698-0.0000 ( 2863 PWs) bands (ev): -49.7617 -49.7617 -49.7499 -49.7499 -24.1300 -24.1300 -24.0906 -24.0906 -16.5218 -16.5218 -16.4932 -16.4932 -16.3546 -16.3546 -16.3189 -16.3189 5.2448 5.2448 7.1332 7.1332 8.3512 8.3512 9.6371 9.6371 10.4714 10.4714 10.7242 10.7242 10.7949 10.7949 11.6714 11.6714 13.0942 13.0942 13.7172 13.7172 14.6049 14.6049 k =-0.3087 0.7870-0.0000 ( 2863 PWs) bands (ev): -49.7609 -49.7609 -49.7500 -49.7500 -24.1296 -24.1296 -24.0934 -24.0934 -16.5244 -16.5244 -16.4959 -16.4959 -16.3563 -16.3563 -16.3213 -16.3213 5.3173 5.3173 7.2427 7.2427 8.2163 8.2163 9.6350 9.6350 10.3960 10.3960 10.7419 10.7419 10.8240 10.8240 11.6291 11.6291 13.0265 13.0265 13.7019 13.7019 14.6551 14.6551 k =-0.3036 0.8042-0.0000 ( 2863 PWs) bands (ev): -49.7601 -49.7601 -49.7502 -49.7502 -24.1290 -24.1290 -24.0961 -24.0961 -16.5267 -16.5267 -16.4988 -16.4988 -16.3572 -16.3572 -16.3237 -16.3237 5.3895 5.3895 7.3529 7.3529 8.0837 8.0837 9.6341 9.6341 10.3189 10.3189 10.7103 10.7103 10.9068 10.9068 11.5878 11.5878 12.9569 12.9569 13.6783 13.6783 14.7068 14.7068 k =-0.2984 0.8214-0.0000 ( 2857 PWs) bands (ev): -49.7593 -49.7593 -49.7504 -49.7504 -24.1283 -24.1283 -24.0987 -24.0987 -16.5288 -16.5288 -16.5017 -16.5017 -16.3575 -16.3575 -16.3261 -16.3261 5.4610 5.4610 7.4628 7.4628 7.9550 7.9550 9.6344 9.6344 10.2406 10.2406 10.6785 10.6785 10.9937 10.9937 11.5480 11.5480 12.8868 12.8868 13.6459 13.6459 14.7597 14.7597 k =-0.2932 0.8386-0.0000 ( 2857 PWs) bands (ev): -49.7586 -49.7586 -49.7506 -49.7506 -24.1276 -24.1276 -24.1012 -24.1012 -16.5307 -16.5307 -16.5048 -16.5048 -16.3572 -16.3572 -16.3286 -16.3286 5.5310 5.5310 7.5684 7.5684 7.8349 7.8349 9.6361 9.6361 10.1613 10.1613 10.6491 10.6491 11.0810 11.0810 11.5107 11.5107 12.8172 12.8172 13.6044 13.6044 14.8134 14.8134 k =-0.2881 0.8558-0.0000 ( 2865 PWs) bands (ev): -49.7579 -49.7579 -49.7509 -49.7509 -24.1268 -24.1268 -24.1038 -24.1038 -16.5322 -16.5322 -16.5080 -16.5080 -16.3565 -16.3565 -16.3312 -16.3312 5.5987 5.5987 7.6316 7.6316 7.7625 7.7625 9.6392 9.6392 10.0812 10.0812 10.6223 10.6223 11.1657 11.1657 11.4787 11.4787 12.7489 12.7489 13.5541 13.5541 14.8678 14.8678 k =-0.2829 0.8730-0.0000 ( 2861 PWs) bands (ev): -49.7572 -49.7572 -49.7512 -49.7512 -24.1258 -24.1258 -24.1062 -24.1062 -16.5333 -16.5333 -16.5111 -16.5111 -16.3553 -16.3553 -16.3337 -16.3337 5.6628 5.6628 7.5586 7.5586 7.8324 7.8324 9.6437 9.6437 10.0007 10.0007 10.5984 10.5984 11.2397 11.2397 11.4600 11.4600 12.6825 12.6825 13.4957 13.4957 14.9226 14.9226 k =-0.2777 0.8903-0.0000 ( 2859 PWs) bands (ev): -49.7565 -49.7565 -49.7515 -49.7515 -24.1247 -24.1247 -24.1085 -24.1085 -16.5341 -16.5341 -16.5141 -16.5141 -16.3538 -16.3538 -16.3362 -16.3362 5.7218 5.7218 7.4552 7.4552 7.9408 7.9408 9.6496 9.6496 9.9200 9.9200 10.5775 10.5775 11.2823 11.2823 11.4753 11.4753 12.6186 12.6186 13.4301 13.4301 14.9775 14.9775 k =-0.2726 0.9075-0.0000 ( 2855 PWs) bands (ev): -49.7559 -49.7559 -49.7518 -49.7518 -24.1235 -24.1235 -24.1107 -24.1107 -16.5344 -16.5344 -16.5170 -16.5170 -16.3520 -16.3520 -16.3387 -16.3387 5.7736 5.7736 7.3565 7.3565 8.0542 8.0542 9.6566 9.6566 9.8399 9.8399 10.5596 10.5596 11.2816 11.2816 11.5364 11.5364 12.5574 12.5574 13.3585 13.3585 15.0324 15.0324 k =-0.2726 0.9075-0.0000 ( 2855 PWs) bands (ev): -49.7559 -49.7559 -49.7518 -49.7518 -24.1235 -24.1235 -24.1107 -24.1107 -16.5344 -16.5344 -16.5170 -16.5170 -16.3520 -16.3520 -16.3387 -16.3387 5.7736 5.7736 7.3565 7.3565 8.0542 8.0542 9.6566 9.6566 9.8399 9.8399 10.5596 10.5596 11.2816 11.2816 11.5364 11.5364 12.5574 12.5574 13.3585 13.3585 15.0324 15.0324 k =-0.2726 0.9075 0.0178 ( 2859 PWs) bands (ev): -49.7559 -49.7559 -49.7519 -49.7519 -24.1235 -24.1235 -24.1108 -24.1108 -16.5350 -16.5350 -16.5164 -16.5164 -16.3529 -16.3529 -16.3380 -16.3380 5.7747 5.7747 7.3577 7.3577 8.0540 8.0540 9.6506 9.6506 9.8458 9.8458 10.5565 10.5565 11.2814 11.2814 11.5408 11.5408 12.5451 12.5451 13.3705 13.3705 15.0335 15.0335 k =-0.2726 0.9075 0.0357 ( 2859 PWs) bands (ev): -49.7559 -49.7559 -49.7519 -49.7519 -24.1235 -24.1235 -24.1108 -24.1108 -16.5365 -16.5365 -16.5146 -16.5146 -16.3551 -16.3551 -16.3361 -16.3361 5.7779 5.7779 7.3611 7.3611 8.0534 8.0534 9.6349 9.6349 9.8611 9.8611 10.5472 10.5472 11.2807 11.2807 11.5538 11.5538 12.5103 12.5103 13.4041 13.4041 15.0349 15.0349 k =-0.2726 0.9075 0.0535 ( 2859 PWs) bands (ev): -49.7559 -49.7559 -49.7519 -49.7519 -24.1235 -24.1235 -24.1108 -24.1108 -16.5386 -16.5386 -16.5122 -16.5122 -16.3580 -16.3580 -16.3338 -16.3338 5.7833 5.7833 7.3669 7.3669 8.0523 8.0523 9.6136 9.6136 9.8817 9.8817 10.5324 10.5324 11.2795 11.2795 11.5749 11.5749 12.4581 12.4581 13.4542 13.4542 15.0237 15.0237 k =-0.2726 0.9075 0.0714 ( 2861 PWs) bands (ev): -49.7559 -49.7559 -49.7519 -49.7519 -24.1235 -24.1235 -24.1109 -24.1109 -16.5410 -16.5410 -16.5094 -16.5094 -16.3613 -16.3613 -16.3313 -16.3313 5.7908 5.7908 7.3750 7.3750 8.0504 8.0504 9.5902 9.5902 9.9043 9.9043 10.5129 10.5129 11.2774 11.2774 11.6036 11.6036 12.3938 12.3938 13.5151 13.5151 14.9734 14.9734 k =-0.2726 0.9075 0.0892 ( 2859 PWs) bands (ev): -49.7558 -49.7558 -49.7519 -49.7519 -24.1234 -24.1234 -24.1110 -24.1110 -16.5435 -16.5435 -16.5063 -16.5063 -16.3647 -16.3647 -16.3288 -16.3288 5.8004 5.8004 7.3854 7.3854 8.0476 8.0476 9.5671 9.5671 9.9267 9.9267 10.4897 10.4897 11.2744 11.2744 11.6390 11.6390 12.3218 12.3218 13.5819 13.5819 14.8990 14.8990 k =-0.2726 0.9075 0.1071 ( 2859 PWs) bands (ev): -49.7558 -49.7558 -49.7519 -49.7519 -24.1235 -24.1235 -24.1111 -24.1111 -16.5459 -16.5459 -16.5032 -16.5032 -16.3683 -16.3683 -16.3264 -16.3264 5.8121 5.8121 7.3980 7.3980 8.0436 8.0436 9.5456 9.5456 9.9474 9.9474 10.4635 10.4635 11.2707 11.2707 11.6800 11.6800 12.2454 12.2454 13.6509 13.6509 14.8241 14.8241 k =-0.2726 0.9075 0.1249 ( 2855 PWs) bands (ev): -49.7558 -49.7558 -49.7519 -49.7519 -24.1234 -24.1234 -24.1112 -24.1112 -16.5483 -16.5483 -16.5000 -16.5000 -16.3719 -16.3719 -16.3241 -16.3241 5.8258 5.8258 7.4129 7.4129 8.0379 8.0379 9.5271 9.5271 9.9655 9.9655 10.4353 10.4353 11.2662 11.2662 11.7249 11.7249 12.1674 12.1674 13.7186 13.7186 14.7559 14.7559 k =-0.2726 0.9075 0.1428 ( 2860 PWs) bands (ev): -49.7557 -49.7557 -49.7519 -49.7519 -24.1234 -24.1234 -24.1113 -24.1113 -16.5507 -16.5507 -16.4969 -16.4969 -16.3755 -16.3755 -16.3220 -16.3220 5.8416 5.8416 7.4300 7.4300 8.0302 8.0302 9.5122 9.5122 9.9801 9.9801 10.4059 10.4059 11.2611 11.2611 11.7712 11.7712 12.0912 12.0912 13.7822 13.7822 14.6978 14.6978 k =-0.2726 0.9075 0.1606 ( 2856 PWs) bands (ev): -49.7557 -49.7557 -49.7520 -49.7520 -24.1233 -24.1233 -24.1115 -24.1115 -16.5530 -16.5530 -16.4938 -16.4938 -16.3790 -16.3790 -16.3199 -16.3199 5.8594 5.8594 7.4494 7.4494 8.0203 8.0203 9.5018 9.5018 9.9908 9.9908 10.3758 10.3758 11.2556 11.2556 11.8116 11.8116 12.0243 12.0243 13.8386 13.8386 14.6522 14.6522 k =-0.2726 0.9075 0.1784 ( 2854 PWs) bands (ev): -49.7557 -49.7557 -49.7520 -49.7520 -24.1233 -24.1233 -24.1116 -24.1116 -16.5551 -16.5551 -16.4908 -16.4908 -16.3824 -16.3824 -16.3181 -16.3181 5.8791 5.8791 7.4709 7.4709 8.0077 8.0077 9.4964 9.4964 9.9972 9.9972 10.3457 10.3457 11.2498 11.2498 11.8221 11.8221 11.9911 11.9911 13.8850 13.8850 14.6215 14.6215 k =-0.2726 0.9075 0.1963 ( 2856 PWs) bands (ev): -49.7556 -49.7556 -49.7520 -49.7520 -24.1233 -24.1233 -24.1118 -24.1118 -16.5571 -16.5571 -16.4881 -16.4881 -16.3857 -16.3857 -16.3165 -16.3165 5.9007 5.9007 7.4945 7.4945 7.9923 7.9923 9.4963 9.4963 9.9988 9.9988 10.3158 10.3158 11.2440 11.2440 11.7796 11.7796 12.0146 12.0146 13.9192 13.9192 14.6069 14.6069 k =-0.2726 0.9075 0.2141 ( 2858 PWs) bands (ev): -49.7556 -49.7556 -49.7520 -49.7520 -24.1232 -24.1232 -24.1121 -24.1121 -16.5589 -16.5589 -16.4856 -16.4856 -16.3887 -16.3887 -16.3150 -16.3150 5.9242 5.9242 7.5202 7.5202 7.9738 7.9738 9.5018 9.5018 9.9957 9.9957 10.2867 10.2867 11.2384 11.2384 11.7112 11.7112 12.0677 12.0677 13.9404 13.9404 14.6085 14.6085 k =-0.2726 0.9075 0.2320 ( 2858 PWs) bands (ev): -49.7555 -49.7555 -49.7521 -49.7521 -24.1232 -24.1232 -24.1123 -24.1123 -16.5606 -16.5606 -16.4834 -16.4834 -16.3915 -16.3915 -16.3137 -16.3137 5.9494 5.9494 7.5479 7.5479 7.9523 7.9523 9.5129 9.5129 9.9877 9.9877 10.2584 10.2584 11.2329 11.2329 11.6362 11.6362 12.1314 12.1314 13.9498 13.9498 14.6242 14.6242 k =-0.2726 0.9075 0.2498 ( 2856 PWs) bands (ev): -49.7555 -49.7555 -49.7521 -49.7521 -24.1231 -24.1231 -24.1125 -24.1125 -16.5621 -16.5621 -16.4815 -16.4815 -16.3938 -16.3938 -16.3126 -16.3126 5.9764 5.9764 7.5775 7.5775 7.9278 7.9278 9.5293 9.5293 9.9753 9.9753 10.2311 10.2311 11.2278 11.2278 11.5600 11.5600 12.2003 12.2003 13.9502 13.9502 14.6503 14.6503 k =-0.2726 0.9075 0.2677 ( 2856 PWs) bands (ev): -49.7554 -49.7554 -49.7522 -49.7522 -24.1230 -24.1230 -24.1128 -24.1128 -16.5635 -16.5635 -16.4802 -16.4802 -16.3958 -16.3958 -16.3117 -16.3117 6.0051 6.0051 7.6090 7.6090 7.9004 7.9004 9.5506 9.5506 9.9588 9.9588 10.2050 10.2050 11.2230 11.2230 11.4845 11.4845 12.2725 12.2725 13.9447 13.9447 14.6827 14.6827 k =-0.2726 0.9075 0.2855 ( 2852 PWs) bands (ev): -49.7553 -49.7553 -49.7522 -49.7522 -24.1229 -24.1229 -24.1130 -24.1130 -16.5646 -16.5646 -16.4793 -16.4793 -16.3971 -16.3971 -16.3110 -16.3110 6.0353 6.0353 7.6419 7.6419 7.8706 7.8706 9.5757 9.5757 9.9390 9.9390 10.1801 10.1801 11.2184 11.2184 11.4110 11.4110 12.3474 12.3474 13.9358 13.9358 14.7176 14.7176 k =-0.2726 0.9075 0.3034 ( 2856 PWs) bands (ev): -49.7553 -49.7553 -49.7522 -49.7522 -24.1229 -24.1229 -24.1133 -24.1133 -16.5657 -16.5657 -16.4791 -16.4791 -16.3980 -16.3980 -16.3105 -16.3105 6.0671 6.0671 7.6758 7.6758 7.8392 7.8392 9.6033 9.6033 9.9172 9.9172 10.1567 10.1567 11.2130 11.2130 11.3411 11.3411 12.4243 12.4243 13.9256 13.9256 14.7520 14.7520 k =-0.2726 0.9075 0.3212 ( 2850 PWs) bands (ev): -49.7552 -49.7552 -49.7523 -49.7523 -24.1227 -24.1227 -24.1136 -24.1136 -16.5665 -16.5665 -16.4793 -16.4793 -16.3983 -16.3983 -16.3101 -16.3101 6.1004 6.1004 7.7081 7.7081 7.8088 7.8088 9.6305 9.6305 9.8957 9.8957 10.1351 10.1351 11.2026 11.2026 11.2793 11.2793 12.5031 12.5031 13.9152 13.9152 14.7835 14.7835 k =-0.2726 0.9075 0.3391 ( 2848 PWs) bands (ev): -49.7551 -49.7551 -49.7523 -49.7523 -24.1226 -24.1226 -24.1138 -24.1138 -16.5672 -16.5672 -16.4802 -16.4802 -16.3979 -16.3979 -16.3099 -16.3099 6.1351 6.1351 7.7256 7.7256 7.7929 7.7929 9.6524 9.6524 9.8786 9.8786 10.1157 10.1157 11.1717 11.1717 11.2419 11.2419 12.5835 12.5835 13.9052 13.9052 14.8104 14.8104 k =-0.2726 0.9075 0.3569 ( 2849 PWs) bands (ev): -49.7551 -49.7551 -49.7524 -49.7524 -24.1225 -24.1225 -24.1141 -24.1141 -16.5676 -16.5676 -16.4816 -16.4816 -16.3971 -16.3971 -16.3100 -16.3100 6.1711 6.1711 7.7059 7.7059 7.8141 7.8141 9.6615 9.6615 9.8724 9.8724 10.0994 10.0994 11.1182 11.1182 11.2311 11.2311 12.6653 12.6653 13.8958 13.8958 14.8314 14.8314 k =-0.2726 0.9075 0.3747 ( 2853 PWs) bands (ev): -49.7550 -49.7550 -49.7524 -49.7524 -24.1224 -24.1224 -24.1145 -24.1145 -16.5679 -16.5679 -16.4836 -16.4836 -16.3957 -16.3957 -16.3102 -16.3102 6.2083 6.2083 7.6695 7.6695 7.8521 7.8521 9.6517 9.6517 9.8816 9.8816 10.0875 10.0875 11.0608 11.0608 11.2289 11.2289 12.7484 12.7484 13.8873 13.8873 14.8455 14.8455 k =-0.2726 0.9075 0.3926 ( 2857 PWs) bands (ev): -49.7549 -49.7549 -49.7525 -49.7525 -24.1224 -24.1224 -24.1148 -24.1148 -16.5681 -16.5681 -16.4859 -16.4859 -16.3940 -16.3940 -16.3106 -16.3106 6.2467 6.2467 7.6285 7.6285 7.8951 7.8951 9.6246 9.6246 9.9016 9.9016 10.0822 10.0822 11.0057 11.0057 11.2295 11.2295 12.8326 12.8326 13.8794 13.8794 14.8521 14.8521 k =-0.2726 0.9075 0.4104 ( 2855 PWs) bands (ev): -49.7548 -49.7548 -49.7526 -49.7526 -24.1223 -24.1223 -24.1150 -24.1150 -16.5680 -16.5680 -16.4886 -16.4886 -16.3918 -16.3918 -16.3112 -16.3112 6.2862 6.2862 7.5854 7.5854 7.9407 7.9407 9.5856 9.5856 9.9232 9.9232 10.0865 10.0865 10.9550 10.9550 11.2315 11.2315 12.9177 12.9177 13.8722 13.8722 14.8505 14.8505 k =-0.2726 0.9075 0.4283 ( 2855 PWs) bands (ev): -49.7547 -49.7547 -49.7526 -49.7526 -24.1222 -24.1222 -24.1153 -24.1153 -16.5678 -16.5678 -16.4914 -16.4914 -16.3894 -16.3894 -16.3119 -16.3119 6.3268 6.3268 7.5408 7.5408 7.9883 7.9883 9.5392 9.5392 9.9386 9.9386 10.1028 10.1028 10.9104 10.9104 11.2342 11.2342 13.0036 13.0036 13.8656 13.8656 14.8404 14.8404 k =-0.2726 0.9075 0.4461 ( 2851 PWs) bands (ev): -49.7547 -49.7547 -49.7527 -49.7527 -24.1220 -24.1220 -24.1156 -24.1156 -16.5673 -16.5673 -16.4945 -16.4945 -16.3868 -16.3868 -16.3127 -16.3127 6.3682 6.3682 7.4952 7.4952 8.0377 8.0377 9.4876 9.4876 9.9460 9.9460 10.1289 10.1289 10.8733 10.8733 11.2373 11.2373 13.0901 13.0901 13.8599 13.8599 14.8214 14.8214 k =-0.2726 0.9075 0.4640 ( 2845 PWs) bands (ev): -49.7546 -49.7546 -49.7528 -49.7528 -24.1218 -24.1218 -24.1159 -24.1159 -16.5667 -16.5667 -16.4977 -16.4977 -16.3840 -16.3840 -16.3137 -16.3137 6.4106 6.4106 7.4488 7.4488 8.0888 8.0888 9.4324 9.4324 9.9482 9.9482 10.1588 10.1588 10.8455 10.8455 11.2403 11.2403 13.1771 13.1771 13.8553 13.8553 14.7931 14.7931 k =-0.2726 0.9075 0.4818 ( 2847 PWs) bands (ev): -49.7545 -49.7545 -49.7528 -49.7528 -24.1216 -24.1216 -24.1162 -24.1162 -16.5660 -16.5660 -16.5009 -16.5009 -16.3813 -16.3813 -16.3148 -16.3148 6.4537 6.4537 7.4018 7.4018 8.1414 8.1414 9.3744 9.3744 9.9481 9.9481 10.1866 10.1866 10.8289 10.8289 11.2427 11.2427 13.2642 13.2642 13.8523 13.8523 14.7550 14.7550 k =-0.2726 0.9075 0.4997 ( 2849 PWs) bands (ev): -49.7544 -49.7544 -49.7529 -49.7529 -24.1215 -24.1215 -24.1166 -24.1166 -16.5651 -16.5651 -16.5042 -16.5042 -16.3784 -16.3784 -16.3161 -16.3161 6.4976 6.4976 7.3544 7.3544 8.1954 8.1954 9.3143 9.3143 9.9476 9.9476 10.2081 10.2081 10.8251 10.8251 11.2441 11.2441 13.3512 13.3512 13.8515 13.8515 14.7060 14.7060 k =-0.2726 0.9075 0.5175 ( 2852 PWs) bands (ev): -49.7543 -49.7543 -49.7530 -49.7530 -24.1212 -24.1212 -24.1170 -24.1170 -16.5642 -16.5642 -16.5074 -16.5074 -16.3756 -16.3756 -16.3174 -16.3174 6.5421 6.5421 7.3066 7.3066 8.2508 8.2508 9.2526 9.2526 9.9475 9.9475 10.2210 10.2210 10.8345 10.8345 11.2440 11.2440 13.4377 13.4377 13.8539 13.8539 14.6444 14.6444 k =-0.2726 0.9075 0.5353 ( 2858 PWs) bands (ev): -49.7542 -49.7542 -49.7531 -49.7531 -24.1211 -24.1211 -24.1174 -24.1174 -16.5631 -16.5631 -16.5105 -16.5105 -16.3729 -16.3729 -16.3188 -16.3188 6.5872 6.5872 7.2586 7.2586 8.3075 8.3075 9.1896 9.1896 9.9483 9.9483 10.2251 10.2251 10.8560 10.8560 11.2418 11.2418 13.5229 13.5229 13.8608 13.8608 14.5695 14.5695 k =-0.2726 0.9075 0.5532 ( 2858 PWs) bands (ev): -49.7542 -49.7542 -49.7531 -49.7531 -24.1209 -24.1209 -24.1177 -24.1177 -16.5620 -16.5620 -16.5134 -16.5134 -16.3703 -16.3703 -16.3202 -16.3202 6.6328 6.6328 7.2106 7.2106 8.3654 8.3654 9.1258 9.1258 9.9502 9.9502 10.2221 10.2221 10.8870 10.8870 11.2370 11.2370 13.6058 13.6058 13.8737 13.8737 14.4841 14.4841 k =-0.2726 0.9075 0.5710 ( 2862 PWs) bands (ev): -49.7541 -49.7541 -49.7532 -49.7532 -24.1207 -24.1207 -24.1180 -24.1180 -16.5609 -16.5609 -16.5161 -16.5161 -16.3679 -16.3679 -16.3216 -16.3216 6.6787 6.6787 7.1625 7.1625 8.4244 8.4244 9.0614 9.0614 9.9529 9.9529 10.2142 10.2142 10.9246 10.9246 11.2289 11.2289 13.6849 13.6849 13.8949 13.8949 14.3938 14.3938 k =-0.2726 0.9075 0.5889 ( 2866 PWs) bands (ev): -49.7540 -49.7540 -49.7533 -49.7533 -24.1205 -24.1205 -24.1184 -24.1184 -16.5598 -16.5598 -16.5185 -16.5185 -16.3658 -16.3658 -16.3229 -16.3229 6.7249 6.7249 7.1146 7.1146 8.4844 8.4844 8.9968 8.9968 9.9563 9.9563 10.2039 10.2039 10.9655 10.9655 11.2171 11.2171 13.7577 13.7577 13.9272 13.9272 14.3046 14.3046 k =-0.2726 0.9075 0.6067 ( 2866 PWs) bands (ev): -49.7539 -49.7539 -49.7534 -49.7534 -24.1203 -24.1203 -24.1187 -24.1187 -16.5588 -16.5588 -16.5205 -16.5205 -16.3640 -16.3640 -16.3240 -16.3240 6.7711 6.7711 7.0670 7.0670 8.5452 8.5452 8.9323 8.9323 9.9599 9.9599 10.1933 10.1933 11.0073 11.0073 11.2012 11.2012 13.8221 13.8221 13.9722 13.9722 14.2205 14.2205 k =-0.2726 0.9075 0.6246 ( 2864 PWs) bands (ev): -49.7538 -49.7538 -49.7535 -49.7535 -24.1200 -24.1200 -24.1189 -24.1189 -16.5580 -16.5580 -16.5221 -16.5221 -16.3626 -16.3626 -16.3249 -16.3249 6.8168 6.8168 7.0204 7.0204 8.6064 8.6064 8.8683 8.8683 9.9632 9.9632 10.1843 10.1843 11.0477 11.0477 11.1810 11.1810 13.8795 13.8795 14.0247 14.0247 14.1467 14.1467 k =-0.2726 0.9075 0.6424 ( 2872 PWs) bands (ev): -49.7537 -49.7537 -49.7536 -49.7536 -24.1199 -24.1199 -24.1193 -24.1193 -16.5576 -16.5576 -16.5231 -16.5231 -16.3618 -16.3618 -16.3255 -16.3255 6.8597 6.8597 6.9769 6.9769 8.6665 8.6665 8.8065 8.8065 9.9654 9.9654 10.1782 10.1782 11.0842 11.0842 11.1572 11.1572 13.9347 13.9347 14.0423 14.0423 14.1173 14.1173 k =-0.2726 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7537 -49.7537 -49.7537 -49.7537 -24.1197 -24.1197 -24.1195 -24.1195 -16.5574 -16.5574 -16.5234 -16.5234 -16.3615 -16.3615 -16.3257 -16.3257 6.8848 6.8848 6.9516 6.9516 8.7079 8.7079 8.7646 8.7646 9.9663 9.9663 10.1761 10.1761 11.1064 11.1064 11.1393 11.1393 13.9905 13.9905 13.9922 13.9922 14.1386 14.1386 k =-0.2726 0.9075 0.6603 ( 2876 PWs) bands (ev): -49.7537 -49.7537 -49.7537 -49.7537 -24.1197 -24.1197 -24.1195 -24.1195 -16.5574 -16.5574 -16.5234 -16.5234 -16.3615 -16.3615 -16.3257 -16.3257 6.8848 6.8848 6.9516 6.9516 8.7079 8.7079 8.7646 8.7646 9.9663 9.9663 10.1761 10.1761 11.1064 11.1064 11.1393 11.1393 13.9905 13.9905 13.9922 13.9922 14.1386 14.1386 k =-0.2777 0.8903 0.6603 ( 2876 PWs) bands (ev): -49.7538 -49.7538 -49.7538 -49.7538 -24.1192 -24.1192 -24.1190 -24.1190 -16.5585 -16.5585 -16.5185 -16.5185 -16.3646 -16.3646 -16.3224 -16.3224 6.8798 6.8798 6.9501 6.9501 8.6791 8.6791 8.7328 8.7328 9.9898 9.9898 10.1976 10.1976 11.0900 11.0900 11.1220 11.1220 14.0023 14.0023 14.0291 14.0291 14.1196 14.1196 k =-0.2829 0.8730 0.6603 ( 2880 PWs) bands (ev): -49.7540 -49.7540 -49.7540 -49.7540 -24.1187 -24.1187 -24.1184 -24.1184 -16.5594 -16.5594 -16.5132 -16.5132 -16.3677 -16.3677 -16.3191 -16.3191 6.8688 6.8688 6.9423 6.9423 8.6531 8.6531 8.7029 8.7029 10.0167 10.0167 10.2211 10.2211 11.0775 11.0775 11.1085 11.1085 13.9882 13.9882 14.0081 14.0081 14.1564 14.1564 k =-0.2881 0.8558 0.6603 ( 2880 PWs) bands (ev): -49.7542 -49.7542 -49.7542 -49.7542 -24.1180 -24.1180 -24.1177 -24.1177 -16.5599 -16.5599 -16.5074 -16.5074 -16.3707 -16.3707 -16.3156 -16.3156 6.8520 6.8520 6.9286 6.9286 8.6292 8.6292 8.6741 8.6741 10.0470 10.0470 10.2465 10.2465 11.0696 11.0696 11.0994 11.0994 13.9583 13.9583 13.9631 13.9631 14.2126 14.2126 k =-0.2932 0.8386 0.6603 ( 2880 PWs) bands (ev): -49.7544 -49.7544 -49.7544 -49.7544 -24.1172 -24.1172 -24.1169 -24.1169 -16.5601 -16.5601 -16.5013 -16.5013 -16.3738 -16.3738 -16.3121 -16.3121 6.8297 6.8297 6.9094 6.9094 8.6067 8.6067 8.6459 8.6459 10.0808 10.0808 10.2739 10.2739 11.0667 11.0667 11.0952 11.0952 13.9126 13.9126 13.9193 13.9193 14.2691 14.2691 k =-0.2984 0.8214 0.6603 ( 2880 PWs) bands (ev): -49.7547 -49.7547 -49.7547 -49.7547 -24.1163 -24.1163 -24.1160 -24.1160 -16.5600 -16.5600 -16.4949 -16.4949 -16.3769 -16.3769 -16.3085 -16.3085 6.8025 6.8025 6.8850 6.8850 8.5851 8.5851 8.6177 8.6177 10.1181 10.1181 10.3031 10.3031 11.0694 11.0694 11.0963 11.0963 13.8597 13.8597 13.8751 13.8751 14.3222 14.3222 k =-0.3036 0.8042 0.6603 ( 2864 PWs) bands (ev): -49.7549 -49.7549 -49.7549 -49.7549 -24.1152 -24.1152 -24.1148 -24.1148 -16.5596 -16.5596 -16.4880 -16.4880 -16.3798 -16.3798 -16.3047 -16.3047 6.7708 6.7708 6.8560 6.8560 8.5635 8.5635 8.5887 8.5887 10.1588 10.1588 10.3343 10.3343 11.0780 11.0780 11.1027 11.1027 13.8053 13.8053 13.8275 13.8275 14.3707 14.3707 k =-0.3087 0.7870 0.6603 ( 2860 PWs) bands (ev): -49.7552 -49.7552 -49.7552 -49.7552 -24.1141 -24.1141 -24.1137 -24.1137 -16.5590 -16.5590 -16.4808 -16.4808 -16.3828 -16.3828 -16.3009 -16.3009 6.7352 6.7352 6.8228 6.8228 8.5412 8.5412 8.5587 8.5587 10.2030 10.2030 10.3674 10.3674 11.0926 11.0926 11.1148 11.1148 13.7500 13.7500 13.7777 13.7777 14.4136 14.4136 k =-0.3139 0.7698 0.6603 ( 2856 PWs) bands (ev): -49.7555 -49.7555 -49.7555 -49.7555 -24.1130 -24.1130 -24.1126 -24.1126 -16.5582 -16.5582 -16.4733 -16.4733 -16.3857 -16.3857 -16.2970 -16.2970 6.6962 6.6962 6.7861 6.7861 8.5179 8.5179 8.5271 8.5271 10.2502 10.2502 10.4025 10.4025 11.1133 11.1133 11.1326 11.1326 13.6941 13.6941 13.7265 13.7265 14.4503 14.4503 k =-0.3191 0.7526 0.6603 ( 2856 PWs) bands (ev): -49.7559 -49.7559 -49.7559 -49.7559 -24.1118 -24.1118 -24.1114 -24.1114 -16.5572 -16.5572 -16.4657 -16.4657 -16.3886 -16.3886 -16.2930 -16.2930 6.6544 6.6544 6.7463 6.7463 8.4928 8.4928 8.4937 8.4937 10.3005 10.3005 10.4394 10.4394 11.1401 11.1401 11.1560 11.1560 13.6378 13.6378 13.6742 13.6742 14.4805 14.4805 k =-0.3242 0.7354 0.6603 ( 2846 PWs) bands (ev): -49.7562 -49.7562 -49.7562 -49.7562 -24.1104 -24.1104 -24.1100 -24.1100 -16.5559 -16.5559 -16.4577 -16.4577 -16.3913 -16.3913 -16.2888 -16.2888 6.6102 6.6102 6.7038 6.7038 8.4584 8.4584 8.4659 8.4659 10.3534 10.3534 10.4783 10.4783 11.1728 11.1728 11.1851 11.1851 13.5815 13.5815 13.6214 13.6214 14.5037 14.5037 k =-0.3294 0.7181 0.6603 ( 2846 PWs) bands (ev): -49.7566 -49.7566 -49.7566 -49.7566 -24.1091 -24.1091 -24.1086 -24.1086 -16.5546 -16.5546 -16.4498 -16.4498 -16.3939 -16.3939 -16.2846 -16.2846 6.5642 6.5642 6.6593 6.6593 8.4211 8.4211 8.4367 8.4367 10.4086 10.4086 10.5189 10.5189 11.2112 11.2112 11.2197 11.2197 13.5254 13.5254 13.5684 13.5684 14.5199 14.5199 k =-0.3346 0.7009 0.6603 ( 2848 PWs) bands (ev): -49.7570 -49.7570 -49.7570 -49.7570 -24.1078 -24.1078 -24.1073 -24.1073 -16.5532 -16.5532 -16.4421 -16.4421 -16.3960 -16.3960 -16.2802 -16.2802 6.5167 6.5167 6.6130 6.6130 8.3817 8.3817 8.4052 8.4052 10.4657 10.4657 10.5613 10.5613 11.2552 11.2552 11.2597 11.2597 13.4699 13.4699 13.5156 13.5156 14.5292 14.5292 k =-0.3398 0.6837 0.6603 ( 2848 PWs) bands (ev): -49.7574 -49.7574 -49.7574 -49.7574 -24.1064 -24.1064 -24.1058 -24.1058 -16.5517 -16.5517 -16.4348 -16.4348 -16.3974 -16.3974 -16.2758 -16.2758 6.4681 6.4681 6.5654 6.5654 8.3406 8.3406 8.3713 8.3713 10.5243 10.5243 10.6053 10.6053 11.3042 11.3042 11.3049 11.3049 13.4154 13.4154 13.4635 13.4635 14.5316 14.5316 k =-0.3449 0.6665 0.6603 ( 2854 PWs) bands (ev): -49.7579 -49.7579 -49.7579 -49.7579 -24.1049 -24.1049 -24.1044 -24.1044 -16.5501 -16.5501 -16.4288 -16.4288 -16.3974 -16.3974 -16.2713 -16.2713 6.4187 6.4187 6.5167 6.5167 8.2977 8.2977 8.3353 8.3353 10.5839 10.5839 10.6506 10.6506 11.3551 11.3551 11.3581 11.3581 13.3621 13.3621 13.4123 13.4123 14.5277 14.5277 k =-0.3501 0.6493 0.6603 ( 2862 PWs) bands (ev): -49.7583 -49.7583 -49.7583 -49.7583 -24.1035 -24.1035 -24.1030 -24.1030 -16.5484 -16.5484 -16.4250 -16.4250 -16.3951 -16.3951 -16.2667 -16.2667 6.3690 6.3690 6.4674 6.4674 8.2534 8.2534 8.2971 8.2971 10.6441 10.6441 10.6970 10.6970 11.4100 11.4100 11.4164 11.4164 13.3105 13.3105 13.3625 13.3625 14.5179 14.5179 k =-0.3553 0.6321 0.6603 ( 2858 PWs) bands (ev): -49.7588 -49.7588 -49.7588 -49.7588 -24.1019 -24.1019 -24.1014 -24.1014 -16.5466 -16.5466 -16.4237 -16.4237 -16.3899 -16.3899 -16.2619 -16.2619 6.3191 6.3191 6.4176 6.4176 8.2079 8.2079 8.2571 8.2571 10.7044 10.7044 10.7442 10.7442 11.4693 11.4693 11.4787 11.4787 13.2610 13.2610 13.3145 13.3145 14.5029 14.5029 k =-0.3604 0.6149 0.6603 ( 2862 PWs) bands (ev): -49.7592 -49.7592 -49.7592 -49.7592 -24.1004 -24.1004 -24.0999 -24.0999 -16.5448 -16.5448 -16.4244 -16.4244 -16.3826 -16.3826 -16.2571 -16.2571 6.2693 6.2693 6.3677 6.3677 8.1614 8.1614 8.2155 8.2155 10.7643 10.7643 10.7918 10.7918 11.5328 11.5328 11.5448 11.5448 13.2140 13.2140 13.2688 13.2688 14.4835 14.4835 k =-0.3656 0.5977 0.6603 ( 2862 PWs) bands (ev): -49.7597 -49.7597 -49.7597 -49.7597 -24.0988 -24.0988 -24.0983 -24.0983 -16.5429 -16.5429 -16.4262 -16.4262 -16.3741 -16.3741 -16.2522 -16.2522 6.2198 6.2198 6.3177 6.3177 8.1142 8.1142 8.1724 8.1724 10.8234 10.8234 10.8395 10.8395 11.6001 11.6001 11.6142 11.6142 13.1699 13.1699 13.2257 13.2257 14.4603 14.4603 k =-0.3708 0.5805 0.6603 ( 2854 PWs) bands (ev): -49.7602 -49.7602 -49.7601 -49.7601 -24.0972 -24.0972 -24.0966 -24.0966 -16.5410 -16.5410 -16.4286 -16.4286 -16.3649 -16.3649 -16.2473 -16.2473 6.1709 6.1709 6.2681 6.2681 8.0667 8.0667 8.1283 8.1283 10.8811 10.8811 10.8869 10.8869 11.6708 11.6708 11.6865 11.6865 13.1294 13.1294 13.1857 13.1857 14.4343 14.4343 k =-0.3759 0.5632 0.6603 ( 2854 PWs) bands (ev): -49.7606 -49.7606 -49.7606 -49.7606 -24.0956 -24.0956 -24.0950 -24.0950 -16.5391 -16.5391 -16.4312 -16.4312 -16.3554 -16.3554 -16.2423 -16.2423 6.1227 6.1227 6.2189 6.2189 8.0190 8.0190 8.0834 8.0834 10.9334 10.9334 10.9370 10.9370 11.7444 11.7444 11.7614 11.7614 13.0928 13.0928 13.1493 13.1493 14.4062 14.4062 k =-0.3811 0.5460 0.6603 ( 2854 PWs) bands (ev): -49.7611 -49.7611 -49.7611 -49.7611 -24.0940 -24.0940 -24.0935 -24.0935 -16.5372 -16.5372 -16.4341 -16.4341 -16.3457 -16.3457 -16.2373 -16.2373 6.0754 6.0754 6.1703 6.1703 7.9714 7.9714 8.0379 8.0379 10.9787 10.9787 10.9906 10.9906 11.8205 11.8205 11.8384 11.8384 13.0607 13.0607 13.1170 13.1170 14.3768 14.3768 k =-0.3863 0.5288 0.6603 ( 2848 PWs) bands (ev): -49.7615 -49.7615 -49.7615 -49.7615 -24.0924 -24.0924 -24.0918 -24.0918 -16.5353 -16.5353 -16.4370 -16.4370 -16.3359 -16.3359 -16.2323 -16.2323 6.0292 6.0292 6.1225 6.1225 7.9242 7.9242 7.9922 7.9922 11.0222 11.0222 11.0414 11.0414 11.8986 11.8986 11.9172 11.9172 13.0335 13.0335 13.0891 13.0891 14.3467 14.3467 k =-0.3914 0.5116 0.6603 ( 2840 PWs) bands (ev): -49.7620 -49.7620 -49.7620 -49.7620 -24.0907 -24.0907 -24.0902 -24.0902 -16.5334 -16.5334 -16.4399 -16.4399 -16.3260 -16.3260 -16.2274 -16.2274 5.9842 5.9842 6.0756 6.0756 7.8777 7.8777 7.9465 7.9465 11.0636 11.0636 11.0890 11.0890 11.9781 11.9781 11.9973 11.9973 13.0118 13.0118 13.0662 13.0662 14.3166 14.3166 k =-0.3966 0.4944 0.6603 ( 2836 PWs) bands (ev): -49.7624 -49.7624 -49.7624 -49.7624 -24.0892 -24.0892 -24.0886 -24.0886 -16.5315 -16.5315 -16.4429 -16.4429 -16.3161 -16.3161 -16.2225 -16.2225 5.9405 5.9405 6.0297 6.0297 7.8320 7.8320 7.9012 7.9012 11.1023 11.1023 11.1330 11.1330 12.0586 12.0586 12.0783 12.0783 12.9961 12.9961 13.0486 13.0486 14.2871 14.2871 k =-0.4018 0.4772 0.6603 ( 2852 PWs) bands (ev): -49.7629 -49.7629 -49.7629 -49.7629 -24.0878 -24.0878 -24.0873 -24.0873 -16.5298 -16.5298 -16.4460 -16.4460 -16.3065 -16.3065 -16.2178 -16.2178 5.8983 5.8983 5.9851 5.9851 7.7874 7.7874 7.8563 7.8563 11.1381 11.1381 11.1729 11.1729 12.1395 12.1395 12.1596 12.1596 12.9867 12.9867 13.0367 13.0367 14.2587 14.2587 k =-0.4070 0.4600 0.6603 ( 2856 PWs) bands (ev): -49.7633 -49.7633 -49.7633 -49.7633 -24.0864 -24.0864 -24.0859 -24.0859 -16.5280 -16.5280 -16.4491 -16.4491 -16.2969 -16.2969 -16.2131 -16.2131 5.8577 5.8577 5.9417 5.9417 7.7441 7.7441 7.8123 7.8123 11.1706 11.1706 11.2085 11.2085 12.2200 12.2200 12.2408 12.2408 12.9840 12.9840 13.0308 13.0308 14.2319 14.2319 k =-0.4121 0.4428 0.6603 ( 2856 PWs) bands (ev): -49.7638 -49.7638 -49.7638 -49.7638 -24.0849 -24.0849 -24.0844 -24.0844 -16.5263 -16.5263 -16.4521 -16.4521 -16.2875 -16.2875 -16.2086 -16.2086 5.8189 5.8189 5.8999 5.8999 7.7023 7.7023 7.7692 7.7692 11.1997 11.1997 11.2397 11.2397 12.2995 12.2995 12.3211 12.3211 12.9880 12.9880 13.0310 13.0310 14.2073 14.2073 k =-0.4173 0.4256 0.6603 ( 2860 PWs) bands (ev): -49.7642 -49.7642 -49.7642 -49.7642 -24.0836 -24.0836 -24.0831 -24.0831 -16.5245 -16.5245 -16.4550 -16.4550 -16.2783 -16.2783 -16.2042 -16.2042 5.7818 5.7818 5.8595 5.8595 7.6621 7.6621 7.7274 7.7274 11.2251 11.2251 11.2662 11.2662 12.3774 12.3774 12.3998 12.3998 12.9989 12.9989 13.0376 13.0376 14.1849 14.1849 k =-0.4225 0.4083 0.6603 ( 2864 PWs) bands (ev): -49.7646 -49.7646 -49.7646 -49.7646 -24.0823 -24.0823 -24.0818 -24.0818 -16.5228 -16.5228 -16.4580 -16.4580 -16.2693 -16.2693 -16.2001 -16.2001 5.7466 5.7466 5.8208 5.8208 7.6238 7.6238 7.6870 7.6870 11.2469 11.2469 11.2883 11.2883 12.4529 12.4529 12.4763 12.4763 13.0164 13.0164 13.0506 13.0506 14.1618 14.1618 k =-0.4276 0.3911 0.6603 ( 2856 PWs) bands (ev): -49.7649 -49.7649 -49.7649 -49.7649 -24.0809 -24.0809 -24.0805 -24.0805 -16.5211 -16.5211 -16.4608 -16.4608 -16.2606 -16.2606 -16.1961 -16.1961 5.7135 5.7135 5.7839 5.7839 7.5875 7.5875 7.6482 7.6482 11.2652 11.2652 11.3060 11.3060 12.5253 12.5253 12.5495 12.5495 13.0403 13.0403 13.0700 13.0700 14.1414 14.1414 k =-0.4328 0.3739 0.6603 ( 2860 PWs) bands (ev): -49.7653 -49.7653 -49.7653 -49.7653 -24.0798 -24.0798 -24.0793 -24.0793 -16.5194 -16.5194 -16.4637 -16.4637 -16.2521 -16.2521 -16.1925 -16.1925 5.6824 5.6824 5.7488 5.7488 7.5533 7.5533 7.6112 7.6112 11.2801 11.2801 11.3197 11.3197 12.5939 12.5939 12.6186 12.6186 13.0698 13.0698 13.0958 13.0958 14.1241 14.1241 k =-0.4380 0.3567 0.6603 ( 2856 PWs) bands (ev): -49.7656 -49.7656 -49.7656 -49.7656 -24.0786 -24.0786 -24.0782 -24.0782 -16.5177 -16.5177 -16.4665 -16.4665 -16.2440 -16.2440 -16.1891 -16.1891 5.6535 5.6535 5.7157 5.7157 7.5214 7.5214 7.5761 7.5761 11.2921 11.2921 11.3298 11.3298 12.6581 12.6581 12.6826 12.6826 13.1043 13.1043 13.1275 13.1275 14.1099 14.1099 k =-0.4431 0.3395 0.6603 ( 2860 PWs) bands (ev): -49.7660 -49.7660 -49.7660 -49.7660 -24.0775 -24.0775 -24.0772 -24.0772 -16.5160 -16.5160 -16.4693 -16.4693 -16.2363 -16.2363 -16.1861 -16.1861 5.6269 5.6269 5.6847 5.6847 7.4919 7.4919 7.5431 7.5431 11.3013 11.3013 11.3368 11.3368 12.7174 12.7174 12.7407 12.7407 13.1429 13.1429 13.1647 13.1647 14.0989 14.0989 k =-0.4483 0.3223 0.6603 ( 2868 PWs) bands (ev): -49.7663 -49.7663 -49.7663 -49.7663 -24.0766 -24.0766 -24.0763 -24.0763 -16.5143 -16.5143 -16.4720 -16.4720 -16.2290 -16.2290 -16.1835 -16.1835 5.6026 5.6026 5.6557 5.6557 7.4649 7.4649 7.5123 7.5123 11.3083 11.3083 11.3411 11.3411 12.7714 12.7714 12.7926 12.7926 13.1843 13.1843 13.2063 13.2063 14.0912 14.0912 k =-0.4535 0.3051 0.6603 ( 2864 PWs) bands (ev): -49.7665 -49.7665 -49.7665 -49.7665 -24.0757 -24.0757 -24.0754 -24.0754 -16.5126 -16.5126 -16.4746 -16.4746 -16.2220 -16.2220 -16.1812 -16.1812 5.5807 5.5807 5.6290 5.6290 7.4404 7.4404 7.4838 7.4838 11.3133 11.3133 11.3432 11.3432 12.8199 12.8199 12.8382 12.8382 13.2274 13.2274 13.2510 13.2510 14.0869 14.0869 k =-0.4586 0.2879 0.6603 ( 2868 PWs) bands (ev): -49.7668 -49.7668 -49.7668 -49.7668 -24.0749 -24.0749 -24.0746 -24.0746 -16.5108 -16.5108 -16.4772 -16.4772 -16.2156 -16.2156 -16.1793 -16.1793 5.5612 5.5612 5.6046 5.6046 7.4186 7.4186 7.4577 7.4577 11.3169 11.3169 11.3436 11.3436 12.8628 12.8628 12.8775 12.8775 13.2709 13.2709 13.2971 13.2971 14.0860 14.0860 k =-0.4638 0.2707 0.6603 ( 2860 PWs) bands (ev): -49.7670 -49.7670 -49.7670 -49.7670 -24.0741 -24.0741 -24.0738 -24.0738 -16.5090 -16.5090 -16.4797 -16.4797 -16.2094 -16.2094 -16.1778 -16.1778 5.5442 5.5442 5.5825 5.5825 7.3995 7.3995 7.4342 7.4342 11.3193 11.3193 11.3428 11.3428 12.8999 12.8999 12.9111 12.9111 13.3137 13.3137 13.3425 13.3425 14.0884 14.0884 k =-0.4690 0.2534 0.6603 ( 2856 PWs) bands (ev): -49.7672 -49.7672 -49.7672 -49.7672 -24.0734 -24.0734 -24.0732 -24.0732 -16.5072 -16.5072 -16.4821 -16.4821 -16.2038 -16.2038 -16.1768 -16.1768 5.5298 5.5298 5.5629 5.5629 7.3832 7.3832 7.4132 7.4132 11.3209 11.3209 11.3411 11.3411 12.9315 12.9315 12.9393 12.9393 13.3545 13.3545 13.3852 13.3852 14.0939 14.0939 k =-0.4742 0.2362 0.6603 ( 2856 PWs) bands (ev): -49.7673 -49.7673 -49.7673 -49.7673 -24.0728 -24.0728 -24.0726 -24.0726 -16.5054 -16.5054 -16.4845 -16.4845 -16.1987 -16.1987 -16.1762 -16.1762 5.5180 5.5180 5.5457 5.5457 7.3698 7.3698 7.3950 7.3950 11.3220 11.3220 11.3388 11.3388 12.9576 12.9576 12.9626 12.9626 13.3924 13.3924 13.4235 13.4235 14.1023 14.1023 k =-0.4793 0.2190 0.6603 ( 2860 PWs) bands (ev): -49.7675 -49.7675 -49.7675 -49.7675 -24.0724 -24.0724 -24.0722 -24.0722 -16.5035 -16.5035 -16.4869 -16.4869 -16.1942 -16.1942 -16.1762 -16.1762 5.5088 5.5088 5.5311 5.5311 7.3592 7.3592 7.3795 7.3795 11.3228 11.3228 11.3363 11.3363 12.9784 12.9784 12.9813 12.9813 13.4263 13.4263 13.4555 13.4555 14.1130 14.1130 k =-0.4845 0.2018 0.6603 ( 2864 PWs) bands (ev): -49.7676 -49.7676 -49.7676 -49.7676 -24.0721 -24.0721 -24.0719 -24.0719 -16.5016 -16.5016 -16.4892 -16.4892 -16.1901 -16.1901 -16.1766 -16.1766 5.5023 5.5023 5.5190 5.5190 7.3515 7.3515 7.3668 7.3668 11.3236 11.3236 11.3338 11.3338 12.9942 12.9942 12.9957 12.9957 13.4553 13.4553 13.4802 13.4802 14.1253 14.1253 k =-0.4897 0.1846 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0719 -24.0719 -24.0718 -24.0718 -16.4998 -16.4998 -16.4914 -16.4914 -16.1866 -16.1866 -16.1776 -16.1776 5.4984 5.4984 5.5096 5.5096 7.3467 7.3467 7.3570 7.3570 11.3246 11.3246 11.3313 11.3313 13.0052 13.0052 13.0059 13.0059 13.4784 13.4784 13.4966 13.4966 14.1381 14.1381 k =-0.4948 0.1674 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0717 -24.0717 -24.0717 -24.0717 -16.4978 -16.4978 -16.4936 -16.4936 -16.1836 -16.1836 -16.1791 -16.1791 5.4972 5.4972 5.5028 5.5028 7.3449 7.3449 7.3500 7.3500 11.3258 11.3258 11.3292 11.3292 13.0117 13.0117 13.0120 13.0120 13.4948 13.4948 13.5044 13.5044 14.1501 14.1501 k =-0.5000 0.1502 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4957 -16.4957 -16.4957 -16.4957 -16.1811 -16.1811 -16.1811 -16.1811 5.4986 5.4986 5.4986 5.4986 7.3460 7.3460 7.3460 7.3460 11.3273 11.3273 11.3273 11.3273 13.0139 13.0139 13.0139 13.0139 13.5037 13.5037 13.5037 13.5037 14.1599 14.1599 k =-0.5000 0.1502 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4957 -16.4957 -16.4957 -16.4957 -16.1811 -16.1811 -16.1811 -16.1811 5.4986 5.4986 5.4986 5.4986 7.3460 7.3460 7.3460 7.3460 11.3273 11.3273 11.3273 11.3273 13.0139 13.0139 13.0139 13.0139 13.5037 13.5037 13.5037 13.5037 14.1599 14.1599 k =-0.5000 0.1502 0.6424 ( 2872 PWs) bands (ev): -49.7684 -49.7684 -49.7671 -49.7671 -24.0739 -24.0739 -24.0693 -24.0693 -16.4997 -16.4997 -16.4916 -16.4916 -16.1837 -16.1837 -16.1785 -16.1785 5.4065 5.4065 5.5931 5.5931 7.2340 7.2340 7.4584 7.4584 11.2475 11.2475 11.4085 11.4085 12.9791 12.9791 13.0460 13.0460 13.4907 13.4907 13.5198 13.5198 14.1143 14.1143 k =-0.5000 0.1502 0.6246 ( 2870 PWs) bands (ev): -49.7690 -49.7690 -49.7664 -49.7664 -24.0761 -24.0761 -24.0671 -24.0671 -16.5034 -16.5034 -16.4875 -16.4875 -16.1864 -16.1864 -16.1760 -16.1760 5.3166 5.3166 5.6897 5.6897 7.1225 7.1225 7.5708 7.5708 11.1691 11.1691 11.4908 11.4908 12.9421 12.9421 13.0751 13.0751 13.4811 13.4811 13.5388 13.5388 14.0707 14.0707 k =-0.5000 0.1502 0.6067 ( 2866 PWs) bands (ev): -49.7697 -49.7697 -49.7658 -49.7658 -24.0782 -24.0782 -24.0648 -24.0648 -16.5071 -16.5071 -16.4832 -16.4832 -16.1890 -16.1890 -16.1736 -16.1736 5.2290 5.2290 5.7886 5.7886 7.0120 7.0120 7.6829 7.6829 11.0924 11.0924 11.5741 11.5741 12.9031 12.9031 13.1008 13.1008 13.4748 13.4748 13.5604 13.5604 14.0294 14.0294 k =-0.5000 0.1502 0.5889 ( 2862 PWs) bands (ev): -49.7703 -49.7703 -49.7651 -49.7651 -24.0803 -24.0803 -24.0626 -24.0626 -16.5106 -16.5106 -16.4789 -16.4789 -16.1918 -16.1918 -16.1712 -16.1712 5.1438 5.1438 5.8897 5.8897 6.9026 6.9026 7.7943 7.7943 11.0175 11.0175 11.6582 11.6582 12.8628 12.8628 13.1231 13.1231 13.4716 13.4716 13.5842 13.5842 13.9910 13.9910 k =-0.5000 0.1502 0.5710 ( 2874 PWs) bands (ev): -49.7710 -49.7710 -49.7645 -49.7645 -24.0826 -24.0826 -24.0604 -24.0604 -16.5142 -16.5142 -16.4745 -16.4745 -16.1947 -16.1947 -16.1689 -16.1689 5.0609 5.0609 5.9929 5.9929 6.7945 6.7945 7.9046 7.9046 10.9446 10.9446 11.7428 11.7428 12.8215 12.8215 13.1418 13.1418 13.4712 13.4712 13.6100 13.6100 13.9556 13.9556 k =-0.5000 0.1502 0.5532 ( 2874 PWs) bands (ev): -49.7716 -49.7716 -49.7639 -49.7639 -24.0847 -24.0847 -24.0581 -24.0581 -16.5175 -16.5175 -16.4700 -16.4700 -16.1976 -16.1976 -16.1666 -16.1666 4.9803 4.9803 6.0982 6.0982 6.6881 6.6881 8.0135 8.0135 10.8738 10.8738 11.8279 11.8279 12.7798 12.7798 13.1573 13.1573 13.4730 13.4730 13.6375 13.6375 13.9237 13.9237 k =-0.5000 0.1502 0.5353 ( 2870 PWs) bands (ev): -49.7722 -49.7722 -49.7633 -49.7633 -24.0867 -24.0867 -24.0559 -24.0559 -16.5207 -16.5207 -16.4654 -16.4654 -16.2005 -16.2005 -16.1644 -16.1644 4.9021 4.9021 6.2055 6.2055 6.5836 6.5836 8.1204 8.1204 10.8053 10.8053 11.9129 11.9129 12.7380 12.7380 13.1696 13.1696 13.4761 13.4761 13.6663 13.6663 13.8957 13.8957 k =-0.5000 0.1502 0.5175 ( 2870 PWs) bands (ev): -49.7729 -49.7729 -49.7626 -49.7626 -24.0887 -24.0887 -24.0537 -24.0537 -16.5237 -16.5237 -16.4607 -16.4607 -16.2036 -16.2036 -16.1622 -16.1622 4.8263 4.8263 6.3141 6.3141 6.4819 6.4819 8.2250 8.2250 10.7393 10.7393 11.9978 11.9978 12.6967 12.6967 13.1792 13.1792 13.4798 13.4798 13.6958 13.6958 13.8720 13.8720 k =-0.5000 0.1502 0.4997 ( 2874 PWs) bands (ev): -49.7735 -49.7735 -49.7620 -49.7620 -24.0907 -24.0907 -24.0515 -24.0515 -16.5267 -16.5267 -16.4560 -16.4560 -16.2067 -16.2067 -16.1602 -16.1602 4.7529 4.7529 6.3727 6.3727 6.4343 6.4343 8.3265 8.3265 10.6760 10.6760 12.0819 12.0819 12.6563 12.6563 13.1862 13.1862 13.4832 13.4832 13.7252 13.7252 13.8534 13.8534 k =-0.5000 0.1502 0.4818 ( 2874 PWs) bands (ev): -49.7741 -49.7741 -49.7615 -49.7615 -24.0927 -24.0927 -24.0494 -24.0494 -16.5295 -16.5295 -16.4511 -16.4511 -16.2098 -16.2098 -16.1582 -16.1582 4.6819 4.6819 6.2792 6.2792 6.5432 6.5432 8.4247 8.4247 10.6157 10.6157 12.1647 12.1647 12.6174 12.6174 13.1905 13.1905 13.4861 13.4861 13.7519 13.7519 13.8422 13.8422 k =-0.5000 0.1502 0.4640 ( 2870 PWs) bands (ev): -49.7747 -49.7747 -49.7609 -49.7609 -24.0945 -24.0945 -24.0472 -24.0472 -16.5321 -16.5321 -16.4463 -16.4463 -16.2130 -16.2130 -16.1562 -16.1562 4.6134 4.6134 6.1837 6.1837 6.6585 6.6585 8.5187 8.5187 10.5584 10.5584 12.2453 12.2453 12.5806 12.5806 13.1922 13.1922 13.4885 13.4885 13.7702 13.7702 13.8437 13.8437 k =-0.5000 0.1502 0.4461 ( 2862 PWs) bands (ev): -49.7753 -49.7753 -49.7603 -49.7603 -24.0962 -24.0962 -24.0450 -24.0450 -16.5345 -16.5345 -16.4413 -16.4413 -16.2162 -16.2162 -16.1542 -16.1542 4.5473 4.5473 6.0904 6.0904 6.7761 6.7761 8.6081 8.6081 10.5046 10.5046 12.3222 12.3222 12.5470 12.5470 13.1908 13.1908 13.4905 13.4905 13.7761 13.7761 13.8615 13.8615 k =-0.5000 0.1502 0.4283 ( 2864 PWs) bands (ev): -49.7758 -49.7758 -49.7597 -49.7597 -24.0981 -24.0981 -24.0430 -24.0430 -16.5370 -16.5370 -16.4363 -16.4363 -16.2195 -16.2195 -16.1524 -16.1524 4.4836 4.4836 5.9997 5.9997 6.8958 6.8958 8.6922 8.6922 10.4543 10.4543 12.3914 12.3914 12.5196 12.5196 13.1862 13.1862 13.4930 13.4930 13.7758 13.7758 13.8888 13.8888 k =-0.5000 0.1502 0.4104 ( 2860 PWs) bands (ev): -49.7764 -49.7764 -49.7592 -49.7592 -24.0998 -24.0998 -24.0409 -24.0409 -16.5392 -16.5392 -16.4313 -16.4313 -16.2228 -16.2228 -16.1506 -16.1506 4.4224 4.4224 5.9117 5.9117 7.0174 7.0174 8.7705 8.7705 10.4080 10.4080 12.4355 12.4355 12.5144 12.5144 13.1785 13.1785 13.4968 13.4968 13.7756 13.7756 13.9187 13.9187 k =-0.5000 0.1502 0.3926 ( 2858 PWs) bands (ev): -49.7769 -49.7769 -49.7587 -49.7587 -24.1014 -24.1014 -24.0389 -24.0389 -16.5414 -16.5414 -16.4263 -16.4263 -16.2262 -16.2262 -16.1489 -16.1489 4.3638 4.3638 5.8267 5.8267 7.1408 7.1408 8.8423 8.8423 10.3658 10.3658 12.4317 12.4317 12.5515 12.5515 13.1690 13.1690 13.5028 13.5028 13.7782 13.7782 13.9481 13.9481 k =-0.5000 0.1502 0.3747 ( 2860 PWs) bands (ev): -49.7774 -49.7774 -49.7582 -49.7582 -24.1030 -24.1030 -24.0371 -24.0371 -16.5434 -16.5434 -16.4212 -16.4212 -16.2297 -16.2297 -16.1472 -16.1472 4.3076 4.3076 5.7447 5.7447 7.2661 7.2661 8.9072 8.9072 10.3279 10.3279 12.4123 12.4123 12.5947 12.5947 13.1605 13.1605 13.5116 13.5116 13.7845 13.7845 13.9750 13.9750 k =-0.5000 0.1502 0.3569 ( 2860 PWs) bands (ev): -49.7779 -49.7779 -49.7577 -49.7577 -24.1045 -24.1045 -24.0352 -24.0352 -16.5453 -16.5453 -16.4161 -16.4161 -16.2332 -16.2332 -16.1456 -16.1456 4.2539 4.2539 5.6659 5.6659 7.3931 7.3931 8.9646 8.9646 10.2946 10.2946 12.3921 12.3921 12.6237 12.6237 13.1580 13.1580 13.5238 13.5238 13.7950 13.7950 13.9982 13.9982 k =-0.5000 0.1502 0.3391 ( 2862 PWs) bands (ev): -49.7784 -49.7784 -49.7572 -49.7572 -24.1061 -24.1061 -24.0334 -24.0334 -16.5471 -16.5471 -16.4110 -16.4110 -16.2369 -16.2369 -16.1441 -16.1441 4.2028 4.2028 5.5903 5.5903 7.5218 7.5218 9.0144 9.0144 10.2659 10.2659 12.3739 12.3739 12.6301 12.6301 13.1667 13.1667 13.5393 13.5393 13.8100 13.8100 14.0170 14.0170 k =-0.5000 0.1502 0.3212 ( 2862 PWs) bands (ev): -49.7789 -49.7789 -49.7568 -49.7568 -24.1075 -24.1075 -24.0316 -24.0316 -16.5488 -16.5488 -16.4059 -16.4059 -16.2405 -16.2405 -16.1426 -16.1426 4.1542 4.1542 5.5180 5.5180 7.6520 7.6520 9.0564 9.0564 10.2418 10.2418 12.3583 12.3583 12.6105 12.6105 13.1894 13.1894 13.5582 13.5582 13.8295 13.8295 14.0311 14.0311 k =-0.5000 0.1502 0.3034 ( 2866 PWs) bands (ev): -49.7794 -49.7794 -49.7563 -49.7563 -24.1089 -24.1089 -24.0300 -24.0300 -16.5503 -16.5503 -16.4008 -16.4008 -16.2442 -16.2442 -16.1413 -16.1413 4.1081 4.1081 5.4492 5.4492 7.7838 7.7838 9.0907 9.0907 10.2222 10.2222 12.3453 12.3453 12.5665 12.5665 13.2245 13.2245 13.5802 13.5802 13.8531 13.8531 14.0408 14.0408 k =-0.5000 0.1502 0.2855 ( 2870 PWs) bands (ev): -49.7798 -49.7798 -49.7559 -49.7559 -24.1102 -24.1102 -24.0285 -24.0285 -16.5518 -16.5518 -16.3958 -16.3958 -16.2480 -16.2480 -16.1399 -16.1399 4.0646 4.0646 5.3839 5.3839 7.9169 7.9169 9.1177 9.1177 10.2067 10.2067 12.3348 12.3348 12.5024 12.5024 13.2679 13.2679 13.6052 13.6052 13.8806 13.8806 14.0468 14.0468 k =-0.5000 0.1502 0.2677 ( 2864 PWs) bands (ev): -49.7802 -49.7802 -49.7555 -49.7555 -24.1113 -24.1113 -24.0269 -24.0269 -16.5531 -16.5531 -16.3906 -16.3906 -16.2518 -16.2518 -16.1386 -16.1386 4.0237 4.0237 5.3221 5.3221 8.0512 8.0512 9.1378 9.1378 10.1949 10.1949 12.3266 12.3266 12.4228 12.4228 13.3154 13.3154 13.6330 13.6330 13.9114 13.9114 14.0503 14.0503 k =-0.5000 0.1502 0.2498 ( 2864 PWs) bands (ev): -49.7806 -49.7806 -49.7552 -49.7552 -24.1125 -24.1125 -24.0254 -24.0254 -16.5543 -16.5543 -16.3855 -16.3855 -16.2557 -16.2557 -16.1375 -16.1375 3.9854 3.9854 5.2641 5.2641 8.1867 8.1867 9.1520 9.1520 10.1863 10.1863 12.3151 12.3151 12.3364 12.3364 13.3638 13.3638 13.6634 13.6634 13.9444 13.9444 14.0526 14.0526 k =-0.5000 0.1502 0.2320 ( 2860 PWs) bands (ev): -49.7809 -49.7809 -49.7548 -49.7548 -24.1135 -24.1135 -24.0240 -24.0240 -16.5554 -16.5554 -16.3804 -16.3804 -16.2596 -16.2596 -16.1363 -16.1363 3.9497 3.9497 5.2097 5.2097 8.3230 8.3230 9.1609 9.1609 10.1803 10.1803 12.2266 12.2266 12.3195 12.3195 13.4106 13.4106 13.6961 13.6961 13.9776 13.9776 14.0565 14.0565 k =-0.5000 0.1502 0.2141 ( 2858 PWs) bands (ev): -49.7813 -49.7813 -49.7545 -49.7545 -24.1145 -24.1145 -24.0227 -24.0227 -16.5565 -16.5565 -16.3753 -16.3753 -16.2636 -16.2636 -16.1352 -16.1352 3.9166 3.9166 5.1591 5.1591 8.4600 8.4600 9.1655 9.1655 10.1764 10.1764 12.1179 12.1179 12.3169 12.3169 13.4543 13.4543 13.7306 13.7306 14.0054 14.0054 14.0673 14.0673 k =-0.5000 0.1502 0.1963 ( 2856 PWs) bands (ev): -49.7816 -49.7816 -49.7542 -49.7542 -24.1154 -24.1154 -24.0215 -24.0215 -16.5574 -16.5574 -16.3703 -16.3703 -16.2676 -16.2676 -16.1342 -16.1342 3.8861 3.8861 5.1124 5.1124 8.5974 8.5974 9.1667 9.1667 10.1739 10.1739 12.0027 12.0027 12.3162 12.3162 13.4939 13.4939 13.7665 13.7665 14.0206 14.0206 14.0925 14.0925 k =-0.5000 0.1502 0.1784 ( 2860 PWs) bands (ev): -49.7819 -49.7819 -49.7539 -49.7539 -24.1164 -24.1164 -24.0204 -24.0204 -16.5583 -16.5583 -16.3653 -16.3653 -16.2717 -16.2717 -16.1333 -16.1333 3.8582 3.8582 5.0695 5.0695 8.7346 8.7346 9.1655 9.1655 10.1724 10.1724 11.8829 11.8829 12.3165 12.3165 13.5290 13.5290 13.8029 13.8029 14.0264 14.0264 14.1284 14.1284 k =-0.5000 0.1502 0.1606 ( 2866 PWs) bands (ev): -49.7821 -49.7821 -49.7537 -49.7537 -24.1172 -24.1172 -24.0194 -24.0194 -16.5590 -16.5590 -16.3604 -16.3604 -16.2758 -16.2758 -16.1326 -16.1326 3.8329 3.8329 5.0306 5.0306 8.8712 8.8712 9.1628 9.1628 10.1717 10.1717 11.7598 11.7598 12.3177 12.3177 13.5595 13.5595 13.8389 13.8389 14.0292 14.0292 14.1682 14.1682 k =-0.5000 0.1502 0.1428 ( 2862 PWs) bands (ev): -49.7823 -49.7823 -49.7535 -49.7535 -24.1179 -24.1179 -24.0185 -24.0185 -16.5597 -16.5597 -16.3554 -16.3554 -16.2799 -16.2799 -16.1318 -16.1318 3.8103 3.8103 4.9957 4.9957 9.0052 9.0052 9.1604 9.1604 10.1714 10.1714 11.6346 11.6346 12.3194 12.3194 13.5853 13.5853 13.8737 13.8737 14.0317 14.0317 14.2087 14.2087 k =-0.5000 0.1502 0.1249 ( 2862 PWs) bands (ev): -49.7826 -49.7826 -49.7533 -49.7533 -24.1184 -24.1184 -24.0178 -24.0178 -16.5602 -16.5602 -16.3506 -16.3506 -16.2841 -16.2841 -16.1312 -16.1312 3.7904 3.7904 4.9648 4.9648 9.1204 9.1204 9.1743 9.1743 10.1713 10.1713 11.5089 11.5089 12.3215 12.3215 13.6068 13.6068 13.9062 13.9062 14.0347 14.0347 14.2480 14.2480 k =-0.5000 0.1502 0.1071 ( 2868 PWs) bands (ev): -49.7827 -49.7827 -49.7531 -49.7531 -24.1190 -24.1190 -24.0171 -24.0171 -16.5608 -16.5608 -16.3458 -16.3458 -16.2884 -16.2884 -16.1307 -16.1307 3.7731 3.7731 4.9379 4.9379 9.1396 9.1396 9.2810 9.2810 10.1712 10.1712 11.3842 11.3842 12.3236 12.3236 13.6243 13.6243 13.9355 13.9355 14.0385 14.0385 14.2849 14.2849 k =-0.5000 0.1502 0.0892 ( 2860 PWs) bands (ev): -49.7829 -49.7829 -49.7530 -49.7530 -24.1194 -24.1194 -24.0164 -24.0164 -16.5611 -16.5611 -16.3410 -16.3410 -16.2926 -16.2926 -16.1301 -16.1301 3.7584 3.7584 4.9152 4.9152 9.1370 9.1370 9.4048 9.4048 10.1713 10.1713 11.2630 11.2630 12.3257 12.3257 13.6382 13.6382 13.9610 13.9610 14.0431 14.0431 14.3183 14.3183 k =-0.5000 0.1502 0.0714 ( 2860 PWs) bands (ev): -49.7830 -49.7830 -49.7528 -49.7528 -24.1197 -24.1197 -24.0160 -24.0160 -16.5614 -16.5614 -16.3364 -16.3364 -16.2968 -16.2968 -16.1298 -16.1298 3.7464 3.7464 4.8965 4.8965 9.1332 9.1332 9.5224 9.5224 10.1713 10.1713 11.1482 11.1482 12.3276 12.3276 13.6489 13.6489 13.9818 13.9818 14.0484 14.0484 14.3471 14.3471 k =-0.5000 0.1502 0.0535 ( 2860 PWs) bands (ev): -49.7831 -49.7831 -49.7527 -49.7527 -24.1200 -24.1200 -24.0156 -24.0156 -16.5617 -16.5617 -16.3320 -16.3320 -16.3009 -16.3009 -16.1295 -16.1295 3.7371 3.7371 4.8819 4.8819 9.1297 9.1297 9.6282 9.6282 10.1714 10.1714 11.0447 11.0447 12.3291 12.3291 13.6567 13.6567 13.9976 13.9976 14.0539 14.0539 14.3705 14.3705 k =-0.5000 0.1502 0.0357 ( 2856 PWs) bands (ev): -49.7832 -49.7832 -49.7527 -49.7527 -24.1202 -24.1202 -24.0153 -24.0153 -16.5618 -16.5618 -16.3279 -16.3279 -16.3047 -16.3047 -16.1292 -16.1292 3.7304 3.7304 4.8715 4.8715 9.1271 9.1271 9.7150 9.7150 10.1714 10.1714 10.9593 10.9593 12.3303 12.3303 13.6621 13.6621 14.0084 14.0084 14.0589 14.0589 14.3878 14.3878 k =-0.5000 0.1502 0.0178 ( 2854 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1203 -24.1203 -24.0151 -24.0151 -16.5619 -16.5619 -16.3246 -16.3246 -16.3079 -16.3079 -16.1290 -16.1290 3.7264 3.7264 4.8653 4.8653 9.1254 9.1254 9.7737 9.7737 10.1714 10.1714 10.9015 10.9015 12.3311 12.3311 13.6652 13.6652 14.0145 14.0145 14.0624 14.0624 14.3984 14.3984 k =-0.5000 0.1502-0.0000 ( 2856 PWs) bands (ev): -49.7832 -49.7832 -49.7526 -49.7526 -24.1204 -24.1204 -24.0151 -24.0151 -16.5620 -16.5620 -16.3231 -16.3231 -16.3093 -16.3093 -16.1290 -16.1290 3.7251 3.7251 4.8632 4.8632 9.1248 9.1248 9.7947 9.7947 10.1715 10.1715 10.8808 10.8808 12.3313 12.3313 13.6662 13.6662 14.0165 14.0165 14.0637 14.0637 14.4020 14.4020 k = 0.0000 0.0000 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4880 -16.4880 -16.4880 -16.4880 -16.1881 -16.1881 -16.1881 -16.1881 4.8950 4.8950 4.8950 4.8950 8.7763 8.7763 8.7763 8.7763 10.3992 10.3992 10.3992 10.3992 12.9199 12.9199 12.9199 12.9199 13.3767 13.3767 13.3767 13.3767 14.6732 14.6733 k =-0.0167 0.0050 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4880 -16.4880 -16.4880 -16.4880 -16.1881 -16.1881 -16.1881 -16.1881 4.8962 4.8962 4.8962 4.8962 8.7712 8.7712 8.7712 8.7712 10.4033 10.4033 10.4033 10.4033 12.9206 12.9206 12.9206 12.9206 13.3767 13.3767 13.3767 13.3767 14.6704 14.6704 k =-0.0333 0.0100 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4881 -16.4881 -16.4881 -16.4881 -16.1880 -16.1880 -16.1880 -16.1880 4.8998 4.8998 4.8998 4.8998 8.7563 8.7563 8.7563 8.7563 10.4152 10.4152 10.4152 10.4152 12.9228 12.9228 12.9228 12.9228 13.3767 13.3767 13.3767 13.3767 14.6619 14.6619 k =-0.0500 0.0150 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4882 -16.4882 -16.4882 -16.4882 -16.1879 -16.1879 -16.1879 -16.1879 4.9058 4.9058 4.9058 4.9058 8.7321 8.7321 8.7321 8.7321 10.4346 10.4346 10.4346 10.4346 12.9265 12.9265 12.9265 12.9265 13.3766 13.3766 13.3766 13.3766 14.6481 14.6481 k =-0.0667 0.0200 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4883 -16.4883 -16.4883 -16.4883 -16.1878 -16.1878 -16.1878 -16.1878 4.9141 4.9141 4.9141 4.9141 8.6992 8.6992 8.6992 8.6992 10.4606 10.4606 10.4606 10.4606 12.9316 12.9316 12.9316 12.9316 13.3764 13.3764 13.3764 13.3764 14.6293 14.6293 k =-0.0833 0.0250 0.6603 ( 2866 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4886 -16.4886 -16.4886 -16.4886 -16.1876 -16.1876 -16.1876 -16.1876 4.9248 4.9248 4.9248 4.9248 8.6587 8.6587 8.6587 8.6587 10.4923 10.4923 10.4923 10.4923 12.9380 12.9380 12.9380 12.9380 13.3762 13.3762 13.3763 13.3763 14.6063 14.6063 k =-0.1000 0.0300 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4888 -16.4888 -16.4888 -16.4888 -16.1874 -16.1874 -16.1874 -16.1874 4.9378 4.9378 4.9378 4.9378 8.6115 8.6115 8.6115 8.6115 10.5289 10.5289 10.5289 10.5289 12.9457 12.9457 12.9457 12.9457 13.3760 13.3760 13.3760 13.3760 14.5796 14.5796 k =-0.1167 0.0350 0.6603 ( 2854 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4890 -16.4890 -16.4890 -16.4890 -16.1871 -16.1871 -16.1871 -16.1871 4.9530 4.9530 4.9530 4.9530 8.5586 8.5586 8.5586 8.5586 10.5693 10.5693 10.5693 10.5693 12.9545 12.9545 12.9545 12.9545 13.3757 13.3757 13.3757 13.3757 14.5501 14.5501 k =-0.1333 0.0400 0.6603 ( 2860 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0712 -24.0712 -24.0712 -24.0712 -16.4893 -16.4893 -16.4893 -16.4893 -16.1869 -16.1869 -16.1869 -16.1869 4.9703 4.9703 4.9703 4.9703 8.5009 8.5009 8.5009 8.5009 10.6127 10.6127 10.6127 10.6127 12.9644 12.9644 12.9644 12.9644 13.3754 13.3754 13.3754 13.3754 14.5184 14.5184 k =-0.1500 0.0451 0.6603 ( 2860 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4896 -16.4896 -16.4896 -16.4896 -16.1866 -16.1866 -16.1866 -16.1866 4.9898 4.9898 4.9898 4.9898 8.4394 8.4394 8.4394 8.4394 10.6582 10.6582 10.6582 10.6582 12.9750 12.9750 12.9750 12.9750 13.3750 13.3750 13.3750 13.3750 14.4855 14.4855 k =-0.1667 0.0501 0.6603 ( 2860 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4899 -16.4899 -16.4899 -16.4899 -16.1863 -16.1863 -16.1863 -16.1863 5.0112 5.0112 5.0112 5.0112 8.3748 8.3748 8.3748 8.3748 10.7051 10.7051 10.7051 10.7051 12.9863 12.9863 12.9863 12.9863 13.3747 13.3747 13.3747 13.3747 14.4520 14.4520 k =-0.1833 0.0551 0.6603 ( 2874 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0714 -24.0714 -24.0714 -24.0714 -16.4904 -16.4904 -16.4904 -16.4904 -16.1861 -16.1861 -16.1861 -16.1861 5.0346 5.0346 5.0346 5.0346 8.3079 8.3079 8.3079 8.3079 10.7527 10.7527 10.7527 10.7527 12.9979 12.9979 12.9979 12.9979 13.3745 13.3745 13.3745 13.3745 14.4186 14.4186 k =-0.2000 0.0601 0.6603 ( 2870 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0714 -24.0714 -24.0714 -24.0714 -16.4907 -16.4907 -16.4907 -16.4907 -16.1857 -16.1857 -16.1857 -16.1857 5.0596 5.0596 5.0596 5.0596 8.2393 8.2393 8.2393 8.2393 10.8006 10.8006 10.8006 10.8006 13.0096 13.0096 13.0096 13.0096 13.3746 13.3746 13.3746 13.3746 14.3860 14.3860 k =-0.2167 0.0651 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4911 -16.4911 -16.4911 -16.4911 -16.1852 -16.1852 -16.1852 -16.1852 5.0864 5.0864 5.0864 5.0864 8.1697 8.1697 8.1697 8.1697 10.8482 10.8482 10.8482 10.8482 13.0209 13.0209 13.0209 13.0209 13.3750 13.3750 13.3750 13.3750 14.3548 14.3548 k =-0.2333 0.0701 0.6603 ( 2858 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4914 -16.4914 -16.4914 -16.4914 -16.1849 -16.1849 -16.1849 -16.1849 5.1145 5.1145 5.1145 5.1145 8.0995 8.0995 8.0995 8.0995 10.8951 10.8951 10.8951 10.8951 13.0315 13.0315 13.0315 13.0315 13.3761 13.3761 13.3762 13.3762 14.3254 14.3254 k =-0.2500 0.0751 0.6603 ( 2858 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0713 -24.0713 -24.0713 -24.0713 -16.4918 -16.4918 -16.4918 -16.4918 -16.1845 -16.1845 -16.1845 -16.1845 5.1439 5.1439 5.1439 5.1439 8.0293 8.0293 8.0293 8.0293 10.9409 10.9409 10.9409 10.9409 13.0409 13.0409 13.0409 13.0409 13.3782 13.3782 13.3782 13.3782 14.2983 14.2983 k =-0.2667 0.0801 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0714 -24.0714 -24.0714 -24.0714 -16.4923 -16.4923 -16.4923 -16.4923 -16.1841 -16.1841 -16.1841 -16.1841 5.1744 5.1744 5.1744 5.1744 7.9596 7.9596 7.9596 7.9596 10.9852 10.9852 10.9852 10.9852 13.0487 13.0487 13.0487 13.0487 13.3816 13.3816 13.3816 13.3816 14.2737 14.2737 k =-0.2833 0.0851 0.6603 ( 2864 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0714 -24.0714 -24.0714 -24.0714 -16.4927 -16.4927 -16.4927 -16.4927 -16.1838 -16.1838 -16.1838 -16.1838 5.2056 5.2056 5.2056 5.2056 7.8910 7.8910 7.8910 7.8910 11.0279 11.0279 11.0279 11.0279 13.0544 13.0544 13.0544 13.0544 13.3864 13.3864 13.3864 13.3864 14.2519 14.2519 k =-0.3000 0.0901 0.6603 ( 2868 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4931 -16.4931 -16.4931 -16.4931 -16.1834 -16.1834 -16.1834 -16.1834 5.2373 5.2373 5.2373 5.2373 7.8239 7.8239 7.8239 7.8239 11.0686 11.0686 11.0686 11.0686 13.0579 13.0579 13.0579 13.0579 13.3930 13.3930 13.3930 13.3930 14.2329 14.2329 k =-0.3167 0.0951 0.6603 ( 2864 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4934 -16.4934 -16.4934 -16.4934 -16.1831 -16.1831 -16.1831 -16.1831 5.2692 5.2692 5.2692 5.2692 7.7589 7.7589 7.7589 7.7589 11.1071 11.1071 11.1071 11.1071 13.0590 13.0590 13.0590 13.0590 13.4014 13.4014 13.4014 13.4014 14.2166 14.2166 k =-0.3333 0.1001 0.6603 ( 2864 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4938 -16.4938 -16.4938 -16.4938 -16.1828 -16.1828 -16.1828 -16.1828 5.3009 5.3009 5.3009 5.3009 7.6964 7.6964 7.6964 7.6964 11.1431 11.1431 11.1431 11.1431 13.0578 13.0578 13.0578 13.0578 13.4115 13.4115 13.4115 13.4115 14.2029 14.2029 k =-0.3500 0.1051 0.6603 ( 2864 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4941 -16.4941 -16.4941 -16.4941 -16.1824 -16.1824 -16.1824 -16.1824 5.3319 5.3319 5.3319 5.3319 7.6371 7.6371 7.6371 7.6371 11.1764 11.1764 11.1764 11.1764 13.0546 13.0546 13.0546 13.0546 13.4229 13.4229 13.4229 13.4229 14.1918 14.1918 k =-0.3667 0.1101 0.6603 ( 2868 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4945 -16.4945 -16.4945 -16.4945 -16.1822 -16.1822 -16.1822 -16.1822 5.3619 5.3619 5.3619 5.3619 7.5816 7.5816 7.5816 7.5816 11.2068 11.2068 11.2068 11.2068 13.0499 13.0499 13.0499 13.0499 13.4352 13.4352 13.4352 13.4352 14.1829 14.1829 k =-0.3833 0.1151 0.6603 ( 2862 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0715 -24.0715 -24.0715 -24.0715 -16.4947 -16.4947 -16.4947 -16.4947 -16.1819 -16.1819 -16.1819 -16.1819 5.3902 5.3902 5.3902 5.3902 7.5304 7.5304 7.5304 7.5304 11.2342 11.2342 11.2342 11.2342 13.0442 13.0442 13.0442 13.0442 13.4480 13.4480 13.4480 13.4480 14.1759 14.1759 k =-0.4000 0.1201 0.6603 ( 2870 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4950 -16.4950 -16.4950 -16.4950 -16.1817 -16.1817 -16.1817 -16.1817 5.4165 5.4165 5.4165 5.4165 7.4843 7.4843 7.4843 7.4843 11.2583 11.2583 11.2583 11.2583 13.0379 13.0379 13.0379 13.0379 13.4605 13.4605 13.4605 13.4605 14.1706 14.1706 k =-0.4167 0.1251 0.6603 ( 2874 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4952 -16.4952 -16.4952 -16.4952 -16.1815 -16.1815 -16.1815 -16.1815 5.4400 5.4400 5.4400 5.4400 7.4438 7.4438 7.4438 7.4438 11.2791 11.2791 11.2791 11.2791 13.0316 13.0316 13.0316 13.0316 13.4724 13.4724 13.4724 13.4724 14.1667 14.1667 k =-0.4333 0.1301 0.6603 ( 2868 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4954 -16.4954 -16.4954 -16.4954 -16.1813 -16.1813 -16.1813 -16.1813 5.4602 5.4602 5.4602 5.4602 7.4095 7.4095 7.4095 7.4095 11.2963 11.2963 11.2963 11.2963 13.0258 13.0258 13.0258 13.0258 13.4829 13.4829 13.4829 13.4829 14.1639 14.1639 k =-0.4500 0.1352 0.6603 ( 2868 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4955 -16.4955 -16.4955 -16.4955 -16.1812 -16.1812 -16.1812 -16.1812 5.4766 5.4766 5.4766 5.4766 7.3822 7.3822 7.3822 7.3822 11.3098 11.3098 11.3098 11.3098 13.0209 13.0209 13.0209 13.0209 13.4917 13.4917 13.4917 13.4917 14.1620 14.1620 k =-0.4667 0.1402 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4956 -16.4956 -16.4956 -16.4956 -16.1812 -16.1812 -16.1812 -16.1812 5.4887 5.4887 5.4887 5.4887 7.3622 7.3622 7.3622 7.3622 11.3195 11.3195 11.3195 11.3195 13.0171 13.0171 13.0171 13.0171 13.4982 13.4982 13.4982 13.4982 14.1607 14.1608 k =-0.4833 0.1452 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4957 -16.4957 -16.4957 -16.4957 -16.1811 -16.1811 -16.1811 -16.1811 5.4961 5.4961 5.4961 5.4961 7.3501 7.3501 7.3501 7.3501 11.3253 11.3253 11.3253 11.3253 13.0147 13.0147 13.0147 13.0147 13.5023 13.5023 13.5023 13.5023 14.1601 14.1601 k =-0.5000 0.1502 0.6603 ( 2872 PWs) bands (ev): -49.7677 -49.7677 -49.7677 -49.7677 -24.0716 -24.0716 -24.0716 -24.0716 -16.4957 -16.4957 -16.4957 -16.4957 -16.1811 -16.1811 -16.1811 -16.1811 5.4986 5.4986 5.4986 5.4986 7.3460 7.3460 7.3460 7.3460 11.3273 11.3273 11.3273 11.3273 13.0139 13.0139 13.0139 13.0139 13.5037 13.5037 13.5037 13.5037 14.1599 14.1599 Writing output data file HfAl.save init_run : 1.48s CPU 12.69s WALL ( 1 calls) electrons : 404.07s CPU 411.52s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.27s CPU 1.47s WALL ( 1 calls) Called by electrons: c_bands : 404.04s CPU 411.10s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.95s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.02s CPU 0.55s WALL ( 1 calls) newd : 0.21s CPU 0.49s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 446 calls) cegterg : 347.48s CPU 350.03s WALL ( 841 calls) Called by sum_band: Called by *egterg: h_psi : 174.49s CPU 181.22s WALL ( 12938 calls) s_psi : 15.57s CPU 16.15s WALL ( 12938 calls) g_psi : 0.39s CPU 0.47s WALL ( 11651 calls) cdiaghg : 116.48s CPU 114.25s WALL ( 12097 calls) cegterg:over : 29.77s CPU 26.34s WALL ( 11651 calls) cegterg:upda : 3.94s CPU 6.87s WALL ( 11651 calls) cegterg:last : 4.44s CPU 5.35s WALL ( 2417 calls) Called by h_psi: h_psi:vloc : 143.42s CPU 149.12s WALL ( 12938 calls) h_psi:vnl : 30.93s CPU 31.64s WALL ( 12938 calls) add_vuspsi : 8.36s CPU 12.40s WALL ( 12938 calls) General routines calbec : 22.52s CPU 19.15s WALL ( 12938 calls) fft : 0.19s CPU 1.18s WALL ( 19 calls) ffts : 0.01s CPU 0.08s WALL ( 4 calls) fftw : 135.55s CPU 140.00s WALL ( 1103184 calls) interpolate : 0.01s CPU 0.10s WALL ( 4 calls) davcio : 0.07s CPU 3.31s WALL ( 892 calls) Parallel routines fft_scatter : 79.72s CPU 82.52s WALL ( 1103207 calls) PWSCF : 7m39.14s CPU 10m18.77s WALL This run was terminated on: 4:56:35 21Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=