Program PWSCF v.5.1.1 starts on 25Nov2015 at 11:31:24 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: ./BixBO2x3.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 33 19 5 1530 666 102 Max 34 20 6 1540 685 109 Sum 1629 937 273 73793 32449 5065 bravais-lattice index = 14 lattice parameter (alat) = 8.2031 a.u. unit-cell volume = 745.3658 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 50.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.203094 celldm(2)= 1.000000 celldm(3)= 1.496237 celldm(4)= 0.217289 celldm(5)= 0.217289 celldm(6)= 0.352723 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.352723 0.935728 0.000000 ) a(3) = ( 0.325116 0.224895 1.443068 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.376950 -0.166549 ) b(2) = ( 0.000000 1.068687 -0.166549 ) b(3) = ( 0.000000 0.000000 0.692968 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Bi read from file: /home/autes/Pseudo/Bi_MT_PBE.UPF MD5 check sum: b574f8a1102dd4d1778b4090b55884d0 Pseudo is Norm-conserving, Zval = 5.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1283 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 3 for B read from file: /home/autes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c 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 1059 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 O 6.00 15.99940 O( 1.00) Bi 5.00 208.98040 Bi( 1.00) B 3.00 10.81100 B( 1.00) No symmetry found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 338 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 2) = ( 0.0108696 0.0075189 -0.0036206), wk = 0.0029586 k( 3) = ( 0.0217391 0.0150378 -0.0072413), wk = 0.0029586 k( 4) = ( 0.0326087 0.0225566 -0.0108619), wk = 0.0029586 k( 5) = ( 0.0434783 0.0300755 -0.0144825), wk = 0.0029586 k( 6) = ( 0.0543478 0.0375944 -0.0181032), wk = 0.0029586 k( 7) = ( 0.0652174 0.0451133 -0.0217238), wk = 0.0029586 k( 8) = ( 0.0760870 0.0526321 -0.0253445), wk = 0.0029586 k( 9) = ( 0.0869565 0.0601510 -0.0289651), wk = 0.0029586 k( 10) = ( 0.0978261 0.0676699 -0.0325857), wk = 0.0029586 k( 11) = ( 0.1086957 0.0751888 -0.0362064), wk = 0.0029586 k( 12) = ( 0.1195652 0.0827077 -0.0398270), wk = 0.0029586 k( 13) = ( 0.1304348 0.0902265 -0.0434476), wk = 0.0029586 k( 14) = ( 0.1413043 0.0977454 -0.0470683), wk = 0.0029586 k( 15) = ( 0.1521739 0.1052643 -0.0506889), wk = 0.0029586 k( 16) = ( 0.1630435 0.1127832 -0.0543096), wk = 0.0029586 k( 17) = ( 0.1739130 0.1203020 -0.0579302), wk = 0.0029586 k( 18) = ( 0.1847826 0.1278209 -0.0615508), wk = 0.0029586 k( 19) = ( 0.1956522 0.1353398 -0.0651715), wk = 0.0029586 k( 20) = ( 0.2065217 0.1428587 -0.0687921), wk = 0.0029586 k( 21) = ( 0.2173913 0.1503775 -0.0724127), wk = 0.0029586 k( 22) = ( 0.2282609 0.1578964 -0.0760334), wk = 0.0029586 k( 23) = ( 0.2391304 0.1654153 -0.0796540), wk = 0.0029586 k( 24) = ( 0.2500000 0.1729342 -0.0832747), wk = 0.0029586 k( 25) = ( 0.2608696 0.1804531 -0.0868953), wk = 0.0029586 k( 26) = ( 0.2717391 0.1879719 -0.0905159), wk = 0.0029586 k( 27) = ( 0.2826087 0.1954908 -0.0941366), wk = 0.0029586 k( 28) = ( 0.2934783 0.2030097 -0.0977572), wk = 0.0029586 k( 29) = ( 0.3043478 0.2105286 -0.1013778), wk = 0.0029586 k( 30) = ( 0.3152174 0.2180474 -0.1049985), wk = 0.0029586 k( 31) = ( 0.3260870 0.2255663 -0.1086191), wk = 0.0029586 k( 32) = ( 0.3369565 0.2330852 -0.1122398), wk = 0.0029586 k( 33) = ( 0.3478261 0.2406041 -0.1158604), wk = 0.0029586 k( 34) = ( 0.3586956 0.2481229 -0.1194810), wk = 0.0029586 k( 35) = ( 0.3695652 0.2556418 -0.1231017), wk = 0.0029586 k( 36) = ( 0.3804348 0.2631607 -0.1267223), wk = 0.0029586 k( 37) = ( 0.3913044 0.2706796 -0.1303429), wk = 0.0029586 k( 38) = ( 0.4021739 0.2781985 -0.1339636), wk = 0.0029586 k( 39) = ( 0.4130435 0.2857173 -0.1375842), wk = 0.0029586 k( 40) = ( 0.4239130 0.2932362 -0.1412048), wk = 0.0029586 k( 41) = ( 0.4347826 0.3007551 -0.1448255), wk = 0.0029586 k( 42) = ( 0.4456522 0.3082740 -0.1484461), wk = 0.0029586 k( 43) = ( 0.4565217 0.3157928 -0.1520668), wk = 0.0029586 k( 44) = ( 0.4673913 0.3233117 -0.1556874), wk = 0.0029586 k( 45) = ( 0.4782609 0.3308306 -0.1593080), wk = 0.0029586 k( 46) = ( 0.4891304 0.3383495 -0.1629287), wk = 0.0029586 k( 47) = ( 0.5000000 0.3458683 -0.1665493), wk = 0.0029586 k( 48) = ( 0.5000000 0.3458683 -0.1665493), wk = 0.0029586 k( 49) = ( 0.5028956 0.3478713 -0.1536968), wk = 0.0029586 k( 50) = ( 0.5057912 0.3498743 -0.1408444), wk = 0.0029586 k( 51) = ( 0.5086868 0.3518773 -0.1279919), wk = 0.0029586 k( 52) = ( 0.5115824 0.3538803 -0.1151394), wk = 0.0029586 k( 53) = ( 0.5144780 0.3558833 -0.1022869), wk = 0.0029586 k( 54) = ( 0.5173736 0.3578863 -0.0894345), wk = 0.0029586 k( 55) = ( 0.5202692 0.3598893 -0.0765820), wk = 0.0029586 k( 56) = ( 0.5231648 0.3618923 -0.0637295), wk = 0.0029586 k( 57) = ( 0.5260604 0.3638953 -0.0508771), wk = 0.0029586 k( 58) = ( 0.5289560 0.3658983 -0.0380246), wk = 0.0029586 k( 59) = ( 0.5318516 0.3679013 -0.0251721), wk = 0.0029586 k( 60) = ( 0.5347472 0.3699042 -0.0123196), wk = 0.0029586 k( 61) = ( 0.5376428 0.3719072 0.0005328), wk = 0.0029586 k( 62) = ( 0.5405384 0.3739102 0.0133853), wk = 0.0029586 k( 63) = ( 0.5405384 0.3739102 0.0133853), wk = 0.0029586 k( 64) = ( 0.5374200 0.3717532 0.0261968), wk = 0.0029586 k( 65) = ( 0.5343017 0.3695961 0.0390083), wk = 0.0029586 k( 66) = ( 0.5311834 0.3674390 0.0518198), wk = 0.0029586 k( 67) = ( 0.5280650 0.3652820 0.0646313), wk = 0.0029586 k( 68) = ( 0.5249467 0.3631249 0.0774427), wk = 0.0029586 k( 69) = ( 0.5218284 0.3609678 0.0902542), wk = 0.0029586 k( 70) = ( 0.5187100 0.3588108 0.1030657), wk = 0.0029586 k( 71) = ( 0.5155917 0.3566537 0.1158772), wk = 0.0029586 k( 72) = ( 0.5124734 0.3544966 0.1286887), wk = 0.0029586 k( 73) = ( 0.5093550 0.3523396 0.1415002), wk = 0.0029586 k( 74) = ( 0.5062367 0.3501825 0.1543116), wk = 0.0029586 k( 75) = ( 0.5031183 0.3480254 0.1671231), wk = 0.0029586 k( 76) = ( 0.5000000 0.3458683 0.1799346), wk = 0.0029586 k( 77) = ( 0.5000000 0.3458683 0.1799346), wk = 0.0029586 k( 78) = ( 0.5075595 0.3349400 0.1799346), wk = 0.0029586 k( 79) = ( 0.5151191 0.3240117 0.1799346), wk = 0.0029586 k( 80) = ( 0.5226786 0.3130834 0.1799346), wk = 0.0029586 k( 81) = ( 0.5302381 0.3021551 0.1799346), wk = 0.0029586 k( 82) = ( 0.5377976 0.2912267 0.1799346), wk = 0.0029586 k( 83) = ( 0.5453571 0.2802984 0.1799346), wk = 0.0029586 k( 84) = ( 0.5529167 0.2693701 0.1799346), wk = 0.0029586 k( 85) = ( 0.5604762 0.2584417 0.1799346), wk = 0.0029586 k( 86) = ( 0.5680357 0.2475134 0.1799346), wk = 0.0029586 k( 87) = ( 0.5755952 0.2365851 0.1799346), wk = 0.0029586 k( 88) = ( 0.5831548 0.2256568 0.1799346), wk = 0.0029586 k( 89) = ( 0.5907143 0.2147284 0.1799346), wk = 0.0029586 k( 90) = ( 0.5982738 0.2038001 0.1799346), wk = 0.0029586 k( 91) = ( 0.6058333 0.1928718 0.1799346), wk = 0.0029586 k( 92) = ( 0.6133928 0.1819435 0.1799346), wk = 0.0029586 k( 93) = ( 0.6209524 0.1710152 0.1799346), wk = 0.0029586 k( 94) = ( 0.6285119 0.1600868 0.1799346), wk = 0.0029586 k( 95) = ( 0.6360714 0.1491585 0.1799346), wk = 0.0029586 k( 96) = ( 0.6436309 0.1382302 0.1799346), wk = 0.0029586 k( 97) = ( 0.6511905 0.1273018 0.1799346), wk = 0.0029586 k( 98) = ( 0.6587500 0.1163735 0.1799346), wk = 0.0029586 k( 99) = ( 0.3412500 -0.4933236 0.3464839), wk = 0.0029586 k( 100) = ( 0.3334943 -0.4821117 0.3464839), wk = 0.0029586 k( 101) = ( 0.3257386 -0.4708998 0.3464839), wk = 0.0029586 k( 102) = ( 0.3179830 -0.4596879 0.3464839), wk = 0.0029586 k( 103) = ( 0.3102273 -0.4484760 0.3464839), wk = 0.0029586 k( 104) = ( 0.3024716 -0.4372641 0.3464839), wk = 0.0029586 k( 105) = ( 0.2947159 -0.4260522 0.3464839), wk = 0.0029586 k( 106) = ( 0.2869602 -0.4148403 0.3464839), wk = 0.0029586 k( 107) = ( 0.2792045 -0.4036284 0.3464839), wk = 0.0029586 k( 108) = ( 0.2714489 -0.3924165 0.3464839), wk = 0.0029586 k( 109) = ( 0.2636932 -0.3812046 0.3464839), wk = 0.0029586 k( 110) = ( 0.2559375 -0.3699927 0.3464839), wk = 0.0029586 k( 111) = ( 0.2481818 -0.3587808 0.3464839), wk = 0.0029586 k( 112) = ( 0.2404261 -0.3475689 0.3464839), wk = 0.0029586 k( 113) = ( 0.2326705 -0.3363570 0.3464839), wk = 0.0029586 k( 114) = ( 0.2249148 -0.3251451 0.3464839), wk = 0.0029586 k( 115) = ( 0.2171591 -0.3139332 0.3464839), wk = 0.0029586 k( 116) = ( 0.2094034 -0.3027213 0.3464839), wk = 0.0029586 k( 117) = ( 0.2016477 -0.2915094 0.3464839), wk = 0.0029586 k( 118) = ( 0.1938921 -0.2802975 0.3464839), wk = 0.0029586 k( 119) = ( 0.1861364 -0.2690856 0.3464839), wk = 0.0029586 k( 120) = ( 0.1783807 -0.2578737 0.3464839), wk = 0.0029586 k( 121) = ( 0.1706250 -0.2466618 0.3464839), wk = 0.0029586 k( 122) = ( 0.1628693 -0.2354499 0.3464839), wk = 0.0029586 k( 123) = ( 0.1551136 -0.2242380 0.3464839), wk = 0.0029586 k( 124) = ( 0.1473580 -0.2130261 0.3464839), wk = 0.0029586 k( 125) = ( 0.1396023 -0.2018142 0.3464839), wk = 0.0029586 k( 126) = ( 0.1318466 -0.1906023 0.3464839), wk = 0.0029586 k( 127) = ( 0.1240909 -0.1793904 0.3464839), wk = 0.0029586 k( 128) = ( 0.1163352 -0.1681785 0.3464839), wk = 0.0029586 k( 129) = ( 0.1085795 -0.1569666 0.3464839), wk = 0.0029586 k( 130) = ( 0.1008239 -0.1457547 0.3464839), wk = 0.0029586 k( 131) = ( 0.0930682 -0.1345428 0.3464839), wk = 0.0029586 k( 132) = ( 0.0853125 -0.1233309 0.3464839), wk = 0.0029586 k( 133) = ( 0.0775568 -0.1121190 0.3464839), wk = 0.0029586 k( 134) = ( 0.0698011 -0.1009071 0.3464839), wk = 0.0029586 k( 135) = ( 0.0620455 -0.0896952 0.3464839), wk = 0.0029586 k( 136) = ( 0.0542898 -0.0784833 0.3464839), wk = 0.0029586 k( 137) = ( 0.0465341 -0.0672714 0.3464839), wk = 0.0029586 k( 138) = ( 0.0387784 -0.0560595 0.3464839), wk = 0.0029586 k( 139) = ( 0.0310227 -0.0448476 0.3464839), wk = 0.0029586 k( 140) = ( 0.0232671 -0.0336357 0.3464839), wk = 0.0029586 k( 141) = ( 0.0155114 -0.0224238 0.3464839), wk = 0.0029586 k( 142) = ( 0.0077557 -0.0112119 0.3464839), wk = 0.0029586 k( 143) = ( 0.0000000 0.0000000 0.3464839), wk = 0.0029586 k( 144) = ( 0.0000000 0.0000000 0.3464839), wk = 0.0029586 k( 145) = ( 0.0112064 0.0077519 0.3464839), wk = 0.0029586 k( 146) = ( 0.0224128 0.0155037 0.3464839), wk = 0.0029586 k( 147) = ( 0.0336191 0.0232556 0.3464839), wk = 0.0029586 k( 148) = ( 0.0448255 0.0310075 0.3464839), wk = 0.0029586 k( 149) = ( 0.0560319 0.0387593 0.3464839), wk = 0.0029586 k( 150) = ( 0.0672383 0.0465112 0.3464839), wk = 0.0029586 k( 151) = ( 0.0784447 0.0542631 0.3464839), wk = 0.0029586 k( 152) = ( 0.0896510 0.0620149 0.3464839), wk = 0.0029586 k( 153) = ( 0.1008574 0.0697668 0.3464839), wk = 0.0029586 k( 154) = ( 0.1120638 0.0775186 0.3464839), wk = 0.0029586 k( 155) = ( 0.1232702 0.0852705 0.3464839), wk = 0.0029586 k( 156) = ( 0.1344766 0.0930224 0.3464839), wk = 0.0029586 k( 157) = ( 0.1456830 0.1007742 0.3464839), wk = 0.0029586 k( 158) = ( 0.1568893 0.1085261 0.3464839), wk = 0.0029586 k( 159) = ( 0.1680957 0.1162780 0.3464839), wk = 0.0029586 k( 160) = ( 0.1793021 0.1240298 0.3464839), wk = 0.0029586 k( 161) = ( 0.1905085 0.1317817 0.3464839), wk = 0.0029586 k( 162) = ( 0.2017149 0.1395336 0.3464839), wk = 0.0029586 k( 163) = ( 0.2129212 0.1472854 0.3464839), wk = 0.0029586 k( 164) = ( 0.2241276 0.1550373 0.3464839), wk = 0.0029586 k( 165) = ( 0.2353340 0.1627892 0.3464839), wk = 0.0029586 k( 166) = ( 0.2465404 0.1705410 0.3464839), wk = 0.0029586 k( 167) = ( 0.2577468 0.1782929 0.3464839), wk = 0.0029586 k( 168) = ( 0.2689531 0.1860448 0.3464839), wk = 0.0029586 k( 169) = ( 0.2801595 0.1937966 0.3464839), wk = 0.0029586 k( 170) = ( 0.2913659 0.2015485 0.3464839), wk = 0.0029586 k( 171) = ( 0.3025723 0.2093004 0.3464839), wk = 0.0029586 k( 172) = ( 0.3137787 0.2170522 0.3464839), wk = 0.0029586 k( 173) = ( 0.3249850 0.2248041 0.3464839), wk = 0.0029586 k( 174) = ( 0.3361914 0.2325559 0.3464839), wk = 0.0029586 k( 175) = ( 0.3473978 0.2403078 0.3464839), wk = 0.0029586 k( 176) = ( 0.3586042 0.2480597 0.3464839), wk = 0.0029586 k( 177) = ( 0.3698106 0.2558115 0.3464839), wk = 0.0029586 k( 178) = ( 0.3810170 0.2635634 0.3464839), wk = 0.0029586 k( 179) = ( 0.3922233 0.2713153 0.3464839), wk = 0.0029586 k( 180) = ( 0.4034297 0.2790671 0.3464839), wk = 0.0029586 k( 181) = ( 0.4146361 0.2868190 0.3464839), wk = 0.0029586 k( 182) = ( 0.4258425 0.2945709 0.3464839), wk = 0.0029586 k( 183) = ( 0.4370489 0.3023227 0.3464839), wk = 0.0029586 k( 184) = ( 0.4482552 0.3100746 0.3464839), wk = 0.0029586 k( 185) = ( 0.4594616 0.3178265 0.3464839), wk = 0.0029586 k( 186) = ( 0.5000000 0.3458683 -0.1665493), wk = 0.0029586 k( 187) = ( 0.5075874 0.3348998 -0.1665493), wk = 0.0029586 k( 188) = ( 0.5151747 0.3239312 -0.1665493), wk = 0.0029586 k( 189) = ( 0.5227621 0.3129626 -0.1665493), wk = 0.0029586 k( 190) = ( 0.5303494 0.3019941 -0.1665493), wk = 0.0029586 k( 191) = ( 0.5379368 0.2910255 -0.1665493), wk = 0.0029586 k( 192) = ( 0.5455242 0.2800569 -0.1665493), wk = 0.0029586 k( 193) = ( 0.5531115 0.2690884 -0.1665493), wk = 0.0029586 k( 194) = ( 0.5606989 0.2581198 -0.1665493), wk = 0.0029586 k( 195) = ( 0.5682862 0.2471512 -0.1665493), wk = 0.0029586 k( 196) = ( 0.5758736 0.2361827 -0.1665493), wk = 0.0029586 k( 197) = ( 0.5834610 0.2252141 -0.1665493), wk = 0.0029586 k( 198) = ( 0.5910483 0.2142455 -0.1665493), wk = 0.0029586 k( 199) = ( 0.5986357 0.2032770 -0.1665493), wk = 0.0029586 k( 200) = ( 0.6062231 0.1923084 -0.1665493), wk = 0.0029586 k( 201) = ( 0.6138104 0.1813398 -0.1665493), wk = 0.0029586 k( 202) = ( 0.6213978 0.1703713 -0.1665493), wk = 0.0029586 k( 203) = ( 0.3786022 -0.5473213 -0.0000000), wk = 0.0029586 k( 204) = ( 0.3708756 -0.5361515 -0.0000000), wk = 0.0029586 k( 205) = ( 0.3631491 -0.5249816 -0.0000000), wk = 0.0029586 k( 206) = ( 0.3554225 -0.5138118 -0.0000000), wk = 0.0029586 k( 207) = ( 0.3476959 -0.5026420 -0.0000000), wk = 0.0029586 k( 208) = ( 0.3399693 -0.4914722 -0.0000000), wk = 0.0029586 k( 209) = ( 0.3322428 -0.4803024 -0.0000000), wk = 0.0029586 k( 210) = ( 0.3245162 -0.4691325 -0.0000000), wk = 0.0029586 k( 211) = ( 0.3167896 -0.4579627 -0.0000000), wk = 0.0029586 k( 212) = ( 0.3090630 -0.4467929 -0.0000000), wk = 0.0029586 k( 213) = ( 0.3013365 -0.4356231 -0.0000000), wk = 0.0029586 k( 214) = ( 0.2936099 -0.4244533 -0.0000000), wk = 0.0029586 k( 215) = ( 0.2858833 -0.4132834 -0.0000000), wk = 0.0029586 k( 216) = ( 0.2781567 -0.4021136 -0.0000000), wk = 0.0029586 k( 217) = ( 0.2704302 -0.3909438 -0.0000000), wk = 0.0029586 k( 218) = ( 0.2627036 -0.3797740 -0.0000000), wk = 0.0029586 k( 219) = ( 0.2549770 -0.3686041 -0.0000000), wk = 0.0029586 k( 220) = ( 0.2472504 -0.3574343 -0.0000000), wk = 0.0029586 k( 221) = ( 0.2395239 -0.3462645 -0.0000000), wk = 0.0029586 k( 222) = ( 0.2317973 -0.3350947 -0.0000000), wk = 0.0029586 k( 223) = ( 0.2240707 -0.3239248 -0.0000000), wk = 0.0029586 k( 224) = ( 0.2163441 -0.3127550 -0.0000000), wk = 0.0029586 k( 225) = ( 0.2086176 -0.3015852 -0.0000000), wk = 0.0029586 k( 226) = ( 0.2008910 -0.2904154 -0.0000000), wk = 0.0029586 k( 227) = ( 0.1931644 -0.2792456 -0.0000000), wk = 0.0029586 k( 228) = ( 0.1854378 -0.2680757 -0.0000000), wk = 0.0029586 k( 229) = ( 0.1777112 -0.2569059 -0.0000000), wk = 0.0029586 k( 230) = ( 0.1699847 -0.2457361 -0.0000000), wk = 0.0029586 k( 231) = ( 0.1622581 -0.2345663 -0.0000000), wk = 0.0029586 k( 232) = ( 0.1545315 -0.2233964 -0.0000000), wk = 0.0029586 k( 233) = ( 0.1468049 -0.2122266 -0.0000000), wk = 0.0029586 k( 234) = ( 0.1390784 -0.2010568 -0.0000000), wk = 0.0029586 k( 235) = ( 0.1313518 -0.1898870 -0.0000000), wk = 0.0029586 k( 236) = ( 0.1236252 -0.1787171 -0.0000000), wk = 0.0029586 k( 237) = ( 0.1158986 -0.1675473 -0.0000000), wk = 0.0029586 k( 238) = ( 0.1081721 -0.1563775 -0.0000000), wk = 0.0029586 k( 239) = ( 0.1004455 -0.1452077 -0.0000000), wk = 0.0029586 k( 240) = ( 0.0927189 -0.1340379 -0.0000000), wk = 0.0029586 k( 241) = ( 0.0849923 -0.1228681 -0.0000000), wk = 0.0029586 k( 242) = ( 0.0772658 -0.1116982 -0.0000000), wk = 0.0029586 k( 243) = ( 0.0695392 -0.1005284 -0.0000000), wk = 0.0029586 k( 244) = ( 0.0618126 -0.0893586 -0.0000000), wk = 0.0029586 k( 245) = ( 0.0540860 -0.0781888 -0.0000000), wk = 0.0029586 k( 246) = ( 0.0463595 -0.0670189 -0.0000000), wk = 0.0029586 k( 247) = ( 0.0386329 -0.0558491 -0.0000000), wk = 0.0029586 k( 248) = ( 0.0309063 -0.0446793 -0.0000000), wk = 0.0029586 k( 249) = ( 0.0231797 -0.0335095 -0.0000000), wk = 0.0029586 k( 250) = ( 0.0154532 -0.0223396 -0.0000000), wk = 0.0029586 k( 251) = ( 0.0077266 -0.0111698 -0.0000000), wk = 0.0029586 k( 252) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 254) = ( 0.0125000 -0.0047119 -0.0020819), wk = 0.0029586 k( 255) = ( 0.0250000 -0.0094238 -0.0041637), wk = 0.0029586 k( 256) = ( 0.0375000 -0.0141356 -0.0062456), wk = 0.0029586 k( 257) = ( 0.0500000 -0.0188475 -0.0083275), wk = 0.0029586 k( 258) = ( 0.0625000 -0.0235594 -0.0104093), wk = 0.0029586 k( 259) = ( 0.0750000 -0.0282713 -0.0124912), wk = 0.0029586 k( 260) = ( 0.0875000 -0.0329831 -0.0145731), wk = 0.0029586 k( 261) = ( 0.1000000 -0.0376950 -0.0166549), wk = 0.0029586 k( 262) = ( 0.1125000 -0.0424069 -0.0187368), wk = 0.0029586 k( 263) = ( 0.1250000 -0.0471188 -0.0208187), wk = 0.0029586 k( 264) = ( 0.1375000 -0.0518306 -0.0229005), wk = 0.0029586 k( 265) = ( 0.1500000 -0.0565425 -0.0249824), wk = 0.0029586 k( 266) = ( 0.1625000 -0.0612544 -0.0270643), wk = 0.0029586 k( 267) = ( 0.1750000 -0.0659663 -0.0291461), wk = 0.0029586 k( 268) = ( 0.1875000 -0.0706781 -0.0312280), wk = 0.0029586 k( 269) = ( 0.2000000 -0.0753900 -0.0333099), wk = 0.0029586 k( 270) = ( 0.2125000 -0.0801019 -0.0353917), wk = 0.0029586 k( 271) = ( 0.2250000 -0.0848138 -0.0374736), wk = 0.0029586 k( 272) = ( 0.2375000 -0.0895256 -0.0395555), wk = 0.0029586 k( 273) = ( 0.2500000 -0.0942375 -0.0416373), wk = 0.0029586 k( 274) = ( 0.2625000 -0.0989494 -0.0437192), wk = 0.0029586 k( 275) = ( 0.2750000 -0.1036613 -0.0458011), wk = 0.0029586 k( 276) = ( 0.2875000 -0.1083731 -0.0478829), wk = 0.0029586 k( 277) = ( 0.3000000 -0.1130850 -0.0499648), wk = 0.0029586 k( 278) = ( 0.3125000 -0.1177969 -0.0520467), wk = 0.0029586 k( 279) = ( 0.3250000 -0.1225088 -0.0541285), wk = 0.0029586 k( 280) = ( 0.3375000 -0.1272206 -0.0562104), wk = 0.0029586 k( 281) = ( 0.3500000 -0.1319325 -0.0582923), wk = 0.0029586 k( 282) = ( 0.3625000 -0.1366444 -0.0603741), wk = 0.0029586 k( 283) = ( 0.3750000 -0.1413563 -0.0624560), wk = 0.0029586 k( 284) = ( 0.3875000 -0.1460681 -0.0645379), wk = 0.0029586 k( 285) = ( 0.4000000 -0.1507800 -0.0666197), wk = 0.0029586 k( 286) = ( 0.4125000 -0.1554919 -0.0687016), wk = 0.0029586 k( 287) = ( 0.4250000 -0.1602038 -0.0707835), wk = 0.0029586 k( 288) = ( 0.4375000 -0.1649156 -0.0728653), wk = 0.0029586 k( 289) = ( 0.4500000 -0.1696275 -0.0749472), wk = 0.0029586 k( 290) = ( 0.4625000 -0.1743394 -0.0770291), wk = 0.0029586 k( 291) = ( 0.4750000 -0.1790513 -0.0791109), wk = 0.0029586 k( 292) = ( 0.4875000 -0.1837631 -0.0811928), wk = 0.0029586 k( 293) = ( 0.5000000 -0.1884750 -0.0832747), wk = 0.0029586 k( 294) = ( 0.5000000 -0.1884750 0.2632093), wk = 0.0029586 k( 295) = ( 0.4886364 -0.1841915 0.2572272), wk = 0.0029586 k( 296) = ( 0.4772727 -0.1799080 0.2512452), wk = 0.0029586 k( 297) = ( 0.4659091 -0.1756244 0.2452632), wk = 0.0029586 k( 298) = ( 0.4545455 -0.1713409 0.2392812), wk = 0.0029586 k( 299) = ( 0.4431818 -0.1670574 0.2332991), wk = 0.0029586 k( 300) = ( 0.4318182 -0.1627739 0.2273171), wk = 0.0029586 k( 301) = ( 0.4204545 -0.1584904 0.2213351), wk = 0.0029586 k( 302) = ( 0.4090909 -0.1542068 0.2153530), wk = 0.0029586 k( 303) = ( 0.3977273 -0.1499233 0.2093710), wk = 0.0029586 k( 304) = ( 0.3863636 -0.1456398 0.2033890), wk = 0.0029586 k( 305) = ( 0.3750000 -0.1413563 0.1974070), wk = 0.0029586 k( 306) = ( 0.3636364 -0.1370727 0.1914249), wk = 0.0029586 k( 307) = ( 0.3522727 -0.1327892 0.1854429), wk = 0.0029586 k( 308) = ( 0.3409091 -0.1285057 0.1794609), wk = 0.0029586 k( 309) = ( 0.3295455 -0.1242222 0.1734788), wk = 0.0029586 k( 310) = ( 0.3181818 -0.1199386 0.1674968), wk = 0.0029586 k( 311) = ( 0.3068182 -0.1156551 0.1615148), wk = 0.0029586 k( 312) = ( 0.2954545 -0.1113716 0.1555328), wk = 0.0029586 k( 313) = ( 0.2840909 -0.1070881 0.1495507), wk = 0.0029586 k( 314) = ( 0.2727273 -0.1028046 0.1435687), wk = 0.0029586 k( 315) = ( 0.2613636 -0.0985210 0.1375867), wk = 0.0029586 k( 316) = ( 0.2500000 -0.0942375 0.1316046), wk = 0.0029586 k( 317) = ( 0.2386364 -0.0899540 0.1256226), wk = 0.0029586 k( 318) = ( 0.2272727 -0.0856705 0.1196406), wk = 0.0029586 k( 319) = ( 0.2159091 -0.0813869 0.1136585), wk = 0.0029586 k( 320) = ( 0.2045454 -0.0771034 0.1076765), wk = 0.0029586 k( 321) = ( 0.1931818 -0.0728199 0.1016945), wk = 0.0029586 k( 322) = ( 0.1818182 -0.0685364 0.0957125), wk = 0.0029586 k( 323) = ( 0.1704546 -0.0642528 0.0897304), wk = 0.0029586 k( 324) = ( 0.1590909 -0.0599693 0.0837484), wk = 0.0029586 k( 325) = ( 0.1477273 -0.0556858 0.0777664), wk = 0.0029586 k( 326) = ( 0.1363636 -0.0514023 0.0717843), wk = 0.0029586 k( 327) = ( 0.1250000 -0.0471188 0.0658023), wk = 0.0029586 k( 328) = ( 0.1136364 -0.0428352 0.0598203), wk = 0.0029586 k( 329) = ( 0.1022727 -0.0385517 0.0538383), wk = 0.0029586 k( 330) = ( 0.0909091 -0.0342682 0.0478562), wk = 0.0029586 k( 331) = ( 0.0795455 -0.0299847 0.0418742), wk = 0.0029586 k( 332) = ( 0.0681818 -0.0257011 0.0358922), wk = 0.0029586 k( 333) = ( 0.0568182 -0.0214176 0.0299101), wk = 0.0029586 k( 334) = ( 0.0454546 -0.0171341 0.0239281), wk = 0.0029586 k( 335) = ( 0.0340909 -0.0128506 0.0179461), wk = 0.0029586 k( 336) = ( 0.0227273 -0.0085670 0.0119641), wk = 0.0029586 k( 337) = ( 0.0113636 -0.0042835 0.0059820), wk = 0.0029586 k( 338) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 2) = ( 0.0108696 0.0108696 -0.0000000), wk = 0.0029586 k( 3) = ( 0.0217391 0.0217391 -0.0000000), wk = 0.0029586 k( 4) = ( 0.0326087 0.0326087 0.0000000), wk = 0.0029586 k( 5) = ( 0.0434783 0.0434783 -0.0000000), wk = 0.0029586 k( 6) = ( 0.0543478 0.0543478 -0.0000000), wk = 0.0029586 k( 7) = ( 0.0652174 0.0652174 -0.0000000), wk = 0.0029586 k( 8) = ( 0.0760870 0.0760870 0.0000000), wk = 0.0029586 k( 9) = ( 0.0869565 0.0869565 -0.0000000), wk = 0.0029586 k( 10) = ( 0.0978261 0.0978261 -0.0000000), wk = 0.0029586 k( 11) = ( 0.1086957 0.1086957 -0.0000000), wk = 0.0029586 k( 12) = ( 0.1195652 0.1195652 -0.0000000), wk = 0.0029586 k( 13) = ( 0.1304348 0.1304348 -0.0000000), wk = 0.0029586 k( 14) = ( 0.1413043 0.1413043 -0.0000000), wk = 0.0029586 k( 15) = ( 0.1521739 0.1521739 0.0000000), wk = 0.0029586 k( 16) = ( 0.1630435 0.1630435 -0.0000000), wk = 0.0029586 k( 17) = ( 0.1739130 0.1739130 -0.0000000), wk = 0.0029586 k( 18) = ( 0.1847826 0.1847826 0.0000000), wk = 0.0029586 k( 19) = ( 0.1956522 0.1956522 -0.0000000), wk = 0.0029586 k( 20) = ( 0.2065217 0.2065217 -0.0000000), wk = 0.0029586 k( 21) = ( 0.2173913 0.2173913 -0.0000000), wk = 0.0029586 k( 22) = ( 0.2282609 0.2282609 0.0000000), wk = 0.0029586 k( 23) = ( 0.2391304 0.2391304 0.0000000), wk = 0.0029586 k( 24) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0029586 k( 25) = ( 0.2608696 0.2608696 -0.0000000), wk = 0.0029586 k( 26) = ( 0.2717391 0.2717391 0.0000000), wk = 0.0029586 k( 27) = ( 0.2826087 0.2826087 -0.0000000), wk = 0.0029586 k( 28) = ( 0.2934783 0.2934783 -0.0000000), wk = 0.0029586 k( 29) = ( 0.3043478 0.3043478 0.0000000), wk = 0.0029586 k( 30) = ( 0.3152174 0.3152174 0.0000000), wk = 0.0029586 k( 31) = ( 0.3260870 0.3260870 -0.0000000), wk = 0.0029586 k( 32) = ( 0.3369565 0.3369565 -0.0000000), wk = 0.0029586 k( 33) = ( 0.3478261 0.3478261 -0.0000000), wk = 0.0029586 k( 34) = ( 0.3586956 0.3586956 -0.0000000), wk = 0.0029586 k( 35) = ( 0.3695652 0.3695652 0.0000000), wk = 0.0029586 k( 36) = ( 0.3804348 0.3804348 0.0000000), wk = 0.0029586 k( 37) = ( 0.3913044 0.3913044 -0.0000000), wk = 0.0029586 k( 38) = ( 0.4021739 0.4021739 0.0000000), wk = 0.0029586 k( 39) = ( 0.4130435 0.4130435 -0.0000000), wk = 0.0029586 k( 40) = ( 0.4239130 0.4239130 -0.0000000), wk = 0.0029586 k( 41) = ( 0.4347826 0.4347826 -0.0000000), wk = 0.0029586 k( 42) = ( 0.4456522 0.4456522 -0.0000000), wk = 0.0029586 k( 43) = ( 0.4565217 0.4565217 0.0000000), wk = 0.0029586 k( 44) = ( 0.4673913 0.4673913 0.0000000), wk = 0.0029586 k( 45) = ( 0.4782609 0.4782609 -0.0000000), wk = 0.0029586 k( 46) = ( 0.4891304 0.4891304 -0.0000000), wk = 0.0029586 k( 47) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029586 k( 48) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029586 k( 49) = ( 0.5028956 0.5028956 0.0199389), wk = 0.0029586 k( 50) = ( 0.5057912 0.5057912 0.0398777), wk = 0.0029586 k( 51) = ( 0.5086868 0.5086868 0.0598166), wk = 0.0029586 k( 52) = ( 0.5115824 0.5115824 0.0797555), wk = 0.0029586 k( 53) = ( 0.5144780 0.5144780 0.0996943), wk = 0.0029586 k( 54) = ( 0.5173736 0.5173736 0.1196332), wk = 0.0029586 k( 55) = ( 0.5202692 0.5202692 0.1395720), wk = 0.0029586 k( 56) = ( 0.5231648 0.5231648 0.1595109), wk = 0.0029586 k( 57) = ( 0.5260604 0.5260604 0.1794498), wk = 0.0029586 k( 58) = ( 0.5289560 0.5289560 0.1993886), wk = 0.0029586 k( 59) = ( 0.5318516 0.5318516 0.2193275), wk = 0.0029586 k( 60) = ( 0.5347472 0.5347472 0.2392664), wk = 0.0029586 k( 61) = ( 0.5376428 0.5376428 0.2592052), wk = 0.0029586 k( 62) = ( 0.5405384 0.5405384 0.2791441), wk = 0.0029586 k( 63) = ( 0.5405384 0.5405384 0.2791441), wk = 0.0029586 k( 64) = ( 0.5374200 0.5374200 0.2961330), wk = 0.0029586 k( 65) = ( 0.5343017 0.5343017 0.3131219), wk = 0.0029586 k( 66) = ( 0.5311834 0.5311834 0.3301109), wk = 0.0029586 k( 67) = ( 0.5280650 0.5280650 0.3470998), wk = 0.0029586 k( 68) = ( 0.5249467 0.5249467 0.3640887), wk = 0.0029586 k( 69) = ( 0.5218284 0.5218284 0.3810776), wk = 0.0029586 k( 70) = ( 0.5187100 0.5187100 0.3980665), wk = 0.0029586 k( 71) = ( 0.5155917 0.5155917 0.4150554), wk = 0.0029586 k( 72) = ( 0.5124734 0.5124734 0.4320443), wk = 0.0029586 k( 73) = ( 0.5093550 0.5093550 0.4490333), wk = 0.0029586 k( 74) = ( 0.5062367 0.5062367 0.4660222), wk = 0.0029586 k( 75) = ( 0.5031183 0.5031183 0.4830111), wk = 0.0029586 k( 76) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029586 k( 77) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029586 k( 78) = ( 0.5075595 0.4924405 0.5000000), wk = 0.0029586 k( 79) = ( 0.5151191 0.4848809 0.5000000), wk = 0.0029586 k( 80) = ( 0.5226786 0.4773214 0.5000000), wk = 0.0029586 k( 81) = ( 0.5302381 0.4697619 0.5000000), wk = 0.0029586 k( 82) = ( 0.5377976 0.4622024 0.5000000), wk = 0.0029586 k( 83) = ( 0.5453571 0.4546429 0.5000000), wk = 0.0029586 k( 84) = ( 0.5529167 0.4470833 0.5000000), wk = 0.0029586 k( 85) = ( 0.5604762 0.4395238 0.5000000), wk = 0.0029586 k( 86) = ( 0.5680357 0.4319643 0.5000000), wk = 0.0029586 k( 87) = ( 0.5755952 0.4244048 0.5000000), wk = 0.0029586 k( 88) = ( 0.5831548 0.4168452 0.5000000), wk = 0.0029586 k( 89) = ( 0.5907143 0.4092857 0.5000000), wk = 0.0029586 k( 90) = ( 0.5982738 0.4017262 0.5000000), wk = 0.0029586 k( 91) = ( 0.6058333 0.3941667 0.5000000), wk = 0.0029586 k( 92) = ( 0.6133928 0.3866072 0.5000000), wk = 0.0029586 k( 93) = ( 0.6209524 0.3790476 0.5000000), wk = 0.0029586 k( 94) = ( 0.6285119 0.3714881 0.5000000), wk = 0.0029586 k( 95) = ( 0.6360714 0.3639286 0.5000000), wk = 0.0029586 k( 96) = ( 0.6436309 0.3563691 0.5000000), wk = 0.0029586 k( 97) = ( 0.6511905 0.3488095 0.5000000), wk = 0.0029586 k( 98) = ( 0.6587500 0.3412500 0.5000000), wk = 0.0029586 k( 99) = ( 0.3412500 -0.3412500 0.5000000), wk = 0.0029586 k( 100) = ( 0.3334943 -0.3334943 0.5000000), wk = 0.0029586 k( 101) = ( 0.3257386 -0.3257386 0.5000000), wk = 0.0029586 k( 102) = ( 0.3179830 -0.3179830 0.5000000), wk = 0.0029586 k( 103) = ( 0.3102273 -0.3102273 0.5000000), wk = 0.0029586 k( 104) = ( 0.3024716 -0.3024716 0.5000000), wk = 0.0029586 k( 105) = ( 0.2947159 -0.2947159 0.5000000), wk = 0.0029586 k( 106) = ( 0.2869602 -0.2869602 0.5000000), wk = 0.0029586 k( 107) = ( 0.2792045 -0.2792046 0.5000000), wk = 0.0029586 k( 108) = ( 0.2714489 -0.2714489 0.5000000), wk = 0.0029586 k( 109) = ( 0.2636932 -0.2636932 0.5000000), wk = 0.0029586 k( 110) = ( 0.2559375 -0.2559375 0.5000000), wk = 0.0029586 k( 111) = ( 0.2481818 -0.2481818 0.5000000), wk = 0.0029586 k( 112) = ( 0.2404261 -0.2404261 0.5000000), wk = 0.0029586 k( 113) = ( 0.2326705 -0.2326705 0.5000000), wk = 0.0029586 k( 114) = ( 0.2249148 -0.2249148 0.5000000), wk = 0.0029586 k( 115) = ( 0.2171591 -0.2171591 0.5000000), wk = 0.0029586 k( 116) = ( 0.2094034 -0.2094034 0.5000000), wk = 0.0029586 k( 117) = ( 0.2016477 -0.2016477 0.5000000), wk = 0.0029586 k( 118) = ( 0.1938921 -0.1938921 0.5000000), wk = 0.0029586 k( 119) = ( 0.1861364 -0.1861364 0.5000000), wk = 0.0029586 k( 120) = ( 0.1783807 -0.1783807 0.5000000), wk = 0.0029586 k( 121) = ( 0.1706250 -0.1706250 0.5000000), wk = 0.0029586 k( 122) = ( 0.1628693 -0.1628693 0.5000000), wk = 0.0029586 k( 123) = ( 0.1551136 -0.1551136 0.5000000), wk = 0.0029586 k( 124) = ( 0.1473580 -0.1473580 0.5000000), wk = 0.0029586 k( 125) = ( 0.1396023 -0.1396023 0.5000000), wk = 0.0029586 k( 126) = ( 0.1318466 -0.1318466 0.5000000), wk = 0.0029586 k( 127) = ( 0.1240909 -0.1240909 0.5000000), wk = 0.0029586 k( 128) = ( 0.1163352 -0.1163352 0.5000000), wk = 0.0029586 k( 129) = ( 0.1085795 -0.1085795 0.5000000), wk = 0.0029586 k( 130) = ( 0.1008239 -0.1008239 0.5000000), wk = 0.0029586 k( 131) = ( 0.0930682 -0.0930682 0.5000000), wk = 0.0029586 k( 132) = ( 0.0853125 -0.0853125 0.5000000), wk = 0.0029586 k( 133) = ( 0.0775568 -0.0775568 0.5000000), wk = 0.0029586 k( 134) = ( 0.0698011 -0.0698011 0.5000000), wk = 0.0029586 k( 135) = ( 0.0620455 -0.0620455 0.5000000), wk = 0.0029586 k( 136) = ( 0.0542898 -0.0542898 0.5000000), wk = 0.0029586 k( 137) = ( 0.0465341 -0.0465341 0.5000000), wk = 0.0029586 k( 138) = ( 0.0387784 -0.0387784 0.5000000), wk = 0.0029586 k( 139) = ( 0.0310227 -0.0310227 0.5000000), wk = 0.0029586 k( 140) = ( 0.0232671 -0.0232671 0.5000000), wk = 0.0029586 k( 141) = ( 0.0155114 -0.0155114 0.5000000), wk = 0.0029586 k( 142) = ( 0.0077557 -0.0077557 0.5000000), wk = 0.0029586 k( 143) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029586 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029586 k( 145) = ( 0.0112064 0.0112064 0.5053867), wk = 0.0029586 k( 146) = ( 0.0224128 0.0224128 0.5107735), wk = 0.0029586 k( 147) = ( 0.0336191 0.0336191 0.5161602), wk = 0.0029586 k( 148) = ( 0.0448255 0.0448255 0.5215469), wk = 0.0029586 k( 149) = ( 0.0560319 0.0560319 0.5269337), wk = 0.0029586 k( 150) = ( 0.0672383 0.0672383 0.5323204), wk = 0.0029586 k( 151) = ( 0.0784447 0.0784447 0.5377071), wk = 0.0029586 k( 152) = ( 0.0896510 0.0896510 0.5430938), wk = 0.0029586 k( 153) = ( 0.1008574 0.1008574 0.5484806), wk = 0.0029586 k( 154) = ( 0.1120638 0.1120638 0.5538673), wk = 0.0029586 k( 155) = ( 0.1232702 0.1232702 0.5592540), wk = 0.0029586 k( 156) = ( 0.1344766 0.1344766 0.5646408), wk = 0.0029586 k( 157) = ( 0.1456830 0.1456830 0.5700275), wk = 0.0029586 k( 158) = ( 0.1568893 0.1568893 0.5754142), wk = 0.0029586 k( 159) = ( 0.1680957 0.1680957 0.5808009), wk = 0.0029586 k( 160) = ( 0.1793021 0.1793021 0.5861877), wk = 0.0029586 k( 161) = ( 0.1905085 0.1905085 0.5915744), wk = 0.0029586 k( 162) = ( 0.2017149 0.2017149 0.5969611), wk = 0.0029586 k( 163) = ( 0.2129212 0.2129212 0.6023479), wk = 0.0029586 k( 164) = ( 0.2241276 0.2241276 0.6077346), wk = 0.0029586 k( 165) = ( 0.2353340 0.2353340 0.6131213), wk = 0.0029586 k( 166) = ( 0.2465404 0.2465404 0.6185080), wk = 0.0029586 k( 167) = ( 0.2577468 0.2577468 0.6238948), wk = 0.0029586 k( 168) = ( 0.2689531 0.2689531 0.6292815), wk = 0.0029586 k( 169) = ( 0.2801595 0.2801595 0.6346682), wk = 0.0029586 k( 170) = ( 0.2913659 0.2913659 0.6400550), wk = 0.0029586 k( 171) = ( 0.3025723 0.3025723 0.6454417), wk = 0.0029586 k( 172) = ( 0.3137787 0.3137787 0.6508284), wk = 0.0029586 k( 173) = ( 0.3249850 0.3249850 0.6562151), wk = 0.0029586 k( 174) = ( 0.3361914 0.3361914 0.6616019), wk = 0.0029586 k( 175) = ( 0.3473978 0.3473978 0.6669886), wk = 0.0029586 k( 176) = ( 0.3586042 0.3586042 0.6723753), wk = 0.0029586 k( 177) = ( 0.3698106 0.3698106 0.6777621), wk = 0.0029586 k( 178) = ( 0.3810170 0.3810170 0.6831488), wk = 0.0029586 k( 179) = ( 0.3922233 0.3922233 0.6885355), wk = 0.0029586 k( 180) = ( 0.4034297 0.4034297 0.6939222), wk = 0.0029586 k( 181) = ( 0.4146361 0.4146361 0.6993090), wk = 0.0029586 k( 182) = ( 0.4258425 0.4258425 0.7046957), wk = 0.0029586 k( 183) = ( 0.4370489 0.4370489 0.7100824), wk = 0.0029586 k( 184) = ( 0.4482552 0.4482552 0.7154692), wk = 0.0029586 k( 185) = ( 0.4594616 0.4594616 0.7208559), wk = 0.0029586 k( 186) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0029586 k( 187) = ( 0.5075874 0.4924126 -0.0000000), wk = 0.0029586 k( 188) = ( 0.5151747 0.4848253 -0.0000000), wk = 0.0029586 k( 189) = ( 0.5227621 0.4772379 -0.0000000), wk = 0.0029586 k( 190) = ( 0.5303494 0.4696506 -0.0000000), wk = 0.0029586 k( 191) = ( 0.5379368 0.4620632 0.0000000), wk = 0.0029586 k( 192) = ( 0.5455242 0.4544758 0.0000000), wk = 0.0029586 k( 193) = ( 0.5531115 0.4468885 0.0000000), wk = 0.0029586 k( 194) = ( 0.5606989 0.4393011 -0.0000000), wk = 0.0029586 k( 195) = ( 0.5682862 0.4317138 -0.0000000), wk = 0.0029586 k( 196) = ( 0.5758736 0.4241264 0.0000000), wk = 0.0029586 k( 197) = ( 0.5834610 0.4165390 -0.0000000), wk = 0.0029586 k( 198) = ( 0.5910483 0.4089517 -0.0000000), wk = 0.0029586 k( 199) = ( 0.5986357 0.4013643 0.0000000), wk = 0.0029586 k( 200) = ( 0.6062231 0.3937769 0.0000000), wk = 0.0029586 k( 201) = ( 0.6138104 0.3861896 -0.0000000), wk = 0.0029586 k( 202) = ( 0.6213978 0.3786022 0.0000000), wk = 0.0029586 k( 203) = ( 0.3786022 -0.3786022 -0.0000000), wk = 0.0029586 k( 204) = ( 0.3708756 -0.3708756 0.0000000), wk = 0.0029586 k( 205) = ( 0.3631491 -0.3631491 -0.0000000), wk = 0.0029586 k( 206) = ( 0.3554225 -0.3554225 0.0000000), wk = 0.0029586 k( 207) = ( 0.3476959 -0.3476959 0.0000000), wk = 0.0029586 k( 208) = ( 0.3399693 -0.3399693 0.0000000), wk = 0.0029586 k( 209) = ( 0.3322428 -0.3322428 0.0000000), wk = 0.0029586 k( 210) = ( 0.3245162 -0.3245162 0.0000000), wk = 0.0029586 k( 211) = ( 0.3167896 -0.3167896 0.0000000), wk = 0.0029586 k( 212) = ( 0.3090630 -0.3090630 0.0000000), wk = 0.0029586 k( 213) = ( 0.3013365 -0.3013365 0.0000000), wk = 0.0029586 k( 214) = ( 0.2936099 -0.2936099 0.0000000), wk = 0.0029586 k( 215) = ( 0.2858833 -0.2858833 -0.0000000), wk = 0.0029586 k( 216) = ( 0.2781567 -0.2781567 0.0000000), wk = 0.0029586 k( 217) = ( 0.2704302 -0.2704302 0.0000000), wk = 0.0029586 k( 218) = ( 0.2627036 -0.2627036 -0.0000000), wk = 0.0029586 k( 219) = ( 0.2549770 -0.2549770 -0.0000000), wk = 0.0029586 k( 220) = ( 0.2472504 -0.2472504 -0.0000000), wk = 0.0029586 k( 221) = ( 0.2395239 -0.2395239 -0.0000000), wk = 0.0029586 k( 222) = ( 0.2317973 -0.2317973 -0.0000000), wk = 0.0029586 k( 223) = ( 0.2240707 -0.2240707 0.0000000), wk = 0.0029586 k( 224) = ( 0.2163441 -0.2163441 0.0000000), wk = 0.0029586 k( 225) = ( 0.2086176 -0.2086175 -0.0000000), wk = 0.0029586 k( 226) = ( 0.2008910 -0.2008910 -0.0000000), wk = 0.0029586 k( 227) = ( 0.1931644 -0.1931644 0.0000000), wk = 0.0029586 k( 228) = ( 0.1854378 -0.1854378 0.0000000), wk = 0.0029586 k( 229) = ( 0.1777112 -0.1777112 0.0000000), wk = 0.0029586 k( 230) = ( 0.1699847 -0.1699847 0.0000000), wk = 0.0029586 k( 231) = ( 0.1622581 -0.1622581 0.0000000), wk = 0.0029586 k( 232) = ( 0.1545315 -0.1545315 0.0000000), wk = 0.0029586 k( 233) = ( 0.1468049 -0.1468049 -0.0000000), wk = 0.0029586 k( 234) = ( 0.1390784 -0.1390784 0.0000000), wk = 0.0029586 k( 235) = ( 0.1313518 -0.1313518 -0.0000000), wk = 0.0029586 k( 236) = ( 0.1236252 -0.1236252 0.0000000), wk = 0.0029586 k( 237) = ( 0.1158986 -0.1158986 -0.0000000), wk = 0.0029586 k( 238) = ( 0.1081721 -0.1081721 -0.0000000), wk = 0.0029586 k( 239) = ( 0.1004455 -0.1004455 0.0000000), wk = 0.0029586 k( 240) = ( 0.0927189 -0.0927189 0.0000000), wk = 0.0029586 k( 241) = ( 0.0849923 -0.0849923 -0.0000000), wk = 0.0029586 k( 242) = ( 0.0772658 -0.0772658 0.0000000), wk = 0.0029586 k( 243) = ( 0.0695392 -0.0695392 0.0000000), wk = 0.0029586 k( 244) = ( 0.0618126 -0.0618126 0.0000000), wk = 0.0029586 k( 245) = ( 0.0540860 -0.0540860 -0.0000000), wk = 0.0029586 k( 246) = ( 0.0463595 -0.0463595 0.0000000), wk = 0.0029586 k( 247) = ( 0.0386329 -0.0386329 0.0000000), wk = 0.0029586 k( 248) = ( 0.0309063 -0.0309063 -0.0000000), wk = 0.0029586 k( 249) = ( 0.0231797 -0.0231797 0.0000000), wk = 0.0029586 k( 250) = ( 0.0154532 -0.0154532 -0.0000000), wk = 0.0029586 k( 251) = ( 0.0077266 -0.0077266 -0.0000000), wk = 0.0029586 k( 252) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 k( 254) = ( 0.0125000 0.0000000 -0.0000000), wk = 0.0029586 k( 255) = ( 0.0250000 0.0000000 -0.0000000), wk = 0.0029586 k( 256) = ( 0.0375000 0.0000000 0.0000000), wk = 0.0029586 k( 257) = ( 0.0500000 0.0000000 -0.0000000), wk = 0.0029586 k( 258) = ( 0.0625000 0.0000000 -0.0000000), wk = 0.0029586 k( 259) = ( 0.0750000 0.0000000 0.0000000), wk = 0.0029586 k( 260) = ( 0.0875000 0.0000000 0.0000000), wk = 0.0029586 k( 261) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0029586 k( 262) = ( 0.1125000 0.0000000 0.0000000), wk = 0.0029586 k( 263) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0029586 k( 264) = ( 0.1375000 0.0000000 -0.0000000), wk = 0.0029586 k( 265) = ( 0.1500000 0.0000000 0.0000000), wk = 0.0029586 k( 266) = ( 0.1625000 0.0000000 0.0000000), wk = 0.0029586 k( 267) = ( 0.1750000 0.0000000 0.0000000), wk = 0.0029586 k( 268) = ( 0.1875000 0.0000000 -0.0000000), wk = 0.0029586 k( 269) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0029586 k( 270) = ( 0.2125000 0.0000000 0.0000000), wk = 0.0029586 k( 271) = ( 0.2250000 0.0000000 0.0000000), wk = 0.0029586 k( 272) = ( 0.2375000 -0.0000000 0.0000000), wk = 0.0029586 k( 273) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0029586 k( 274) = ( 0.2625000 0.0000000 -0.0000000), wk = 0.0029586 k( 275) = ( 0.2750000 0.0000000 -0.0000000), wk = 0.0029586 k( 276) = ( 0.2875000 0.0000000 -0.0000000), wk = 0.0029586 k( 277) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0029586 k( 278) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0029586 k( 279) = ( 0.3250000 0.0000000 0.0000000), wk = 0.0029586 k( 280) = ( 0.3375000 0.0000000 0.0000000), wk = 0.0029586 k( 281) = ( 0.3500000 0.0000000 0.0000000), wk = 0.0029586 k( 282) = ( 0.3625000 0.0000000 -0.0000000), wk = 0.0029586 k( 283) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0029586 k( 284) = ( 0.3875000 0.0000000 -0.0000000), wk = 0.0029586 k( 285) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0029586 k( 286) = ( 0.4125000 0.0000000 -0.0000000), wk = 0.0029586 k( 287) = ( 0.4250000 0.0000000 0.0000000), wk = 0.0029586 k( 288) = ( 0.4375000 0.0000000 -0.0000000), wk = 0.0029586 k( 289) = ( 0.4500000 0.0000000 0.0000000), wk = 0.0029586 k( 290) = ( 0.4625000 0.0000000 0.0000000), wk = 0.0029586 k( 291) = ( 0.4750000 -0.0000000 0.0000000), wk = 0.0029586 k( 292) = ( 0.4875000 0.0000000 0.0000000), wk = 0.0029586 k( 293) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0029586 k( 294) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029586 k( 295) = ( 0.4886364 0.0000000 0.4886364), wk = 0.0029586 k( 296) = ( 0.4772727 0.0000000 0.4772727), wk = 0.0029586 k( 297) = ( 0.4659091 0.0000000 0.4659091), wk = 0.0029586 k( 298) = ( 0.4545455 0.0000000 0.4545455), wk = 0.0029586 k( 299) = ( 0.4431818 0.0000000 0.4431818), wk = 0.0029586 k( 300) = ( 0.4318182 0.0000000 0.4318182), wk = 0.0029586 k( 301) = ( 0.4204545 0.0000000 0.4204545), wk = 0.0029586 k( 302) = ( 0.4090909 0.0000000 0.4090909), wk = 0.0029586 k( 303) = ( 0.3977273 0.0000000 0.3977273), wk = 0.0029586 k( 304) = ( 0.3863636 0.0000000 0.3863636), wk = 0.0029586 k( 305) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0029586 k( 306) = ( 0.3636364 0.0000000 0.3636364), wk = 0.0029586 k( 307) = ( 0.3522727 -0.0000000 0.3522727), wk = 0.0029586 k( 308) = ( 0.3409091 0.0000000 0.3409091), wk = 0.0029586 k( 309) = ( 0.3295455 0.0000000 0.3295455), wk = 0.0029586 k( 310) = ( 0.3181818 0.0000000 0.3181818), wk = 0.0029586 k( 311) = ( 0.3068182 0.0000000 0.3068182), wk = 0.0029586 k( 312) = ( 0.2954545 0.0000000 0.2954545), wk = 0.0029586 k( 313) = ( 0.2840909 0.0000000 0.2840909), wk = 0.0029586 k( 314) = ( 0.2727273 0.0000000 0.2727273), wk = 0.0029586 k( 315) = ( 0.2613636 0.0000000 0.2613636), wk = 0.0029586 k( 316) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0029586 k( 317) = ( 0.2386364 0.0000000 0.2386364), wk = 0.0029586 k( 318) = ( 0.2272727 0.0000000 0.2272727), wk = 0.0029586 k( 319) = ( 0.2159091 0.0000000 0.2159091), wk = 0.0029586 k( 320) = ( 0.2045454 -0.0000000 0.2045455), wk = 0.0029586 k( 321) = ( 0.1931818 0.0000000 0.1931818), wk = 0.0029586 k( 322) = ( 0.1818182 0.0000000 0.1818182), wk = 0.0029586 k( 323) = ( 0.1704546 0.0000000 0.1704546), wk = 0.0029586 k( 324) = ( 0.1590909 0.0000000 0.1590909), wk = 0.0029586 k( 325) = ( 0.1477273 0.0000000 0.1477273), wk = 0.0029586 k( 326) = ( 0.1363636 0.0000000 0.1363636), wk = 0.0029586 k( 327) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0029586 k( 328) = ( 0.1136364 0.0000000 0.1136364), wk = 0.0029586 k( 329) = ( 0.1022727 0.0000000 0.1022727), wk = 0.0029586 k( 330) = ( 0.0909091 0.0000000 0.0909091), wk = 0.0029586 k( 331) = ( 0.0795455 0.0000000 0.0795455), wk = 0.0029586 k( 332) = ( 0.0681818 0.0000000 0.0681818), wk = 0.0029586 k( 333) = ( 0.0568182 0.0000000 0.0568182), wk = 0.0029586 k( 334) = ( 0.0454546 0.0000000 0.0454546), wk = 0.0029586 k( 335) = ( 0.0340909 0.0000000 0.0340909), wk = 0.0029586 k( 336) = ( 0.0227273 0.0000000 0.0227273), wk = 0.0029586 k( 337) = ( 0.0113636 0.0000000 0.0113636), wk = 0.0029586 k( 338) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029586 Dense grid: 73793 G-vectors FFT dimensions: ( 48, 48, 72) Smooth grid: 32449 G-vectors FFT dimensions: ( 36, 36, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 196, 60) NL pseudopotentials 0.21 Mb ( 98, 142) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1538) G-vector shells 0.01 Mb ( 1512) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.72 Mb ( 196, 240) Each subspace H/S matrix 0.88 Mb ( 240, 240) Each matrix 0.26 Mb ( 142, 2, 60) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./BixBO2x3.save/charge-density.dat negative rho (up, down): 1.370E-04 0.000E+00 Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.7 secs Computing kpt #: 2 total cpu time spent up to now is 44.9 secs Computing kpt #: 3 total cpu time spent up to now is 47.7 secs Computing kpt #: 4 total cpu time spent up to now is 50.7 secs Computing kpt #: 5 total cpu time spent up to now is 53.5 secs Computing kpt #: 6 total cpu time spent up to now is 56.3 secs Computing kpt #: 7 total cpu time spent up to now is 59.2 secs Computing kpt #: 8 total cpu time spent up to now is 62.1 secs Computing kpt #: 9 total cpu time spent up to now is 65.1 secs Computing kpt #: 10 total cpu time spent up to now is 68.1 secs Computing kpt #: 11 total cpu time spent up to now is 71.2 secs Computing kpt #: 12 total cpu time spent up to now is 74.2 secs Computing kpt #: 13 total cpu time spent up to now is 77.3 secs Computing kpt #: 14 total cpu time spent up to now is 80.3 secs Computing kpt #: 15 total cpu time spent up to now is 83.3 secs Computing kpt #: 16 total cpu time spent up to now is 86.3 secs Computing kpt #: 17 total cpu time spent up to now is 89.3 secs Computing kpt #: 18 total cpu time spent up to now is 92.4 secs Computing kpt #: 19 total cpu time spent up to now is 95.4 secs Computing kpt #: 20 total cpu time spent up to now is 98.4 secs Computing kpt #: 21 total cpu time spent up to now is 101.3 secs Computing kpt #: 22 total cpu time spent up to now is 104.3 secs Computing kpt #: 23 total cpu time spent up to now is 107.2 secs Computing kpt #: 24 total cpu time spent up to now is 110.2 secs Computing kpt #: 25 total cpu time spent up to now is 113.2 secs Computing kpt #: 26 total cpu time spent up to now is 116.3 secs Computing kpt #: 27 total cpu time spent up to now is 119.4 secs Computing kpt #: 28 total cpu time spent up to now is 122.5 secs Computing kpt #: 29 total cpu time spent up to now is 125.4 secs Computing kpt #: 30 total cpu time spent up to now is 128.1 secs Computing kpt #: 31 total cpu time spent up to now is 131.1 secs Computing kpt #: 32 total cpu time spent up to now is 133.7 secs Computing kpt #: 33 total cpu time spent up to now is 136.4 secs Computing kpt #: 34 total cpu time spent up to now is 138.9 secs Computing kpt #: 35 total cpu time spent up to now is 141.4 secs Computing kpt #: 36 total cpu time spent up to now is 143.9 secs Computing kpt #: 37 total cpu time spent up to now is 146.4 secs Computing kpt #: 38 total cpu time spent up to now is 148.9 secs Computing kpt #: 39 total cpu time spent up to now is 151.3 secs Computing kpt #: 40 total cpu time spent up to now is 153.7 secs Computing kpt #: 41 total cpu time spent up to now is 156.2 secs Computing kpt #: 42 total cpu time spent up to now is 158.6 secs Computing kpt #: 43 total cpu time spent up to now is 161.0 secs Computing kpt #: 44 total cpu time spent up to now is 164.1 secs Computing kpt #: 45 total cpu time spent up to now is 167.5 secs Computing kpt #: 46 total cpu time spent up to now is 170.4 secs Computing kpt #: 47 total cpu time spent up to now is 172.6 secs Computing kpt #: 48 total cpu time spent up to now is 175.0 secs Computing kpt #: 49 total cpu time spent up to now is 177.4 secs Computing kpt #: 50 total cpu time spent up to now is 179.9 secs Computing kpt #: 51 total cpu time spent up to now is 182.5 secs Computing kpt #: 52 total cpu time spent up to now is 184.9 secs Computing kpt #: 53 total cpu time spent up to now is 187.4 secs Computing kpt #: 54 total cpu time spent up to now is 189.7 secs Computing kpt #: 55 total cpu time spent up to now is 192.1 secs Computing kpt #: 56 total cpu time spent up to now is 194.6 secs Computing kpt #: 57 total cpu time spent up to now is 196.9 secs Computing kpt #: 58 total cpu time spent up to now is 199.3 secs Computing kpt #: 59 total cpu time spent up to now is 201.7 secs Computing kpt #: 60 total cpu time spent up to now is 204.1 secs Computing kpt #: 61 total cpu time spent up to now is 206.5 secs Computing kpt #: 62 total cpu time spent up to now is 208.9 secs Computing kpt #: 63 total cpu time spent up to now is 211.4 secs Computing kpt #: 64 total cpu time spent up to now is 213.8 secs Computing kpt #: 65 total cpu time spent up to now is 216.2 secs Computing kpt #: 66 total cpu time spent up to now is 218.7 secs Computing kpt #: 67 total cpu time spent up to now is 221.1 secs Computing kpt #: 68 total cpu time spent up to now is 223.6 secs Computing kpt #: 69 total cpu time spent up to now is 226.1 secs Computing kpt #: 70 total cpu time spent up to now is 228.6 secs Computing kpt #: 71 total cpu time spent up to now is 231.1 secs Computing kpt #: 72 total cpu time spent up to now is 233.7 secs Computing kpt #: 73 total cpu time spent up to now is 236.1 secs Computing kpt #: 74 total cpu time spent up to now is 238.6 secs Computing kpt #: 75 total cpu time spent up to now is 241.0 secs Computing kpt #: 76 total cpu time spent up to now is 243.5 secs Computing kpt #: 77 total cpu time spent up to now is 245.9 secs Computing kpt #: 78 total cpu time spent up to now is 248.3 secs Computing kpt #: 79 total cpu time spent up to now is 250.7 secs Computing kpt #: 80 total cpu time spent up to now is 253.1 secs Computing kpt #: 81 total cpu time spent up to now is 255.6 secs Computing kpt #: 82 total cpu time spent up to now is 258.0 secs Computing kpt #: 83 total cpu time spent up to now is 260.4 secs Computing kpt #: 84 total cpu time spent up to now is 262.8 secs Computing kpt #: 85 total cpu time spent up to now is 265.2 secs Computing kpt #: 86 total cpu time spent up to now is 267.6 secs Computing kpt #: 87 total cpu time spent up to now is 270.0 secs Computing kpt #: 88 total cpu time spent up to now is 272.5 secs Computing kpt #: 89 total cpu time spent up to now is 274.8 secs Computing kpt #: 90 total cpu time spent up to now is 277.1 secs Computing kpt #: 91 total cpu time spent up to now is 279.4 secs Computing kpt #: 92 total cpu time spent up to now is 281.7 secs Computing kpt #: 93 total cpu time spent up to now is 284.0 secs Computing kpt #: 94 total cpu time spent up to now is 286.3 secs Computing kpt #: 95 total cpu time spent up to now is 288.7 secs Computing kpt #: 96 total cpu time spent up to now is 290.9 secs Computing kpt #: 97 total cpu time spent up to now is 293.3 secs Computing kpt #: 98 total cpu time spent up to now is 295.4 secs Computing kpt #: 99 total cpu time spent up to now is 297.7 secs Computing kpt #: 100 total cpu time spent up to now is 300.0 secs Computing kpt #: 101 total cpu time spent up to now is 302.4 secs Computing kpt #: 102 total cpu time spent up to now is 304.6 secs Computing kpt #: 103 total cpu time spent up to now is 306.8 secs Computing kpt #: 104 total cpu time spent up to now is 309.2 secs Computing kpt #: 105 total cpu time spent up to now is 311.4 secs Computing kpt #: 106 total cpu time spent up to now is 313.6 secs Computing kpt #: 107 total cpu time spent up to now is 315.8 secs Computing kpt #: 108 total cpu time spent up to now is 318.0 secs Computing kpt #: 109 total cpu time spent up to now is 320.2 secs Computing kpt #: 110 total cpu time spent up to now is 322.4 secs Computing kpt #: 111 total cpu time spent up to now is 324.5 secs Computing kpt #: 112 total cpu time spent up to now is 327.1 secs Computing kpt #: 113 total cpu time spent up to now is 329.2 secs Computing kpt #: 114 total cpu time spent up to now is 331.4 secs Computing kpt #: 115 total cpu time spent up to now is 333.6 secs Computing kpt #: 116 total cpu time spent up to now is 335.8 secs Computing kpt #: 117 total cpu time spent up to now is 338.1 secs Computing kpt #: 118 total cpu time spent up to now is 340.4 secs Computing kpt #: 119 total cpu time spent up to now is 342.7 secs Computing kpt #: 120 total cpu time spent up to now is 345.1 secs Computing kpt #: 121 total cpu time spent up to now is 347.5 secs Computing kpt #: 122 total cpu time spent up to now is 349.9 secs Computing kpt #: 123 total cpu time spent up to now is 352.4 secs Computing kpt #: 124 total cpu time spent up to now is 354.7 secs Computing kpt #: 125 total cpu time spent up to now is 357.6 secs Computing kpt #: 126 total cpu time spent up to now is 360.0 secs Computing kpt #: 127 total cpu time spent up to now is 362.6 secs Computing kpt #: 128 total cpu time spent up to now is 365.1 secs Computing kpt #: 129 total cpu time spent up to now is 367.6 secs Computing kpt #: 130 total cpu time spent up to now is 370.2 secs Computing kpt #: 131 total cpu time spent up to now is 372.7 secs Computing kpt #: 132 total cpu time spent up to now is 375.3 secs Computing kpt #: 133 total cpu time spent up to now is 378.0 secs Computing kpt #: 134 total cpu time spent up to now is 380.8 secs Computing kpt #: 135 total cpu time spent up to now is 383.5 secs Computing kpt #: 136 total cpu time spent up to now is 386.4 secs Computing kpt #: 137 total cpu time spent up to now is 389.1 secs Computing kpt #: 138 total cpu time spent up to now is 391.9 secs Computing kpt #: 139 total cpu time spent up to now is 394.8 secs Computing kpt #: 140 total cpu time spent up to now is 397.8 secs Computing kpt #: 141 total cpu time spent up to now is 400.6 secs Computing kpt #: 142 total cpu time spent up to now is 403.5 secs Computing kpt #: 143 total cpu time spent up to now is 406.4 secs Computing kpt #: 144 total cpu time spent up to now is 409.2 secs Computing kpt #: 145 total cpu time spent up to now is 412.1 secs Computing kpt #: 146 total cpu time spent up to now is 415.0 secs Computing kpt #: 147 total cpu time spent up to now is 417.8 secs Computing kpt #: 148 total cpu time spent up to now is 420.7 secs Computing kpt #: 149 total cpu time spent up to now is 423.7 secs Computing kpt #: 150 total cpu time spent up to now is 426.6 secs Computing kpt #: 151 total cpu time spent up to now is 429.5 secs Computing kpt #: 152 total cpu time spent up to now is 432.3 secs Computing kpt #: 153 total cpu time spent up to now is 435.3 secs Computing kpt #: 154 total cpu time spent up to now is 438.2 secs Computing kpt #: 155 total cpu time spent up to now is 441.1 secs Computing kpt #: 156 total cpu time spent up to now is 444.0 secs Computing kpt #: 157 total cpu time spent up to now is 447.0 secs Computing kpt #: 158 total cpu time spent up to now is 449.9 secs Computing kpt #: 159 total cpu time spent up to now is 452.8 secs Computing kpt #: 160 total cpu time spent up to now is 455.7 secs Computing kpt #: 161 total cpu time spent up to now is 458.8 secs Computing kpt #: 162 total cpu time spent up to now is 461.7 secs Computing kpt #: 163 total cpu time spent up to now is 465.3 secs Computing kpt #: 164 total cpu time spent up to now is 468.3 secs Computing kpt #: 165 total cpu time spent up to now is 471.3 secs Computing kpt #: 166 total cpu time spent up to now is 474.2 secs Computing kpt #: 167 total cpu time spent up to now is 477.1 secs Computing kpt #: 168 total cpu time spent up to now is 480.0 secs Computing kpt #: 169 total cpu time spent up to now is 482.8 secs Computing kpt #: 170 total cpu time spent up to now is 485.7 secs Computing kpt #: 171 total cpu time spent up to now is 488.4 secs Computing kpt #: 172 total cpu time spent up to now is 491.1 secs Computing kpt #: 173 total cpu time spent up to now is 494.1 secs Computing kpt #: 174 total cpu time spent up to now is 496.9 secs Computing kpt #: 175 total cpu time spent up to now is 499.7 secs Computing kpt #: 176 total cpu time spent up to now is 502.7 secs Computing kpt #: 177 total cpu time spent up to now is 505.6 secs Computing kpt #: 178 total cpu time spent up to now is 508.2 secs Computing kpt #: 179 total cpu time spent up to now is 511.0 secs Computing kpt #: 180 total cpu time spent up to now is 513.8 secs Computing kpt #: 181 total cpu time spent up to now is 516.4 secs Computing kpt #: 182 total cpu time spent up to now is 519.0 secs Computing kpt #: 183 total cpu time spent up to now is 521.5 secs Computing kpt #: 184 total cpu time spent up to now is 524.0 secs Computing kpt #: 185 total cpu time spent up to now is 526.5 secs Computing kpt #: 186 total cpu time spent up to now is 528.7 secs Computing kpt #: 187 total cpu time spent up to now is 531.1 secs Computing kpt #: 188 total cpu time spent up to now is 533.4 secs Computing kpt #: 189 total cpu time spent up to now is 535.8 secs Computing kpt #: 190 total cpu time spent up to now is 538.2 secs Computing kpt #: 191 total cpu time spent up to now is 540.6 secs Computing kpt #: 192 total cpu time spent up to now is 542.9 secs Computing kpt #: 193 total cpu time spent up to now is 545.4 secs Computing kpt #: 194 total cpu time spent up to now is 547.7 secs Computing kpt #: 195 total cpu time spent up to now is 550.1 secs Computing kpt #: 196 total cpu time spent up to now is 552.5 secs Computing kpt #: 197 total cpu time spent up to now is 554.9 secs Computing kpt #: 198 total cpu time spent up to now is 557.1 secs Computing kpt #: 199 total cpu time spent up to now is 559.5 secs Computing kpt #: 200 total cpu time spent up to now is 561.8 secs Computing kpt #: 201 total cpu time spent up to now is 564.1 secs Computing kpt #: 202 total cpu time spent up to now is 566.4 secs Computing kpt #: 203 total cpu time spent up to now is 568.7 secs Computing kpt #: 204 total cpu time spent up to now is 570.9 secs Computing kpt #: 205 total cpu time spent up to now is 573.2 secs Computing kpt #: 206 total cpu time spent up to now is 575.4 secs Computing kpt #: 207 total cpu time spent up to now is 577.7 secs Computing kpt #: 208 total cpu time spent up to now is 579.9 secs Computing kpt #: 209 total cpu time spent up to now is 582.1 secs Computing kpt #: 210 total cpu time spent up to now is 584.3 secs Computing kpt #: 211 total cpu time spent up to now is 586.6 secs Computing kpt #: 212 total cpu time spent up to now is 588.8 secs Computing kpt #: 213 total cpu time spent up to now is 591.0 secs Computing kpt #: 214 total cpu time spent up to now is 593.3 secs Computing kpt #: 215 total cpu time spent up to now is 595.5 secs Computing kpt #: 216 total cpu time spent up to now is 597.8 secs Computing kpt #: 217 total cpu time spent up to now is 600.2 secs Computing kpt #: 218 total cpu time spent up to now is 602.5 secs Computing kpt #: 219 total cpu time spent up to now is 604.8 secs Computing kpt #: 220 total cpu time spent up to now is 607.1 secs Computing kpt #: 221 total cpu time spent up to now is 609.6 secs Computing kpt #: 222 total cpu time spent up to now is 611.9 secs Computing kpt #: 223 total cpu time spent up to now is 614.4 secs Computing kpt #: 224 total cpu time spent up to now is 617.4 secs Computing kpt #: 225 total cpu time spent up to now is 619.7 secs Computing kpt #: 226 total cpu time spent up to now is 622.0 secs Computing kpt #: 227 total cpu time spent up to now is 624.5 secs Computing kpt #: 228 total cpu time spent up to now is 627.0 secs Computing kpt #: 229 total cpu time spent up to now is 629.5 secs Computing kpt #: 230 total cpu time spent up to now is 632.2 secs Computing kpt #: 231 total cpu time spent up to now is 634.7 secs Computing kpt #: 232 total cpu time spent up to now is 637.3 secs Computing kpt #: 233 total cpu time spent up to now is 640.0 secs Computing kpt #: 234 total cpu time spent up to now is 642.6 secs Computing kpt #: 235 total cpu time spent up to now is 645.3 secs Computing kpt #: 236 total cpu time spent up to now is 648.0 secs Computing kpt #: 237 total cpu time spent up to now is 650.6 secs Computing kpt #: 238 total cpu time spent up to now is 653.2 secs Computing kpt #: 239 total cpu time spent up to now is 655.9 secs Computing kpt #: 240 total cpu time spent up to now is 658.6 secs Computing kpt #: 241 total cpu time spent up to now is 661.3 secs Computing kpt #: 242 total cpu time spent up to now is 664.1 secs Computing kpt #: 243 total cpu time spent up to now is 666.9 secs Computing kpt #: 244 total cpu time spent up to now is 669.6 secs Computing kpt #: 245 total cpu time spent up to now is 672.4 secs Computing kpt #: 246 total cpu time spent up to now is 675.3 secs Computing kpt #: 247 total cpu time spent up to now is 678.1 secs Computing kpt #: 248 total cpu time spent up to now is 680.9 secs Computing kpt #: 249 total cpu time spent up to now is 683.7 secs Computing kpt #: 250 total cpu time spent up to now is 686.5 secs Computing kpt #: 251 total cpu time spent up to now is 689.3 secs Computing kpt #: 252 total cpu time spent up to now is 692.1 secs Computing kpt #: 253 total cpu time spent up to now is 695.1 secs Computing kpt #: 254 total cpu time spent up to now is 697.9 secs Computing kpt #: 255 total cpu time spent up to now is 700.7 secs Computing kpt #: 256 total cpu time spent up to now is 703.6 secs Computing kpt #: 257 total cpu time spent up to now is 706.4 secs Computing kpt #: 258 total cpu time spent up to now is 709.2 secs Computing kpt #: 259 total cpu time spent up to now is 712.2 secs Computing kpt #: 260 total cpu time spent up to now is 715.0 secs Computing kpt #: 261 total cpu time spent up to now is 717.8 secs Computing kpt #: 262 total cpu time spent up to now is 720.6 secs Computing kpt #: 263 total cpu time spent up to now is 723.5 secs Computing kpt #: 264 total cpu time spent up to now is 726.3 secs Computing kpt #: 265 total cpu time spent up to now is 729.1 secs Computing kpt #: 266 total cpu time spent up to now is 731.9 secs Computing kpt #: 267 total cpu time spent up to now is 734.6 secs Computing kpt #: 268 total cpu time spent up to now is 737.5 secs Computing kpt #: 269 total cpu time spent up to now is 740.4 secs Computing kpt #: 270 total cpu time spent up to now is 743.2 secs Computing kpt #: 271 total cpu time spent up to now is 745.9 secs Computing kpt #: 272 total cpu time spent up to now is 748.6 secs Computing kpt #: 273 total cpu time spent up to now is 751.3 secs Computing kpt #: 274 total cpu time spent up to now is 754.0 secs Computing kpt #: 275 total cpu time spent up to now is 756.7 secs Computing kpt #: 276 total cpu time spent up to now is 759.4 secs Computing kpt #: 277 total cpu time spent up to now is 762.3 secs Computing kpt #: 278 total cpu time spent up to now is 765.6 secs Computing kpt #: 279 total cpu time spent up to now is 768.2 secs Computing kpt #: 280 total cpu time spent up to now is 770.8 secs Computing kpt #: 281 total cpu time spent up to now is 773.4 secs Computing kpt #: 282 total cpu time spent up to now is 776.0 secs Computing kpt #: 283 total cpu time spent up to now is 778.5 secs Computing kpt #: 284 total cpu time spent up to now is 781.0 secs Computing kpt #: 285 total cpu time spent up to now is 783.6 secs Computing kpt #: 286 total cpu time spent up to now is 786.1 secs Computing kpt #: 287 total cpu time spent up to now is 788.6 secs Computing kpt #: 288 total cpu time spent up to now is 791.1 secs Computing kpt #: 289 total cpu time spent up to now is 793.6 secs Computing kpt #: 290 total cpu time spent up to now is 796.1 secs Computing kpt #: 291 total cpu time spent up to now is 798.5 secs Computing kpt #: 292 total cpu time spent up to now is 801.1 secs Computing kpt #: 293 total cpu time spent up to now is 803.5 secs Computing kpt #: 294 total cpu time spent up to now is 805.8 secs Computing kpt #: 295 total cpu time spent up to now is 808.0 secs Computing kpt #: 296 total cpu time spent up to now is 810.2 secs Computing kpt #: 297 total cpu time spent up to now is 812.6 secs Computing kpt #: 298 total cpu time spent up to now is 815.0 secs Computing kpt #: 299 total cpu time spent up to now is 817.3 secs Computing kpt #: 300 total cpu time spent up to now is 819.6 secs Computing kpt #: 301 total cpu time spent up to now is 821.8 secs Computing kpt #: 302 total cpu time spent up to now is 824.5 secs Computing kpt #: 303 total cpu time spent up to now is 826.8 secs Computing kpt #: 304 total cpu time spent up to now is 829.2 secs Computing kpt #: 305 total cpu time spent up to now is 831.6 secs Computing kpt #: 306 total cpu time spent up to now is 834.2 secs Computing kpt #: 307 total cpu time spent up to now is 836.7 secs Computing kpt #: 308 total cpu time spent up to now is 839.2 secs Computing kpt #: 309 total cpu time spent up to now is 841.8 secs Computing kpt #: 310 total cpu time spent up to now is 844.3 secs Computing kpt #: 311 total cpu time spent up to now is 846.9 secs Computing kpt #: 312 total cpu time spent up to now is 849.5 secs Computing kpt #: 313 total cpu time spent up to now is 852.1 secs Computing kpt #: 314 total cpu time spent up to now is 854.9 secs Computing kpt #: 315 total cpu time spent up to now is 857.6 secs Computing kpt #: 316 total cpu time spent up to now is 860.5 secs Computing kpt #: 317 total cpu time spent up to now is 863.2 secs Computing kpt #: 318 total cpu time spent up to now is 865.9 secs Computing kpt #: 319 total cpu time spent up to now is 868.8 secs Computing kpt #: 320 total cpu time spent up to now is 871.6 secs Computing kpt #: 321 total cpu time spent up to now is 874.4 secs Computing kpt #: 322 total cpu time spent up to now is 877.1 secs Computing kpt #: 323 total cpu time spent up to now is 879.9 secs Computing kpt #: 324 total cpu time spent up to now is 882.7 secs Computing kpt #: 325 total cpu time spent up to now is 885.4 secs Computing kpt #: 326 total cpu time spent up to now is 888.3 secs Computing kpt #: 327 total cpu time spent up to now is 891.2 secs Computing kpt #: 328 total cpu time spent up to now is 894.1 secs Computing kpt #: 329 total cpu time spent up to now is 896.9 secs Computing kpt #: 330 total cpu time spent up to now is 899.8 secs Computing kpt #: 331 total cpu time spent up to now is 902.6 secs Computing kpt #: 332 total cpu time spent up to now is 905.4 secs Computing kpt #: 333 total cpu time spent up to now is 908.2 secs Computing kpt #: 334 total cpu time spent up to now is 911.0 secs Computing kpt #: 335 total cpu time spent up to now is 913.8 secs Computing kpt #: 336 total cpu time spent up to now is 916.6 secs Computing kpt #: 337 total cpu time spent up to now is 919.4 secs Computing kpt #: 338 total cpu time spent up to now is 922.1 secs ethr = 2.00E-11, avg # of iterations = 35.7 total cpu time spent up to now is 922.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4043 PWs) bands (ev): -16.3520 -16.3520 -14.9694 -14.9694 -14.3409 -14.3409 -13.7447 -13.7447 -13.6643 -13.6643 -13.2766 -13.2766 -5.1978 -5.1978 -4.4807 -4.4807 -3.4349 -3.4349 -2.7291 -2.7291 -2.6764 -2.6764 -1.1267 -1.1267 -0.2269 -0.2269 0.1378 0.1378 0.3592 0.3592 1.2024 1.2024 1.5397 1.5397 1.9707 1.9707 2.2906 2.2906 2.3719 2.3719 2.4843 2.4843 2.8626 2.8626 3.0255 3.0255 3.2518 3.2518 3.3983 3.3983 8.3131 8.3131 10.0132 10.0132 10.5814 10.5814 11.0131 11.0131 12.3170 12.3170 k = 0.0109 0.0075-0.0036 ( 4043 PWs) bands (ev): -16.3515 -16.3513 -14.9696 -14.9690 -14.3411 -14.3404 -13.7456 -13.7454 -13.6646 -13.6638 -13.2776 -13.2765 -5.1978 -5.1972 -4.4835 -4.4833 -3.4340 -3.4334 -2.7344 -2.7202 -2.6804 -2.6690 -1.1329 -1.1215 -0.2298 -0.2273 0.1203 0.1528 0.3528 0.3672 1.1942 1.2107 1.5229 1.5570 1.9587 1.9639 2.2910 2.3024 2.3726 2.3781 2.4846 2.4856 2.8616 2.8624 3.0258 3.0265 3.2515 3.2518 3.3978 3.3980 8.3002 8.3255 10.0008 10.0243 10.5689 10.5918 11.0010 11.0306 12.3076 12.3276 k = 0.0217 0.0150-0.0072 ( 4043 PWs) bands (ev): -16.3498 -16.3495 -14.9698 -14.9686 -14.3410 -14.3395 -13.7481 -13.7477 -13.6647 -13.6630 -13.2796 -13.2775 -5.1972 -5.1960 -4.4915 -4.4910 -3.4309 -3.4295 -2.7362 -2.7086 -2.6802 -2.6583 -1.1399 -1.1171 -0.2361 -0.2307 0.1018 0.1639 0.3491 0.3758 1.1867 1.2190 1.5070 1.5741 1.9316 1.9402 2.3030 2.3197 2.3793 2.3928 2.4868 2.4892 2.8595 2.8612 3.0274 3.0288 3.2507 3.2513 3.3966 3.3970 8.2867 8.3371 9.9871 10.0342 10.5562 10.5986 10.9956 11.0521 12.2996 12.3394 k = 0.0326 0.0226-0.0109 ( 4045 PWs) bands (ev): -16.3469 -16.3465 -14.9698 -14.9681 -14.3406 -14.3384 -13.7521 -13.7516 -13.6645 -13.6621 -13.2826 -13.2794 -5.1960 -5.1942 -4.5044 -4.5036 -3.4254 -3.4233 -2.7348 -2.6980 -2.6723 -2.6439 -1.1476 -1.1137 -0.2464 -0.2369 0.0834 0.1700 0.3486 0.3842 1.1798 1.2264 1.4927 1.5903 1.8939 1.9066 2.3199 2.3353 2.3919 2.4142 2.4924 2.4985 2.8564 2.8588 3.0302 3.0322 3.2495 3.2504 3.3947 3.3954 8.2728 8.3481 9.9721 10.0429 10.5447 10.6002 10.9979 11.0765 12.2930 12.3521 k = 0.0435 0.0301-0.0145 ( 4050 PWs) bands (ev): -16.3429 -16.3423 -14.9697 -14.9674 -14.3399 -14.3370 -13.7575 -13.7570 -13.6643 -13.6611 -13.2865 -13.2823 -5.1946 -5.1921 -4.5216 -4.5206 -3.4177 -3.4150 -2.7309 -2.6919 -2.6536 -2.6257 -1.1561 -1.1111 -0.2608 -0.2459 0.0664 0.1712 0.3512 0.3918 1.1735 1.2321 1.4804 1.6047 1.8487 1.8708 2.3359 2.3482 2.4074 2.4324 2.5044 2.5203 2.8522 2.8555 3.0341 3.0368 3.2478 3.2490 3.3922 3.3931 8.2585 8.3583 9.9558 10.0505 10.5355 10.5962 11.0082 11.1029 12.2880 12.3656 k = 0.0543 0.0376-0.0181 ( 4053 PWs) bands (ev): -16.3376 -16.3369 -14.9696 -14.9667 -14.3389 -14.3353 -13.7644 -13.7638 -13.6639 -13.6601 -13.2913 -13.2861 -5.1932 -5.1899 -4.5424 -4.5411 -3.4079 -3.4046 -2.7250 -2.6871 -2.6276 -2.6035 -1.1652 -1.1094 -0.2795 -0.2575 0.0515 0.1681 0.3561 0.3979 1.1678 1.2351 1.4703 1.6157 1.7997 1.8379 2.3501 2.3601 2.4202 2.4411 2.5262 2.5563 2.8473 2.8513 3.0390 3.0423 3.2457 3.2473 3.3891 3.3903 8.2439 8.3676 9.9383 10.0572 10.5293 10.5869 11.0261 11.1308 12.2845 12.3797 k = 0.0652 0.0451-0.0217 ( 4053 PWs) bands (ev): -16.3312 -16.3303 -14.9693 -14.9659 -14.3376 -14.3334 -13.7725 -13.7720 -13.6635 -13.6591 -13.2970 -13.2908 -5.1921 -5.1879 -4.5660 -4.5642 -3.3962 -3.3923 -2.7174 -2.6817 -2.5969 -2.5775 -1.1748 -1.1085 -0.3024 -0.2718 0.0390 0.1619 0.3618 0.4022 1.1625 1.2343 1.4622 1.6211 1.7501 1.8120 2.3634 2.3722 2.4270 2.4435 2.5575 2.6006 2.8418 2.8466 3.0447 3.0487 3.2432 3.2450 3.3856 3.3870 8.2291 8.3761 9.9197 10.0631 10.5259 10.5738 11.0504 11.1598 12.2827 12.3941 k = 0.0761 0.0526-0.0253 ( 4057 PWs) bands (ev): -16.3237 -16.3226 -14.9689 -14.9650 -14.3362 -14.3313 -13.7818 -13.7814 -13.6632 -13.6581 -13.3035 -13.2963 -5.1919 -5.1867 -4.5912 -4.5889 -3.3828 -3.3782 -2.7084 -2.6750 -2.5624 -2.5478 -1.1847 -1.1082 -0.3291 -0.2887 0.0290 0.1537 0.3672 0.4046 1.1572 1.2290 1.4546 1.6170 1.7050 1.7963 2.3767 2.3848 2.4291 2.4430 2.5944 2.6476 2.8363 2.8418 3.0512 3.0557 3.2402 3.2424 3.3819 3.3836 8.2140 8.3836 9.9002 10.0685 10.5241 10.5596 11.0797 11.1894 12.2824 12.4088 k = 0.0870 0.0602-0.0290 ( 4051 PWs) bands (ev): -16.3149 -16.3137 -14.9684 -14.9640 -14.3347 -14.3291 -13.7922 -13.7919 -13.6629 -13.6572 -13.3107 -13.3026 -5.1933 -5.1869 -4.6170 -4.6140 -3.3678 -3.3627 -2.6982 -2.6671 -2.5249 -2.5149 -1.1949 -1.1085 -0.3592 -0.3081 0.0212 0.1444 0.3714 0.4047 1.1511 1.2193 1.4455 1.5975 1.6737 1.7918 2.3898 2.3983 2.4292 2.4415 2.6323 2.6935 2.8321 2.8380 3.0581 3.0632 3.2367 3.2392 3.3782 3.3802 8.1990 8.3901 9.8801 10.0737 10.5181 10.5513 11.1128 11.2196 12.2837 12.4234 k = 0.0978 0.0677-0.0326 ( 4055 PWs) bands (ev): -16.3050 -16.3037 -14.9678 -14.9629 -14.3330 -14.3268 -13.8038 -13.8036 -13.6627 -13.6565 -13.3187 -13.3097 -5.1970 -5.1893 -4.6419 -4.6381 -3.3513 -3.3457 -2.6867 -2.6577 -2.4849 -2.4791 -1.2051 -1.1092 -0.3919 -0.3298 0.0151 0.1345 0.3737 0.4026 1.1429 1.2055 1.4326 1.5618 1.6631 1.7959 2.4007 2.4115 2.4301 2.4411 2.6676 2.7328 2.8326 2.8375 3.0652 3.0710 3.2326 3.2356 3.3749 3.3771 8.1838 8.3956 9.8595 10.0789 10.5028 10.5546 11.1485 11.2502 12.2864 12.4378 k = 0.1087 0.0752-0.0362 ( 4061 PWs) bands (ev): -16.2940 -16.2925 -14.9671 -14.9618 -14.3313 -14.3246 -13.8164 -13.8163 -13.6626 -13.6558 -13.3274 -13.3175 -5.2039 -5.1948 -4.6645 -4.6598 -3.3337 -3.3277 -2.6741 -2.6469 -2.4430 -2.4411 -1.2154 -1.1102 -0.4266 -0.3535 0.0103 0.1242 0.3740 0.3984 1.1304 1.1893 1.4150 1.5210 1.6672 1.8054 2.4054 2.4194 2.4375 2.4465 2.6959 2.7565 2.8392 2.8502 3.0723 3.0788 3.2279 3.2314 3.3722 3.3749 8.1688 8.4001 9.8389 10.0843 10.4830 10.5653 11.1861 11.2811 12.2906 12.4519 k = 0.1196 0.0827-0.0398 ( 4059 PWs) bands (ev): -16.2818 -16.2802 -14.9663 -14.9605 -14.3297 -14.3225 -13.8301 -13.8299 -13.6626 -13.6553 -13.3366 -13.3259 -5.2150 -5.2044 -4.6835 -4.6778 -3.3151 -3.3088 -2.6602 -2.6346 -2.4012 -2.3996 -1.2256 -1.1114 -0.4627 -0.3791 0.0061 0.1134 0.3723 0.3923 1.1109 1.1723 1.3936 1.4834 1.6806 1.8177 2.4038 2.4194 2.4519 2.4605 2.7130 2.7612 2.8527 2.8811 3.0792 3.0867 3.2227 3.2268 3.3709 3.3739 8.1539 8.4035 9.8186 10.0903 10.4622 10.5801 11.2250 11.3122 12.2961 12.4656 k = 0.1304 0.0902-0.0434 ( 4061 PWs) bands (ev): -16.2685 -16.2667 -14.9654 -14.9592 -14.3282 -14.3205 -13.8447 -13.8443 -13.6627 -13.6548 -13.3464 -13.3349 -5.2310 -5.2189 -4.6976 -4.6909 -3.2958 -3.2891 -2.6450 -2.6209 -2.3598 -2.3553 -1.2354 -1.1126 -0.4997 -0.4061 0.0021 0.1021 0.3687 0.3846 1.0831 1.1541 1.3703 1.4526 1.7002 1.8309 2.3993 2.4163 2.4690 2.4792 2.7184 2.7560 2.8748 2.9187 3.0856 3.0944 3.2171 3.2218 3.3713 3.3749 8.1393 8.4058 9.7989 10.0969 10.4416 10.5979 11.2646 11.3436 12.3029 12.4787 k = 0.1413 0.0977-0.0471 ( 4060 PWs) bands (ev): -16.2541 -16.2522 -14.9643 -14.9578 -14.3270 -14.3189 -13.8601 -13.8595 -13.6629 -13.6544 -13.3566 -13.3444 -5.2523 -5.2388 -4.7059 -4.6983 -3.2759 -3.2691 -2.6284 -2.6056 -2.3176 -2.3103 -1.2450 -1.1136 -0.5371 -0.4344 -0.0023 0.0900 0.3637 0.3757 1.0484 1.1323 1.3483 1.4297 1.7237 1.8440 2.3936 2.4124 2.4877 2.4997 2.7154 2.7468 2.9016 2.9559 3.0914 3.1022 3.2111 3.2166 3.3741 3.3785 8.1249 8.4071 9.7800 10.1042 10.4219 10.6181 11.3046 11.3752 12.3108 12.4913 k = 0.1522 0.1053-0.0507 ( 4059 PWs) bands (ev): -16.2386 -16.2365 -14.9632 -14.9563 -14.3263 -14.3178 -13.8761 -13.8754 -13.6631 -13.6541 -13.3672 -13.3543 -5.2790 -5.2643 -4.7080 -4.6996 -3.2558 -3.2489 -2.6106 -2.5888 -2.2747 -2.2652 -1.2540 -1.1143 -0.5744 -0.4634 -0.0076 0.0768 0.3578 0.3662 1.0086 1.1040 1.3311 1.4134 1.7494 1.8563 2.3875 2.4083 2.5076 2.5205 2.7077 2.7364 2.9289 2.9888 3.0963 3.1101 3.2055 3.2117 3.3798 3.3854 8.1110 8.4074 9.7622 10.1121 10.4037 10.6402 11.3446 11.4069 12.3197 12.5032 k = 0.1630 0.1128-0.0543 ( 4055 PWs) bands (ev): -16.2220 -16.2198 -14.9620 -14.9548 -14.3260 -14.3172 -13.8926 -13.8918 -13.6635 -13.6539 -13.3782 -13.3645 -5.3106 -5.2950 -4.7039 -4.6950 -3.2358 -3.2288 -2.5913 -2.5705 -2.2317 -2.2204 -1.2624 -1.1146 -0.6112 -0.4929 -0.0144 0.0622 0.3514 0.3569 0.9653 1.0689 1.3205 1.4020 1.7756 1.8669 2.3813 2.4043 2.5283 2.5402 2.6978 2.7264 2.9539 3.0148 3.0999 3.1181 3.2013 3.2084 3.3888 3.3962 8.0975 8.4068 9.7457 10.1207 10.3873 10.6638 11.3846 11.4388 12.3295 12.5144 k = 0.1739 0.1203-0.0579 ( 4055 PWs) bands (ev): -16.2043 -16.2020 -14.9607 -14.9532 -14.3265 -14.3175 -13.9095 -13.9085 -13.6639 -13.6538 -13.3893 -13.3751 -5.3465 -5.3302 -4.6941 -4.6849 -3.2159 -3.2091 -2.5708 -2.5508 -2.1888 -2.1760 -1.2701 -1.1143 -0.6472 -0.5224 -0.0232 0.0459 0.3445 0.3491 0.9196 1.0282 1.3158 1.3941 1.8011 1.8756 2.3753 2.4004 2.5493 2.5570 2.6874 2.7189 2.9747 3.0326 3.1016 3.1242 3.1998 3.2090 3.4013 3.4113 8.0845 8.4052 9.7307 10.1296 10.3732 10.6886 11.4242 11.4709 12.3401 12.5249 k = 0.1848 0.1278-0.0616 ( 4061 PWs) bands (ev): -16.1855 -16.1831 -14.9593 -14.9516 -14.3279 -14.3189 -13.9264 -13.9254 -13.6644 -13.6537 -13.4006 -13.3858 -5.3859 -5.3691 -4.6792 -4.6698 -3.1966 -3.1899 -2.5490 -2.5297 -2.1464 -2.1326 -1.2771 -1.1132 -0.6820 -0.5515 -0.0343 0.0278 0.3374 0.3435 0.8725 0.9836 1.3155 1.3886 1.8248 1.8818 2.3697 2.3966 2.5662 2.5716 2.6780 2.7168 2.9904 3.0431 3.1007 3.1253 3.2017 3.2163 3.4175 3.4310 8.0722 8.4027 9.7172 10.1384 10.3619 10.7141 11.4634 11.5031 12.3514 12.5347 k = 0.1957 0.1353-0.0652 ( 4062 PWs) bands (ev): -16.1657 -16.1632 -14.9579 -14.9499 -14.3305 -14.3215 -13.9432 -13.9422 -13.6650 -13.6538 -13.4119 -13.3966 -5.4280 -5.4109 -4.6598 -4.6503 -3.1780 -3.1714 -2.5261 -2.5074 -2.1048 -2.0903 -1.2831 -1.1113 -0.7151 -0.5800 -0.0482 0.0079 0.3313 0.3399 0.8246 0.9368 1.3181 1.3850 1.8455 1.8854 2.3646 2.3925 2.5701 2.5891 2.6717 2.7223 3.0008 3.0481 3.0965 3.1207 3.2072 3.2299 3.4370 3.4550 8.0605 8.3994 9.7054 10.1467 10.3538 10.7402 11.5020 11.5355 12.3631 12.5438 k = 0.2065 0.1429-0.0688 ( 4060 PWs) bands (ev): -16.1448 -16.1422 -14.9564 -14.9482 -14.3345 -14.3256 -13.9595 -13.9586 -13.6657 -13.6539 -13.4232 -13.4075 -5.4721 -5.4548 -4.6365 -4.6271 -3.1602 -3.1538 -2.5023 -2.4842 -2.0642 -2.0494 -1.2881 -1.1085 -0.7462 -0.6073 -0.0650 -0.0138 0.3271 0.3381 0.7764 0.8889 1.3224 1.3824 1.8620 1.8864 2.3601 2.3877 2.5658 2.6008 2.6728 2.7358 3.0066 3.0498 3.0892 3.1122 3.2163 3.2469 3.4597 3.4829 8.0496 8.3954 9.6954 10.1538 10.3495 10.7666 11.5401 11.5679 12.3753 12.5521 k = 0.2174 0.1504-0.0724 ( 4052 PWs) bands (ev): -16.1230 -16.1203 -14.9549 -14.9466 -14.3401 -14.3316 -13.9750 -13.9743 -13.6666 -13.6542 -13.4344 -13.4183 -5.5175 -5.5001 -4.6099 -4.6005 -3.1436 -3.1372 -2.4780 -2.4602 -2.0248 -2.0103 -1.2919 -1.1045 -0.7750 -0.6332 -0.0846 -0.0369 0.3252 0.3382 0.7283 0.8404 1.3277 1.3806 1.8719 1.8864 2.3557 2.3816 2.5561 2.6032 2.6846 2.7548 3.0089 3.0496 3.0796 3.1016 3.2280 3.2649 3.4849 3.5137 8.0394 8.3907 9.6871 10.1592 10.3496 10.7929 11.5774 11.6003 12.3877 12.5597 k = 0.2283 0.1579-0.0760 ( 4062 PWs) bands (ev): -16.1002 -16.0974 -14.9534 -14.9450 -14.3477 -14.3397 -13.9895 -13.9890 -13.6676 -13.6547 -13.4454 -13.4290 -5.5637 -5.5463 -4.5804 -4.5712 -3.1281 -3.1216 -2.4535 -2.4360 -1.9869 -1.9729 -1.2944 -1.0995 -0.8009 -0.6572 -0.1068 -0.0613 0.3256 0.3401 0.6805 0.7921 1.3332 1.3790 1.8713 1.8885 2.3510 2.3735 2.5441 2.5995 2.7040 2.7770 3.0089 3.0484 3.0687 3.0902 3.2413 3.2830 3.5121 3.5467 8.0301 8.3854 9.6806 10.1623 10.3543 10.8189 11.6140 11.6328 12.4003 12.5665 k = 0.2391 0.1654-0.0797 ( 4064 PWs) bands (ev): -16.0764 -16.0735 -14.9520 -14.9434 -14.3575 -14.3502 -14.0029 -14.0022 -13.6689 -13.6555 -13.4561 -13.4395 -5.6103 -5.5929 -4.5484 -4.5393 -3.1140 -3.1072 -2.4294 -2.4120 -1.9505 -1.9376 -1.2955 -1.0932 -0.8236 -0.6789 -0.1311 -0.0866 0.3282 0.3439 0.6333 0.7441 1.3386 1.3775 1.8631 1.8896 2.3448 2.3627 2.5318 2.5941 2.7267 2.8003 3.0078 3.0469 3.0572 3.0793 3.2556 3.3009 3.5407 3.5811 8.0217 8.3796 9.6759 10.1630 10.3636 10.8444 11.6499 11.6651 12.4128 12.5724 k = 0.2500 0.1729-0.0833 ( 4064 PWs) bands (ev): -16.0516 -16.0487 -14.9506 -14.9420 -14.3696 -14.3632 -14.0148 -14.0137 -13.6705 -13.6566 -13.4663 -13.4496 -5.6567 -5.6395 -4.5142 -4.5053 -3.1011 -3.0938 -2.4064 -2.3890 -1.9157 -1.9041 -1.2949 -1.0856 -0.8428 -0.6981 -0.1570 -0.1126 0.3330 0.3494 0.5869 0.6968 1.3434 1.3757 1.8508 1.8864 2.3359 2.3488 2.5211 2.5893 2.7501 2.8235 3.0064 3.0441 3.0463 3.0707 3.2704 3.3186 3.5703 3.6160 8.0142 8.3733 9.6730 10.1616 10.3771 10.8691 11.6850 11.6974 12.4252 12.5776 k = 0.2609 0.1805-0.0869 ( 4068 PWs) bands (ev): -16.0260 -16.0230 -14.9493 -14.9407 -14.3842 -14.3787 -14.0252 -14.0234 -13.6723 -13.6581 -13.4760 -13.4593 -5.7027 -5.6858 -4.4781 -4.4694 -3.0895 -3.0815 -2.3850 -2.3676 -1.8826 -1.8724 -1.2924 -1.0768 -0.8582 -0.7145 -0.1840 -0.1390 0.3396 0.3565 0.5415 0.6502 1.3473 1.3734 1.8352 1.8782 2.3232 2.3314 2.5132 2.5856 2.7725 2.8453 3.0058 3.0355 3.0402 3.0672 3.2855 3.3364 3.6003 3.6510 8.0077 8.3665 9.6717 10.1583 10.3942 10.8928 11.7193 11.7294 12.4374 12.5819 k = 0.2717 0.1880-0.0905 ( 4068 PWs) bands (ev): -15.9994 -15.9964 -14.9482 -14.9395 -14.4013 -14.3969 -14.0337 -14.0312 -13.6747 -13.6601 -13.4849 -13.4684 -5.7481 -5.7314 -4.4403 -4.4319 -3.0791 -3.0703 -2.3662 -2.3486 -1.8509 -1.8423 -1.2878 -1.0666 -0.8693 -0.7278 -0.2115 -0.1655 0.3474 0.3652 0.4976 0.6047 1.3500 1.3706 1.8167 1.8654 2.3061 2.3108 2.5084 2.5829 2.7928 2.8642 3.0067 3.0275 3.0334 3.0694 3.3011 3.3543 3.6304 3.6856 8.0022 8.3593 9.6721 10.1536 10.4142 10.9153 11.7528 11.7612 12.4493 12.5854 k = 0.2826 0.1955-0.0941 ( 4070 PWs) bands (ev): -15.9720 -15.9690 -14.9473 -14.9386 -14.4207 -14.4174 -14.0405 -14.0372 -13.6775 -13.6626 -13.4931 -13.4769 -5.7925 -5.7762 -4.4011 -4.3929 -3.0697 -3.0600 -2.3508 -2.3329 -1.8205 -1.8134 -1.2810 -1.0550 -0.8763 -0.7379 -0.2391 -0.1918 0.3552 0.3751 0.4562 0.5604 1.3515 1.3670 1.7955 1.8482 2.2846 2.2874 2.5062 2.5807 2.8104 2.8789 3.0085 3.0229 3.0282 3.0761 3.3170 3.3726 3.6602 3.7195 7.9978 8.3517 9.6741 10.1478 10.4365 10.9365 11.7855 11.7927 12.4606 12.5881 k = 0.2935 0.2030-0.0978 ( 4070 PWs) bands (ev): -15.9438 -15.9407 -14.9467 -14.9381 -14.4423 -14.4401 -14.0457 -14.0416 -13.6808 -13.6659 -13.5005 -13.4847 -5.8357 -5.8199 -4.3607 -4.3528 -3.0614 -3.0507 -2.3395 -2.3213 -1.7910 -1.7853 -1.2717 -1.0423 -0.8789 -0.7447 -0.2663 -0.2176 0.3586 0.3859 0.4215 0.5180 1.3513 1.3627 1.7720 1.8272 2.2594 2.2617 2.5056 2.5783 2.8248 2.8883 3.0080 3.0188 3.0332 3.0858 3.3336 3.3913 3.6895 3.7522 7.9944 8.3438 9.6776 10.1412 10.4606 10.9560 11.8174 11.8238 12.4714 12.5901 k = 0.3043 0.2105-0.1014 ( 4070 PWs) bands (ev): -15.9148 -15.9117 -14.9465 -14.9379 -14.4657 -14.4647 -14.0492 -14.0445 -13.6848 -13.6699 -13.5068 -13.4916 -5.8776 -5.8622 -4.3193 -4.3116 -3.0539 -3.0421 -2.3331 -2.3145 -1.7622 -1.7575 -1.2600 -1.0284 -0.8773 -0.7481 -0.2927 -0.2428 0.3442 0.3944 0.4079 0.4791 1.3494 1.3576 1.7464 1.8027 2.2314 2.2342 2.5055 2.5749 2.8365 2.8928 3.0063 3.0154 3.0476 3.0979 3.3510 3.4106 3.7180 3.7836 7.9921 8.3355 9.6825 10.1339 10.4862 10.9739 11.8484 11.8544 12.4814 12.5913 k = 0.3152 0.2180-0.1050 ( 4072 PWs) bands (ev): -15.8851 -15.8820 -14.9468 -14.9382 -14.4908 -14.4907 -14.0514 -14.0461 -13.6893 -13.6746 -13.5121 -13.4977 -5.9181 -5.9032 -4.2771 -4.2697 -3.0470 -3.0343 -2.3321 -2.3130 -1.7338 -1.7298 -1.2457 -1.0135 -0.8717 -0.7482 -0.3181 -0.2670 0.3117 0.3917 0.4173 0.4514 1.3453 1.3517 1.7191 1.7755 2.2017 2.2051 2.5049 2.5700 2.8458 2.8940 3.0056 3.0141 3.0667 3.1113 3.3693 3.4304 3.7455 3.8135 7.9908 8.3268 9.6887 10.1260 10.5129 10.9899 11.8786 11.8844 12.4906 12.5917 k = 0.3261 0.2256-0.1086 ( 4072 PWs) bands (ev): -15.8546 -15.8515 -14.9477 -14.9391 -14.5180 -14.5169 -14.0524 -14.0465 -13.6945 -13.6801 -13.5164 -13.5029 -5.9568 -5.9426 -4.2343 -4.2272 -3.0407 -3.0269 -2.3366 -2.3169 -1.7058 -1.7019 -1.2289 -0.9979 -0.8622 -0.7452 -0.3421 -0.2901 0.2743 0.3688 0.4323 0.4475 1.3391 1.3450 1.6904 1.7458 2.1708 2.1750 2.5030 2.5631 2.8538 2.8934 3.0062 3.0147 3.0879 3.1254 3.3889 3.4508 3.7720 3.8417 7.9907 8.3177 9.6962 10.1175 10.5404 11.0039 11.9079 11.9138 12.4989 12.5915 k = 0.3370 0.2331-0.1122 ( 4068 PWs) bands (ev): -15.8236 -15.8205 -14.9493 -14.9408 -14.5460 -14.5439 -14.0524 -14.0460 -13.7003 -13.6863 -13.5198 -13.5072 -5.9938 -5.9802 -4.1912 -4.1843 -3.0347 -3.0200 -2.3466 -2.3264 -1.6781 -1.6739 -1.2096 -0.9817 -0.8494 -0.7390 -0.3646 -0.3119 0.2363 0.3339 0.4494 0.4586 1.3308 1.3370 1.6610 1.7144 2.1395 2.1443 2.4995 2.5543 2.8608 2.8925 3.0084 3.0171 3.1093 3.1396 3.4097 3.4718 3.7972 3.8680 7.9917 8.3083 9.7048 10.1084 10.5684 11.0159 11.9363 11.9425 12.5061 12.5906 k = 0.3478 0.2406-0.1159 ( 4070 PWs) bands (ev): -15.7919 -15.7889 -14.9519 -14.9435 -14.5742 -14.5712 -14.0515 -14.0448 -13.7067 -13.6930 -13.5222 -13.5107 -6.0289 -6.0159 -4.1480 -4.1414 -3.0289 -3.0132 -2.3619 -2.3411 -1.6510 -1.6459 -1.1881 -0.9653 -0.8335 -0.7299 -0.3852 -0.3324 0.1986 0.2963 0.4679 0.4748 1.3206 1.3271 1.6313 1.6818 2.1081 2.1135 2.4941 2.5435 2.8675 2.8920 3.0121 3.0209 3.1300 3.1533 3.4318 3.4931 3.8210 3.8923 7.9938 8.2984 9.7144 10.0988 10.5968 11.0258 11.9638 11.9705 12.5121 12.5892 k = 0.3587 0.2481-0.1195 ( 4065 PWs) bands (ev): -15.7597 -15.7567 -14.9557 -14.9474 -14.6023 -14.5985 -14.0499 -14.0429 -13.7134 -13.7003 -13.5238 -13.5135 -6.0620 -6.0497 -4.1050 -4.0986 -3.0230 -3.0064 -2.3820 -2.3607 -1.6248 -1.6183 -1.1644 -0.9488 -0.8150 -0.7181 -0.4038 -0.3513 0.1617 0.2583 0.4877 0.4935 1.3086 1.3147 1.6020 1.6488 2.0771 2.0830 2.4869 2.5310 2.8740 2.8925 3.0171 3.0257 3.1490 3.1662 3.4552 3.5147 3.8435 3.9146 7.9970 8.2881 9.7250 10.0887 10.6254 11.0336 11.9904 11.9975 12.5171 12.5871 k = 0.3696 0.2556-0.1231 ( 4059 PWs) bands (ev): -15.7271 -15.7242 -14.9610 -14.9528 -14.6297 -14.6251 -14.0477 -14.0406 -13.7205 -13.7080 -13.5248 -13.5155 -6.0929 -6.0814 -4.0624 -4.0563 -3.0169 -2.9995 -2.4063 -2.3844 -1.5997 -1.5915 -1.1389 -0.9327 -0.7943 -0.7039 -0.4204 -0.3688 0.1256 0.2206 0.5085 0.5140 1.2945 1.2995 1.5738 1.6160 2.0468 2.0530 2.4781 2.5173 2.8805 2.8940 3.0231 3.0314 3.1661 3.1781 3.4795 3.5362 3.8645 3.9347 8.0013 8.2775 9.7364 10.0780 10.6540 11.0392 12.0159 12.0237 12.5208 12.5846 k = 0.3804 0.2632-0.1267 ( 4059 PWs) bands (ev): -15.6941 -15.6913 -14.9681 -14.9601 -14.6558 -14.6507 -14.0451 -14.0379 -13.7278 -13.7159 -13.5252 -13.5170 -6.1217 -6.1110 -4.0206 -4.0148 -3.0103 -2.9922 -2.4342 -2.4119 -1.5762 -1.5660 -1.1119 -0.9170 -0.7718 -0.6873 -0.4347 -0.3847 0.0905 0.1835 0.5303 0.5360 1.2779 1.2812 1.5474 1.5844 2.0177 2.0240 2.4681 2.5026 2.8869 2.8964 3.0298 3.0376 3.1811 3.1889 3.5045 3.5576 3.8839 3.9526 8.0067 8.2663 9.7486 10.0667 10.6825 11.0426 12.0403 12.0487 12.5234 12.5816 k = 0.3913 0.2707-0.1303 ( 4057 PWs) bands (ev): -15.6609 -15.6583 -14.9773 -14.9696 -14.6802 -14.6747 -14.0421 -14.0350 -13.7350 -13.7238 -13.5252 -13.5180 -6.1482 -6.1383 -3.9800 -3.9745 -3.0031 -2.9842 -2.4650 -2.4423 -1.5543 -1.5422 -1.0837 -0.9022 -0.7479 -0.6689 -0.4469 -0.3990 0.0564 0.1470 0.5530 0.5592 1.2581 1.2600 1.5235 1.5548 1.9899 1.9963 2.4572 2.4875 2.8930 2.8997 3.0370 3.0443 3.1940 3.1985 3.5297 3.5784 3.9019 3.9681 8.0131 8.2548 9.7615 10.0548 10.7106 11.0439 12.0635 12.0725 12.5249 12.5781 k = 0.4022 0.2782-0.1340 ( 4053 PWs) bands (ev): -15.6277 -15.6251 -14.9889 -14.9816 -14.7022 -14.6965 -14.0389 -14.0319 -13.7422 -13.7317 -13.5248 -13.5185 -6.1723 -6.1633 -3.9410 -3.9358 -2.9950 -2.9755 -2.4982 -2.4752 -1.5343 -1.5205 -1.0550 -0.8885 -0.7230 -0.6488 -0.4567 -0.4118 0.0235 0.1112 0.5766 0.5834 1.2337 1.2371 1.5025 1.5280 1.9638 1.9700 2.4460 2.4724 2.8987 2.9037 3.0444 3.0511 3.2048 3.2070 3.5545 3.5983 3.9183 3.9814 8.0205 8.2428 9.7749 10.0424 10.7383 11.0430 12.0854 12.0950 12.5255 12.5741 k = 0.4130 0.2857-0.1376 ( 4057 PWs) bands (ev): -15.5945 -15.5922 -15.0030 -14.9962 -14.7214 -14.7158 -14.0355 -14.0289 -13.7491 -13.7394 -13.5242 -13.5188 -6.1940 -6.1859 -3.9040 -3.8991 -2.9857 -2.9656 -2.5330 -2.5097 -1.5162 -1.5012 -1.0262 -0.8761 -0.6976 -0.6276 -0.4643 -0.4231 -0.0080 0.0763 0.6011 0.6085 1.2058 1.2118 1.4847 1.5045 1.9396 1.9456 2.4348 2.4577 2.9040 2.9080 3.0518 3.0578 3.2137 3.2146 3.5786 3.6172 3.9333 3.9925 8.0289 8.2304 9.7889 10.0295 10.7655 11.0401 12.1060 12.1159 12.5253 12.5697 k = 0.4239 0.2932-0.1412 ( 4057 PWs) bands (ev): -15.5618 -15.5596 -15.0196 -15.0135 -14.7377 -14.7324 -14.0321 -14.0259 -13.7555 -13.7467 -13.5235 -13.5189 -6.2132 -6.2061 -3.8694 -3.8649 -2.9750 -2.9544 -2.5688 -2.5454 -1.5001 -1.4846 -0.9980 -0.8654 -0.6720 -0.6060 -0.4696 -0.4329 -0.0379 0.0422 0.6263 0.6344 1.1754 1.1838 1.4699 1.4847 1.9176 1.9232 2.4242 2.4437 2.9088 2.9125 3.0590 3.0642 3.2204 3.2215 3.6013 3.6346 3.9469 4.0012 8.0382 8.2177 9.8033 10.0160 10.7920 11.0352 12.1250 12.1351 12.5247 12.5648 k = 0.4348 0.3008-0.1448 ( 4057 PWs) bands (ev): -15.5298 -15.5278 -15.0383 -15.0330 -14.7509 -14.7461 -14.0288 -14.0231 -13.7614 -13.7536 -13.5227 -13.5188 -6.2299 -6.2237 -3.8379 -3.8338 -2.9628 -2.9417 -2.6048 -2.5815 -1.4860 -1.4707 -0.9710 -0.8567 -0.6468 -0.5848 -0.4726 -0.4411 -0.0657 0.0092 0.6521 0.6606 1.1436 1.1537 1.4578 1.4685 1.8980 1.9031 2.4143 2.4307 2.9131 2.9166 3.0657 3.0702 3.2258 3.2274 3.6223 3.6503 3.9592 4.0078 8.0484 8.2046 9.8181 10.0021 10.8176 11.0282 12.1423 12.1523 12.5239 12.5597 k = 0.4457 0.3083-0.1484 ( 4062 PWs) bands (ev): -15.4990 -15.4973 -15.0584 -15.0540 -14.7613 -14.7571 -14.0256 -14.0206 -13.7665 -13.7598 -13.5218 -13.5187 -6.2440 -6.2388 -3.8099 -3.8064 -2.9487 -2.9275 -2.6405 -2.6174 -1.4738 -1.4594 -0.9457 -0.8502 -0.6223 -0.5654 -0.4731 -0.4478 -0.0908 -0.0225 0.6780 0.6869 1.1114 1.1225 1.4482 1.4556 1.8810 1.8855 2.4056 2.4191 2.9170 2.9203 3.0718 3.0756 3.2302 3.2321 3.6411 3.6639 3.9701 4.0123 8.0593 8.1912 9.8332 9.9877 10.8424 11.0194 12.1578 12.1672 12.5232 12.5542 k = 0.4565 0.3158-0.1521 ( 4063 PWs) bands (ev): -15.4702 -15.4689 -15.0789 -15.0754 -14.7691 -14.7657 -14.0227 -14.0185 -13.7708 -13.7652 -13.5211 -13.5186 -6.2555 -6.2513 -3.7860 -3.7830 -2.9329 -2.9119 -2.6749 -2.6524 -1.4635 -1.4509 -0.9226 -0.8461 -0.5994 -0.5495 -0.4711 -0.4527 -0.1121 -0.0523 0.7037 0.7124 1.0801 1.0914 1.4408 1.4457 1.8669 1.8707 2.3984 2.4091 2.9205 2.9233 3.0770 3.0801 3.2337 3.2356 3.6574 3.6752 3.9799 4.0148 8.0709 8.1776 9.8486 9.9730 10.8662 11.0087 12.1712 12.1796 12.5228 12.5487 k = 0.4674 0.3233-0.1557 ( 4065 PWs) bands (ev): -15.4446 -15.4436 -15.0984 -15.0958 -14.7746 -14.7721 -14.0202 -14.0169 -13.7741 -13.7698 -13.5203 -13.5185 -6.2643 -6.2612 -3.7667 -3.7644 -2.9154 -2.8954 -2.7067 -2.6856 -1.4551 -1.4449 -0.9022 -0.8449 -0.5787 -0.5385 -0.4670 -0.4557 -0.1285 -0.0796 0.7280 0.7361 1.0516 1.0620 1.4354 1.4385 1.8559 1.8588 2.3928 2.4008 2.9233 2.9256 3.0814 3.0837 3.2365 3.2381 3.6708 3.6838 3.9886 4.0154 8.0832 8.1638 9.8642 9.9579 10.8888 10.9963 12.1823 12.1892 12.5231 12.5432 k = 0.4783 0.3308-0.1593 ( 4071 PWs) bands (ev): -15.4238 -15.4231 -15.1149 -15.1132 -14.7782 -14.7765 -14.0181 -14.0159 -13.7763 -13.7734 -13.5197 -13.5185 -6.2705 -6.2684 -3.7525 -3.7509 -2.8972 -2.8797 -2.7338 -2.7156 -1.4484 -1.4413 -0.8847 -0.8465 -0.5611 -0.5333 -0.4621 -0.4569 -0.1385 -0.1034 0.7494 0.7560 1.0281 1.0364 1.4317 1.4335 1.8480 1.8500 2.3891 2.3943 2.9256 2.9272 3.0847 3.0863 3.2385 3.2397 3.6811 3.6896 3.9961 4.0144 8.0959 8.1500 9.8799 9.9426 10.9102 10.9822 12.1909 12.1958 12.5243 12.5380 k = 0.4891 0.3383-0.1629 ( 4070 PWs) bands (ev): -15.4098 -15.4094 -15.1262 -15.1253 -14.7802 -14.7793 -14.0166 -14.0155 -13.7774 -13.7759 -13.5192 -13.5186 -6.2740 -6.2730 -3.7436 -3.7427 -2.8800 -2.8687 -2.7517 -2.7400 -1.4437 -1.4400 -0.8703 -0.8512 -0.5475 -0.5333 -0.4584 -0.4568 -0.1410 -0.1226 0.7653 0.7691 1.0129 1.0176 1.4296 1.4305 1.8435 1.8445 2.3873 2.3899 2.9271 2.9279 3.0869 3.0877 3.2399 3.2405 3.6881 3.6924 4.0025 4.0118 8.1090 8.1362 9.8956 9.9270 10.9304 10.9664 12.1967 12.1992 12.5263 12.5333 k = 0.5000 0.3459-0.1665 ( 4066 PWs) bands (ev): -15.4047 -15.4047 -15.1299 -15.1299 -14.7805 -14.7805 -14.0157 -14.0157 -13.7772 -13.7772 -13.5189 -13.5189 -6.2749 -6.2749 -3.7403 -3.7403 -2.8686 -2.8686 -2.7540 -2.7540 -1.4409 -1.4409 -0.8592 -0.8592 -0.5382 -0.5382 -0.4568 -0.4568 -0.1355 -0.1355 0.7725 0.7725 1.0091 1.0091 1.4292 1.4292 1.8423 1.8423 2.3876 2.3876 2.9279 2.9279 3.0879 3.0879 3.2405 3.2405 3.6919 3.6919 4.0078 4.0078 8.1225 8.1225 9.9114 9.9114 10.9491 10.9491 12.1995 12.1995 12.5294 12.5294 k = 0.5000 0.3459-0.1665 ( 4066 PWs) bands (ev): -15.4047 -15.4047 -15.1299 -15.1299 -14.7805 -14.7805 -14.0157 -14.0157 -13.7772 -13.7772 -13.5189 -13.5189 -6.2749 -6.2749 -3.7403 -3.7403 -2.8686 -2.8686 -2.7540 -2.7540 -1.4409 -1.4409 -0.8592 -0.8592 -0.5382 -0.5382 -0.4568 -0.4568 -0.1355 -0.1355 0.7725 0.7725 1.0091 1.0091 1.4292 1.4292 1.8423 1.8423 2.3876 2.3876 2.9279 2.9279 3.0879 3.0879 3.2405 3.2405 3.6919 3.6919 4.0078 4.0078 8.1225 8.1225 9.9114 9.9114 10.9491 10.9491 12.1995 12.1995 12.5294 12.5294 k = 0.5029 0.3479-0.1537 ( 4070 PWs) bands (ev): -15.4049 -15.4049 -15.1298 -15.1296 -14.7808 -14.7804 -14.0165 -14.0155 -13.7774 -13.7763 -13.5191 -13.5188 -6.2741 -6.2734 -3.7431 -3.7417 -2.8714 -2.8677 -2.7558 -2.7519 -1.4394 -1.4384 -0.8627 -0.8571 -0.5455 -0.5317 -0.4652 -0.4459 -0.1383 -0.1305 0.7718 0.7727 1.0075 1.0087 1.4285 1.4293 1.8418 1.8453 2.3809 2.3911 2.9272 2.9295 3.0861 3.0921 3.2394 3.2407 3.6910 3.6917 4.0055 4.0098 8.1194 8.1260 9.9068 9.9160 10.9439 10.9533 12.1993 12.1999 12.5223 12.5359 k = 0.5058 0.3499-0.1408 ( 4068 PWs) bands (ev): -15.4054 -15.4054 -15.1291 -15.1288 -14.7812 -14.7804 -14.0179 -14.0158 -13.7768 -13.7748 -13.5196 -13.5189 -6.2712 -6.2697 -3.7501 -3.7472 -2.8759 -2.8687 -2.7570 -2.7494 -1.4342 -1.4323 -0.8677 -0.8565 -0.5529 -0.5271 -0.4698 -0.4336 -0.1390 -0.1235 0.7704 0.7722 1.0041 1.0065 1.4272 1.4287 1.8439 1.8509 2.3715 2.3914 2.9273 2.9319 3.0867 3.0986 3.2372 3.2399 3.6891 3.6903 4.0031 4.0117 8.1166 8.1298 9.9024 9.9208 10.9377 10.9564 12.1993 12.2006 12.5148 12.5417 k = 0.5087 0.3519-0.1280 ( 4063 PWs) bands (ev): -15.4063 -15.4063 -15.1280 -15.1275 -14.7818 -14.7806 -14.0197 -14.0168 -13.7755 -13.7726 -13.5202 -13.5192 -6.2661 -6.2639 -3.7611 -3.7570 -2.8821 -2.8716 -2.7574 -2.7465 -1.4256 -1.4228 -0.8742 -0.8576 -0.5597 -0.5250 -0.4698 -0.4204 -0.1373 -0.1146 0.7680 0.7710 0.9992 1.0026 1.4252 1.4275 1.8482 1.8589 2.3599 2.3883 2.9281 2.9352 3.0896 3.1070 3.2342 3.2381 3.6860 3.6879 4.0004 4.0133 8.1142 8.1338 9.8981 9.9256 10.9305 10.9583 12.1996 12.2015 12.5069 12.5466 k = 0.5116 0.3539-0.1151 ( 4059 PWs) bands (ev): -15.4076 -15.4075 -15.1264 -15.1257 -14.7825 -14.7809 -14.0220 -14.0182 -13.7735 -13.7698 -13.5211 -13.5197 -6.2588 -6.2560 -3.7760 -3.7708 -2.8896 -2.8765 -2.7568 -2.7431 -1.4141 -1.4105 -0.8823 -0.8605 -0.5653 -0.5248 -0.4653 -0.4066 -0.1335 -0.1039 0.7646 0.7688 0.9934 0.9975 1.4226 1.4256 1.8543 1.8690 2.3468 2.3823 2.9295 2.9394 3.0946 3.1170 3.2304 3.2355 3.6818 3.6843 3.9975 4.0148 8.1121 8.1382 9.8941 9.9304 10.9224 10.9591 12.2002 12.2028 12.4986 12.5505 k = 0.5145 0.3559-0.1023 ( 4055 PWs) bands (ev): -15.4092 -15.4092 -15.1243 -15.1235 -14.7832 -14.7813 -14.0246 -14.0201 -13.7710 -13.7666 -13.5221 -13.5203 -6.2495 -6.2460 -3.7947 -3.7886 -2.8983 -2.8830 -2.7550 -2.7392 -1.4003 -1.3962 -0.8918 -0.8654 -0.5691 -0.5247 -0.4576 -0.3927 -0.1275 -0.0916 0.7595 0.7653 0.9871 0.9916 1.4193 1.4231 1.8619 1.8808 2.3331 2.3739 2.9315 2.9444 3.1013 3.1281 3.2260 3.2320 3.6765 3.6795 3.9944 4.0161 8.1103 8.1427 9.8903 9.9352 10.9136 10.9589 12.2010 12.2043 12.4900 12.5531 k = 0.5174 0.3579-0.0894 ( 4057 PWs) bands (ev): -15.4113 -15.4113 -15.1217 -15.1207 -14.7841 -14.7818 -14.0275 -14.0224 -13.7680 -13.7630 -13.5232 -13.5211 -6.2382 -6.2340 -3.8169 -3.8102 -2.9079 -2.8909 -2.7519 -2.7346 -1.3850 -1.3805 -0.9030 -0.8724 -0.5705 -0.5232 -0.4480 -0.3788 -0.1193 -0.0777 0.7526 0.7601 0.9810 0.9856 1.4153 1.4198 1.8702 1.8937 2.3198 2.3638 2.9339 2.9501 3.1092 3.1399 3.2211 3.2278 3.6701 3.6736 3.9912 4.0173 8.1089 8.1475 9.8868 9.9399 10.9041 10.9576 12.2022 12.2062 12.4810 12.5542 k = 0.5203 0.3599-0.0766 ( 4061 PWs) bands (ev): -15.4138 -15.4137 -15.1187 -15.1176 -14.7849 -14.7823 -14.0305 -14.0250 -13.7646 -13.7592 -13.5246 -13.5221 -6.2249 -6.2201 -3.8423 -3.8352 -2.9179 -2.8998 -2.7476 -2.7292 -1.3690 -1.3644 -0.9157 -0.8816 -0.5692 -0.5195 -0.4372 -0.3650 -0.1091 -0.0625 0.7434 0.7529 0.9758 0.9801 1.4105 1.4159 1.8785 1.9071 2.3078 2.3529 2.9368 2.9564 3.1177 3.1518 3.2161 3.2232 3.6626 3.6666 3.9877 4.0183 8.1077 8.1525 9.8836 9.9445 10.8941 10.9554 12.2036 12.2085 12.4716 12.5537 k = 0.5232 0.3619-0.0637 ( 4064 PWs) bands (ev): -15.4168 -15.4167 -15.1152 -15.1140 -14.7856 -14.7827 -14.0335 -14.0278 -13.7609 -13.7553 -13.5261 -13.5233 -6.2098 -6.2044 -3.8707 -3.8635 -2.9282 -2.9094 -2.7421 -2.7231 -1.3532 -1.3486 -0.9299 -0.8930 -0.5648 -0.5131 -0.4253 -0.3515 -0.0970 -0.0461 0.7316 0.7433 0.9721 0.9759 1.4047 1.4111 1.8861 1.9202 2.2983 2.3424 2.9399 2.9630 3.1263 3.1636 3.2111 3.2184 3.6540 3.6584 3.9842 4.0193 8.1067 8.1576 9.8807 9.9491 10.8836 10.9523 12.2055 12.2112 12.4618 12.5514 k = 0.5261 0.3639-0.0509 ( 4068 PWs) bands (ev): -15.4204 -15.4201 -15.1113 -15.1099 -14.7863 -14.7831 -14.0365 -14.0306 -13.7571 -13.7513 -13.5277 -13.5245 -6.1931 -6.1871 -3.9016 -3.8945 -2.9384 -2.9193 -2.7355 -2.7162 -1.3382 -1.3338 -0.9453 -0.9065 -0.5573 -0.5037 -0.4126 -0.3382 -0.0830 -0.0285 0.7174 0.7312 0.9702 0.9734 1.3979 1.4053 1.8922 1.9322 2.2924 2.3335 2.9432 2.9697 3.1342 3.1747 3.2064 3.2138 3.6443 3.6491 3.9806 4.0202 8.1060 8.1629 9.8781 9.9537 10.8727 10.9484 12.2077 12.2142 12.4517 12.5472 k = 0.5290 0.3659-0.0380 ( 4065 PWs) bands (ev): -15.4244 -15.4239 -15.1069 -15.1054 -14.7867 -14.7833 -14.0395 -14.0335 -13.7533 -13.7475 -13.5294 -13.5259 -6.1748 -6.1684 -3.9346 -3.9279 -2.9483 -2.9292 -2.7279 -2.7086 -1.3248 -1.3205 -0.9620 -0.9217 -0.5469 -0.4916 -0.3990 -0.3255 -0.0674 -0.0100 0.7009 0.7166 0.9703 0.9729 1.3897 1.3985 1.8963 1.9422 2.2909 2.3276 2.9466 2.9764 3.1406 3.1845 3.2020 3.2102 3.6335 3.6387 3.9771 4.0211 8.1053 8.1684 9.8758 9.9581 10.8616 10.9439 12.2102 12.2175 12.4412 12.5409 k = 0.5319 0.3679-0.0252 ( 4071 PWs) bands (ev): -15.4290 -15.4284 -15.1022 -15.1006 -14.7870 -14.7833 -14.0422 -14.0363 -13.7495 -13.7438 -13.5312 -13.5273 -6.1551 -6.1483 -3.9693 -3.9632 -2.9577 -2.9388 -2.7194 -2.7002 -1.3134 -1.3093 -0.9795 -0.9384 -0.5340 -0.4771 -0.3845 -0.3133 -0.0503 0.0095 0.6824 0.6997 0.9726 0.9747 1.3799 1.3903 1.8979 1.9494 2.2946 2.3258 2.9500 2.9829 3.1449 3.1909 3.1996 3.2085 3.6217 3.6272 3.9736 4.0220 8.1046 8.1740 9.8737 9.9625 10.8503 10.9389 12.2131 12.2211 12.4305 12.5327 k = 0.5347 0.3699-0.0123 ( 4067 PWs) bands (ev): -15.4341 -15.4333 -15.0970 -15.0953 -14.7869 -14.7831 -14.0447 -14.0389 -13.7459 -13.7404 -13.5331 -13.5289 -6.1343 -6.1270 -4.0052 -3.9998 -2.9666 -2.9481 -2.7100 -2.6912 -1.3044 -1.3004 -0.9977 -0.9562 -0.5193 -0.4605 -0.3689 -0.3020 -0.0319 0.0298 0.6624 0.6810 0.9771 0.9789 1.3683 1.3806 1.8974 1.9532 2.3037 2.3291 2.9532 2.9889 3.1470 3.1888 3.2038 3.2088 3.6089 3.6147 3.9702 4.0230 8.1039 8.1797 9.8720 9.9668 10.8389 10.9334 12.2162 12.2249 12.4196 12.5225 k = 0.5376 0.3719 0.0005 ( 4071 PWs) bands (ev): -15.4399 -15.4388 -15.0915 -15.0897 -14.7866 -14.7826 -14.0469 -14.0414 -13.7426 -13.7374 -13.5351 -13.5305 -6.1125 -6.1050 -4.0418 -4.0373 -2.9749 -2.9570 -2.6999 -2.6816 -1.2982 -1.2938 -1.0163 -0.9748 -0.5036 -0.4424 -0.3519 -0.2915 -0.0125 0.0506 0.6417 0.6609 0.9837 0.9855 1.3544 1.3689 1.8952 1.9537 2.3179 2.3380 2.9563 2.9943 3.1473 3.1839 3.2089 3.2105 3.5952 3.6012 3.9671 4.0241 8.1030 8.1855 9.8705 9.9711 10.8276 10.9276 12.2193 12.2288 12.4089 12.5104 k = 0.5405 0.3739 0.0134 ( 4065 PWs) bands (ev): -15.4462 -15.4449 -15.0856 -15.0837 -14.7858 -14.7817 -14.0487 -14.0435 -13.7396 -13.7347 -13.5372 -13.5321 -6.0900 -6.0822 -4.0785 -4.0751 -2.9825 -2.9653 -2.6891 -2.6713 -1.2948 -1.2896 -1.0351 -0.9937 -0.4878 -0.4233 -0.3335 -0.2821 0.0076 0.0717 0.6208 0.6400 0.9924 0.9944 1.3380 1.3551 1.8921 1.9514 2.3368 2.3523 2.9590 2.9989 3.1464 3.1787 3.2117 3.2133 3.5807 3.5869 3.9644 4.0253 8.1020 8.1914 9.8691 9.9754 10.8163 10.9217 12.2221 12.2328 12.3986 12.4966 k = 0.5405 0.3739 0.0134 ( 4065 PWs) bands (ev): -15.4462 -15.4449 -15.0856 -15.0837 -14.7858 -14.7817 -14.0487 -14.0435 -13.7396 -13.7347 -13.5372 -13.5321 -6.0900 -6.0822 -4.0785 -4.0751 -2.9825 -2.9653 -2.6891 -2.6713 -1.2948 -1.2896 -1.0351 -0.9937 -0.4878 -0.4233 -0.3335 -0.2821 0.0076 0.0717 0.6208 0.6400 0.9924 0.9944 1.3380 1.3551 1.8921 1.9514 2.3368 2.3523 2.9590 2.9989 3.1464 3.1787 3.2117 3.2133 3.5807 3.5869 3.9644 4.0253 8.1020 8.1914 9.8691 9.9754 10.8163 10.9217 12.2221 12.2328 12.3986 12.4966 k = 0.5374 0.3718 0.0262 ( 4067 PWs) bands (ev): -15.4449 -15.4435 -15.0805 -15.0778 -14.7902 -14.7855 -14.0483 -14.0433 -13.7400 -13.7355 -13.5417 -13.5368 -6.0720 -6.0645 -4.1067 -4.1036 -2.9947 -2.9787 -2.6709 -2.6538 -1.2862 -1.2806 -1.0480 -1.0112 -0.4748 -0.4095 -0.3256 -0.2645 0.0129 0.0744 0.6101 0.6294 0.9808 0.9832 1.3221 1.3402 1.8938 1.9519 2.3663 2.3780 2.9689 3.0070 3.1452 3.1750 3.2108 3.2123 3.5640 3.5705 3.9712 4.0300 8.1042 8.1874 9.8749 9.9734 10.8171 10.9118 12.2189 12.2302 12.3944 12.4852 k = 0.5343 0.3696 0.0390 ( 4073 PWs) bands (ev): -15.4444 -15.4430 -15.0746 -15.0713 -14.7943 -14.7891 -14.0478 -14.0431 -13.7403 -13.7362 -13.5464 -13.5415 -6.0537 -6.0465 -4.1352 -4.1323 -3.0053 -2.9904 -2.6533 -2.6370 -1.2782 -1.2722 -1.0609 -1.0286 -0.4629 -0.3963 -0.3176 -0.2487 0.0194 0.0776 0.5983 0.6174 0.9719 0.9747 1.3049 1.3240 1.8945 1.9500 2.4003 2.4093 2.9790 3.0148 3.1439 3.1712 3.2075 3.2093 3.5464 3.5532 3.9785 4.0346 8.1063 8.1831 9.8806 9.9714 10.8179 10.9025 12.2148 12.2271 12.3908 12.4738 k = 0.5312 0.3674 0.0518 ( 4077 PWs) bands (ev): -15.4445 -15.4431 -15.0681 -15.0643 -14.7982 -14.7926 -14.0473 -14.0429 -13.7407 -13.7369 -13.5510 -13.5463 -6.0353 -6.0285 -4.1635 -4.1609 -3.0143 -3.0007 -2.6364 -2.6212 -1.2707 -1.2642 -1.0736 -1.0455 -0.4518 -0.3842 -0.3093 -0.2351 0.0272 0.0814 0.5856 0.6043 0.9657 0.9690 1.2866 1.3063 1.8947 1.9465 2.4380 2.4452 2.9889 3.0219 3.1425 3.1673 3.2014 3.2047 3.5284 3.5354 3.9861 4.0389 8.1083 8.1787 9.8862 9.9693 10.8188 10.8937 12.2102 12.2235 12.3878 12.4626 k = 0.5281 0.3653 0.0646 ( 4078 PWs) bands (ev): -15.4451 -15.4437 -15.0613 -15.0571 -14.8018 -14.7960 -14.0469 -14.0428 -13.7410 -13.7376 -13.5555 -13.5511 -6.0172 -6.0107 -4.1912 -4.1889 -3.0218 -3.0095 -2.6205 -2.6064 -1.2636 -1.2568 -1.0859 -1.0618 -0.4415 -0.3738 -0.3006 -0.2241 0.0360 0.0856 0.5725 0.5906 0.9622 0.9660 1.2674 1.2874 1.8947 1.9420 2.4786 2.4847 2.9981 3.0280 3.1411 3.1633 3.1929 3.1983 3.5105 3.5174 3.9939 4.0430 8.1104 8.1742 9.8918 9.9671 10.8197 10.8854 12.2053 12.2194 12.3854 12.4519 k = 0.5249 0.3631 0.0774 ( 4072 PWs) bands (ev): -15.4459 -15.4446 -15.0544 -15.0499 -14.8051 -14.7992 -14.0464 -14.0426 -13.7413 -13.7383 -13.5598 -13.5556 -5.9995 -5.9936 -4.2177 -4.2157 -3.0281 -3.0171 -2.6057 -2.5928 -1.2570 -1.2500 -1.0977 -1.0774 -0.4316 -0.3654 -0.2916 -0.2155 0.0458 0.0901 0.5594 0.5766 0.9613 0.9657 1.2475 1.2676 1.8947 1.9372 2.5213 2.5268 3.0058 3.0322 3.1399 3.1589 3.1829 3.1903 3.4930 3.4996 4.0016 4.0466 8.1125 8.1696 9.8974 9.9648 10.8207 10.8777 12.2005 12.2150 12.3836 12.4417 k = 0.5218 0.3610 0.0903 ( 4068 PWs) bands (ev): -15.4470 -15.4458 -15.0476 -15.0431 -14.8080 -14.8022 -14.0459 -14.0426 -13.7416 -13.7390 -13.5638 -13.5600 -5.9828 -5.9774 -4.2426 -4.2408 -3.0332 -3.0235 -2.5921 -2.5805 -1.2508 -1.2436 -1.1087 -1.0920 -0.4221 -0.3593 -0.2822 -0.2094 0.0561 0.0947 0.5466 0.5627 0.9629 0.9678 1.2272 1.2470 1.8950 1.9323 2.5655 2.5706 3.0107 3.0337 3.1386 3.1535 3.1732 3.1815 3.4765 3.4826 4.0093 4.0496 8.1147 8.1650 9.9029 9.9622 10.8218 10.8707 12.1959 12.2104 12.3822 12.4322 k = 0.5187 0.3588 0.1031 ( 4072 PWs) bands (ev): -15.4481 -15.4470 -15.0411 -15.0368 -14.8105 -14.8050 -14.0455 -14.0425 -13.7418 -13.7395 -13.5674 -13.5640 -5.9673 -5.9625 -4.2654 -4.2638 -3.0373 -3.0290 -2.5799 -2.5697 -1.2450 -1.2379 -1.1188 -1.1055 -0.4129 -0.3554 -0.2725 -0.2057 0.0665 0.0993 0.5347 0.5493 0.9666 0.9722 1.2070 1.2260 1.8956 1.9276 2.6106 2.6154 3.0110 3.0312 3.1364 3.1468 3.1661 3.1731 3.4612 3.4666 4.0167 4.0520 8.1170 8.1604 9.9083 9.9595 10.8231 10.8642 12.1918 12.2057 12.3814 12.4235 k = 0.5156 0.3567 0.1159 ( 4074 PWs) bands (ev): -15.4492 -15.4482 -15.0352 -15.0311 -14.8126 -14.8076 -14.0450 -14.0425 -13.7420 -13.7401 -13.5706 -13.5676 -5.9533 -5.9492 -4.2856 -4.2842 -3.0405 -3.0335 -2.5691 -2.5605 -1.2395 -1.2327 -1.1280 -1.1177 -0.4042 -0.3535 -0.2629 -0.2041 0.0767 0.1036 0.5241 0.5369 0.9723 0.9784 1.1873 1.2052 1.8965 1.9231 2.6561 2.6607 3.0050 3.0229 3.1323 3.1413 3.1621 3.1665 3.4476 3.4522 4.0237 4.0537 8.1195 8.1558 9.9137 9.9565 10.8247 10.8583 12.1884 12.2011 12.3812 12.4156 k = 0.5125 0.3545 0.1287 ( 4070 PWs) bands (ev): -15.4502 -15.4494 -15.0300 -15.0264 -14.8142 -14.8099 -14.0446 -14.0426 -13.7421 -13.7406 -13.5732 -13.5707 -5.9413 -5.9379 -4.3027 -4.3016 -3.0428 -3.0372 -2.5600 -2.5530 -1.2345 -1.2283 -1.1359 -1.1283 -0.3957 -0.3534 -0.2534 -0.2044 0.0861 0.1072 0.5151 0.5259 0.9796 0.9859 1.1689 1.1851 1.8978 1.9190 2.7013 2.7059 2.9915 3.0074 3.1282 3.1380 3.1601 3.1628 3.4359 3.4396 4.0302 4.0546 8.1221 8.1513 9.9188 9.9533 10.8265 10.8529 12.1858 12.1967 12.3815 12.4085 k = 0.5094 0.3523 0.1415 ( 4068 PWs) bands (ev): -15.4510 -15.4504 -15.0256 -15.0227 -14.8154 -14.8119 -14.0443 -14.0427 -13.7421 -13.7410 -13.5752 -13.5733 -5.9315 -5.9289 -4.3165 -4.3156 -3.0444 -3.0402 -2.5526 -2.5473 -1.2299 -1.2247 -1.1425 -1.1373 -0.3878 -0.3550 -0.2442 -0.2064 0.0944 0.1100 0.5081 0.5165 0.9877 0.9938 1.1526 1.1664 1.8993 1.9153 2.7458 2.7505 2.9708 2.9844 3.1263 3.1352 3.1592 3.1615 3.4265 3.4293 4.0361 4.0546 8.1250 8.1469 9.9239 9.9498 10.8285 10.8481 12.1841 12.1927 12.3824 12.4024 k = 0.5062 0.3502 0.1543 ( 4070 PWs) bands (ev): -15.4515 -15.4511 -15.0222 -15.0202 -14.8160 -14.8136 -14.0439 -14.0429 -13.7421 -13.7414 -13.5765 -13.5753 -5.9241 -5.9224 -4.3265 -4.3259 -3.0453 -3.0425 -2.5469 -2.5434 -1.2261 -1.2222 -1.1474 -1.1441 -0.3803 -0.3580 -0.2357 -0.2099 0.1013 0.1115 0.5033 0.5091 0.9958 1.0010 1.1399 1.1503 1.9012 1.9118 2.7886 2.7936 2.9445 2.9555 3.1264 3.1328 3.1594 3.1613 3.4196 3.4215 4.0413 4.0537 8.1281 8.1427 9.9287 9.9461 10.8309 10.8438 12.1833 12.1892 12.3839 12.3971 k = 0.5031 0.3480 0.1671 ( 4072 PWs) bands (ev): -15.4519 -15.4516 -15.0199 -15.0189 -14.8161 -14.8149 -14.0436 -14.0431 -13.7420 -13.7417 -13.5773 -13.5766 -5.9195 -5.9186 -4.3325 -4.3322 -3.0455 -3.0441 -2.5432 -2.5414 -1.2231 -1.2210 -1.1503 -1.1487 -0.3735 -0.3622 -0.2278 -0.2148 0.1065 0.1115 0.5010 0.5039 1.0026 1.0057 1.1324 1.1381 1.9034 1.9087 2.8282 2.8335 2.9150 2.9232 3.1275 3.1308 3.1601 3.1612 3.4156 3.4165 4.0457 4.0519 8.1314 8.1387 9.9334 9.9421 10.8335 10.8400 12.1834 12.1865 12.3861 12.3926 k = 0.5000 0.3459 0.1799 ( 4070 PWs) bands (ev): -15.4519 -15.4519 -15.0188 -15.0188 -14.8157 -14.8157 -14.0433 -14.0433 -13.7419 -13.7419 -13.5773 -13.5773 -5.9176 -5.9176 -4.3345 -4.3345 -3.0451 -3.0451 -2.5413 -2.5413 -1.2213 -1.2213 -1.1508 -1.1508 -0.3674 -0.3674 -0.2208 -0.2208 0.1099 0.1099 0.5011 0.5011 1.0063 1.0063 1.1317 1.1317 1.9060 1.9060 2.8550 2.8550 2.8979 2.8979 3.1290 3.1290 3.1608 3.1608 3.4145 3.4145 4.0492 4.0492 8.1350 8.1350 9.9379 9.9379 10.8366 10.8366 12.1845 12.1845 12.3890 12.3890 k = 0.5000 0.3459 0.1799 ( 4070 PWs) bands (ev): -15.4519 -15.4519 -15.0188 -15.0188 -14.8157 -14.8157 -14.0433 -14.0433 -13.7419 -13.7419 -13.5773 -13.5773 -5.9176 -5.9176 -4.3345 -4.3345 -3.0451 -3.0451 -2.5413 -2.5413 -1.2213 -1.2213 -1.1508 -1.1508 -0.3674 -0.3674 -0.2208 -0.2208 0.1099 0.1099 0.5011 0.5011 1.0063 1.0063 1.1317 1.1317 1.9060 1.9060 2.8550 2.8550 2.8979 2.8979 3.1290 3.1290 3.1608 3.1608 3.4145 3.4145 4.0492 4.0492 8.1350 8.1350 9.9379 9.9379 10.8366 10.8366 12.1845 12.1845 12.3890 12.3890 k = 0.5076 0.3349 0.1799 ( 4068 PWs) bands (ev): -15.4528 -15.4523 -15.0188 -15.0188 -14.8153 -14.8150 -14.0435 -14.0435 -13.7417 -13.7415 -13.5772 -13.5771 -5.9174 -5.9174 -4.3360 -4.3336 -3.0457 -3.0439 -2.5413 -2.5411 -1.2227 -1.2224 -1.1559 -1.1473 -0.3699 -0.3670 -0.2218 -0.2214 0.1078 0.1140 0.5010 0.5015 1.0053 1.0101 1.1335 1.1335 1.9071 1.9076 2.8535 2.8538 2.8982 2.8982 3.1211 3.1338 3.1565 3.1692 3.4141 3.4141 4.0481 4.0485 8.1240 8.1477 9.9344 9.9416 10.8357 10.8369 12.1827 12.1834 12.3878 12.3878 k = 0.5151 0.3240 0.1799 ( 4072 PWs) bands (ev): -15.4549 -15.4541 -15.0191 -15.0191 -14.8136 -14.8131 -14.0440 -14.0439 -13.7408 -13.7404 -13.5769 -13.5766 -5.9169 -5.9168 -4.3381 -4.3334 -3.0456 -3.0420 -2.5409 -2.5405 -1.2266 -1.2260 -1.1625 -1.1456 -0.3744 -0.3686 -0.2245 -0.2237 0.1078 0.1201 0.5010 0.5019 1.0071 1.0168 1.1387 1.1388 1.9109 1.9119 2.8495 2.8501 2.8991 2.8992 3.1127 3.1312 3.1601 3.1788 3.4129 3.4129 4.0452 4.0460 8.1146 8.1620 9.9311 9.9456 10.8342 10.8367 12.1780 12.1796 12.3843 12.3843 k = 0.5227 0.3131 0.1799 ( 4076 PWs) bands (ev): -15.4583 -15.4571 -15.0195 -15.0195 -14.8107 -14.8101 -14.0448 -14.0446 -13.7394 -13.7388 -13.5764 -13.5760 -5.9160 -5.9159 -4.3408 -4.3339 -3.0448 -3.0395 -2.5402 -2.5397 -1.2330 -1.2321 -1.1707 -1.1455 -0.3807 -0.3723 -0.2287 -0.2276 0.1099 0.1281 0.5011 0.5025 1.0116 1.0262 1.1473 1.1474 1.9174 1.9190 2.8430 2.8438 2.9007 2.9008 3.1046 3.1245 3.1686 3.1889 3.4109 3.4109 4.0405 4.0416 8.1069 8.1781 9.9282 9.9499 10.8321 10.8360 12.1704 12.1729 12.3785 12.3786 k = 0.5302 0.3022 0.1799 ( 4078 PWs) bands (ev): -15.4630 -15.4614 -15.0201 -15.0201 -14.8067 -14.8059 -14.0458 -14.0456 -13.7373 -13.7366 -13.5756 -13.5750 -5.9147 -5.9146 -4.3441 -4.3350 -3.0433 -3.0365 -2.5394 -2.5386 -1.2417 -1.2406 -1.1801 -1.1470 -0.3889 -0.3780 -0.2342 -0.2329 0.1139 0.1380 0.5015 0.5032 1.0189 1.0382 1.1589 1.1591 1.9267 1.9287 2.8341 2.8352 2.9030 2.9031 3.0970 3.1170 3.1786 3.1991 3.4081 3.4082 4.0341 4.0355 8.1008 8.1957 9.9255 9.9544 10.8294 10.8349 12.1601 12.1635 12.3706 12.3707 k = 0.5378 0.2912 0.1799 ( 4074 PWs) bands (ev): -15.4689 -15.4669 -15.0209 -15.0209 -14.8016 -14.8005 -14.0471 -14.0469 -13.7347 -13.7338 -13.5746 -13.5739 -5.9130 -5.9128 -4.3480 -4.3367 -3.0412 -3.0330 -2.5383 -2.5373 -1.2528 -1.2514 -1.1906 -1.1500 -0.3986 -0.3856 -0.2409 -0.2394 0.1198 0.1496 0.5019 0.5041 1.0287 1.0528 1.1734 1.1735 1.9385 1.9411 2.8230 2.8242 2.9059 2.9061 3.0899 3.1095 3.1890 3.2094 3.4045 3.4046 4.0259 4.0277 8.0962 8.2149 9.9232 9.9592 10.8260 10.8335 12.1471 12.1516 12.3607 12.3607 k = 0.5454 0.2803 0.1799 ( 4076 PWs) bands (ev): -15.4759 -15.4736 -15.0219 -15.0218 -14.7954 -14.7942 -14.0485 -14.0483 -13.7316 -13.7305 -13.5733 -13.5725 -5.9109 -5.9107 -4.3524 -4.3392 -3.0384 -3.0290 -2.5371 -2.5360 -1.2660 -1.2644 -1.2020 -1.1543 -0.4099 -0.3950 -0.2485 -0.2469 0.1275 0.1628 0.5026 0.5050 1.0408 1.0697 1.1902 1.1904 1.9530 1.9560 2.8099 2.8112 2.9095 2.9097 3.0835 3.1023 3.1995 3.2195 3.4001 3.4003 4.0161 4.0182 8.0931 8.2356 9.9213 9.9643 10.8220 10.8317 12.1316 12.1373 12.3489 12.3489 k = 0.5529 0.2694 0.1799 ( 4080 PWs) bands (ev): -15.4840 -15.4814 -15.0231 -15.0230 -14.7881 -14.7868 -14.0501 -14.0499 -13.7280 -13.7267 -13.5718 -13.5709 -5.9084 -5.9081 -4.3574 -4.3423 -3.0351 -3.0246 -2.5359 -2.5346 -1.2813 -1.2795 -1.2140 -1.1597 -0.4223 -0.4058 -0.2567 -0.2553 0.1369 0.1774 0.5033 0.5061 1.0552 1.0888 1.2092 1.2093 1.9699 1.9734 2.7949 2.7963 2.9137 2.9139 3.0776 3.0955 3.2099 3.2294 3.3950 3.3951 4.0047 4.0070 8.0912 8.2576 9.9197 9.9698 10.8173 10.8296 12.1137 12.1208 12.3353 12.3354 k = 0.5605 0.2584 0.1799 ( 4074 PWs) bands (ev): -15.4931 -15.4902 -15.0245 -15.0243 -14.7799 -14.7785 -14.0518 -14.0516 -13.7239 -13.7225 -13.5701 -13.5691 -5.9054 -5.9051 -4.3629 -4.3460 -3.0312 -3.0199 -2.5347 -2.5333 -1.2985 -1.2966 -1.2264 -1.1660 -0.4357 -0.4180 -0.2654 -0.2643 0.1478 0.1932 0.5042 0.5071 1.0717 1.1098 1.2298 1.2300 1.9892 1.9931 2.7784 2.7798 2.9185 2.9188 3.0721 3.0890 3.2201 3.2390 3.3891 3.3892 3.9918 3.9944 8.0906 8.2808 9.9186 9.9755 10.8120 10.8274 12.0936 12.1022 12.3203 12.3203 k = 0.5680 0.2475 0.1799 ( 4070 PWs) bands (ev): -15.5032 -15.5000 -15.0261 -15.0259 -14.7708 -14.7694 -14.0536 -14.0533 -13.7194 -13.7178 -13.5682 -13.5670 -5.9019 -5.9016 -4.3689 -4.3504 -3.0268 -3.0150 -2.5337 -2.5321 -1.3175 -1.3154 -1.2390 -1.1730 -0.4499 -0.4310 -0.2743 -0.2736 0.1600 0.2100 0.5050 0.5082 1.0899 1.1326 1.2519 1.2520 2.0106 2.0149 2.7604 2.7620 2.9239 2.9242 3.0671 3.0829 3.2299 3.2481 3.3824 3.3826 3.9774 3.9803 8.0911 8.3051 9.9180 9.9816 10.8061 10.8251 12.0717 12.0819 12.3039 12.3040 k = 0.5756 0.2366 0.1799 ( 4064 PWs) bands (ev): -15.5142 -15.5108 -15.0279 -15.0278 -14.7607 -14.7593 -14.0553 -14.0550 -13.7145 -13.7128 -13.5661 -13.5648 -5.8979 -5.8976 -4.3754 -4.3554 -3.0220 -3.0100 -2.5329 -2.5313 -1.3382 -1.3359 -1.2514 -1.1804 -0.4644 -0.4448 -0.2832 -0.2830 0.1734 0.2276 0.5058 0.5092 1.1097 1.1568 1.2751 1.2751 2.0340 2.0387 2.7413 2.7431 2.9299 2.9303 3.0623 3.0771 3.2394 3.2569 3.3750 3.3752 3.9618 3.9649 8.0925 8.3302 9.9179 9.9880 10.7995 10.8228 12.0482 12.0600 12.2863 12.2866 k = 0.5832 0.2257 0.1799 ( 4056 PWs) bands (ev): -15.5260 -15.5224 -15.0300 -15.0299 -14.7499 -14.7485 -14.0570 -14.0567 -13.7093 -13.7075 -13.5637 -13.5624 -5.8934 -5.8931 -4.3824 -4.3611 -3.0169 -3.0049 -2.5326 -2.5308 -1.3602 -1.3579 -1.2635 -1.1880 -0.4791 -0.4588 -0.2925 -0.2920 0.1877 0.2458 0.5065 0.5100 1.1307 1.1822 1.2991 1.2991 2.0592 2.0642 2.7213 2.7232 2.9364 2.9369 3.0579 3.0715 3.2484 3.2653 3.3670 3.3671 3.9449 3.9483 8.0947 8.3562 9.9183 9.9947 10.7922 10.8206 12.0233 12.0368 12.2679 12.2682 k = 0.5907 0.2147 0.1799 ( 4054 PWs) bands (ev): -15.5385 -15.5348 -15.0324 -15.0322 -14.7383 -14.7370 -14.0585 -14.0582 -13.7038 -13.7019 -13.5612 -13.5598 -5.8884 -5.8880 -4.3898 -4.3674 -3.0114 -2.9999 -2.5328 -2.5309 -1.3836 -1.3813 -1.2751 -1.1956 -0.4936 -0.4727 -0.3017 -0.3005 0.2028 0.2645 0.5071 0.5106 1.1529 1.2086 1.3237 1.3238 2.0859 2.0912 2.7006 2.7027 2.9435 2.9440 3.0536 3.0662 3.2569 3.2731 3.3582 3.3584 3.9270 3.9305 8.0975 8.3826 9.9193 10.0017 10.7843 10.8186 11.9974 12.0125 12.2487 12.2490 k = 0.5983 0.2038 0.1799 ( 4052 PWs) bands (ev): -15.5518 -15.5479 -15.0351 -15.0349 -14.7261 -14.7248 -14.0599 -14.0596 -13.6981 -13.6960 -13.5585 -13.5570 -5.8828 -5.8824 -4.3977 -4.3742 -3.0058 -2.9950 -2.5335 -2.5316 -1.4082 -1.4058 -1.2859 -1.2029 -0.5077 -0.4863 -0.3106 -0.3085 0.2184 0.2834 0.5074 0.5110 1.1758 1.2357 1.3487 1.3490 2.1137 2.1193 2.6794 2.6817 2.9510 2.9517 3.0495 3.0610 3.2649 3.2803 3.3488 3.3490 3.9080 3.9117 8.1009 8.4093 9.9209 10.0088 10.7759 10.8170 11.9708 11.9874 12.2290 12.2294 k = 0.6058 0.1929 0.1799 ( 4058 PWs) bands (ev): -15.5657 -15.5618 -15.0380 -15.0378 -14.7131 -14.7120 -14.0611 -14.0608 -13.6921 -13.6900 -13.5556 -13.5541 -5.8767 -5.8762 -4.4060 -4.3817 -2.9999 -2.9902 -2.5350 -2.5331 -1.4338 -1.4314 -1.2958 -1.2098 -0.5211 -0.4993 -0.3189 -0.3160 0.2343 0.3024 0.5075 0.5112 1.1992 1.2633 1.3741 1.3745 2.1424 2.1483 2.6579 2.6605 2.9591 2.9599 3.0456 3.0559 3.2723 3.2870 3.3388 3.3390 3.8883 3.8921 8.1046 8.4361 9.9231 10.0162 10.7670 10.8158 11.9438 11.9619 12.2089 12.2093 k = 0.6134 0.1819 0.1799 ( 4064 PWs) bands (ev): -15.5803 -15.5762 -15.0413 -15.0411 -14.6995 -14.6986 -14.0620 -14.0617 -13.6860 -13.6837 -13.5526 -13.5510 -5.8699 -5.8694 -4.4146 -4.3897 -2.9941 -2.9858 -2.5374 -2.5354 -1.4603 -1.4579 -1.3047 -1.2162 -0.5336 -0.5114 -0.3266 -0.3229 0.2504 0.3213 0.5073 0.5110 1.2230 1.2911 1.3996 1.4002 2.1716 2.1777 2.6363 2.6392 2.9677 2.9685 3.0417 3.0510 3.2791 3.2929 3.3284 3.3287 3.8678 3.8717 8.1084 8.4628 9.9258 10.0235 10.7577 10.8152 11.9168 11.9360 12.1886 12.1891 k = 0.6210 0.1710 0.1799 ( 4064 PWs) bands (ev): -15.5953 -15.5912 -15.0449 -15.0447 -14.6854 -14.6846 -14.0626 -14.0624 -13.6797 -13.6774 -13.5494 -13.5479 -5.8624 -5.8619 -4.4237 -4.3983 -2.9882 -2.9817 -2.5406 -2.5386 -1.4875 -1.4851 -1.3123 -1.2217 -0.5450 -0.5224 -0.3336 -0.3289 0.2665 0.3399 0.5069 0.5106 1.2467 1.3189 1.4253 1.4260 2.2010 2.2072 2.6149 2.6181 2.9767 2.9776 3.0380 3.0461 3.2848 3.2974 3.3179 3.3187 3.8467 3.8508 8.1123 8.4891 9.9289 10.0308 10.7481 10.8153 11.8900 11.9101 12.1683 12.1688 k = 0.6285 0.1601 0.1799 ( 4068 PWs) bands (ev): -15.6108 -15.6067 -15.0489 -15.0486 -14.6707 -14.6702 -14.0629 -14.0627 -13.6733 -13.6709 -13.5461 -13.5446 -5.8543 -5.8537 -4.4331 -4.4073 -2.9824 -2.9779 -2.5448 -2.5429 -1.5153 -1.5130 -1.3187 -1.2264 -0.5551 -0.5321 -0.3396 -0.3340 0.2823 0.3583 0.5063 0.5100 1.2702 1.3464 1.4509 1.4519 2.2300 2.2365 2.5939 2.5973 2.9861 2.9872 3.0344 3.0414 3.2885 3.2974 3.3084 3.3121 3.8252 3.8294 8.1160 8.5148 9.9324 10.0379 10.7383 10.8163 11.8637 11.8845 12.1482 12.1487 k = 0.6361 0.1492 0.1799 ( 4066 PWs) bands (ev): -15.6268 -15.6226 -15.0532 -15.0528 -14.6556 -14.6552 -14.0628 -14.0626 -13.6668 -13.6643 -13.5427 -13.5412 -5.8455 -5.8449 -4.4428 -4.4169 -2.9767 -2.9746 -2.5501 -2.5481 -1.5436 -1.5415 -1.3237 -1.2302 -0.5639 -0.5405 -0.3447 -0.3381 0.2979 0.3761 0.5056 0.5092 1.2932 1.3734 1.4765 1.4777 2.2585 2.2651 2.5735 2.5771 2.9959 2.9972 3.0308 3.0369 3.2859 3.2890 3.3043 3.3130 3.8034 3.8077 8.1195 8.5396 9.9360 10.0447 10.7286 10.8182 11.8383 11.8592 12.1285 12.1289 k = 0.6436 0.1382 0.1799 ( 4066 PWs) bands (ev): -15.6432 -15.6390 -15.0578 -15.0575 -14.6400 -14.6398 -14.0623 -14.0621 -13.6602 -13.6577 -13.5392 -13.5377 -5.8359 -5.8353 -4.4529 -4.4269 -2.9718 -2.9712 -2.5564 -2.5545 -1.5723 -1.5703 -1.3272 -1.2329 -0.5713 -0.5475 -0.3488 -0.3411 0.3129 0.3933 0.5047 0.5084 1.3156 1.3997 1.5019 1.5034 2.2858 2.2926 2.5539 2.5577 3.0059 3.0074 3.0275 3.0325 3.2763 3.2774 3.3063 3.3163 3.7815 3.7858 8.1226 8.5633 9.9397 10.0510 10.7191 10.8212 11.8139 11.8346 12.1092 12.1096 k = 0.6512 0.1273 0.1799 ( 4056 PWs) bands (ev): -15.6599 -15.6557 -15.0628 -15.0624 -14.6240 -14.6239 -14.0613 -14.0612 -13.6536 -13.6511 -13.5356 -13.5341 -5.8257 -5.8250 -4.4633 -4.4374 -2.9695 -2.9659 -2.5638 -2.5619 -1.6014 -1.5995 -1.3294 -1.2345 -0.5772 -0.5530 -0.3516 -0.3430 0.3272 0.4098 0.5039 0.5075 1.3370 1.4251 1.5270 1.5290 2.3118 2.3187 2.5353 2.5392 3.0157 3.0173 3.0250 3.0288 3.2646 3.2650 3.3098 3.3196 3.7596 3.7639 8.1251 8.5857 9.9432 10.0566 10.7102 10.8254 11.7908 11.8109 12.0906 12.0910 k = 0.6587 0.1164 0.1799 ( 4056 PWs) bands (ev): -15.6769 -15.6727 -15.0682 -15.0678 -14.6079 -14.6075 -14.0600 -14.0598 -13.6470 -13.6444 -13.5319 -13.5305 -5.8147 -5.8140 -4.4739 -4.4482 -2.9676 -2.9609 -2.5722 -2.5704 -1.6306 -1.6289 -1.3301 -1.2351 -0.5816 -0.5571 -0.3533 -0.3436 0.3408 0.4255 0.5032 0.5069 1.3573 1.4493 1.5518 1.5542 2.3358 2.3428 2.5179 2.5219 3.0196 3.0208 3.0301 3.0305 3.2523 3.2523 3.3132 3.3227 3.7378 3.7422 8.1269 8.6064 9.9461 10.0615 10.7022 10.8309 11.7692 11.7882 12.0727 12.0730 k = 0.3413-0.4933 0.3465 ( 4056 PWs) bands (ev): -15.6769 -15.6727 -15.0682 -15.0678 -14.6079 -14.6075 -14.0600 -14.0598 -13.6470 -13.6444 -13.5319 -13.5305 -5.8147 -5.8140 -4.4739 -4.4482 -2.9676 -2.9609 -2.5722 -2.5704 -1.6306 -1.6289 -1.3301 -1.2351 -0.5816 -0.5571 -0.3533 -0.3436 0.3408 0.4255 0.5032 0.5069 1.3573 1.4493 1.5518 1.5542 2.3358 2.3428 2.5179 2.5219 3.0196 3.0208 3.0301 3.0305 3.2523 3.2523 3.3132 3.3227 3.7378 3.7422 8.1269 8.6064 9.9461 10.0615 10.7022 10.8309 11.7692 11.7882 12.0727 12.0730 k = 0.3335-0.4821 0.3465 ( 4046 PWs) bands (ev): -15.6946 -15.6905 -15.0740 -15.0737 -14.5909 -14.5902 -14.0581 -14.0579 -13.6403 -13.6376 -13.5281 -13.5268 -5.8026 -5.8019 -4.4851 -4.4597 -2.9663 -2.9561 -2.5820 -2.5803 -1.6608 -1.6592 -1.3294 -1.2345 -0.5848 -0.5599 -0.3536 -0.3428 0.3538 0.4405 0.5029 0.5065 1.3769 1.4729 1.5768 1.5796 2.3582 2.3652 2.5017 2.5057 3.0168 3.0181 3.0398 3.0415 3.2392 3.2396 3.3164 3.3254 3.7157 3.7202 8.1280 8.6259 9.9483 10.0654 10.6951 10.8377 11.7487 11.7661 12.0553 12.0555 k = 0.3257-0.4709 0.3465 ( 4050 PWs) bands (ev): -15.7125 -15.7085 -15.0803 -15.0799 -14.5736 -14.5726 -14.0557 -14.0556 -13.6335 -13.6309 -13.5243 -13.5230 -5.7898 -5.7891 -4.4965 -4.4716 -2.9654 -2.9516 -2.5928 -2.5912 -1.6910 -1.6896 -1.3272 -1.2328 -0.5865 -0.5614 -0.3525 -0.3405 0.3656 0.4543 0.5032 0.5067 1.3949 1.4949 1.6013 1.6045 2.3775 2.3846 2.4875 2.4914 3.0139 3.0142 3.0505 3.0529 3.2265 3.2273 3.3190 3.3275 3.6940 3.6985 8.1282 8.6432 9.9494 10.0682 10.6895 10.8458 11.7301 11.7455 12.0390 12.0391 k = 0.3180-0.4597 0.3465 ( 4058 PWs) bands (ev): -15.7307 -15.7266 -15.0869 -15.0865 -14.5560 -14.5547 -14.0528 -14.0527 -13.6268 -13.6241 -13.5204 -13.5193 -5.7762 -5.7754 -4.5081 -4.4837 -2.9651 -2.9474 -2.6046 -2.6031 -1.7212 -1.7200 -1.3237 -1.2300 -0.5871 -0.5617 -0.3499 -0.3368 0.3763 0.4666 0.5045 0.5075 1.4113 1.5152 1.6250 1.6287 2.3931 2.4002 2.4759 2.4796 3.0104 3.0110 3.0608 3.0639 3.2146 3.2159 3.3211 3.3292 3.6729 3.6775 8.1274 8.6581 9.9490 10.0699 10.6856 10.8551 11.7134 11.7264 12.0239 12.0239 k = 0.3102-0.4485 0.3465 ( 4060 PWs) bands (ev): -15.7490 -15.7450 -15.0939 -15.0935 -14.5382 -14.5365 -14.0494 -14.0493 -13.6202 -13.6175 -13.5166 -13.5155 -5.7617 -5.7610 -4.5199 -4.4962 -2.9652 -2.9436 -2.6173 -2.6159 -1.7514 -1.7503 -1.3190 -1.2262 -0.5866 -0.5610 -0.3459 -0.3314 0.3857 0.4770 0.5071 0.5092 1.4259 1.5338 1.6478 1.6521 2.4041 2.4110 2.4677 2.4713 3.0067 3.0082 3.0702 3.0739 3.2040 3.2060 3.3227 3.3303 3.6525 3.6572 8.1254 8.6706 9.9470 10.0702 10.6838 10.8652 11.6989 11.7092 12.0100 12.0101 k = 0.3025-0.4373 0.3465 ( 4060 PWs) bands (ev): -15.7673 -15.7634 -15.1013 -15.1008 -14.5200 -14.5181 -14.0454 -14.0454 -13.6136 -13.6110 -13.5128 -13.5118 -5.7465 -5.7458 -4.5319 -4.5089 -2.9657 -2.9402 -2.6308 -2.6295 -1.7814 -1.7804 -1.3132 -1.2215 -0.5852 -0.5594 -0.3403 -0.3245 0.3937 0.4854 0.5115 0.5119 1.4388 1.5507 1.6695 1.6745 2.4095 2.4158 2.4638 2.4676 3.0032 3.0057 3.0776 3.0822 3.1957 3.1985 3.3238 3.3309 3.6330 3.6377 8.1224 8.6803 9.9433 10.0692 10.6840 10.8760 11.6865 11.6938 11.9975 11.9977 k = 0.2947-0.4261 0.3465 ( 4056 PWs) bands (ev): -15.7858 -15.7819 -15.1090 -15.1085 -14.5017 -14.4994 -14.0410 -14.0410 -13.6072 -13.6045 -13.5090 -13.5082 -5.7305 -5.7298 -4.5440 -4.5217 -2.9666 -2.9371 -2.6449 -2.6438 -1.8112 -1.8104 -1.3063 -1.2160 -0.5830 -0.5573 -0.3332 -0.3159 0.4005 0.4920 0.5157 0.5176 1.4498 1.5657 1.6900 1.6957 2.4098 2.4152 2.4638 2.4679 2.9999 3.0033 3.0819 3.0873 3.1910 3.1945 3.3243 3.3311 3.6143 3.6191 8.1181 8.6872 9.9377 10.0671 10.6862 10.8872 11.6762 11.6806 11.9865 11.9869 k = 0.2870-0.4148 0.3465 ( 4058 PWs) bands (ev): -15.8042 -15.8005 -15.1170 -15.1165 -14.4831 -14.4805 -14.0361 -14.0361 -13.6009 -13.5982 -13.5052 -13.5046 -5.7138 -5.7130 -4.5562 -4.5348 -2.9678 -2.9343 -2.6597 -2.6587 -1.8407 -1.8400 -1.2985 -1.2097 -0.5804 -0.5547 -0.3247 -0.3058 0.4060 0.4975 0.5207 0.5246 1.4591 1.5789 1.7090 1.7155 2.4071 2.4116 2.4656 2.4699 2.9969 3.0011 3.0823 3.0882 3.1908 3.1948 3.3242 3.3307 3.5967 3.6016 8.1127 8.6912 9.9303 10.0636 10.6903 10.8982 11.6683 11.6695 11.9770 11.9775 k = 0.2792-0.4036 0.3465 ( 4060 PWs) bands (ev): -15.8227 -15.8190 -15.1253 -15.1248 -14.4643 -14.4614 -14.0307 -14.0307 -13.5947 -13.5920 -13.5016 -13.5011 -5.6963 -5.6955 -4.5684 -4.5479 -2.9692 -2.9319 -2.6750 -2.6741 -1.8699 -1.8694 -1.2900 -1.2027 -0.5775 -0.5520 -0.3146 -0.2940 0.4104 0.5028 0.5269 0.5319 1.4666 1.5904 1.7262 1.7336 2.4034 2.4070 2.4674 2.4717 2.9941 2.9992 3.0785 3.0845 3.1953 3.1994 3.3237 3.3299 3.5803 3.5853 8.1060 8.6920 9.9214 10.0591 10.6960 10.9086 11.6608 11.6625 11.9692 11.9698 k = 0.2714-0.3924 0.3465 ( 4058 PWs) bands (ev): -15.8411 -15.8375 -15.1339 -15.1333 -14.4455 -14.4421 -14.0248 -14.0248 -13.5886 -13.5860 -13.4980 -13.4978 -5.6781 -5.6773 -4.5807 -4.5611 -2.9708 -2.9297 -2.6907 -2.6900 -1.8988 -1.8983 -1.2808 -1.1952 -0.5744 -0.5492 -0.3032 -0.2808 0.4138 0.5084 0.5345 0.5391 1.4724 1.6004 1.7413 1.7498 2.3997 2.4027 2.4682 2.4723 2.9915 2.9974 3.0714 3.0772 3.2036 3.2076 3.3226 3.3287 3.5650 3.5702 8.0980 8.6897 9.9111 10.0536 10.7028 10.9180 11.6545 11.6588 11.9630 11.9638 k = 0.2637-0.3812 0.3465 ( 4056 PWs) bands (ev): -15.8594 -15.8559 -15.1427 -15.1421 -14.4264 -14.4228 -14.0185 -14.0185 -13.5827 -13.5801 -13.4946 -13.4945 -5.6592 -5.6584 -4.5930 -4.5743 -2.9726 -2.9278 -2.7066 -2.7060 -1.9272 -1.9269 -1.2710 -1.1872 -0.5714 -0.5465 -0.2904 -0.2661 0.4163 0.5140 0.5433 0.5466 1.4766 1.6088 1.7539 1.7638 2.3966 2.3989 2.4679 2.4716 2.9892 2.9959 3.0620 3.0674 3.2144 3.2181 3.3210 3.3270 3.5511 3.5564 8.0888 8.6842 9.8999 10.0472 10.7103 10.9259 11.6505 11.6573 11.9584 11.9594 k = 0.2559-0.3700 0.3465 ( 4066 PWs) bands (ev): -15.8776 -15.8742 -15.1517 -15.1511 -14.4073 -14.4034 -14.0118 -14.0118 -13.5770 -13.5744 -13.4914 -13.4913 -5.6396 -5.6388 -4.6053 -4.5875 -2.9745 -2.9261 -2.7227 -2.7223 -1.9552 -1.9549 -1.2608 -1.1789 -0.5685 -0.5441 -0.2765 -0.2500 0.4181 0.5195 0.5535 0.5545 1.4793 1.6158 1.7639 1.7752 2.3941 2.3958 2.4666 2.4699 2.9871 2.9947 3.0510 3.0560 3.2264 3.2300 3.3190 3.3250 3.5384 3.5439 8.0784 8.6754 9.8879 10.0400 10.7180 10.9320 11.6488 11.6576 11.9555 11.9567 k = 0.2482-0.3588 0.3465 ( 4064 PWs) bands (ev): -15.8957 -15.8923 -15.1609 -15.1604 -14.3882 -14.3839 -14.0047 -14.0047 -13.5714 -13.5689 -13.4884 -13.4881 -5.6195 -5.6187 -4.6175 -4.6007 -2.9763 -2.9246 -2.7389 -2.7387 -1.9827 -1.9825 -1.2502 -1.1702 -0.5660 -0.5420 -0.2614 -0.2328 0.4191 0.5244 0.5637 0.5650 1.4807 1.6216 1.7707 1.7838 2.3922 2.3935 2.4648 2.4674 2.9852 2.9936 3.0390 3.0435 3.2390 3.2424 3.3166 3.3227 3.5272 3.5329 8.0668 8.6635 9.8755 10.0321 10.7256 10.9360 11.6493 11.6597 11.9543 11.9556 k = 0.2404-0.3476 0.3465 ( 4062 PWs) bands (ev): -15.9135 -15.9103 -15.1703 -15.1697 -14.3690 -14.3644 -13.9973 -13.9973 -13.5660 -13.5635 -13.4856 -13.4851 -5.5987 -5.5979 -4.6296 -4.6137 -2.9782 -2.9233 -2.7551 -2.7551 -2.0097 -2.0095 -1.2393 -1.1613 -0.5638 -0.5402 -0.2455 -0.2145 0.4197 0.5281 0.5745 0.5779 1.4808 1.6263 1.7741 1.7893 2.3910 2.3919 2.4627 2.4647 2.9833 2.9927 3.0265 3.0303 3.2515 3.2550 3.3138 3.3202 3.5175 3.5233 8.0541 8.6485 9.8631 10.0237 10.7325 10.9377 11.6516 11.6632 11.9547 11.9562 k = 0.2327-0.3364 0.3465 ( 4062 PWs) bands (ev): -15.9311 -15.9280 -15.1798 -15.1792 -14.3497 -14.3448 -13.9895 -13.9895 -13.5608 -13.5584 -13.4830 -13.4822 -5.5775 -5.5767 -4.6416 -4.6267 -2.9800 -2.9222 -2.7714 -2.7713 -2.0361 -2.0359 -1.2283 -1.1521 -0.5619 -0.5389 -0.2288 -0.1953 0.4198 0.5306 0.5871 0.5921 1.4796 1.6298 1.7738 1.7914 2.3903 2.3908 2.4610 2.4621 2.9811 2.9920 3.0141 3.0166 3.2636 3.2673 3.3108 3.3176 3.5092 3.5152 8.0403 8.6305 9.8508 10.0148 10.7386 10.9370 11.6553 11.6678 11.9567 11.9584 k = 0.2249-0.3251 0.3465 ( 4062 PWs) bands (ev): -15.9485 -15.9455 -15.1894 -15.1888 -14.3306 -14.3254 -13.9814 -13.9814 -13.5559 -13.5534 -13.4806 -13.4796 -5.5558 -5.5550 -4.6534 -4.6395 -2.9817 -2.9212 -2.7875 -2.7873 -2.0619 -2.0617 -1.2170 -1.1429 -0.5604 -0.5379 -0.2117 -0.1755 0.4197 0.5320 0.6016 0.6076 1.4773 1.6323 1.7697 1.7901 2.3899 2.3902 2.4601 2.4603 2.9777 2.9911 3.0026 3.0028 3.2745 3.2787 3.3078 3.3154 3.5024 3.5085 8.0256 8.6096 9.8388 10.0055 10.7434 10.9340 11.6601 11.6732 11.9601 11.9620 k = 0.2172-0.3139 0.3465 ( 4064 PWs) bands (ev): -15.9656 -15.9627 -15.1991 -15.1984 -14.3114 -14.3059 -13.9731 -13.9731 -13.5511 -13.5487 -13.4783 -13.4772 -5.5337 -5.5328 -4.6650 -4.6520 -2.9832 -2.9204 -2.8035 -2.8031 -2.0871 -2.0869 -1.2057 -1.1335 -0.5592 -0.5372 -0.1943 -0.1554 0.4195 0.5324 0.6177 0.6242 1.4739 1.6337 1.7618 1.7851 2.3897 2.3899 2.4596 2.4603 2.9713 2.9855 2.9935 2.9942 3.2834 3.2881 3.3057 3.3142 3.4971 3.5033 8.0100 8.5860 9.8274 9.9960 10.7470 10.9288 11.6654 11.6788 11.9650 11.9671 k = 0.2094-0.3027 0.3465 ( 4060 PWs) bands (ev): -15.9824 -15.9796 -15.2087 -15.2081 -14.2924 -14.2866 -13.9645 -13.9645 -13.5465 -13.5442 -13.4763 -13.4749 -5.5112 -5.5104 -4.6764 -4.6644 -2.9846 -2.9196 -2.8193 -2.8186 -2.1115 -2.1114 -1.1944 -1.1241 -0.5583 -0.5366 -0.1771 -0.1351 0.4196 0.5321 0.6351 0.6419 1.4692 1.6338 1.7504 1.7768 2.3897 2.3899 2.4602 2.4619 2.9606 2.9717 2.9899 2.9924 3.2886 3.2920 3.3080 3.3156 3.4933 3.4995 7.9936 8.5599 9.8166 9.9862 10.7492 10.9216 11.6708 11.6844 11.9711 11.9734 k = 0.2016-0.2915 0.3465 ( 4058 PWs) bands (ev): -15.9989 -15.9962 -15.2184 -15.2178 -14.2734 -14.2675 -13.9558 -13.9558 -13.5422 -13.5399 -13.4745 -13.4729 -5.4884 -5.4876 -4.6876 -4.6765 -2.9858 -2.9190 -2.8347 -2.8339 -2.1354 -2.1352 -1.1829 -1.1146 -0.5574 -0.5361 -0.1602 -0.1149 0.4200 0.5315 0.6536 0.6604 1.4633 1.6322 1.7360 1.7653 2.3896 2.3899 2.4625 2.4651 2.9475 2.9568 2.9882 2.9923 3.2895 3.2901 3.3150 3.3202 3.4910 3.4971 7.9765 8.5316 9.8064 9.9761 10.7499 10.9127 11.6757 11.6893 11.9784 11.9809 k = 0.1939-0.2803 0.3465 ( 4056 PWs) bands (ev): -16.0149 -16.0123 -15.2280 -15.2274 -14.2547 -14.2485 -13.9469 -13.9469 -13.5381 -13.5359 -13.4730 -13.4712 -5.4654 -5.4647 -4.6986 -4.6883 -2.9868 -2.9185 -2.8499 -2.8488 -2.1584 -2.1582 -1.1715 -1.1050 -0.5564 -0.5355 -0.1440 -0.0952 0.4211 0.5308 0.6728 0.6795 1.4559 1.6281 1.7198 1.7511 2.3893 2.3899 2.4664 2.4700 2.9333 2.9416 2.9876 2.9925 3.2861 3.2874 3.3227 3.3265 3.4901 3.4961 7.9589 8.5012 9.7969 9.9660 10.7494 10.9023 11.6797 11.6933 11.9867 11.9893 k = 0.1861-0.2691 0.3465 ( 4054 PWs) bands (ev): -16.0306 -16.0281 -15.2375 -15.2369 -14.2361 -14.2297 -13.9379 -13.9379 -13.5342 -13.5321 -13.4716 -13.4696 -5.4423 -5.4415 -4.7092 -4.6997 -2.9876 -2.9180 -2.8647 -2.8634 -2.1808 -2.1806 -1.1601 -1.0955 -0.5552 -0.5347 -0.1288 -0.0764 0.4231 0.5302 0.6925 0.6989 1.4469 1.6200 1.7036 1.7349 2.3889 2.3898 2.4719 2.4764 2.9186 2.9263 2.9877 2.9929 3.2814 3.2839 3.3298 3.3331 3.4905 3.4963 7.9408 8.4691 9.7881 9.9557 10.7476 10.8906 11.6826 11.6960 11.9959 11.9987 k = 0.1784-0.2579 0.3465 ( 4054 PWs) bands (ev): -16.0458 -16.0435 -15.2470 -15.2464 -14.2177 -14.2111 -13.9288 -13.9288 -13.5305 -13.5285 -13.4706 -13.4683 -5.4191 -5.4184 -4.7195 -4.7109 -2.9881 -2.9177 -2.8790 -2.8776 -2.2024 -2.2021 -1.1488 -1.0859 -0.5537 -0.5334 -0.1150 -0.0586 0.4263 0.5301 0.7122 0.7183 1.4360 1.6063 1.6895 1.7173 2.3883 2.3896 2.4789 2.4840 2.9039 2.9110 2.9883 2.9934 3.2763 3.2797 3.3361 3.3393 3.4923 3.4978 7.9224 8.4354 9.7799 9.9452 10.7447 10.8780 11.6841 11.6972 12.0058 12.0087 k = 0.1706-0.2467 0.3465 ( 4052 PWs) bands (ev): -16.0606 -16.0584 -15.2563 -15.2557 -14.1996 -14.1929 -13.9197 -13.9197 -13.5271 -13.5251 -13.4697 -13.4673 -5.3960 -5.3952 -4.7295 -4.7216 -2.9885 -2.9175 -2.8929 -2.8913 -2.2232 -2.2229 -1.1374 -1.0764 -0.5516 -0.5316 -0.1026 -0.0422 0.4309 0.5306 0.7317 0.7373 1.4231 1.5861 1.6791 1.6993 2.3876 2.3892 2.4869 2.4928 2.8891 2.8958 2.9891 2.9941 3.2711 3.2750 3.3415 3.3448 3.4951 3.5003 7.9039 8.4006 9.7724 9.9348 10.7408 10.8647 11.6840 11.6967 12.0163 12.0194 k = 0.1629-0.2354 0.3465 ( 4054 PWs) bands (ev): -16.0750 -16.0728 -15.2654 -15.2648 -14.1818 -14.1749 -13.9107 -13.9106 -13.5239 -13.5220 -13.4691 -13.4665 -5.3729 -5.3722 -4.7391 -4.7320 -2.9887 -2.9180 -2.9060 -2.9046 -2.2432 -2.2428 -1.1262 -1.0669 -0.5488 -0.5290 -0.0920 -0.0275 0.4369 0.5320 0.7505 0.7555 1.4080 1.5604 1.6718 1.6815 2.3868 2.3888 2.4959 2.5022 2.8747 2.8809 2.9902 2.9949 3.2657 3.2700 3.3460 3.3496 3.4989 3.5037 7.8853 8.3647 9.7654 9.9242 10.7361 10.8509 11.6822 11.6944 12.0273 12.0304 k = 0.1551-0.2242 0.3465 ( 4050 PWs) bands (ev): -16.0888 -16.0867 -15.2743 -15.2737 -14.1643 -14.1573 -13.9016 -13.9015 -13.5209 -13.5191 -13.4687 -13.4660 -5.3500 -5.3493 -4.7484 -4.7419 -2.9888 -2.9228 -2.9173 -2.9143 -2.2625 -2.2620 -1.1150 -1.0575 -0.5451 -0.5254 -0.0833 -0.0148 0.4444 0.5344 0.7681 0.7726 1.3907 1.5310 1.6647 1.6666 2.3859 2.3882 2.5054 2.5121 2.8606 2.8665 2.9915 2.9957 3.2602 3.2649 3.3498 3.3538 3.5034 3.5079 7.8668 8.3281 9.7590 9.9136 10.7308 10.8368 11.6788 11.6904 12.0386 12.0418 k = 0.1474-0.2130 0.3465 ( 4058 PWs) bands (ev): -16.1020 -16.1001 -15.2829 -15.2824 -14.1472 -14.1402 -13.8927 -13.8926 -13.5182 -13.5165 -13.4686 -13.4657 -5.3274 -5.3268 -4.7573 -4.7515 -2.9889 -2.9343 -2.9294 -2.9156 -2.2809 -2.2804 -1.1038 -1.0481 -0.5404 -0.5209 -0.0763 -0.0041 0.4533 0.5380 0.7840 0.7878 1.3715 1.4997 1.6495 1.6624 2.3850 2.3876 2.5151 2.5220 2.8470 2.8525 2.9930 2.9967 3.2546 3.2597 3.3530 3.3573 3.5086 3.5127 7.8485 8.2910 9.7532 9.9030 10.7249 10.8227 11.6739 11.6847 12.0500 12.0533 k = 0.1396-0.2018 0.3465 ( 4060 PWs) bands (ev): -16.1148 -16.1129 -15.2913 -15.2908 -14.1305 -14.1235 -13.8839 -13.8838 -13.5156 -13.5141 -13.4686 -13.4656 -5.3052 -5.3046 -4.7658 -4.7606 -2.9892 -2.9465 -2.9406 -2.9159 -2.2984 -2.2979 -1.0928 -1.0388 -0.5346 -0.5152 -0.0711 0.0043 0.4637 0.5426 0.7975 0.8008 1.3511 1.4678 1.6361 1.6587 2.3840 2.3869 2.5247 2.5317 2.8342 2.8392 2.9947 2.9978 3.2490 3.2544 3.3557 3.3604 3.5143 3.5180 7.8307 8.2536 9.7478 9.8924 10.7188 10.8086 11.6675 11.6774 12.0616 12.0649 k = 0.1318-0.1906 0.3465 ( 4054 PWs) bands (ev): -16.1269 -16.1252 -15.2994 -15.2989 -14.1143 -14.1073 -13.8752 -13.8751 -13.5133 -13.5119 -13.4689 -13.4658 -5.2834 -5.2828 -4.7739 -4.7692 -2.9900 -2.9585 -2.9506 -2.9161 -2.3151 -2.3145 -1.0819 -1.0297 -0.5275 -0.5083 -0.0676 0.0105 0.4752 0.5484 0.8078 0.8107 1.3302 1.4365 1.6247 1.6553 2.3831 2.3862 2.5339 2.5408 2.8224 2.8269 2.9965 2.9990 3.2434 3.2490 3.3580 3.3630 3.5202 3.5236 7.8135 8.2161 9.7429 9.8818 10.7124 10.7947 11.6599 11.6689 12.0733 12.0764 k = 0.1241-0.1794 0.3465 ( 4050 PWs) bands (ev): -16.1385 -16.1369 -15.3072 -15.3067 -14.0986 -14.0916 -13.8668 -13.8667 -13.5113 -13.5099 -13.4693 -13.4662 -5.2621 -5.2616 -4.7815 -4.7774 -2.9919 -2.9701 -2.9588 -2.9164 -2.3309 -2.3303 -1.0711 -1.0208 -0.5191 -0.5000 -0.0655 0.0146 0.4875 0.5551 0.8142 0.8170 1.3100 1.4070 1.6153 1.6518 2.3823 2.3855 2.5424 2.5491 2.8117 2.8156 2.9985 3.0003 3.2379 3.2437 3.3600 3.3653 3.5264 3.5294 7.7970 8.1788 9.7384 9.8713 10.7059 10.7811 11.6513 11.6592 12.0848 12.0879 k = 0.1163-0.1682 0.3465 ( 4046 PWs) bands (ev): -16.1495 -16.1479 -15.3147 -15.3142 -14.0834 -14.0765 -13.8586 -13.8585 -13.5094 -13.5081 -13.4700 -13.4668 -5.2415 -5.2410 -4.7887 -4.7851 -2.9957 -2.9813 -2.9644 -2.9167 -2.3459 -2.3452 -1.0604 -1.0122 -0.5093 -0.4904 -0.0645 0.0166 0.5005 0.5625 0.8160 0.8188 1.2917 1.3802 1.6076 1.6484 2.3815 2.3847 2.5500 2.5563 2.8023 2.8056 3.0007 3.0017 3.2325 3.2384 3.3618 3.3672 3.5326 3.5354 7.7813 8.1418 9.7343 9.8608 10.6994 10.7680 11.6418 11.6487 12.0962 12.0992 k = 0.1086-0.1570 0.3465 ( 4050 PWs) bands (ev): -16.1598 -16.1584 -15.3217 -15.3213 -14.0688 -14.0621 -13.8507 -13.8506 -13.5077 -13.5066 -13.4708 -13.4676 -5.2217 -5.2212 -4.7955 -4.7923 -3.0017 -2.9920 -2.9672 -2.9172 -2.3600 -2.3593 -1.0500 -1.0038 -0.4982 -0.4795 -0.0645 0.0167 0.5138 0.5704 0.8124 0.8158 1.2764 1.3570 1.6015 1.6448 2.3808 2.3840 2.5562 2.5620 2.7944 2.7970 3.0029 3.0033 3.2271 3.2331 3.3633 3.3689 3.5389 3.5413 7.7666 8.1054 9.7307 9.8504 10.6931 10.7554 11.6317 11.6377 12.1073 12.1103 k = 0.1008-0.1458 0.3465 ( 4040 PWs) bands (ev): -16.1695 -16.1682 -15.3284 -15.3280 -14.0549 -14.0483 -13.8432 -13.8430 -13.5062 -13.5052 -13.4717 -13.4685 -5.2026 -5.2021 -4.8019 -4.7991 -3.0091 -3.0022 -2.9679 -2.9178 -2.3731 -2.3724 -1.0398 -0.9957 -0.4856 -0.4672 -0.0652 0.0152 0.5270 0.5786 0.8032 0.8075 1.2649 1.3380 1.5968 1.6413 2.3801 2.3833 2.5611 2.5662 2.7882 2.7900 3.0049 3.0053 3.2219 3.2280 3.3647 3.3703 3.5451 3.5472 7.7532 8.0698 9.7276 9.8402 10.6870 10.7433 11.6213 11.6263 12.1182 12.1210 k = 0.0931-0.1345 0.3465 ( 4034 PWs) bands (ev): -16.1785 -16.1773 -15.3347 -15.3343 -14.0417 -14.0353 -13.8360 -13.8359 -13.5049 -13.5040 -13.4727 -13.4696 -5.1845 -5.1840 -4.8077 -4.8053 -3.0171 -3.0119 -2.9673 -2.9185 -2.3854 -2.3847 -1.0298 -0.9881 -0.4718 -0.4536 -0.0663 0.0122 0.5399 0.5866 0.7885 0.7941 1.2575 1.3234 1.5934 1.6377 2.3796 2.3827 2.5644 2.5688 2.7836 2.7847 3.0066 3.0077 3.2169 3.2230 3.3659 3.3715 3.5511 3.5530 7.7410 8.0350 9.7249 9.8301 10.6811 10.7319 11.6106 11.6148 12.1287 12.1314 k = 0.0853-0.1233 0.3465 ( 4038 PWs) bands (ev): -16.1869 -16.1858 -15.3405 -15.3402 -14.0292 -14.0231 -13.8292 -13.8291 -13.5038 -13.5030 -13.4738 -13.4708 -5.1674 -5.1670 -4.8132 -4.8111 -3.0252 -3.0211 -2.9660 -2.9194 -2.3967 -2.3960 -1.0202 -0.9810 -0.4567 -0.4390 -0.0677 0.0081 0.5522 0.5942 0.7692 0.7760 1.2540 1.3130 1.5911 1.6342 2.3791 2.3820 2.5661 2.5698 2.7807 2.7811 3.0084 3.0101 3.2121 3.2181 3.3671 3.3726 3.5569 3.5586 7.7303 8.0012 9.7227 9.8202 10.6757 10.7212 11.6001 11.6034 12.1388 12.1413 k = 0.0776-0.1121 0.3465 ( 4034 PWs) bands (ev): -16.1946 -16.1936 -15.3459 -15.3456 -14.0175 -14.0118 -13.8229 -13.8227 -13.5028 -13.5022 -13.4749 -13.4721 -5.1514 -5.1511 -4.8181 -4.8164 -3.0329 -3.0296 -2.9642 -2.9205 -2.4070 -2.4064 -1.0110 -0.9744 -0.4407 -0.4234 -0.0690 0.0030 0.5634 0.6011 0.7463 0.7543 1.2539 1.3064 1.5896 1.6307 2.3786 2.3814 2.5663 2.5693 2.7790 2.7793 3.0103 3.0125 3.2075 3.2134 3.3681 3.3735 3.5625 3.5640 7.7211 7.9687 9.7211 9.8105 10.6706 10.7112 11.5898 11.5924 12.1484 12.1507 k = 0.0698-0.1009 0.3465 ( 4032 PWs) bands (ev): -16.2016 -16.2006 -15.3509 -15.3505 -14.0067 -14.0013 -13.8170 -13.8169 -13.5020 -13.5015 -13.4761 -13.4734 -5.1367 -5.1364 -4.8226 -4.8211 -3.0403 -3.0375 -2.9621 -2.9217 -2.4164 -2.4158 -1.0021 -0.9684 -0.4238 -0.4072 -0.0702 -0.0029 0.5733 0.6065 0.7215 0.7303 1.2564 1.3029 1.5890 1.6272 2.3783 2.3808 2.5654 2.5676 2.7783 2.7791 3.0122 3.0148 3.2033 3.2090 3.3691 3.3742 3.5677 3.5690 7.7137 7.9376 9.7199 9.8012 10.6661 10.7019 11.5799 11.5819 12.1574 12.1595 k = 0.0620-0.0897 0.3465 ( 4030 PWs) bands (ev): -16.2078 -16.2070 -15.3553 -15.3550 -13.9968 -13.9919 -13.8116 -13.8115 -13.5013 -13.5009 -13.4772 -13.4747 -5.1232 -5.1229 -4.8266 -4.8254 -3.0471 -3.0448 -2.9598 -2.9230 -2.4249 -2.4243 -0.9938 -0.9631 -0.4065 -0.3906 -0.0711 -0.0092 0.5810 0.6096 0.6968 0.7056 1.2609 1.3016 1.5890 1.6239 2.3779 2.3802 2.5634 2.5651 2.7786 2.7798 3.0142 3.0170 3.1994 3.2048 3.3700 3.3747 3.5726 3.5737 7.7081 7.9079 9.7193 9.7921 10.6621 10.6934 11.5706 11.5722 12.1657 12.1677 k = 0.0543-0.0785 0.3465 ( 4028 PWs) bands (ev): -16.2134 -16.2127 -15.3593 -15.3590 -13.9879 -13.9834 -13.8068 -13.8067 -13.5008 -13.5005 -13.4783 -13.4761 -5.1111 -5.1109 -4.8302 -4.8291 -3.0533 -3.0514 -2.9573 -2.9245 -2.4323 -2.4318 -0.9860 -0.9585 -0.3890 -0.3741 -0.0716 -0.0159 0.5855 0.6084 0.6755 0.6826 1.2666 1.3018 1.5896 1.6208 2.3777 2.3797 2.5608 2.5620 2.7798 2.7812 3.0161 3.0190 3.1959 3.2009 3.3708 3.3752 3.5770 3.5780 7.7044 7.8799 9.7192 9.7834 10.6587 10.6857 11.5621 11.5632 12.1734 12.1751 k = 0.0465-0.0673 0.3465 ( 4030 PWs) bands (ev): -16.2182 -16.2176 -15.3627 -15.3625 -13.9800 -13.9760 -13.8026 -13.8025 -13.5003 -13.5001 -13.4792 -13.4773 -5.1005 -5.1003 -4.8333 -4.8324 -3.0587 -3.0571 -2.9547 -2.9262 -2.4388 -2.4383 -0.9787 -0.9548 -0.3718 -0.3581 -0.0716 -0.0228 0.5849 0.5998 0.6615 0.6642 1.2729 1.3028 1.5906 1.6178 2.3775 2.3792 2.5578 2.5587 2.7814 2.7829 3.0179 3.0208 3.1928 3.1974 3.3716 3.3755 3.5810 3.5818 7.7027 7.8537 9.7198 9.7752 10.6559 10.6787 11.5545 11.5553 12.1802 12.1817 k = 0.0388-0.0561 0.3465 ( 4036 PWs) bands (ev): -16.2223 -16.2218 -15.3656 -15.3655 -13.9731 -13.9697 -13.7990 -13.7989 -13.5000 -13.4998 -13.4801 -13.4785 -5.0914 -5.0912 -4.8359 -4.8352 -3.0634 -3.0621 -2.9521 -2.9280 -2.4443 -2.4439 -0.9722 -0.9518 -0.3554 -0.3433 -0.0710 -0.0296 0.5774 0.5844 0.6532 0.6554 1.2794 1.3041 1.5920 1.6149 2.3773 2.3788 2.5549 2.5554 2.7832 2.7847 3.0196 3.0224 3.1902 3.1942 3.3723 3.3756 3.5844 3.5851 7.7031 7.8293 9.7210 9.7674 10.6537 10.6726 11.5478 11.5484 12.1862 12.1875 k = 0.0310-0.0448 0.3465 ( 4038 PWs) bands (ev): -16.2256 -16.2252 -15.3681 -15.3679 -13.9673 -13.9646 -13.7959 -13.7959 -13.4997 -13.4996 -13.4808 -13.4795 -5.0838 -5.0837 -4.8380 -4.8375 -3.0673 -3.0663 -2.9495 -2.9300 -2.4488 -2.4485 -0.9663 -0.9498 -0.3405 -0.3301 -0.0698 -0.0363 0.5646 0.5667 0.6492 0.6538 1.2856 1.3053 1.5937 1.6121 2.3772 2.3784 2.5521 2.5524 2.7851 2.7864 3.0212 3.0236 3.1881 3.1914 3.3729 3.3757 3.5873 3.5878 7.7057 7.8069 9.7227 9.7601 10.6522 10.6672 11.5423 11.5426 12.1912 12.1922 k = 0.0233-0.0336 0.3465 ( 4034 PWs) bands (ev): -16.2282 -16.2279 -15.3699 -15.3698 -13.9627 -13.9606 -13.7936 -13.7935 -13.4995 -13.4995 -13.4814 -13.4804 -5.0779 -5.0777 -4.8396 -4.8392 -3.0704 -3.0696 -2.9468 -2.9321 -2.4523 -2.4521 -0.9612 -0.9487 -0.3275 -0.3194 -0.0679 -0.0426 0.5506 0.5506 0.6490 0.6536 1.2912 1.3060 1.5956 1.6095 2.3772 2.3781 2.5497 2.5499 2.7867 2.7878 3.0226 3.0245 3.1866 3.1891 3.3736 3.3756 3.5896 3.5900 7.7105 7.7865 9.7252 9.7533 10.6515 10.6626 11.5379 11.5381 12.1952 12.1960 k = 0.0155-0.0224 0.3465 ( 4026 PWs) bands (ev): -16.2301 -16.2299 -15.3713 -15.3712 -13.9593 -13.9579 -13.7919 -13.7918 -13.4994 -13.4994 -13.4818 -13.4811 -5.0736 -5.0735 -4.8407 -4.8405 -3.0725 -3.0720 -2.9442 -2.9343 -2.4548 -2.4546 -0.9569 -0.9485 -0.3173 -0.3116 -0.0654 -0.0484 0.5381 0.5387 0.6501 0.6537 1.2961 1.3060 1.5977 1.6069 2.3772 2.3778 2.5479 2.5480 2.7881 2.7888 3.0237 3.0251 3.1856 3.1873 3.3741 3.3755 3.5913 3.5916 7.7175 7.7683 9.7283 9.7471 10.6515 10.6588 11.5347 11.5348 12.1982 12.1987 k = 0.0078-0.0112 0.3465 ( 4024 PWs) bands (ev): -16.2312 -16.2310 -15.3721 -15.3720 -13.9571 -13.9564 -13.7908 -13.7908 -13.4993 -13.4993 -13.4819 -13.4816 -5.0710 -5.0709 -4.8414 -4.8413 -3.0738 -3.0735 -2.9416 -2.9366 -2.4563 -2.4562 -0.9534 -0.9492 -0.3103 -0.3074 -0.0622 -0.0537 0.5303 0.5308 0.6516 0.6534 1.3001 1.3050 1.5998 1.6045 2.3772 2.3775 2.5468 2.5469 2.7890 2.7894 3.0246 3.0253 3.1852 3.1860 3.3746 3.3753 3.5924 3.5925 7.7268 7.7522 9.7320 9.7414 10.6522 10.6558 11.5328 11.5328 12.2000 12.2003 k = 0.0000 0.0000 0.3465 ( 4022 PWs) bands (ev): -16.2315 -16.2315 -15.3723 -15.3723 -13.9561 -13.9561 -13.7905 -13.7905 -13.4993 -13.4993 -13.4819 -13.4819 -5.0701 -5.0701 -4.8416 -4.8416 -3.0741 -3.0741 -2.9391 -2.9391 -2.4567 -2.4567 -0.9508 -0.9508 -0.3069 -0.3069 -0.0583 -0.0583 0.5278 0.5278 0.6527 0.6527 1.3031 1.3031 1.6021 1.6021 2.3774 2.3774 2.5464 2.5464 2.7894 2.7894 3.0251 3.0251 3.1853 3.1853 3.3750 3.3750 3.5928 3.5928 7.7384 7.7384 9.7364 9.7364 10.6536 10.6536 11.5322 11.5322 12.2007 12.2007 k = 0.0000 0.0000 0.3465 ( 4022 PWs) bands (ev): -16.2315 -16.2315 -15.3723 -15.3723 -13.9561 -13.9561 -13.7905 -13.7905 -13.4993 -13.4993 -13.4819 -13.4819 -5.0701 -5.0701 -4.8416 -4.8416 -3.0741 -3.0741 -2.9391 -2.9391 -2.4567 -2.4567 -0.9508 -0.9508 -0.3069 -0.3069 -0.0583 -0.0583 0.5278 0.5278 0.6527 0.6527 1.3031 1.3031 1.6021 1.6021 2.3774 2.3774 2.5464 2.5464 2.7894 2.7894 3.0251 3.0251 3.1853 3.1853 3.3750 3.3750 3.5928 3.5928 7.7384 7.7384 9.7364 9.7364 10.6536 10.6536 11.5322 11.5322 12.2007 12.2007 k = 0.0112 0.0078 0.3465 ( 4024 PWs) bands (ev): -16.2309 -16.2309 -15.3723 -15.3716 -13.9568 -13.9566 -13.7909 -13.7905 -13.5073 -13.5017 -13.4797 -13.4748 -5.0729 -5.0706 -4.8410 -4.8408 -3.0759 -3.0719 -2.9383 -2.9348 -2.4596 -2.4549 -0.9551 -0.9500 -0.3186 -0.2993 -0.0653 -0.0489 0.5164 0.5391 0.6425 0.6663 1.3014 1.3067 1.6025 1.6056 2.3760 2.3768 2.5462 2.5463 2.7856 2.7873 3.0242 3.0261 3.1820 3.1870 3.3724 3.3799 3.5924 3.5927 7.7281 7.7511 9.7214 9.7520 10.6469 10.6605 11.5323 11.5336 12.1970 12.2058 k = 0.0224 0.0155 0.3465 ( 4020 PWs) bands (ev): -16.2292 -16.2291 -15.3714 -15.3701 -13.9586 -13.9581 -13.7917 -13.7910 -13.5181 -13.5113 -13.4716 -13.4661 -5.0789 -5.0744 -4.8389 -4.8387 -3.0769 -3.0692 -2.9323 -2.9259 -2.4634 -2.4541 -0.9626 -0.9525 -0.3337 -0.2965 -0.0694 -0.0377 0.5056 0.5486 0.6371 0.6823 1.3018 1.3123 1.6068 1.6130 2.3727 2.3744 2.5454 2.5458 2.7762 2.7793 3.0235 3.0272 3.1773 3.1869 3.3724 3.3870 3.5917 3.5924 7.7204 7.7662 9.7070 9.7682 10.6403 10.6675 11.5341 11.5368 12.1947 12.2122 k = 0.0336 0.0233 0.3465 ( 4024 PWs) bands (ev): -16.2263 -16.2262 -15.3698 -15.3679 -13.9615 -13.9607 -13.7930 -13.7920 -13.5298 -13.5225 -13.4629 -13.4576 -5.0880 -5.0815 -4.8355 -4.8352 -3.0766 -3.0660 -2.9216 -2.9129 -2.4680 -2.4543 -0.9732 -0.9583 -0.3514 -0.2987 -0.0700 -0.0254 0.4957 0.5541 0.6385 0.7000 1.3044 1.3197 1.6150 1.6239 2.3676 2.3701 2.5440 2.5446 2.7616 2.7659 3.0228 3.0280 3.1715 3.1850 3.3749 3.3960 3.5906 3.5916 7.7151 7.7837 9.6933 9.7849 10.6336 10.6749 11.5376 11.5416 12.1938 12.2200 k = 0.0448 0.0310 0.3465 ( 4023 PWs) bands (ev): -16.2223 -16.2221 -15.3675 -15.3649 -13.9654 -13.9644 -13.7950 -13.7937 -13.5418 -13.5342 -13.4547 -13.4497 -5.1001 -5.0916 -4.8307 -4.8305 -3.0747 -3.0618 -2.9066 -2.8964 -2.4734 -2.4553 -0.9867 -0.9675 -0.3711 -0.3055 -0.0672 -0.0123 0.4868 0.5547 0.6474 0.7192 1.3094 1.3288 1.6268 1.6383 2.3607 2.3638 2.5415 2.5426 2.7427 2.7480 3.0219 3.0284 3.1648 3.1815 3.3796 3.4065 3.5892 3.5905 7.7124 7.8033 9.6802 9.8022 10.6267 10.6826 11.5428 11.5480 12.1942 12.2290 k = 0.0560 0.0388 0.3465 ( 4024 PWs) bands (ev): -16.2171 -16.2168 -15.3644 -15.3612 -13.9702 -13.9691 -13.7977 -13.7963 -13.5540 -13.5462 -13.4471 -13.4425 -5.1151 -5.1048 -4.8247 -4.8245 -3.0708 -3.0563 -2.8879 -2.8770 -2.4793 -2.4571 -1.0029 -0.9797 -0.3922 -0.3163 -0.0614 0.0013 0.4787 0.5513 0.6622 0.7392 1.3165 1.3395 1.6421 1.6559 2.3518 2.3556 2.5376 2.5393 2.7204 2.7264 3.0205 3.0283 3.1577 3.1767 3.3862 3.4183 3.5876 3.5891 7.7120 7.8250 9.6678 9.8198 10.6197 10.6907 11.5496 11.5561 12.1958 12.2391 k = 0.0672 0.0465 0.3465 ( 4031 PWs) bands (ev): -16.2107 -16.2104 -15.3606 -15.3567 -13.9760 -13.9748 -13.8014 -13.8000 -13.5660 -13.5580 -13.4403 -13.4360 -5.1327 -5.1207 -4.8176 -4.8172 -3.0649 -3.0491 -2.8664 -2.8554 -2.4856 -2.4594 -1.0214 -0.9948 -0.4139 -0.3300 -0.0531 0.0151 0.4713 0.5456 0.6807 0.7599 1.3260 1.3519 1.6606 1.6763 2.3408 2.3451 2.5319 2.5344 2.6959 2.7022 3.0187 3.0274 3.1502 3.1710 3.3943 3.4311 3.5857 3.5873 7.7141 7.8485 9.6560 9.8378 10.6124 10.6993 11.5582 11.5659 12.1986 12.2503 k = 0.0784 0.0543 0.3465 ( 4029 PWs) bands (ev): -16.2032 -16.2028 -15.3560 -15.3515 -13.9828 -13.9814 -13.8062 -13.8050 -13.5775 -13.5696 -13.4342 -13.4303 -5.1527 -5.1393 -4.8093 -4.8088 -3.0567 -3.0401 -2.8426 -2.8321 -2.4918 -2.4619 -1.0420 -1.0125 -0.4360 -0.3458 -0.0430 0.0290 0.4642 0.5388 0.7014 0.7810 1.3376 1.3659 1.6817 1.6991 2.3272 2.3320 2.5240 2.5276 2.6705 2.6768 3.0161 3.0258 3.1426 3.1646 3.4036 3.4448 3.5837 3.5853 7.7184 7.8737 9.6450 9.8561 10.6047 10.7084 11.5685 11.5775 12.2025 12.2624 k = 0.0897 0.0620 0.3465 ( 4029 PWs) bands (ev): -16.1945 -16.1941 -15.3507 -15.3456 -13.9904 -13.9890 -13.8124 -13.8115 -13.5884 -13.5806 -13.4290 -13.4254 -5.1750 -5.1602 -4.7999 -4.7991 -3.0464 -3.0292 -2.8172 -2.8078 -2.4975 -2.4641 -1.0643 -1.0323 -0.4578 -0.3628 -0.0317 0.0428 0.4574 0.5314 0.7231 0.8020 1.3512 1.3816 1.7049 1.7239 2.3104 2.3155 2.5138 2.5187 2.6453 2.6515 3.0129 3.0234 3.1354 3.1582 3.4136 3.4590 3.5816 3.5832 7.7248 7.9003 9.6347 9.8745 10.5967 10.7179 11.5806 11.5907 12.2074 12.2752 k = 0.1009 0.0698 0.3465 ( 4029 PWs) bands (ev): -16.1848 -16.1843 -15.3447 -15.3390 -13.9989 -13.9976 -13.8202 -13.8197 -13.5984 -13.5908 -13.4245 -13.4213 -5.1993 -5.1834 -4.7895 -4.7883 -3.0340 -3.0165 -2.7913 -2.7832 -2.5023 -2.4654 -1.0879 -1.0538 -0.4792 -0.3802 -0.0196 0.0562 0.4506 0.5236 0.7452 0.8228 1.3668 1.3989 1.7296 1.7500 2.2893 2.2949 2.5018 2.5083 2.6213 2.6274 3.0089 3.0200 3.1288 3.1521 3.4241 3.4737 3.5794 3.5812 7.7331 7.9282 9.6252 9.8930 10.5883 10.7280 11.5944 11.6058 12.2131 12.2886 k = 0.1121 0.0775 0.3465 ( 4033 PWs) bands (ev): -16.1739 -16.1734 -15.3381 -15.3318 -14.0083 -14.0070 -13.8297 -13.8296 -13.6074 -13.6001 -13.4208 -13.4179 -5.2256 -5.2085 -4.7779 -4.7764 -3.0197 -3.0020 -2.7660 -2.7587 -2.5053 -2.4650 -1.1124 -1.0766 -0.4996 -0.3974 -0.0071 0.0691 0.4437 0.5156 0.7673 0.8432 1.3840 1.4179 1.7551 1.7768 2.2628 2.2692 2.4886 2.4974 2.5991 2.6051 3.0040 3.0153 3.1235 3.1470 3.4346 3.4885 3.5772 3.5796 7.7433 7.9571 9.6165 9.9114 10.5796 10.7385 11.6100 11.6225 12.2195 12.3025 k = 0.1233 0.0853 0.3465 ( 4029 PWs) bands (ev): -16.1618 -16.1613 -15.3308 -15.3239 -14.0186 -14.0175 -13.8413 -13.8407 -13.6152 -13.6083 -13.4179 -13.4153 -5.2534 -5.2355 -4.7653 -4.7633 -3.0039 -2.9859 -2.7429 -2.7350 -2.5055 -2.4619 -1.1374 -1.1001 -0.5189 -0.4142 0.0053 0.0812 0.4364 0.5075 0.7888 0.8628 1.4027 1.4385 1.7806 1.8035 2.2301 2.2379 2.4757 2.4879 2.5788 2.5847 2.9981 3.0090 3.1200 3.1434 3.4449 3.5031 3.5752 3.5789 7.7550 7.9866 9.6088 9.9295 10.5706 10.7494 11.6273 11.6410 12.2265 12.3165 k = 0.1345 0.0930 0.3465 ( 4035 PWs) bands (ev): -16.1487 -16.1481 -15.3228 -15.3154 -14.0300 -14.0291 -13.8547 -13.8534 -13.6219 -13.6154 -13.4157 -13.4133 -5.2828 -5.2640 -4.7517 -4.7492 -2.9867 -2.9686 -2.7237 -2.7131 -2.5015 -2.4549 -1.1623 -1.1238 -0.5370 -0.4300 0.0175 0.0923 0.4289 0.4993 0.8096 0.8816 1.4226 1.4607 1.8053 1.8291 2.1912 2.2007 2.4639 2.4810 2.5599 2.5657 2.9910 3.0008 3.1187 3.1417 3.4544 3.5168 3.5739 3.5793 7.7682 8.0166 9.6020 9.9473 10.5614 10.7606 11.6463 11.6612 12.2338 12.3307 k = 0.1457 0.1008 0.3465 ( 4036 PWs) bands (ev): -16.1345 -16.1338 -15.3143 -15.3063 -14.0426 -14.0418 -13.8693 -13.8673 -13.6275 -13.6215 -13.4143 -13.4120 -5.3135 -5.2940 -4.7370 -4.7341 -2.9685 -2.9502 -2.7089 -2.6950 -2.4919 -2.4428 -1.1868 -1.1471 -0.5536 -0.4446 0.0290 0.1021 0.4209 0.4913 0.8294 0.8993 1.4434 1.4845 1.8282 1.8525 2.1471 2.1582 2.4540 2.4776 2.5420 2.5481 2.9829 2.9909 3.1198 3.1423 3.4628 3.5281 3.5745 3.5818 7.7826 8.0468 9.5964 9.9646 10.5522 10.7721 11.6670 11.6831 12.2415 12.3447 k = 0.1569 0.1085 0.3465 ( 4038 PWs) bands (ev): -16.1192 -16.1185 -15.3052 -15.2967 -14.0565 -14.0560 -13.8849 -13.8823 -13.6322 -13.6266 -13.4136 -13.4113 -5.3452 -5.3252 -4.7213 -4.7179 -2.9498 -2.9313 -2.6987 -2.6823 -2.4756 -2.4252 -1.2104 -1.1696 -0.5686 -0.4578 0.0396 0.1104 0.4126 0.4834 0.8480 0.9158 1.4645 1.5095 1.8479 1.8717 2.0999 2.1120 2.4457 2.4772 2.5254 2.5317 2.9740 2.9797 3.1233 3.1452 3.4697 3.5353 3.5777 3.5877 7.7979 8.0768 9.5920 9.9811 10.5431 10.7839 11.6893 11.7066 12.2492 12.3583 k = 0.1681 0.1163 0.3465 ( 4038 PWs) bands (ev): -16.1028 -16.1021 -15.2955 -15.2865 -14.0721 -14.0716 -13.9011 -13.8979 -13.6361 -13.6310 -13.4137 -13.4112 -5.3779 -5.3574 -4.7045 -4.7007 -2.9311 -2.9121 -2.6928 -2.6751 -2.4524 -2.4019 -1.2326 -1.1906 -0.5821 -0.4696 0.0490 0.1168 0.4039 0.4758 0.8653 0.9309 1.4856 1.5355 1.8622 1.8833 2.0534 2.0647 2.4381 2.4781 2.5117 2.5173 2.9645 2.9681 3.1288 3.1503 3.4748 3.5378 3.5834 3.5981 7.8140 8.1064 9.5889 9.9968 10.5342 10.7958 11.7132 11.7316 12.2570 12.3716 k = 0.1793 0.1240 0.3465 ( 4043 PWs) bands (ev): -16.0854 -16.0846 -15.2853 -15.2759 -14.0895 -14.0888 -13.9173 -13.9137 -13.6393 -13.6347 -13.4144 -13.4117 -5.4113 -5.3905 -4.6868 -4.6825 -2.9128 -2.8932 -2.6903 -2.6729 -2.4230 -2.3735 -1.2531 -1.2097 -0.5938 -0.4796 0.0571 0.1214 0.3948 0.4685 0.8811 0.9446 1.5059 1.5618 1.8664 1.8803 2.0149 2.0220 2.4298 2.4743 2.5054 2.5064 2.9535 2.9582 3.1362 3.1574 3.4780 3.5371 3.5909 3.6123 7.8306 8.1353 9.5872 10.0114 10.5258 10.8077 11.7385 11.7581 12.2646 12.3843 k = 0.1905 0.1318 0.3465 ( 4040 PWs) bands (ev): -16.0670 -16.0661 -15.2747 -15.2648 -14.1089 -14.1079 -13.9332 -13.9293 -13.6422 -13.6380 -13.4158 -13.4128 -5.4453 -5.4243 -4.6681 -4.6633 -2.8955 -2.8748 -2.6903 -2.6742 -2.3888 -2.3409 -1.2714 -1.2265 -0.6039 -0.4880 0.0635 0.1238 0.3853 0.4616 0.8954 0.9566 1.5248 1.5876 1.8523 1.8544 1.9899 1.9970 2.4200 2.4628 2.4970 2.5123 2.9421 2.9507 3.1449 3.1660 3.4794 3.5348 3.6000 3.6287 7.8475 8.1632 9.5870 10.0249 10.5182 10.8196 11.7652 11.7858 12.2719 12.3963 k = 0.2017 0.1395 0.3465 ( 4047 PWs) bands (ev): -16.0475 -16.0466 -15.2637 -15.2534 -14.1303 -14.1290 -13.9484 -13.9443 -13.6447 -13.6409 -13.4177 -13.4144 -5.4798 -5.4586 -4.6485 -4.6432 -2.8796 -2.8576 -2.6920 -2.6780 -2.3507 -2.3047 -1.2871 -1.2405 -0.6122 -0.4947 0.0683 0.1240 0.3754 0.4551 0.9080 0.9669 1.5411 1.6116 1.8100 1.8161 1.9785 1.9906 2.4087 2.4487 2.4915 2.5240 2.9319 2.9453 3.1547 3.1758 3.4794 3.5318 3.6108 3.6463 7.8645 8.1898 9.5883 10.0370 10.5115 10.8313 11.7931 11.8148 12.2789 12.4075 k = 0.2129 0.1473 0.3465 ( 4047 PWs) bands (ev): -16.0271 -16.0261 -15.2522 -15.2416 -14.1539 -14.1521 -13.9627 -13.9585 -13.6470 -13.6436 -13.4202 -13.4165 -5.5145 -5.4932 -4.6279 -4.6222 -2.8657 -2.8419 -2.6947 -2.6830 -2.3096 -2.2656 -1.3000 -1.2516 -0.6188 -0.4996 0.0711 0.1219 0.3652 0.4488 0.9187 0.9752 1.5528 1.6305 1.7597 1.7682 1.9769 1.9895 2.3969 2.4345 2.4882 2.5384 2.9238 2.9427 3.1652 3.1864 3.4786 3.5286 3.6227 3.6648 7.8815 8.2149 9.5914 10.0477 10.5061 10.8428 11.8222 11.8447 12.2854 12.4179 k = 0.2241 0.1550 0.3465 ( 4053 PWs) bands (ev): -16.0057 -16.0047 -15.2405 -15.2295 -14.1796 -14.1773 -13.9759 -13.9717 -13.6492 -13.6462 -13.4232 -13.4190 -5.5493 -5.5281 -4.6065 -4.6003 -2.8541 -2.8283 -2.6982 -2.6883 -2.2660 -2.2240 -1.3099 -1.2593 -0.6238 -0.5028 0.0720 0.1176 0.3547 0.4428 0.9273 0.9812 1.5556 1.6351 1.7106 1.7278 1.9778 1.9878 2.3860 2.4211 2.4860 2.5544 2.9188 2.9432 3.1761 3.1974 3.4772 3.5255 3.6356 3.6838 7.8981 8.2382 9.5960 10.0569 10.5020 10.8540 11.8521 11.8755 12.2913 12.4273 k = 0.2353 0.1628 0.3465 ( 4052 PWs) bands (ev): -15.9833 -15.9823 -15.2285 -15.2172 -14.2072 -14.2045 -13.9879 -13.9839 -13.6514 -13.6487 -13.4267 -13.4221 -5.5841 -5.5630 -4.5842 -4.5775 -2.8451 -2.8170 -2.7027 -2.6930 -2.2202 -2.1802 -1.3164 -1.2636 -0.6270 -0.5042 0.0707 0.1112 0.3439 0.4369 0.9333 0.9844 1.5408 1.6096 1.6706 1.7172 1.9776 1.9836 2.3771 2.4086 2.4847 2.5714 2.9175 2.9470 3.1871 3.2085 3.4758 3.5227 3.6492 3.7032 7.9143 8.2595 9.6023 10.0645 10.4996 10.8647 11.8827 11.9069 12.2966 12.4359 k = 0.2465 0.1705 0.3465 ( 4053 PWs) bands (ev): -15.9601 -15.9590 -15.2163 -15.2047 -14.2364 -14.2333 -13.9988 -13.9949 -13.6537 -13.6514 -13.4306 -13.4256 -5.6187 -5.5979 -4.5610 -4.5540 -2.8388 -2.8084 -2.7079 -2.6966 -2.1725 -2.1344 -1.3196 -1.2645 -0.6287 -0.5039 0.0671 0.1026 0.3330 0.4311 0.9362 0.9841 1.5046 1.5617 1.6518 1.7236 1.9751 1.9761 2.3705 2.3971 2.4847 2.5892 2.9200 2.9540 3.1979 3.2192 3.4746 3.5204 3.6634 3.7230 7.9300 8.2787 9.6101 10.0707 10.4990 10.8749 11.9139 11.9387 12.3013 12.4435 k = 0.2577 0.1783 0.3465 ( 4055 PWs) bands (ev): -15.9359 -15.9348 -15.2039 -15.1922 -14.2672 -14.2637 -14.0087 -14.0050 -13.6561 -13.6541 -13.4349 -13.4294 -5.6531 -5.6325 -4.5371 -4.5297 -2.8350 -2.8029 -2.7131 -2.6995 -2.1231 -2.0869 -1.3194 -1.2619 -0.6287 -0.5020 0.0612 0.0920 0.3219 0.4253 0.9351 0.9794 1.4572 1.5079 1.6455 1.7314 1.9654 1.9699 2.3655 2.3866 2.4873 2.6079 2.9265 2.9641 3.2081 3.2292 3.4742 3.5188 3.6779 3.7429 7.9449 8.2954 9.6194 10.0753 10.5003 10.8846 11.9453 11.9708 12.3052 12.4502 k = 0.2690 0.1860 0.3465 ( 4060 PWs) bands (ev): -15.9109 -15.9097 -15.1915 -15.1796 -14.2993 -14.2955 -14.0175 -14.0141 -13.6587 -13.6570 -13.4395 -13.4337 -5.6870 -5.6667 -4.5125 -4.5048 -2.8335 -2.8003 -2.7180 -2.7022 -2.0723 -2.0378 -1.3159 -1.2561 -0.6273 -0.4986 0.0528 0.0793 0.3110 0.4194 0.9290 0.9691 1.4085 1.4554 1.6414 1.7354 1.9524 1.9625 2.3603 2.3773 2.4944 2.6277 2.9366 2.9766 3.2176 3.2382 3.4748 3.5180 3.6926 3.7629 7.9590 8.3098 9.6299 10.0785 10.5036 10.8936 11.9767 12.0028 12.3085 12.4559 k = 0.2802 0.1938 0.3465 ( 4061 PWs) bands (ev): -15.8851 -15.8839 -15.1791 -15.1672 -14.3323 -14.3283 -14.0254 -14.0222 -13.6615 -13.6600 -13.4445 -13.4383 -5.7203 -5.7005 -4.4871 -4.4792 -2.8341 -2.8007 -2.7224 -2.7049 -2.0201 -1.9874 -1.3092 -1.2471 -0.6244 -0.4936 0.0418 0.0646 0.3002 0.4134 0.9167 0.9521 1.3639 1.4076 1.6353 1.7333 1.9381 1.9539 2.3532 2.3692 2.5073 2.6491 2.9497 2.9910 3.2261 3.2457 3.4767 3.5182 3.7076 3.7830 7.9722 8.3215 9.6416 10.0805 10.5090 10.9020 12.0078 12.0345 12.3110 12.4607 k = 0.2914 0.2015 0.3465 ( 4060 PWs) bands (ev): -15.8586 -15.8573 -15.1668 -15.1549 -14.3662 -14.3620 -14.0325 -14.0295 -13.6646 -13.6633 -13.4498 -13.4432 -5.7530 -5.7337 -4.4611 -4.4530 -2.8364 -2.8036 -2.7262 -2.7077 -1.9668 -1.9358 -1.2995 -1.2353 -0.6202 -0.4873 0.0283 0.0478 0.2896 0.4072 0.8974 0.9275 1.3262 1.3664 1.6255 1.7237 1.9241 1.9450 2.3441 2.3617 2.5268 2.6720 2.9650 3.0067 3.2333 3.2515 3.4800 3.5195 3.7226 3.8030 7.9845 8.3306 9.6542 10.0812 10.5166 10.9097 12.0382 12.0658 12.3129 12.4645 k = 0.3026 0.2093 0.3465 ( 4060 PWs) bands (ev): -15.8313 -15.8299 -15.1548 -15.1428 -14.4007 -14.3963 -14.0387 -14.0359 -13.6679 -13.6667 -13.4553 -13.4483 -5.7849 -5.7661 -4.4346 -4.4264 -2.8403 -2.8086 -2.7298 -2.7106 -1.9127 -1.8833 -1.2871 -1.2210 -0.6148 -0.4797 0.0122 0.0288 0.2793 0.4007 0.8705 0.8955 1.2964 1.3327 1.6111 1.7062 1.9113 1.9370 2.3343 2.3538 2.5520 2.6964 2.9819 3.0232 3.2391 3.2556 3.4850 3.5220 3.7376 3.8228 7.9959 8.3370 9.6676 10.0808 10.5263 10.9166 12.0677 12.0962 12.3142 12.4675 k = 0.3138 0.2171 0.3465 ( 4058 PWs) bands (ev): -15.8033 -15.8019 -15.1430 -15.1312 -14.4355 -14.4311 -14.0440 -14.0415 -13.6716 -13.6702 -13.4610 -13.4537 -5.8158 -5.7976 -4.4076 -4.3994 -2.8455 -2.8152 -2.7330 -2.7136 -1.8580 -1.8301 -1.2723 -1.2047 -0.6082 -0.4708 -0.0067 0.0077 0.2693 0.3938 0.8369 0.8574 1.2743 1.3064 1.5918 1.6811 1.9003 1.9304 2.3245 2.3456 2.5818 2.7222 2.9996 3.0400 3.2435 3.2578 3.4916 3.5257 3.7527 3.8423 8.0064 8.3408 9.6815 10.0794 10.5380 10.9228 12.0960 12.1258 12.3148 12.4697 k = 0.3250 0.2248 0.3465 ( 4057 PWs) bands (ev): -15.7748 -15.7734 -15.1317 -15.1201 -14.4705 -14.4660 -14.0487 -14.0462 -13.6756 -13.6740 -13.4669 -13.4594 -5.8458 -5.8282 -4.3801 -4.3720 -2.8520 -2.8232 -2.7361 -2.7165 -1.8030 -1.7767 -1.2555 -1.1866 -0.6007 -0.4609 -0.0287 -0.0152 0.2592 0.3862 0.7981 0.8153 1.2585 1.2865 1.5679 1.6498 1.8912 1.9255 2.3154 2.3377 2.6149 2.7491 3.0175 3.0566 3.2465 3.2584 3.4996 3.5304 3.7678 3.8614 8.0161 8.3418 9.6958 10.0770 10.5519 10.9282 12.1227 12.1540 12.3150 12.4712 k = 0.3362 0.2326 0.3465 ( 4053 PWs) bands (ev): -15.7457 -15.7442 -15.1209 -15.1097 -14.5053 -14.5009 -14.0526 -14.0502 -13.6799 -13.6780 -13.4730 -13.4652 -5.8746 -5.8578 -4.3524 -4.3446 -2.8597 -2.8322 -2.7387 -2.7191 -1.7480 -1.7232 -1.2371 -1.1672 -0.5922 -0.4500 -0.0541 -0.0394 0.2488 0.3775 0.7567 0.7718 1.2473 1.2713 1.5399 1.6139 1.8836 1.9221 2.3075 2.3304 2.6499 2.7764 3.0353 3.0729 3.2481 3.2573 3.5087 3.5360 3.7830 3.8800 8.0250 8.3402 9.7103 10.0737 10.5677 10.9329 12.1474 12.1807 12.3148 12.4720 k = 0.3474 0.2403 0.3465 ( 4050 PWs) bands (ev): -15.7162 -15.7147 -15.1109 -15.1002 -14.5398 -14.5355 -14.0557 -14.0533 -13.6844 -13.6822 -13.4791 -13.4712 -5.9022 -5.8861 -4.3245 -4.3170 -2.8684 -2.8422 -2.7407 -2.7211 -1.6935 -1.6703 -1.2174 -1.1469 -0.5830 -0.4382 -0.0832 -0.0645 0.2376 0.3669 0.7152 0.7292 1.2390 1.2591 1.5087 1.5749 1.8773 1.9199 2.3012 2.3242 2.6859 2.8039 3.0524 3.0884 3.2483 3.2550 3.5186 3.5424 3.7982 3.8981 8.0332 8.3361 9.7250 10.0693 10.5855 10.9367 12.1699 12.2054 12.3145 12.4723 k = 0.3586 0.2481 0.3465 ( 4047 PWs) bands (ev): -15.6863 -15.6848 -15.1018 -15.0916 -14.5735 -14.5696 -14.0581 -14.0556 -13.6892 -13.6866 -13.4853 -13.4773 -5.9284 -5.9131 -4.2965 -4.2895 -2.8780 -2.8531 -2.7419 -2.7223 -1.6397 -1.6181 -1.1968 -1.1262 -0.5732 -0.4256 -0.1154 -0.0906 0.2249 0.3535 0.6763 0.6898 1.2319 1.2481 1.4755 1.5346 1.8724 1.9187 2.2965 2.3194 2.7219 2.8309 3.0686 3.1030 3.2474 3.2517 3.5290 3.5493 3.8135 3.9154 8.0408 8.3295 9.7397 10.0639 10.6050 10.9397 12.1899 12.2275 12.3146 12.4723 k = 0.3698 0.2558 0.3465 ( 4053 PWs) bands (ev): -15.6563 -15.6548 -15.0937 -15.0844 -14.6063 -14.6027 -14.0599 -14.0572 -13.6942 -13.6912 -13.4916 -13.4835 -5.9533 -5.9388 -4.2686 -4.2623 -2.8885 -2.8647 -2.7420 -2.7225 -1.5873 -1.5674 -1.1758 -1.1055 -0.5629 -0.4123 -0.1504 -0.1177 0.2101 0.3360 0.6424 0.6556 1.2244 1.2367 1.4419 1.4945 1.8686 1.9183 2.2938 2.3162 2.7571 2.8572 3.0837 3.1165 3.2453 3.2478 3.5393 3.5563 3.8291 3.9320 8.0480 8.3206 9.7543 10.0575 10.6260 10.9418 12.2070 12.2460 12.3160 12.4723 k = 0.3810 0.2636 0.3465 ( 4057 PWs) bands (ev): -15.6263 -15.6247 -15.0871 -15.0787 -14.6376 -14.6345 -14.0609 -14.0579 -13.6994 -13.6961 -13.4978 -13.4898 -5.9766 -5.9629 -4.2410 -4.2355 -2.8997 -2.8769 -2.7410 -2.7216 -1.5367 -1.5186 -1.1547 -1.0852 -0.5522 -0.3984 -0.1874 -0.1458 0.1927 0.3136 0.6155 0.6282 1.2145 1.2229 1.4099 1.4568 1.8661 1.9187 2.2931 2.3148 2.7911 2.8823 3.0974 3.1288 3.2417 3.2440 3.5494 3.5634 3.8449 3.9476 8.0549 8.3095 9.7690 10.0501 10.6483 10.9431 12.2210 12.2592 12.3201 12.4724 k = 0.3922 0.2713 0.3465 ( 4053 PWs) bands (ev): -15.5964 -15.5948 -15.0819 -15.0746 -14.6670 -14.6646 -14.0612 -14.0579 -13.7048 -13.7012 -13.5040 -13.4961 -5.9983 -5.9854 -4.2139 -4.2093 -2.9114 -2.8896 -2.7385 -2.7194 -1.4886 -1.4723 -1.1339 -1.0659 -0.5412 -0.3840 -0.2258 -0.1744 0.1722 0.2861 0.5965 0.6085 1.2001 1.2049 1.3818 1.4236 1.8648 1.9198 2.2943 2.3152 2.8231 2.9057 3.1097 3.1399 3.2371 3.2404 3.5586 3.5700 3.8610 3.9623 8.0616 8.2964 9.7836 10.0417 10.6717 10.9434 12.2316 12.2661 12.3282 12.4732 k = 0.4034 0.2791 0.3465 ( 4055 PWs) bands (ev): -15.5671 -15.5654 -15.0785 -15.0726 -14.6941 -14.6926 -14.0608 -14.0572 -13.7103 -13.7064 -13.5100 -13.5024 -6.0183 -6.0063 -4.1875 -4.1840 -2.9234 -2.9025 -2.7346 -2.7157 -1.4437 -1.4293 -1.1138 -1.0478 -0.5301 -0.3692 -0.2645 -0.2033 0.1488 0.2540 0.5850 0.5972 1.1791 1.1809 1.3600 1.3968 1.8650 1.9219 2.2974 2.3174 2.8529 2.9273 3.1204 3.1496 3.2321 3.2365 3.5667 3.5760 3.8776 3.9760 8.0682 8.2816 9.7982 10.0323 10.6959 10.9427 12.2385 12.2673 12.3394 12.4747 k = 0.4146 0.2868 0.3465 ( 4060 PWs) bands (ev): -15.5386 -15.5369 -15.0770 -15.0725 -14.7185 -14.7177 -14.0596 -14.0557 -13.7160 -13.7119 -13.5160 -13.5086 -6.0365 -6.0253 -4.1620 -4.1597 -2.9356 -2.9155 -2.7290 -2.7105 -1.4026 -1.3902 -1.0948 -1.0315 -0.5189 -0.3548 -0.3020 -0.2320 0.1229 0.2188 0.5806 0.5938 1.1506 1.1508 1.3454 1.3774 1.8667 1.9250 2.3023 2.3213 2.8800 2.9467 3.1293 3.1580 3.2271 3.2322 3.5734 3.5810 3.8946 3.9885 8.0748 8.2652 9.8128 10.0219 10.7204 10.9410 12.2417 12.2647 12.3520 12.4772 k = 0.4258 0.2946 0.3465 ( 4062 PWs) bands (ev): -15.5114 -15.5098 -15.0773 -15.0745 -14.7403 -14.7393 -14.0579 -14.0536 -13.7218 -13.7174 -13.5217 -13.5148 -6.0528 -6.0426 -4.1378 -4.1367 -2.9478 -2.9285 -2.7217 -2.7036 -1.3663 -1.3559 -1.0772 -1.0175 -0.5079 -0.3510 -0.3268 -0.2600 0.0951 0.1818 0.5824 0.5974 1.1151 1.1163 1.3373 1.3648 1.8701 1.9293 2.3088 2.3269 2.9044 2.9638 3.1364 3.1651 3.2225 3.2277 3.5784 3.5849 3.9119 3.9997 8.0814 8.2476 9.8272 10.0109 10.7451 10.9380 12.2412 12.2596 12.3647 12.4808 k = 0.4370 0.3023 0.3465 ( 4064 PWs) bands (ev): -15.4863 -15.4847 -15.0791 -15.0779 -14.7590 -14.7570 -14.0554 -14.0508 -13.7277 -13.7231 -13.5272 -13.5208 -6.0672 -6.0578 -4.1155 -4.1148 -2.9597 -2.9412 -2.7127 -2.6948 -1.3356 -1.3273 -1.0612 -1.0063 -0.4976 -0.3785 -0.3165 -0.2865 0.0661 0.1444 0.5901 0.6069 1.0759 1.0774 1.3342 1.3578 1.8754 1.9350 2.3169 2.3340 2.9257 2.9782 3.1416 3.1709 3.2183 3.2230 3.5813 3.5872 3.9295 4.0097 8.0883 8.2292 9.8416 9.9992 10.7695 10.9339 12.2374 12.2524 12.3768 12.4854 k = 0.4483 0.3101 0.3465 ( 4065 PWs) bands (ev): -15.4642 -15.4627 -15.0821 -15.0815 -14.7742 -14.7710 -14.0524 -14.0474 -13.7336 -13.7289 -13.5323 -13.5266 -6.0796 -6.0711 -4.0959 -4.0939 -2.9714 -2.9536 -2.7018 -2.6841 -1.3115 -1.3050 -1.0471 -0.9983 -0.4896 -0.4059 -0.3113 -0.2999 0.0367 0.1075 0.6030 0.6213 1.0346 1.0363 1.3347 1.3548 1.8826 1.9423 2.3262 2.3425 2.9439 2.9900 3.1449 3.1754 3.2147 3.2182 3.5821 3.5880 3.9471 4.0182 8.0952 8.2102 9.8557 9.9872 10.7934 10.9285 12.2309 12.2435 12.3881 12.4907 k = 0.4595 0.3178 0.3465 ( 4065 PWs) bands (ev): -15.4462 -15.4449 -15.0856 -15.0837 -14.7858 -14.7817 -14.0487 -14.0435 -13.7396 -13.7347 -13.5372 -13.5321 -6.0900 -6.0822 -4.0785 -4.0751 -2.9825 -2.9653 -2.6891 -2.6713 -1.2948 -1.2896 -1.0351 -0.9937 -0.4878 -0.4233 -0.3335 -0.2821 0.0076 0.0717 0.6208 0.6400 0.9924 0.9944 1.3380 1.3551 1.8921 1.9514 2.3368 2.3523 2.9590 2.9989 3.1464 3.1787 3.2117 3.2133 3.5807 3.5869 3.9644 4.0253 8.1020 8.1914 9.8691 9.9754 10.8163 10.9217 12.2221 12.2328 12.3986 12.4966 k = 0.5000 0.3459-0.1665 ( 4066 PWs) bands (ev): -15.4047 -15.4047 -15.1299 -15.1299 -14.7805 -14.7805 -14.0157 -14.0157 -13.7772 -13.7772 -13.5189 -13.5189 -6.2749 -6.2749 -3.7403 -3.7403 -2.8686 -2.8686 -2.7540 -2.7540 -1.4409 -1.4409 -0.8592 -0.8592 -0.5382 -0.5382 -0.4568 -0.4568 -0.1355 -0.1355 0.7725 0.7725 1.0091 1.0091 1.4292 1.4292 1.8423 1.8423 2.3876 2.3876 2.9279 2.9279 3.0879 3.0879 3.2405 3.2405 3.6919 3.6919 4.0078 4.0078 8.1225 8.1225 9.9114 9.9114 10.9491 10.9491 12.1995 12.1995 12.5294 12.5294 k = 0.5076 0.3349-0.1665 ( 4066 PWs) bands (ev): -15.4057 -15.4057 -15.1300 -15.1296 -14.7797 -14.7796 -14.0157 -14.0155 -13.7774 -13.7773 -13.5189 -13.5186 -6.2743 -6.2742 -3.7420 -3.7419 -2.8688 -2.8688 -2.7527 -2.7527 -1.4468 -1.4394 -0.8717 -0.8473 -0.5530 -0.5227 -0.4568 -0.4559 -0.1350 -0.1339 0.7729 0.7729 1.0076 1.0093 1.4306 1.4312 1.8422 1.8428 2.3882 2.3883 2.9262 2.9291 3.0862 3.0901 3.2400 3.2403 3.6911 3.6920 4.0072 4.0073 8.1162 8.1302 9.9114 9.9117 10.9433 10.9528 12.1956 12.2029 12.5271 12.5272 k = 0.5152 0.3239-0.1665 ( 4066 PWs) bands (ev): -15.4087 -15.4085 -15.1297 -15.1289 -14.7773 -14.7771 -14.0154 -14.0150 -13.7778 -13.7776 -13.5188 -13.5182 -6.2724 -6.2724 -3.7470 -3.7468 -2.8696 -2.8696 -2.7488 -2.7488 -1.4570 -1.4424 -0.8845 -0.8367 -0.5659 -0.5093 -0.4566 -0.4521 -0.1323 -0.1301 0.7739 0.7741 1.0052 1.0085 1.4354 1.4365 1.8426 1.8438 2.3901 2.3903 2.9241 2.9299 3.0851 3.0928 3.2387 3.2392 3.6896 3.6914 4.0055 4.0058 8.1111 8.1392 9.9118 9.9124 10.9354 10.9543 12.1912 12.2057 12.5204 12.5205 k = 0.5228 0.3130-0.1665 ( 4068 PWs) bands (ev): -15.4135 -15.4133 -15.1291 -15.1279 -14.7733 -14.7730 -14.0148 -14.0142 -13.7784 -13.7782 -13.5186 -13.5176 -6.2694 -6.2694 -3.7551 -3.7549 -2.8708 -2.8708 -2.7423 -2.7423 -1.4713 -1.4497 -0.8976 -0.8281 -0.5763 -0.5015 -0.4563 -0.4419 -0.1274 -0.1242 0.7758 0.7761 1.0019 1.0067 1.4432 1.4450 1.8435 1.8453 2.3932 2.3935 2.9216 2.9300 3.0846 3.0959 3.2366 3.2373 3.6875 3.6901 4.0028 4.0033 8.1073 8.1496 9.9126 9.9134 10.9256 10.9534 12.1864 12.2079 12.5093 12.5096 k = 0.5303 0.3020-0.1665 ( 4068 PWs) bands (ev): -15.4201 -15.4199 -15.1283 -15.1267 -14.7677 -14.7673 -14.0140 -14.0132 -13.7793 -13.7789 -13.5181 -13.5168 -6.2652 -6.2651 -3.7663 -3.7660 -2.8725 -2.8725 -2.7335 -2.7335 -1.4893 -1.4611 -0.9108 -0.8224 -0.5837 -0.5009 -0.4554 -0.4243 -0.1204 -0.1163 0.7784 0.7788 0.9979 1.0042 1.4538 1.4566 1.8450 1.8473 2.3975 2.3979 2.9188 2.9295 3.0849 3.0994 3.2337 3.2347 3.6846 3.6880 3.9990 3.9996 8.1046 8.1614 9.9140 9.9147 10.9140 10.9503 12.1810 12.2096 12.4941 12.4947 k = 0.5379 0.2910-0.1665 ( 4074 PWs) bands (ev): -15.4285 -15.4283 -15.1271 -15.1251 -14.7608 -14.7603 -14.0130 -14.0119 -13.7804 -13.7800 -13.5175 -13.5159 -6.2598 -6.2597 -3.7802 -3.7798 -2.8748 -2.8747 -2.7225 -2.7225 -1.5105 -1.4764 -0.9244 -0.8204 -0.5885 -0.5054 -0.4533 -0.4014 -0.1114 -0.1064 0.7817 0.7823 0.9937 1.0012 1.4669 1.4708 1.8470 1.8499 2.4030 2.4035 2.9156 2.9281 3.0860 3.1031 3.2301 3.2313 3.6811 3.6853 3.9942 3.9950 8.1029 8.1744 9.9157 9.9163 10.9008 10.9449 12.1753 12.2107 12.4751 12.4761 k = 0.5455 0.2801-0.1665 ( 4076 PWs) bands (ev): -15.4385 -15.4382 -15.1256 -15.1232 -14.7525 -14.7519 -14.0116 -14.0104 -13.7817 -13.7812 -13.5167 -13.5148 -6.2533 -6.2531 -3.7966 -3.7962 -2.8774 -2.8774 -2.7096 -2.7095 -1.5347 -1.4950 -0.9384 -0.8223 -0.5913 -0.5130 -0.4490 -0.3755 -0.1003 -0.0946 0.7857 0.7866 0.9894 0.9980 1.4823 1.4875 1.8496 1.8531 2.4096 2.4102 2.9119 2.9259 3.0878 3.1071 3.2257 3.2271 3.6769 3.6820 3.9883 3.9892 8.1022 8.1888 9.9180 9.9181 10.8862 10.9372 12.1691 12.2111 12.4528 12.4543 k = 0.5531 0.2691-0.1665 ( 4072 PWs) bands (ev): -15.4499 -15.4496 -15.1238 -15.1211 -14.7430 -14.7424 -14.0101 -14.0086 -13.7832 -13.7826 -13.5157 -13.5135 -6.2455 -6.2453 -3.8152 -3.8148 -2.8806 -2.8806 -2.6949 -2.6948 -1.5613 -1.5167 -0.9531 -0.8283 -0.5937 -0.5230 -0.4415 -0.3477 -0.0873 -0.0810 0.7904 0.7916 0.9854 0.9949 1.4994 1.5063 1.8530 1.8570 2.4171 2.4179 2.9079 2.9228 3.0905 3.1113 3.2205 3.2222 3.6722 3.6780 3.9814 3.9824 8.1023 8.2044 9.9199 9.9209 10.8704 10.9274 12.1625 12.2110 12.4276 12.4298 k = 0.5607 0.2581-0.1665 ( 4064 PWs) bands (ev): -15.4627 -15.4624 -15.1218 -15.1186 -14.7325 -14.7318 -14.0082 -14.0066 -13.7849 -13.7843 -13.5146 -13.5120 -6.2366 -6.2364 -3.8358 -3.8353 -2.8842 -2.8842 -2.6788 -2.6787 -1.5900 -1.5410 -0.9684 -0.8379 -0.5971 -0.5348 -0.4300 -0.3184 -0.0725 -0.0657 0.7959 0.7974 0.9818 0.9922 1.5182 1.5269 1.8570 1.8616 2.4256 2.4265 2.9034 2.9188 3.0939 3.1156 3.2147 3.2167 3.6669 3.6734 3.9734 3.9746 8.1031 8.2211 9.9219 9.9244 10.8536 10.9155 12.1554 12.2101 12.4000 12.4030 k = 0.5683 0.2472-0.1665 ( 4070 PWs) bands (ev): -15.4767 -15.4764 -15.1195 -15.1159 -14.7210 -14.7203 -14.0062 -14.0044 -13.7868 -13.7861 -13.5132 -13.5103 -6.2266 -6.2263 -3.8580 -3.8575 -2.8882 -2.8882 -2.6615 -2.6613 -1.6205 -1.5676 -0.9846 -0.8506 -0.6026 -0.5481 -0.4141 -0.2882 -0.0561 -0.0489 0.8021 0.8039 0.9791 0.9901 1.5383 1.5489 1.8619 1.8671 2.4350 2.4360 2.8984 2.9138 3.0979 3.1199 3.2082 3.2104 3.6610 3.6681 3.9643 3.9657 8.1044 8.2389 9.9240 9.9284 10.8361 10.9017 12.1480 12.2085 12.3706 12.3745 k = 0.5759 0.2362-0.1665 ( 4064 PWs) bands (ev): -15.4919 -15.4915 -15.1169 -15.1130 -14.7087 -14.7079 -14.0038 -14.0019 -13.7889 -13.7881 -13.5117 -13.5085 -6.2155 -6.2152 -3.8816 -3.8810 -2.8927 -2.8926 -2.6431 -2.6429 -1.6523 -1.5961 -1.0016 -0.8657 -0.6106 -0.5628 -0.3942 -0.2573 -0.0382 -0.0309 0.8090 0.8113 0.9772 0.9888 1.5594 1.5722 1.8676 1.8733 2.4451 2.4463 2.8929 2.9079 3.1024 3.1240 3.2010 3.2036 3.6546 3.6624 3.9542 3.9558 8.1061 8.2577 9.9261 9.9330 10.8181 10.8862 12.1400 12.2060 12.3399 12.3449 k = 0.5835 0.2252-0.1665 ( 4054 PWs) bands (ev): -15.5080 -15.5076 -15.1141 -15.1098 -14.6958 -14.6949 -14.0013 -13.9992 -13.7911 -13.7902 -13.5099 -13.5065 -6.2032 -6.2029 -3.9063 -3.9057 -2.8975 -2.8974 -2.6240 -2.6237 -1.6853 -1.6261 -1.0194 -0.8828 -0.6211 -0.5787 -0.3710 -0.2259 -0.0190 -0.0117 0.8167 0.8195 0.9764 0.9885 1.5814 1.5966 1.8743 1.8805 2.4558 2.4572 2.8868 2.9010 3.1072 3.1279 3.1934 3.1964 3.6477 3.6560 3.9431 3.9448 8.1080 8.2773 9.9282 9.9382 10.8000 10.8692 12.1314 12.2022 12.3089 12.3146 k = 0.5910 0.2142-0.1665 ( 4054 PWs) bands (ev): -15.5250 -15.5246 -15.1110 -15.1064 -14.6822 -14.6813 -13.9985 -13.9962 -13.7935 -13.7925 -13.5080 -13.5043 -6.1900 -6.1896 -3.9319 -3.9313 -2.9026 -2.9025 -2.6042 -2.6039 -1.7192 -1.6575 -1.0382 -0.9016 -0.6336 -0.5957 -0.3452 -0.1941 0.0011 0.0084 0.8252 0.8287 0.9767 0.9893 1.6041 1.6217 1.8819 1.8886 2.4672 2.4686 2.8801 2.8933 3.1120 3.1312 3.1854 3.1890 3.6405 3.6492 3.9309 3.9329 8.1100 8.2975 9.9300 9.9439 10.7819 10.8510 12.1221 12.1965 12.2785 12.2844 k = 0.5986 0.2033-0.1665 ( 4056 PWs) bands (ev): -15.5428 -15.5424 -15.1078 -15.1028 -14.6681 -14.6672 -13.9954 -13.9931 -13.7959 -13.7948 -13.5058 -13.5019 -6.1757 -6.1753 -3.9582 -3.9576 -2.9080 -2.9079 -2.5840 -2.5836 -1.7537 -1.6899 -1.0577 -0.9218 -0.6480 -0.6137 -0.3174 -0.1623 0.0220 0.0291 0.8345 0.8387 0.9783 0.9912 1.6273 1.6475 1.8905 1.8977 2.4790 2.4805 2.8728 2.8848 3.1165 3.1334 3.1772 3.1817 3.6329 3.6420 3.9177 3.9199 8.1117 8.3183 9.9317 9.9500 10.7644 10.8318 12.1117 12.1872 12.2508 12.2548 k = 0.6062 0.1923-0.1665 ( 4056 PWs) bands (ev): -15.5613 -15.5609 -15.1043 -15.0990 -14.6536 -14.6526 -13.9922 -13.9898 -13.7985 -13.7973 -13.5035 -13.4993 -6.1604 -6.1600 -3.9850 -3.9844 -2.9138 -2.9137 -2.5635 -2.5631 -1.7887 -1.7231 -1.0780 -0.9430 -0.6638 -0.6324 -0.2882 -0.1305 0.0434 0.0501 0.8448 0.8498 0.9811 0.9944 1.6510 1.6738 1.9000 1.9078 2.4912 2.4929 2.8649 2.8756 3.1200 3.1337 3.1695 3.1754 3.6250 3.6344 3.9035 3.9058 8.1132 8.3394 9.9330 9.9566 10.7477 10.8121 12.0999 12.1715 12.2267 12.2290 k = 0.6138 0.1813-0.1665 ( 4056 PWs) bands (ev): -15.5804 -15.5800 -15.1007 -15.0950 -14.6389 -14.6378 -13.9887 -13.9862 -13.8011 -13.7999 -13.5009 -13.4965 -6.1442 -6.1437 -4.0121 -4.0115 -2.9198 -2.9198 -2.5428 -2.5423 -1.8241 -1.7569 -1.0989 -0.9652 -0.6808 -0.6517 -0.2581 -0.0988 0.0650 0.0712 0.8561 0.8620 0.9853 0.9988 1.6749 1.7004 1.9105 1.9188 2.5037 2.5055 2.8564 2.8656 3.1213 3.1312 3.1632 3.1709 3.6169 3.6264 3.8883 3.8908 8.1142 8.3607 9.9338 9.9634 10.7322 10.7921 12.0862 12.1482 12.2008 12.2146 k = 0.6214 0.1704-0.1665 ( 4050 PWs) bands (ev): -15.6000 -15.5997 -15.0968 -15.0908 -14.6239 -14.6228 -13.9850 -13.9825 -13.8038 -13.8024 -13.4981 -13.4935 -6.1270 -6.1265 -4.0394 -4.0388 -2.9261 -2.9261 -2.5220 -2.5215 -1.8596 -1.7910 -1.1204 -0.9881 -0.6986 -0.6716 -0.2274 -0.0674 0.0865 0.0920 0.8685 0.8755 0.9907 1.0045 1.6990 1.7271 1.9221 1.9308 2.5164 2.5184 2.8472 2.8549 3.1191 3.1255 3.1597 3.1687 3.6087 3.6182 3.8721 3.8749 8.1145 8.3819 9.9341 9.9703 10.7184 10.7723 12.0701 12.1203 12.1778 12.2048 k = 0.3786-0.5473-0.0000 ( 4050 PWs) bands (ev): -15.6000 -15.5997 -15.0968 -15.0908 -14.6239 -14.6228 -13.9850 -13.9825 -13.8038 -13.8024 -13.4981 -13.4935 -6.1270 -6.1265 -4.0394 -4.0388 -2.9261 -2.9261 -2.5220 -2.5215 -1.8596 -1.7910 -1.1204 -0.9881 -0.6986 -0.6716 -0.2274 -0.0674 0.0865 0.0920 0.8685 0.8755 0.9907 1.0045 1.6990 1.7271 1.9221 1.9308 2.5164 2.5184 2.8472 2.8549 3.1191 3.1255 3.1597 3.1687 3.6087 3.6182 3.8721 3.8749 8.1145 8.3819 9.9341 9.9703 10.7184 10.7723 12.0701 12.1203 12.1778 12.2048 k = 0.3709-0.5362-0.0000 ( 4056 PWs) bands (ev): -15.6205 -15.6201 -15.0928 -15.0864 -14.6084 -14.6073 -13.9811 -13.9784 -13.8065 -13.8051 -13.4951 -13.4903 -6.1086 -6.1080 -4.0672 -4.0666 -2.9328 -2.9327 -2.5010 -2.5004 -1.8957 -1.8261 -1.1428 -1.0120 -0.7174 -0.6920 -0.1959 -0.0358 0.1079 0.1128 0.8824 0.8905 0.9975 1.0115 1.7237 1.7545 1.9347 1.9440 2.5296 2.5316 2.8371 2.8434 3.1128 3.1168 3.1591 3.1681 3.6002 3.6097 3.8546 3.8577 8.1141 8.4033 9.9336 9.9771 10.7065 10.7526 12.0511 12.0902 12.1580 12.1968 k = 0.3631-0.5250-0.0000 ( 4060 PWs) bands (ev): -15.6414 -15.6410 -15.0886 -15.0819 -14.5929 -14.5918 -13.9769 -13.9742 -13.8092 -13.8077 -13.4918 -13.4868 -6.0892 -6.0887 -4.0949 -4.0944 -2.9399 -2.9396 -2.4801 -2.4795 -1.9318 -1.8611 -1.1654 -1.0363 -0.7366 -0.7127 -0.1643 -0.0048 0.1285 0.1326 0.8976 0.9070 1.0056 1.0197 1.7484 1.7818 1.9483 1.9581 2.5429 2.5449 2.8265 2.8313 3.1034 3.1061 3.1606 3.1682 3.5918 3.6010 3.8361 3.8395 8.1128 8.4243 9.9321 9.9836 10.6972 10.7339 12.0296 12.0597 12.1416 12.1894 k = 0.3554-0.5138-0.0000 ( 4058 PWs) bands (ev): -15.6626 -15.6623 -15.0843 -15.0773 -14.5774 -14.5762 -13.9725 -13.9699 -13.8118 -13.8103 -13.4883 -13.4832 -6.0690 -6.0685 -4.1224 -4.1219 -2.9472 -2.9468 -2.4595 -2.4588 -1.9676 -1.8961 -1.1883 -1.0609 -0.7559 -0.7332 -0.1328 0.0257 0.1481 0.1514 0.9142 0.9250 1.0149 1.0291 1.7731 1.8089 1.9628 1.9730 2.5561 2.5582 2.8152 2.8186 3.0921 3.0942 3.1628 3.1683 3.5835 3.5924 3.8167 3.8204 8.1104 8.4446 9.9295 9.9892 10.6910 10.7166 12.0064 12.0298 12.1282 12.1821 k = 0.3477-0.5026-0.0000 ( 4054 PWs) bands (ev): -15.6841 -15.6838 -15.0799 -15.0726 -14.5619 -14.5607 -13.9680 -13.9653 -13.8144 -13.8128 -13.4846 -13.4793 -6.0480 -6.0474 -4.1495 -4.1491 -2.9548 -2.9542 -2.4393 -2.4385 -2.0031 -1.9309 -1.2111 -1.0855 -0.7752 -0.7536 -0.1017 0.0554 0.1664 0.1688 0.9322 0.9446 1.0255 1.0397 1.7977 1.8358 1.9780 1.9886 2.5692 2.5714 2.8033 2.8054 3.0798 3.0814 3.1649 3.1680 3.5753 3.5838 3.7964 3.8004 8.1070 8.4641 9.9257 9.9939 10.6883 10.7010 11.9823 12.0007 12.1170 12.1745 k = 0.3400-0.4915-0.0000 ( 4056 PWs) bands (ev): -15.7059 -15.7056 -15.0754 -15.0678 -14.5465 -14.5453 -13.9632 -13.9606 -13.8168 -13.8152 -13.4806 -13.4753 -6.0262 -6.0255 -4.1763 -4.1760 -2.9627 -2.9619 -2.4196 -2.4187 -2.0381 -1.9652 -1.2339 -1.1100 -0.7941 -0.7734 -0.0711 0.0843 0.1830 0.1846 0.9515 0.9658 1.0375 1.0513 1.8221 1.8623 1.9940 2.0049 2.5822 2.5843 2.7908 2.7918 3.0669 3.0681 3.1663 3.1671 3.5674 3.5753 3.7753 3.7797 8.1026 8.4825 9.9205 9.9972 10.6874 10.6895 11.9580 11.9725 12.1075 12.1666 k = 0.3322-0.4803-0.0000 ( 4064 PWs) bands (ev): -15.7278 -15.7275 -15.0709 -15.0630 -14.5313 -14.5301 -13.9583 -13.9557 -13.8191 -13.8174 -13.4765 -13.4710 -6.0037 -6.0030 -4.2026 -4.2023 -2.9710 -2.9698 -2.4005 -2.3995 -2.0725 -1.9991 -1.2564 -1.1342 -0.8125 -0.7927 -0.0411 0.1122 0.1980 0.1986 0.9720 0.9885 1.0508 1.0640 1.8462 1.8883 2.0105 2.0218 2.5948 2.5970 2.7777 2.7778 3.0535 3.0545 3.1652 3.1669 3.5598 3.5671 3.7533 3.7581 8.0970 8.4998 9.9137 9.9989 10.6761 10.6949 11.9339 11.9454 12.0993 12.1582 k = 0.3245-0.4691-0.0000 ( 4066 PWs) bands (ev): -15.7499 -15.7496 -15.0663 -15.0582 -14.5164 -14.5152 -13.9532 -13.9506 -13.8212 -13.8194 -13.4721 -13.4666 -5.9804 -5.9797 -4.2284 -4.2281 -2.9796 -2.9781 -2.3822 -2.3811 -2.1062 -2.0324 -1.2784 -1.1580 -0.8302 -0.8110 -0.0119 0.1389 0.2109 0.2112 0.9933 1.0126 1.0656 1.0778 1.8701 1.9137 2.0274 2.0390 2.6069 2.6091 2.7634 2.7643 3.0401 3.0408 3.1624 3.1664 3.5526 3.5592 3.7306 3.7358 8.0904 8.5156 9.9055 9.9989 10.6673 10.7045 11.9102 11.9193 12.0924 12.1495 k = 0.3168-0.4580-0.0000 ( 4064 PWs) bands (ev): -15.7720 -15.7718 -15.0617 -15.0534 -14.5018 -14.5005 -13.9479 -13.9455 -13.8230 -13.8212 -13.4675 -13.4620 -5.9565 -5.9557 -4.2535 -4.2534 -2.9886 -2.9867 -2.3647 -2.3635 -2.1391 -2.0650 -1.2999 -1.1812 -0.8468 -0.8283 0.0165 0.1643 0.2212 0.2228 1.0149 1.0376 1.0824 1.0928 1.8937 1.9385 2.0448 2.0565 2.6182 2.6206 2.7488 2.7505 3.0267 3.0271 3.1586 3.1646 3.5458 3.5517 3.7072 3.7129 8.0829 8.5300 9.8957 9.9971 10.6609 10.7183 11.8872 11.8943 12.0865 12.1402 k = 0.3091-0.4468-0.0000 ( 4064 PWs) bands (ev): -15.7942 -15.7940 -15.0571 -15.0486 -14.4875 -14.4862 -13.9425 -13.9401 -13.8246 -13.8228 -13.4627 -13.4571 -5.9320 -5.9311 -4.2780 -4.2779 -2.9980 -2.9957 -2.3483 -2.3469 -2.1711 -2.0968 -1.3206 -1.2037 -0.8621 -0.8442 0.0437 0.1876 0.2298 0.2333 1.0362 1.0628 1.1016 1.1096 1.9168 1.9625 2.0623 2.0742 2.6284 2.6312 2.7342 2.7367 3.0136 3.0137 3.1536 3.1616 3.5395 3.5446 3.6833 3.6894 8.0744 8.5428 9.8845 9.9936 10.6568 10.7361 11.8648 11.8703 12.0818 12.1306 k = 0.3013-0.4356-0.0000 ( 4058 PWs) bands (ev): -15.8164 -15.8162 -15.0525 -15.0438 -14.4737 -14.4724 -13.9369 -13.9346 -13.8258 -13.8240 -13.4577 -13.4521 -5.9068 -5.9059 -4.3018 -4.3017 -3.0078 -3.0051 -2.3332 -2.3315 -2.2021 -2.1278 -1.3405 -1.2253 -0.8760 -0.8586 0.0697 0.2076 0.2366 0.2439 1.0565 1.0872 1.1234 1.1290 1.9396 1.9856 2.0799 2.0919 2.6371 2.6405 2.7196 2.7231 3.0008 3.0011 3.1477 3.1572 3.5336 3.5380 3.6588 3.6654 8.0653 8.5540 9.8721 9.9885 10.6550 10.7575 11.8431 11.8472 12.0782 12.1206 k = 0.2936-0.4245-0.0000 ( 4060 PWs) bands (ev): -15.8386 -15.8383 -15.0480 -15.0391 -14.4603 -14.4590 -13.9312 -13.9290 -13.8267 -13.8248 -13.4525 -13.4470 -5.8812 -5.8802 -4.3249 -4.3248 -3.0181 -3.0149 -2.3196 -2.3174 -2.2318 -2.1578 -1.3593 -1.2458 -0.8880 -0.8712 0.0943 0.2220 0.2420 0.2569 1.0754 1.1094 1.1481 1.1519 1.9618 2.0077 2.0976 2.1094 2.6431 2.6477 2.7059 2.7107 2.9886 2.9893 3.1406 3.1513 3.5282 3.5319 3.6338 3.6410 8.0555 8.5635 9.8586 9.9821 10.6550 10.7820 11.8220 11.8248 12.0758 12.1103 k = 0.2859-0.4133-0.0000 ( 4064 PWs) bands (ev): -15.8606 -15.8604 -15.0435 -15.0344 -14.4474 -14.4461 -13.9253 -13.9233 -13.8271 -13.8253 -13.4471 -13.4416 -5.8550 -5.8540 -4.3472 -4.3470 -3.0290 -3.0252 -2.3085 -2.3049 -2.2596 -2.1868 -1.3769 -1.2652 -0.8981 -0.8817 0.1172 0.2298 0.2463 0.2734 1.0930 1.1291 1.1751 1.1783 1.9834 2.0286 2.1150 2.1266 2.6451 2.6513 2.6941 2.7008 2.9776 2.9787 3.1326 3.1442 3.5232 3.5262 3.6086 3.6163 8.0454 8.5713 9.8443 9.9746 10.6565 10.8090 11.8013 11.8032 12.0748 12.0999 k = 0.2782-0.4021-0.0000 ( 4064 PWs) bands (ev): -15.8826 -15.8824 -15.0391 -15.0299 -14.4352 -14.4338 -13.9193 -13.9175 -13.8272 -13.8253 -13.4416 -13.4361 -5.8284 -5.8273 -4.3688 -4.3684 -3.0403 -3.0360 -2.3048 -2.2940 -2.2804 -2.2147 -1.3932 -1.2832 -0.9060 -0.8900 0.1378 0.2329 0.2499 0.2915 1.1095 1.1469 1.2039 1.2074 2.0044 2.0482 2.1321 2.1434 2.6413 2.6488 2.6869 2.6948 2.9679 2.9694 3.1236 3.1356 3.5186 3.5209 3.5831 3.5916 8.0349 8.5775 9.8295 9.9663 10.6591 10.8379 11.7811 11.7822 12.0752 12.0895 k = 0.2704-0.3909-0.0000 ( 4056 PWs) bands (ev): -15.9044 -15.9042 -15.0348 -15.0254 -14.4235 -14.4221 -13.9132 -13.9115 -13.8267 -13.8249 -13.4359 -13.4305 -5.8014 -5.8003 -4.3894 -4.3890 -3.0521 -3.0473 -2.3218 -2.2852 -2.2811 -2.2414 -1.4080 -1.2997 -0.9113 -0.8959 0.1556 0.2331 0.2535 0.3095 1.1252 1.1636 1.2340 1.2379 2.0245 2.0663 2.1488 2.1597 2.6322 2.6396 2.6845 2.6924 2.9599 2.9618 3.1137 3.1259 3.5143 3.5158 3.5576 3.5669 8.0244 8.5821 9.8145 9.9574 10.6623 10.8678 11.7612 11.7616 12.0773 12.0793 k = 0.2627-0.3798-0.0000 ( 4064 PWs) bands (ev): -15.9260 -15.9258 -15.0305 -15.0211 -14.4126 -14.4111 -13.9070 -13.9055 -13.8258 -13.8239 -13.4301 -13.4248 -5.7741 -5.7729 -4.4092 -4.4087 -3.0645 -3.0592 -2.3458 -2.2799 -2.2757 -2.2655 -1.4213 -1.3147 -0.9141 -0.8991 0.1698 0.2312 0.2583 0.3268 1.1403 1.1795 1.2646 1.2691 2.0438 2.0829 2.1649 2.1753 2.6198 2.6265 2.6840 2.6912 2.9538 2.9562 3.1031 3.1150 3.5102 3.5105 3.5323 3.5429 8.0141 8.5852 9.7994 9.9483 10.6657 10.8981 11.7414 11.7414 12.0696 12.0810 k = 0.2550-0.3686-0.0000 ( 4060 PWs) bands (ev): -15.9474 -15.9472 -15.0264 -15.0169 -14.4023 -14.4008 -13.9007 -13.8993 -13.8243 -13.8225 -13.4241 -13.4189 -5.7466 -5.7453 -4.4281 -4.4274 -3.0775 -3.0716 -2.3698 -2.2944 -2.2712 -2.2708 -1.4329 -1.3279 -0.9140 -0.8994 0.1794 0.2276 0.2650 0.3429 1.1548 1.1950 1.2955 1.3003 2.0621 2.0975 2.1803 2.1901 2.6060 2.6120 2.6831 2.6897 2.9497 2.9525 3.0917 3.1031 3.5026 3.5035 3.5099 3.5219 8.0040 8.5869 9.7847 9.9392 10.6688 10.9279 11.7215 11.7217 12.0605 12.0863 k = 0.2473-0.3574-0.0000 ( 4064 PWs) bands (ev): -15.9685 -15.9684 -15.0225 -15.0129 -14.3927 -14.3912 -13.8943 -13.8931 -13.8223 -13.8205 -13.4181 -13.4129 -5.7188 -5.7175 -4.4460 -4.4452 -3.0909 -3.0846 -2.3929 -2.3176 -2.2686 -2.2686 -1.4427 -1.3394 -0.9109 -0.8968 0.1842 0.2226 0.2740 0.3577 1.1690 1.2101 1.3261 1.3312 2.0792 2.1102 2.1948 2.2039 2.5920 2.5970 2.6809 2.6869 2.9477 2.9508 3.0798 3.0902 3.4809 3.4859 3.5041 3.5103 7.9945 8.5874 9.7705 9.9303 10.6713 10.9565 11.7017 11.7021 12.0524 12.0934 k = 0.2395-0.3463-0.0000 ( 4060 PWs) bands (ev): -15.9894 -15.9892 -15.0186 -15.0091 -14.3839 -14.3824 -13.8878 -13.8868 -13.8197 -13.8179 -13.4119 -13.4069 -5.6909 -5.6895 -4.4629 -4.4621 -3.1048 -3.0981 -2.4150 -2.3403 -2.2682 -2.2681 -1.4506 -1.3491 -0.9048 -0.8912 0.1849 0.2165 0.2849 0.3711 1.1828 1.2248 1.3561 1.3613 2.0950 2.1204 2.2083 2.2166 2.5785 2.5822 2.6773 2.6826 2.9475 2.9510 3.0674 3.0766 3.4566 3.4637 3.5006 3.5048 7.9856 8.5867 9.7569 9.9218 10.6727 10.9831 11.6819 11.6824 12.0456 12.1021 k = 0.2318-0.3351-0.0000 ( 4066 PWs) bands (ev): -16.0099 -16.0097 -15.0150 -15.0054 -14.3759 -14.3744 -13.8813 -13.8804 -13.8166 -13.8148 -13.4057 -13.4008 -5.6629 -5.6615 -4.4789 -4.4779 -3.1191 -3.1121 -2.4361 -2.3621 -2.2699 -2.2698 -1.4566 -1.3568 -0.8956 -0.8825 0.1824 0.2095 0.2967 0.3831 1.1962 1.2392 1.3851 1.3904 2.1091 2.1282 2.2207 2.2282 2.5661 2.5678 2.6723 2.6769 2.9489 2.9528 3.0547 3.0624 3.4329 3.4408 3.4975 3.5008 7.9775 8.5850 9.7443 9.9139 10.6729 11.0069 11.6621 11.6626 12.0405 12.1123 k = 0.2241-0.3239-0.0000 ( 4066 PWs) bands (ev): -16.0300 -16.0299 -15.0114 -15.0019 -14.3687 -14.3671 -13.8747 -13.8740 -13.8129 -13.8112 -13.3994 -13.3947 -5.6349 -5.6335 -4.4937 -4.4926 -3.1338 -3.1266 -2.4561 -2.3830 -2.2739 -2.2737 -1.4607 -1.3626 -0.8832 -0.8706 0.1777 0.2016 0.3087 0.3936 1.2094 1.2531 1.4129 1.4182 2.1213 2.1330 2.2318 2.2384 2.5542 2.5551 2.6663 2.6699 2.9514 2.9558 3.0417 3.0476 3.4100 3.4183 3.4944 3.4972 7.9705 8.5824 9.7328 9.9067 10.6716 11.0273 11.6422 11.6426 12.0373 12.1239 k = 0.2163-0.3128-0.0000 ( 4068 PWs) bands (ev): -16.0498 -16.0497 -15.0081 -14.9986 -14.3622 -14.3606 -13.8681 -13.8675 -13.8086 -13.8070 -13.3930 -13.3885 -5.6071 -5.6056 -4.5075 -4.5063 -3.1489 -3.1414 -2.4750 -2.4031 -2.2801 -2.2799 -1.4627 -1.3664 -0.8678 -0.8557 0.1714 0.1931 0.3202 0.4025 1.2223 1.2667 1.4392 1.4444 2.1315 2.1349 2.2416 2.2474 2.5417 2.5459 2.6596 2.6620 2.9545 2.9597 3.0287 3.0326 3.3881 3.3965 3.4913 3.4938 7.9645 8.5791 9.7225 9.9004 10.6687 11.0436 11.6221 11.6225 12.0364 12.1366 k = 0.2086-0.3016-0.0000 ( 4068 PWs) bands (ev): -16.0692 -16.0691 -15.0049 -14.9954 -14.3564 -14.3548 -13.8614 -13.8610 -13.8039 -13.8023 -13.3867 -13.3823 -5.5794 -5.5779 -4.5201 -4.5188 -3.1642 -3.1566 -2.4930 -2.4224 -2.2885 -2.2882 -1.4628 -1.3683 -0.8493 -0.8378 0.1640 0.1841 0.3309 0.4099 1.2348 1.2798 1.4638 1.4687 2.1337 2.1392 2.2499 2.2549 2.5306 2.5389 2.6524 2.6534 2.9576 2.9641 3.0161 3.0174 3.3675 3.3759 3.4883 3.4905 7.9598 8.5752 9.7135 9.8950 10.6642 11.0555 11.6018 11.6022 12.0379 12.1503 k = 0.2009-0.2904-0.0000 ( 4070 PWs) bands (ev): -16.0881 -16.0880 -15.0018 -14.9925 -14.3514 -14.3498 -13.8548 -13.8546 -13.7987 -13.7971 -13.3803 -13.3761 -5.5520 -5.5504 -4.5316 -4.5302 -3.1797 -3.1720 -2.5101 -2.4409 -2.2988 -2.2985 -1.4609 -1.3683 -0.8281 -0.8172 0.1559 0.1747 0.3407 0.4158 1.2470 1.2923 1.4864 1.4911 2.1293 2.1442 2.2568 2.2609 2.5211 2.5340 2.6444 2.6451 2.9599 2.9684 3.0023 3.0044 3.3484 3.3565 3.4852 3.4872 7.9565 8.5709 9.7060 9.8907 10.6582 11.0626 11.5813 11.5817 12.0418 12.1646 k = 0.1932-0.2792-0.0000 ( 4072 PWs) bands (ev): -16.1065 -16.1064 -14.9990 -14.9898 -14.3471 -14.3455 -13.8482 -13.8481 -13.7930 -13.7915 -13.3740 -13.3699 -5.5251 -5.5234 -4.5418 -4.5403 -3.1953 -3.1876 -2.5263 -2.4587 -2.3111 -2.3107 -1.4571 -1.3663 -0.8042 -0.7938 0.1473 0.1651 0.3495 0.4202 1.2587 1.3042 1.5070 1.5112 2.1220 2.1462 2.2623 2.2656 2.5135 2.5313 2.6352 2.6378 2.9598 2.9719 2.9880 2.9951 3.3309 3.3387 3.4821 3.4837 7.9546 8.5661 9.6999 9.8876 10.6507 11.0648 11.5606 11.5610 12.0481 12.1794 k = 0.1854-0.2681-0.0000 ( 4070 PWs) bands (ev): -16.1245 -16.1244 -14.9963 -14.9872 -14.3435 -14.3419 -13.8416 -13.8416 -13.7869 -13.7855 -13.3677 -13.3638 -5.4986 -5.4969 -4.5508 -4.5492 -3.2109 -3.2032 -2.5416 -2.4758 -2.3252 -2.3247 -1.4514 -1.3626 -0.7778 -0.7680 0.1384 0.1553 0.3571 0.4232 1.2699 1.3153 1.5253 1.5290 2.1122 2.1453 2.2664 2.2690 2.5079 2.5304 2.6259 2.6306 2.9553 2.9680 2.9810 2.9899 3.3152 3.3225 3.4788 3.4802 7.9543 8.5611 9.6955 9.8857 10.6418 11.0621 11.5396 11.5401 12.0567 12.1943 k = 0.1777-0.2569-0.0000 ( 4068 PWs) bands (ev): -16.1419 -16.1418 -14.9937 -14.9849 -14.3405 -14.3389 -13.8352 -13.8350 -13.7805 -13.7791 -13.3615 -13.3578 -5.4727 -5.4710 -4.5584 -4.5567 -3.2265 -3.2189 -2.5562 -2.4923 -2.3407 -2.3402 -1.4439 -1.3571 -0.7492 -0.7400 0.1294 0.1456 0.3636 0.4249 1.2806 1.3254 1.5412 1.5445 2.1003 2.1414 2.2693 2.2712 2.5043 2.5310 2.6165 2.6235 2.9467 2.9548 2.9831 2.9887 3.3014 3.3080 3.4754 3.4765 7.9555 8.5558 9.6928 9.8851 10.6319 11.0547 11.5183 11.5189 12.0673 12.2092 k = 0.1700-0.2457-0.0000 ( 4062 PWs) bands (ev): -16.1587 -16.1587 -14.9914 -14.9827 -14.3381 -14.3365 -13.8288 -13.8286 -13.7738 -13.7725 -13.3553 -13.3518 -5.4476 -5.4459 -4.5647 -4.5630 -3.2419 -3.2345 -2.5701 -2.5082 -2.3577 -2.3570 -1.4347 -1.3499 -0.7187 -0.7101 0.1203 0.1359 0.3689 0.4254 1.2905 1.3345 1.5548 1.5575 2.0867 2.1348 2.2710 2.2724 2.5023 2.5328 2.6072 2.6165 2.9358 2.9408 2.9861 2.9895 3.2895 3.2954 3.4719 3.4727 7.9583 8.5503 9.6917 9.8859 10.6210 11.0429 11.4967 11.4975 12.0795 12.2237 k = 0.1623-0.2346-0.0000 ( 4060 PWs) bands (ev): -16.1750 -16.1750 -14.9892 -14.9808 -14.3362 -14.3346 -13.8226 -13.8222 -13.7669 -13.7656 -13.3493 -13.3459 -5.4233 -5.4216 -4.5696 -4.5678 -3.2571 -3.2499 -2.5833 -2.5235 -2.3758 -2.3750 -1.4238 -1.3412 -0.6865 -0.6785 0.1115 0.1266 0.3733 0.4247 1.2995 1.3422 1.5661 1.5682 2.0721 2.1257 2.2718 2.2728 2.5018 2.5352 2.5977 2.6094 2.9244 2.9271 2.9888 2.9911 3.2795 3.2847 3.4683 3.4688 7.9627 8.5447 9.6924 9.8881 10.6095 11.0272 11.4748 11.4758 12.0930 12.2377 k = 0.1545-0.2234-0.0000 ( 4058 PWs) bands (ev): -16.1907 -16.1906 -14.9872 -14.9790 -14.3347 -14.3332 -13.8164 -13.8160 -13.7598 -13.7586 -13.3433 -13.3402 -5.4001 -5.3983 -4.5731 -4.5712 -3.2721 -3.2650 -2.5959 -2.5383 -2.3949 -2.3940 -1.4115 -1.3311 -0.6530 -0.6456 0.1030 0.1176 0.3766 0.4229 1.3074 1.3483 1.5751 1.5766 2.0570 2.1146 2.2719 2.2726 2.5023 2.5378 2.5881 2.6021 2.9130 2.9141 2.9911 2.9928 3.2713 3.2757 3.4645 3.4647 7.9688 8.5390 9.6949 9.8918 10.5976 11.0080 11.4524 11.4537 12.1074 12.2510 k = 0.1468-0.2122-0.0000 ( 4050 PWs) bands (ev): -16.2058 -16.2057 -14.9853 -14.9774 -14.3337 -14.3322 -13.8103 -13.8098 -13.7526 -13.7514 -13.3376 -13.3346 -5.3779 -5.3761 -4.5751 -4.5732 -3.2867 -3.2798 -2.6079 -2.5525 -2.4147 -2.4138 -1.3978 -1.3198 -0.6185 -0.6117 0.0950 0.1091 0.3789 0.4203 1.3142 1.3526 1.5818 1.5829 2.0418 2.1020 2.2714 2.2720 2.5032 2.5400 2.5784 2.5945 2.9020 2.9021 2.9931 2.9945 3.2648 3.2684 3.4604 3.4606 7.9765 8.5331 9.6992 9.8969 10.5857 10.9859 11.4297 11.4312 12.1223 12.2634 k = 0.1391-0.2011-0.0000 ( 4052 PWs) bands (ev): -16.2202 -16.2202 -14.9836 -14.9760 -14.3331 -14.3316 -13.8044 -13.8039 -13.7453 -13.7443 -13.3320 -13.3292 -5.3569 -5.3551 -4.5757 -4.5738 -3.3008 -3.2942 -2.6192 -2.5663 -2.4352 -2.4341 -1.3828 -1.3074 -0.5833 -0.5772 0.0875 0.1012 0.3804 0.4168 1.3194 1.3548 1.5866 1.5874 2.0270 2.0884 2.2706 2.2713 2.5041 2.5412 2.5689 2.5866 2.8909 2.8921 2.9950 2.9963 3.2597 3.2627 3.4561 3.4566 7.9857 8.5270 9.7053 9.9035 10.5740 10.9613 11.4064 11.4082 12.1375 12.2749 k = 0.1314-0.1899-0.0000 ( 4048 PWs) bands (ev): -16.2340 -16.2339 -14.9820 -14.9747 -14.3328 -14.3314 -13.7987 -13.7981 -13.7381 -13.7371 -13.3265 -13.3239 -5.3372 -5.3355 -4.5749 -4.5729 -3.3145 -3.3082 -2.6300 -2.5795 -2.4560 -2.4548 -1.3668 -1.2941 -0.5478 -0.5424 0.0809 0.0942 0.3812 0.4128 1.3230 1.3546 1.5894 1.5903 2.0129 2.0742 2.2697 2.2705 2.5044 2.5398 2.5607 2.5784 2.8810 2.8830 2.9967 2.9982 3.2558 3.2583 3.4516 3.4524 7.9964 8.5207 9.7132 9.9115 10.5628 10.9348 11.3826 11.3847 12.1526 12.2854 k = 0.1236-0.1787-0.0000 ( 4050 PWs) bands (ev): -16.2470 -16.2470 -14.9805 -14.9736 -14.3328 -14.3314 -13.7931 -13.7925 -13.7309 -13.7300 -13.3213 -13.3189 -5.3189 -5.3172 -4.5727 -4.5707 -3.3276 -3.3216 -2.6402 -2.5923 -2.4769 -2.4756 -1.3500 -1.2801 -0.5125 -0.5077 0.0752 0.0881 0.3812 0.4082 1.3248 1.3520 1.5907 1.5918 1.9999 2.0600 2.2687 2.2699 2.5036 2.5340 2.5555 2.5700 2.8724 2.8751 2.9986 3.0001 3.2530 3.2550 3.4471 3.4482 8.0086 8.5142 9.7229 9.9209 10.5525 10.9067 11.3583 11.3606 12.1674 12.2948 k = 0.1159-0.1675-0.0000 ( 4050 PWs) bands (ev): -16.2594 -16.2594 -14.9792 -14.9726 -14.3331 -14.3317 -13.7878 -13.7871 -13.7239 -13.7231 -13.3163 -13.3140 -5.3019 -5.3003 -4.5691 -4.5672 -3.3401 -3.3345 -2.6499 -2.6046 -2.4978 -2.4965 -1.3324 -1.2656 -0.4777 -0.4736 0.0707 0.0832 0.3807 0.4033 1.3246 1.3469 1.5905 1.5922 1.9883 2.0462 2.2680 2.2696 2.5012 2.5241 2.5526 2.5617 2.8651 2.8685 3.0005 3.0023 3.2510 3.2526 3.4426 3.4439 8.0222 8.5072 9.7343 9.9316 10.5432 10.8777 11.3333 11.3359 12.1818 12.3031 k = 0.1082-0.1564-0.0000 ( 4044 PWs) bands (ev): -16.2711 -16.2711 -14.9780 -14.9717 -14.3335 -14.3322 -13.7827 -13.7820 -13.7171 -13.7163 -13.3115 -13.3094 -5.2865 -5.2849 -4.5644 -4.5625 -3.3520 -3.3467 -2.6590 -2.6164 -2.5185 -2.5171 -1.3144 -1.2507 -0.4438 -0.4404 0.0674 0.0796 0.3798 0.3982 1.3223 1.3394 1.5891 1.5917 1.9781 2.0331 2.2675 2.2696 2.4968 2.5123 2.5501 2.5537 2.8593 2.8632 3.0025 3.0045 3.2497 3.2510 3.4380 3.4395 8.0371 8.4999 9.7474 9.9434 10.5352 10.8481 11.3078 11.3106 12.1957 12.3103 k = 0.1004-0.1452-0.0000 ( 4040 PWs) bands (ev): -16.2820 -16.2820 -14.9769 -14.9710 -14.3340 -14.3328 -13.7778 -13.7771 -13.7106 -13.7098 -13.3070 -13.3051 -5.2724 -5.2709 -4.5586 -4.5568 -3.3632 -3.3582 -2.6676 -2.6277 -2.5387 -2.5372 -1.2960 -1.2358 -0.4115 -0.4087 0.0657 0.0774 0.3784 0.3931 1.3180 1.3296 1.5867 1.5903 1.9697 2.0211 2.2673 2.2699 2.4903 2.4994 2.5462 2.5470 2.8550 2.8592 3.0047 3.0069 3.2489 3.2500 3.4335 3.4352 8.0532 8.4920 9.7621 9.9561 10.5287 10.8184 11.2816 11.2846 12.2089 12.3164 k = 0.0927-0.1340-0.0000 ( 4042 PWs) bands (ev): -16.2922 -16.2922 -14.9759 -14.9704 -14.3347 -14.3335 -13.7732 -13.7725 -13.7043 -13.7036 -13.3027 -13.3010 -5.2599 -5.2585 -4.5519 -4.5501 -3.3737 -3.3691 -2.6757 -2.6387 -2.5581 -2.5567 -1.2776 -1.2209 -0.3810 -0.3789 0.0657 0.0769 0.3767 0.3880 1.3117 1.3181 1.5834 1.5881 1.9631 2.0105 2.2675 2.2706 2.4817 2.4861 2.5392 2.5430 2.8520 2.8565 3.0070 3.0094 3.2486 3.2495 3.4290 3.4309 8.0703 8.4835 9.7783 9.9695 10.5240 10.7890 11.2550 11.2582 12.2214 12.3215 k = 0.0850-0.1229-0.0000 ( 4047 PWs) bands (ev): -16.3016 -16.3016 -14.9750 -14.9699 -14.3354 -14.3343 -13.7689 -13.7682 -13.6983 -13.6977 -13.2987 -13.2972 -5.2487 -5.2474 -4.5444 -4.5428 -3.3834 -3.3792 -2.6833 -2.6492 -2.5767 -2.5754 -1.2593 -1.2065 -0.3529 -0.3514 0.0674 0.0781 0.3749 0.3831 1.3036 1.3051 1.5794 1.5850 1.9582 2.0013 2.2680 2.2716 2.4715 2.4725 2.5325 2.5381 2.8504 2.8549 3.0093 3.0118 3.2484 3.2492 3.4247 3.4266 8.0885 8.4742 9.7958 9.9831 10.5211 10.7604 11.2280 11.2313 12.2331 12.3255 k = 0.0773-0.1117-0.0000 ( 4043 PWs) bands (ev): -16.3103 -16.3103 -14.9742 -14.9695 -14.3362 -14.3352 -13.7649 -13.7643 -13.6928 -13.6922 -13.2951 -13.2936 -5.2389 -5.2377 -4.5365 -4.5350 -3.3923 -3.3885 -2.6904 -2.6594 -2.5940 -2.5929 -1.2413 -1.1925 -0.3276 -0.3266 0.0711 0.0811 0.3729 0.3784 1.2912 1.2939 1.5749 1.5812 1.9551 1.9937 2.2690 2.2730 2.4590 2.4602 2.5260 2.5325 2.8498 2.8543 3.0116 3.0142 3.2486 3.2493 3.4205 3.4225 8.1074 8.4643 9.8146 9.9967 10.5201 10.7330 11.2009 11.2041 12.2441 12.3286 k = 0.0695-0.1005-0.0000 ( 4037 PWs) bands (ev): -16.3181 -16.3181 -14.9734 -14.9692 -14.3369 -14.3360 -13.7612 -13.7606 -13.6876 -13.6871 -13.2917 -13.2904 -5.2303 -5.2292 -4.5283 -4.5269 -3.4005 -3.3970 -2.6970 -2.6693 -2.6100 -2.6092 -1.2240 -1.1794 -0.3053 -0.3047 0.0766 0.0858 0.3709 0.3742 1.2770 1.2831 1.5700 1.5768 1.9536 1.9877 2.2704 2.2748 2.4457 2.4482 2.5196 2.5264 2.8501 2.8546 3.0138 3.0165 3.2488 3.2495 3.4166 3.4186 8.1271 8.4534 9.8343 10.0097 10.5210 10.7072 11.1737 11.1769 12.2544 12.3308 k = 0.0618-0.0894-0.0000 ( 4037 PWs) bands (ev): -16.3252 -16.3252 -14.9727 -14.9690 -14.3377 -14.3369 -13.7578 -13.7573 -13.6829 -13.6825 -13.2886 -13.2875 -5.2230 -5.2220 -4.5201 -4.5188 -3.4078 -3.4047 -2.7032 -2.6789 -2.6243 -2.6240 -1.2074 -1.1672 -0.2862 -0.2859 0.0837 0.0920 0.3689 0.3704 1.2628 1.2715 1.5648 1.5718 1.9534 1.9831 2.2722 2.2767 2.4329 2.4359 2.5133 2.5199 2.8511 2.8553 3.0160 3.0186 3.2492 3.2498 3.4129 3.4148 8.1474 8.4417 9.8549 10.0215 10.5238 10.6835 11.1470 11.1499 12.2639 12.3321 k = 0.0541-0.0782-0.0000 ( 4035 PWs) bands (ev): -16.3314 -16.3314 -14.9721 -14.9688 -14.3384 -14.3377 -13.7548 -13.7544 -13.6787 -13.6783 -13.2859 -13.2849 -5.2167 -5.2158 -4.5122 -4.5110 -3.4142 -3.4115 -2.7089 -2.6881 -2.6371 -2.6368 -1.1919 -1.1563 -0.2702 -0.2701 0.0921 0.0994 0.3670 0.3672 1.2492 1.2596 1.5596 1.5665 1.9544 1.9798 2.2744 2.2790 2.4207 2.4239 2.5072 2.5133 2.8526 2.8565 3.0180 3.0204 3.2496 3.2501 3.4096 3.4114 8.1681 8.4289 9.8761 10.0314 10.5283 10.6622 11.1210 11.1237 12.2728 12.3325 k = 0.0464-0.0670-0.0000 ( 4031 PWs) bands (ev): -16.3369 -16.3369 -14.9716 -14.9687 -14.3391 -14.3384 -13.7522 -13.7518 -13.6750 -13.6747 -13.2835 -13.2827 -5.2115 -5.2107 -4.5047 -4.5037 -3.4198 -3.4175 -2.7142 -2.6970 -2.6483 -2.6475 -1.1776 -1.1467 -0.2573 -0.2573 0.1012 0.1074 0.3646 0.3652 1.2367 1.2477 1.5546 1.5611 1.9562 1.9775 2.2768 2.2813 2.4093 2.4123 2.5014 2.5069 2.8544 2.8579 3.0198 3.0220 3.2501 3.2505 3.4066 3.4082 8.1891 8.4152 9.8975 10.0390 10.5344 10.6437 11.0963 11.0986 12.2809 12.3323 k = 0.0386-0.0558-0.0000 ( 4043 PWs) bands (ev): -16.3415 -16.3415 -14.9711 -14.9687 -14.3396 -14.3391 -13.7500 -13.7496 -13.6718 -13.6715 -13.2815 -13.2808 -5.2072 -5.2066 -4.4979 -4.4971 -3.4246 -3.4226 -2.7190 -2.7052 -2.6576 -2.6563 -1.1647 -1.1387 -0.2472 -0.2471 0.1103 0.1154 0.3625 0.3636 1.2256 1.2364 1.5500 1.5558 1.9586 1.9760 2.2795 2.2837 2.3989 2.4015 2.4963 2.5010 2.8563 2.8593 3.0213 3.0233 3.2505 3.2509 3.4040 3.4054 8.2102 8.4005 9.9190 10.0436 10.5416 10.6280 11.0734 11.0754 12.2884 12.3313 k = 0.0309-0.0447-0.0000 ( 4045 PWs) bands (ev): -16.3453 -16.3453 -14.9707 -14.9688 -14.3401 -14.3397 -13.7481 -13.7478 -13.6691 -13.6689 -13.2798 -13.2792 -5.2038 -5.2033 -4.4921 -4.4914 -3.4284 -3.4269 -2.7231 -2.7125 -2.6649 -2.6634 -1.1534 -1.1324 -0.2394 -0.2393 0.1190 0.1230 0.3609 0.3623 1.2163 1.2261 1.5460 1.5509 1.9613 1.9750 2.2823 2.2861 2.3898 2.3919 2.4918 2.4957 2.8581 2.8606 3.0226 3.0243 3.2509 3.2512 3.4018 3.4030 8.2313 8.3848 9.9402 10.0447 10.5495 10.6151 11.0532 11.0548 12.2953 12.3296 k = 0.0232-0.0335-0.0000 ( 4049 PWs) bands (ev): -16.3482 -16.3482 -14.9703 -14.9688 -14.3405 -14.3402 -13.7466 -13.7464 -13.6671 -13.6669 -13.2784 -13.2780 -5.2012 -5.2008 -4.4873 -4.4868 -3.4314 -3.4302 -2.7264 -2.7188 -2.6704 -2.6689 -1.1438 -1.1280 -0.2338 -0.2336 0.1265 0.1294 0.3599 0.3611 1.2092 1.2172 1.5429 1.5467 1.9640 1.9741 2.2850 2.2882 2.3823 2.3837 2.4883 2.4912 2.8598 2.8616 3.0237 3.0250 3.2513 3.2515 3.4002 3.4011 8.2523 8.3682 9.9606 10.0421 10.5579 10.6047 11.0363 11.0375 12.3016 12.3273 k = 0.0155-0.0223-0.0000 ( 4045 PWs) bands (ev): -16.3503 -16.3503 -14.9699 -14.9690 -14.3407 -14.3405 -13.7456 -13.7454 -13.6656 -13.6655 -13.2774 -13.2772 -5.1994 -5.1991 -4.4837 -4.4834 -3.4335 -3.4327 -2.7286 -2.7237 -2.6740 -2.6728 -1.1361 -1.1255 -0.2299 -0.2298 0.1324 0.1343 0.3593 0.3603 1.2044 1.2101 1.5407 1.5433 1.9666 1.9732 2.2875 2.2898 2.3766 2.3775 2.4858 2.4878 2.8611 2.8623 3.0246 3.0255 3.2515 3.2517 3.3990 3.3996 8.2730 8.3506 9.9799 10.0359 10.5661 10.5961 11.0236 11.0244 12.3073 12.3245 k = 0.0077-0.0112-0.0000 ( 4047 PWs) bands (ev): -16.3516 -16.3516 -14.9696 -14.9691 -14.3409 -14.3408 -13.7449 -13.7448 -13.6647 -13.6646 -13.2768 -13.2767 -5.1983 -5.1981 -4.4815 -4.4813 -3.4346 -3.4342 -2.7296 -2.7272 -2.6760 -2.6753 -1.1304 -1.1251 -0.2277 -0.2276 0.1362 0.1372 0.3591 0.3596 1.2021 1.2051 1.5396 1.5410 1.9689 1.9722 2.2895 2.2907 2.3730 2.3734 2.4844 2.4854 2.8621 2.8627 3.0252 3.0256 3.2517 3.2518 3.3984 3.3987 8.2933 8.3322 9.9976 10.0261 10.5740 10.5886 11.0157 11.0161 12.3124 12.3210 k = 0.0000 0.0000 0.0000 ( 4043 PWs) bands (ev): -16.3520 -16.3520 -14.9694 -14.9694 -14.3409 -14.3409 -13.7447 -13.7447 -13.6643 -13.6643 -13.2766 -13.2766 -5.1978 -5.1978 -4.4807 -4.4807 -3.4349 -3.4349 -2.7291 -2.7291 -2.6764 -2.6764 -1.1267 -1.1267 -0.2269 -0.2269 0.1378 0.1378 0.3592 0.3592 1.2024 1.2024 1.5397 1.5397 1.9707 1.9707 2.2906 2.2906 2.3719 2.3719 2.4843 2.4843 2.8626 2.8626 3.0255 3.0255 3.2518 3.2518 3.3983 3.3983 8.3131 8.3131 10.0132 10.0132 10.5814 10.5814 11.0131 11.0131 12.3170 12.3170 k = 0.0000 0.0000 0.0000 ( 4043 PWs) bands (ev): -16.3520 -16.3520 -14.9694 -14.9694 -14.3409 -14.3409 -13.7447 -13.7447 -13.6643 -13.6643 -13.2766 -13.2766 -5.1978 -5.1978 -4.4807 -4.4807 -3.4349 -3.4349 -2.7291 -2.7291 -2.6764 -2.6764 -1.1267 -1.1267 -0.2269 -0.2269 0.1378 0.1378 0.3592 0.3592 1.2024 1.2024 1.5397 1.5397 1.9707 1.9707 2.2906 2.2906 2.3719 2.3719 2.4843 2.4843 2.8626 2.8626 3.0255 3.0255 3.2518 3.2518 3.3983 3.3983 8.3131 8.3131 10.0132 10.0132 10.5814 10.5814 11.0131 11.0131 12.3170 12.3170 k = 0.0125-0.0047-0.0021 ( 4046 PWs) bands (ev): -16.3516 -16.3515 -14.9696 -14.9691 -14.3410 -14.3406 -13.7451 -13.7450 -13.6647 -13.6643 -13.2772 -13.2766 -5.1981 -5.1978 -4.4822 -4.4820 -3.4345 -3.4339 -2.7322 -2.7238 -2.6786 -2.6721 -1.1315 -1.1236 -0.2286 -0.2272 0.1273 0.1461 0.3554 0.3637 1.1983 1.2081 1.5304 1.5500 1.9653 1.9695 2.2888 2.2958 2.3724 2.3754 2.4845 2.4855 2.8619 2.8626 3.0254 3.0259 3.2516 3.2518 3.3982 3.3985 8.2955 8.3301 9.9987 10.0255 10.5721 10.5898 11.0073 11.0244 12.3103 12.3237 k = 0.0250-0.0094-0.0042 ( 4044 PWs) bands (ev): -16.3502 -16.3500 -14.9699 -14.9688 -14.3410 -14.3401 -13.7464 -13.7462 -13.6654 -13.6645 -13.2783 -13.2771 -5.1987 -5.1980 -4.4863 -4.4858 -3.4326 -3.4316 -2.7333 -2.7169 -2.6784 -2.6656 -1.1378 -1.1222 -0.2324 -0.2295 0.1150 0.1515 0.3527 0.3687 1.1960 1.2151 1.5223 1.5609 1.9541 1.9618 2.2912 2.3032 2.3762 2.3833 2.4860 2.4881 2.8606 2.8620 3.0255 3.0266 3.2512 3.2516 3.3982 3.3988 8.2773 8.3465 9.9821 10.0356 10.5626 10.5972 11.0073 11.0402 12.3037 12.3304 k = 0.0375-0.0141-0.0062 ( 4045 PWs) bands (ev): -16.3479 -16.3476 -14.9701 -14.9686 -14.3407 -14.3394 -13.7485 -13.7482 -13.6664 -13.6650 -13.2800 -13.2782 -5.1996 -5.1985 -4.4929 -4.4922 -3.4294 -3.4279 -2.7327 -2.7097 -2.6744 -2.6566 -1.1457 -1.1224 -0.2384 -0.2335 0.1017 0.1538 0.3513 0.3737 1.1953 1.2228 1.5161 1.5721 1.9381 1.9487 2.2972 2.3113 2.3828 2.3953 2.4891 2.4926 2.8587 2.8607 3.0259 3.0275 3.2506 3.2511 3.3984 3.3992 8.2586 8.3622 9.9636 10.0436 10.5535 10.6034 11.0134 11.0597 12.2973 12.3370 k = 0.0500-0.0188-0.0083 ( 4043 PWs) bands (ev): -16.3447 -16.3443 -14.9704 -14.9683 -14.3403 -14.3386 -13.7514 -13.7510 -13.6675 -13.6657 -13.2823 -13.2798 -5.2008 -5.1994 -4.5019 -4.5009 -3.4249 -3.4227 -2.7309 -2.7042 -2.6650 -2.6447 -1.1551 -1.1243 -0.2466 -0.2394 0.0880 0.1531 0.3514 0.3786 1.1958 1.2301 1.5122 1.5835 1.9187 1.9318 2.3054 2.3193 2.3914 2.4100 2.4942 2.5000 2.8562 2.8588 3.0266 3.0287 3.2496 3.2503 3.3987 3.3999 8.2395 8.3771 9.9432 10.0494 10.5453 10.6090 11.0253 11.0820 12.2911 12.3432 k = 0.0625-0.0236-0.0104 ( 4046 PWs) bands (ev): -16.3405 -16.3401 -14.9706 -14.9681 -14.3398 -14.3376 -13.7551 -13.7547 -13.6688 -13.6667 -13.2850 -13.2820 -5.2025 -5.2007 -4.5129 -4.5115 -3.4189 -3.4161 -2.7285 -2.7011 -2.6499 -2.6298 -1.1658 -1.1277 -0.2571 -0.2469 0.0746 0.1497 0.3528 0.3834 1.1968 1.2359 1.5113 1.5946 1.8968 1.9130 2.3146 2.3274 2.4013 2.4251 2.5020 2.5113 2.8532 2.8564 3.0276 3.0301 3.2484 3.2491 3.3993 3.4008 8.2202 8.3913 9.9211 10.0531 10.5384 10.6145 11.0424 11.1064 12.2852 12.3490 k = 0.0750-0.0283-0.0125 ( 4041 PWs) bands (ev): -16.3354 -16.3349 -14.9709 -14.9678 -14.3391 -14.3366 -13.7597 -13.7592 -13.6702 -13.6678 -13.2883 -13.2847 -5.2049 -5.2027 -4.5255 -4.5237 -3.4116 -3.4080 -2.7258 -2.6992 -2.6306 -2.6117 -1.1777 -1.1325 -0.2698 -0.2560 0.0620 0.1442 0.3555 0.3879 1.1978 1.2391 1.5139 1.6053 1.8736 1.8937 2.3237 2.3360 2.4112 2.4384 2.5133 2.5278 2.8500 2.8536 3.0289 3.0319 3.2467 3.2475 3.4002 3.4019 8.2007 8.4047 9.8976 10.0549 10.5331 10.6209 11.0637 11.1323 12.2794 12.3542 k = 0.0875-0.0330-0.0146 ( 4038 PWs) bands (ev): -16.3294 -16.3288 -14.9711 -14.9676 -14.3384 -14.3354 -13.7652 -13.7646 -13.6717 -13.6691 -13.2921 -13.2879 -5.2081 -5.2055 -4.5395 -4.5371 -3.4028 -3.3985 -2.7230 -2.6980 -2.6082 -2.5906 -1.1907 -1.1387 -0.2844 -0.2666 0.0506 0.1373 0.3589 0.3921 1.1980 1.2388 1.5201 1.6151 1.8503 1.8751 2.3322 2.3452 2.4202 2.4488 2.5282 2.5491 2.8466 2.8505 3.0305 3.0340 3.2446 3.2455 3.4015 3.4035 8.1812 8.4174 9.8731 10.0548 10.5295 10.6288 11.0884 11.1592 12.2737 12.3588 k = 0.1000-0.0377-0.0167 ( 4041 PWs) bands (ev): -16.3226 -16.3219 -14.9714 -14.9674 -14.3376 -14.3343 -13.7715 -13.7707 -13.6732 -13.6704 -13.2963 -13.2916 -5.2122 -5.2092 -4.5543 -4.5513 -3.3927 -3.3875 -2.7203 -2.6968 -2.5837 -2.5668 -1.2044 -1.1461 -0.3008 -0.2785 0.0405 0.1295 0.3628 0.3959 1.1966 1.2347 1.5292 1.6236 1.8280 1.8581 2.3403 2.3546 2.4280 2.4568 2.5465 2.5739 2.8436 2.8476 3.0324 3.0364 3.2421 3.2431 3.4031 3.4054 8.1618 8.4293 9.8476 10.0531 10.5278 10.6388 11.1158 11.1866 12.2681 12.3626 k = 0.1125-0.0424-0.0187 ( 4042 PWs) bands (ev): -16.3148 -16.3141 -14.9717 -14.9673 -14.3368 -14.3332 -13.7786 -13.7776 -13.6747 -13.6717 -13.3009 -13.2957 -5.2175 -5.2140 -4.5695 -4.5658 -3.3813 -3.3750 -2.7175 -2.6956 -2.5576 -2.5409 -1.2187 -1.1545 -0.3186 -0.2916 0.0319 0.1215 0.3669 0.3994 1.1926 1.2274 1.5399 1.6303 1.8077 1.8437 2.3480 2.3641 2.4345 2.4634 2.5673 2.6001 2.8415 2.8452 3.0346 3.0392 3.2392 3.2404 3.4051 3.4077 8.1426 8.4404 9.8217 10.0500 10.5280 10.6512 11.1450 11.2142 12.2625 12.3655 k = 0.1250-0.0471-0.0208 ( 4044 PWs) bands (ev): -16.3063 -16.3054 -14.9721 -14.9672 -14.3362 -14.3321 -13.7864 -13.7852 -13.6761 -13.6731 -13.3059 -13.3002 -5.2240 -5.2202 -4.5847 -4.5803 -3.3686 -3.3611 -2.7148 -2.6941 -2.5305 -2.5135 -1.2332 -1.1635 -0.3372 -0.3056 0.0247 0.1135 0.3710 0.4025 1.1852 1.2177 1.5504 1.6352 1.7904 1.8324 2.3555 2.3732 2.4401 2.4693 2.5893 2.6257 2.8408 2.8445 3.0371 3.0423 3.2359 3.2374 3.4076 3.4104 8.1240 8.4508 9.7956 10.0458 10.5303 10.6660 11.1755 11.2419 12.2567 12.3676 k = 0.1375-0.0518-0.0229 ( 4048 PWs) bands (ev): -16.2969 -16.2959 -14.9725 -14.9671 -14.3356 -14.3313 -13.7949 -13.7933 -13.6775 -13.6745 -13.3113 -13.3051 -5.2321 -5.2278 -4.5995 -4.5943 -3.3546 -3.3459 -2.7120 -2.6925 -2.5027 -2.4851 -1.2475 -1.1729 -0.3564 -0.3203 0.0188 0.1059 0.3747 0.4052 1.1734 1.2065 1.5583 1.6386 1.7770 1.8249 2.3628 2.3818 2.4452 2.4748 2.6109 2.6484 2.8422 2.8474 3.0398 3.0459 3.2325 3.2343 3.4106 3.4136 8.1059 8.4605 9.7695 10.0407 10.5344 10.6832 11.2068 11.2696 12.2508 12.3688 k = 0.1500-0.0565-0.0250 ( 4050 PWs) bands (ev): -16.2867 -16.2857 -14.9729 -14.9672 -14.3353 -14.3306 -13.8039 -13.8020 -13.6788 -13.6758 -13.3171 -13.3104 -5.2417 -5.2369 -4.6135 -4.6076 -3.3394 -3.3294 -2.7091 -2.6906 -2.4747 -2.4564 -1.2613 -1.1823 -0.3757 -0.3355 0.0142 0.0990 0.3779 0.4076 1.1574 1.1943 1.5620 1.6410 1.7681 1.8209 2.3697 2.3897 2.4500 2.4803 2.6302 2.6660 2.8466 2.8559 3.0427 3.0498 3.2291 3.2314 3.4140 3.4171 8.0887 8.4694 9.7438 10.0349 10.5405 10.7026 11.2386 11.2971 12.2446 12.3692 k = 0.1625-0.0613-0.0271 ( 4044 PWs) bands (ev): -16.2757 -16.2747 -14.9734 -14.9673 -14.3352 -14.3303 -13.8133 -13.8110 -13.6801 -13.6770 -13.3231 -13.3160 -5.2530 -5.2478 -4.6264 -4.6198 -3.3232 -3.3118 -2.7060 -2.6883 -2.4470 -2.4279 -1.2741 -1.1912 -0.3947 -0.3511 0.0105 0.0927 0.3805 0.4096 1.1380 1.1806 1.5610 1.6419 1.7642 1.8198 2.3763 2.3971 2.4547 2.4858 2.6454 2.6767 2.8555 2.8712 3.0459 3.0543 3.2260 3.2290 3.4178 3.4211 8.0724 8.4776 9.7188 10.0287 10.5483 10.7238 11.2705 11.3244 12.2381 12.3687 k = 0.1750-0.0660-0.0291 ( 4045 PWs) bands (ev): -16.2641 -16.2629 -14.9741 -14.9675 -14.3355 -14.3303 -13.8230 -13.8203 -13.6813 -13.6783 -13.3294 -13.3220 -5.2660 -5.2603 -4.6380 -4.6307 -3.3060 -3.2931 -2.7026 -2.6857 -2.4201 -2.4003 -1.2854 -1.1992 -0.4132 -0.3667 0.0077 0.0871 0.3822 0.4112 1.1160 1.1649 1.5565 1.6406 1.7651 1.8206 2.3827 2.4039 2.4592 2.4911 2.6551 2.6803 2.8702 2.8926 3.0492 3.0593 3.2234 3.2274 3.4221 3.4254 8.0572 8.4850 9.6946 10.0221 10.5578 10.7467 11.3024 11.3515 12.2312 12.3674 k = 0.1875-0.0707-0.0312 ( 4042 PWs) bands (ev): -16.2517 -16.2505 -14.9748 -14.9679 -14.3362 -14.3308 -13.8327 -13.8297 -13.6825 -13.6794 -13.3360 -13.3282 -5.2807 -5.2746 -4.6481 -4.6402 -3.2881 -3.2737 -2.6989 -2.6826 -2.3945 -2.3740 -1.2947 -1.2058 -0.4309 -0.3822 0.0055 0.0822 0.3830 0.4125 1.0923 1.1470 1.5501 1.6366 1.7697 1.8224 2.3887 2.4102 2.4633 2.4961 2.6591 2.6781 2.8907 2.9182 3.0528 3.0651 3.2217 3.2274 3.4268 3.4302 8.0433 8.4916 9.6714 10.0153 10.5687 10.7708 11.3341 11.3785 12.2239 12.3654 k = 0.2000-0.0754-0.0333 ( 4044 PWs) bands (ev): -16.2387 -16.2375 -14.9756 -14.9684 -14.3375 -14.3318 -13.8424 -13.8391 -13.6836 -13.6805 -13.3427 -13.3346 -5.2969 -5.2904 -4.6567 -4.6483 -3.2695 -3.2536 -2.6949 -2.6791 -2.3705 -2.3494 -1.3015 -1.2106 -0.4477 -0.3974 0.0038 0.0780 0.3828 0.4135 1.0674 1.1270 1.5430 1.6304 1.7761 1.8241 2.3946 2.4161 2.4669 2.5003 2.6579 2.6719 2.9157 2.9455 3.0567 3.0720 3.2211 3.2293 3.4320 3.4354 8.0309 8.4973 9.6494 10.0083 10.5808 10.7959 11.3653 11.4053 12.2161 12.3626 k = 0.2125-0.0801-0.0354 ( 4044 PWs) bands (ev): -16.2252 -16.2238 -14.9766 -14.9691 -14.3393 -14.3335 -13.8518 -13.8482 -13.6847 -13.6816 -13.3497 -13.3413 -5.3146 -5.3077 -4.6638 -4.6550 -3.2505 -3.2331 -2.6903 -2.6751 -2.3486 -2.3270 -1.3053 -1.2130 -0.4635 -0.4123 0.0025 0.0744 0.3815 0.4142 1.0417 1.1052 1.5361 1.6229 1.7824 1.8252 2.4004 2.4218 2.4697 2.5037 2.6529 2.6632 2.9433 2.9718 3.0613 3.0806 3.2222 3.2342 3.4376 3.4410 8.0199 8.5022 9.6288 10.0012 10.5940 10.8215 11.3960 11.4321 12.2079 12.3592 k = 0.2250-0.0848-0.0375 ( 4045 PWs) bands (ev): -16.2110 -16.2097 -14.9778 -14.9700 -14.3418 -14.3359 -13.8609 -13.8571 -13.6857 -13.6826 -13.3567 -13.3481 -5.3334 -5.3263 -4.6694 -4.6602 -3.2313 -3.2125 -2.6852 -2.6705 -2.3291 -2.3069 -1.3058 -1.2126 -0.4781 -0.4267 0.0013 0.0713 0.3792 0.4145 1.0158 1.0819 1.5298 1.6145 1.7873 1.8252 2.4063 2.4272 2.4715 2.5057 2.6450 2.6536 2.9707 2.9948 3.0671 3.0913 3.2255 3.2430 3.4438 3.4472 8.0106 8.5062 9.6096 9.9939 10.6081 10.8472 11.4261 11.4587 12.1994 12.3550 k = 0.2375-0.0895-0.0396 ( 4049 PWs) bands (ev): -16.1964 -16.1950 -14.9791 -14.9710 -14.3451 -14.3390 -13.8695 -13.8654 -13.6868 -13.6836 -13.3639 -13.3550 -5.3533 -5.3459 -4.6736 -4.6642 -3.2122 -3.1920 -2.6795 -2.6652 -2.3122 -2.2894 -1.3027 -1.2093 -0.4916 -0.4405 0.0003 0.0687 0.3758 0.4144 0.9898 1.0574 1.5242 1.6057 1.7895 1.8240 2.4122 2.4322 2.4721 2.5062 2.6352 2.6443 2.9947 3.0134 3.0756 3.1039 3.2316 3.2565 3.4506 3.4543 8.0031 8.5092 9.5921 9.9865 10.6227 10.8727 11.4555 11.4853 12.1905 12.3502 k = 0.2500-0.0942-0.0416 ( 4054 PWs) bands (ev): -16.1814 -16.1800 -14.9806 -14.9724 -14.3490 -14.3429 -13.8774 -13.8732 -13.6877 -13.6846 -13.3712 -13.3621 -5.3740 -5.3663 -4.6766 -4.6670 -3.1935 -3.1720 -2.6731 -2.6593 -2.2978 -2.2744 -1.2957 -1.2028 -0.5039 -0.4539 -0.0008 0.0664 0.3715 0.4139 0.9641 1.0322 1.5194 1.5967 1.7883 1.8215 2.4181 2.4361 2.4718 2.5050 2.6247 2.6358 3.0120 3.0273 3.0885 3.1170 3.2413 3.2751 3.4581 3.4624 7.9973 8.5110 9.5763 9.9789 10.6378 10.8977 11.4840 11.5117 12.1814 12.3446 k = 0.2625-0.0989-0.0437 ( 4055 PWs) bands (ev): -16.1660 -16.1645 -14.9824 -14.9739 -14.3538 -14.3476 -13.8846 -13.8802 -13.6887 -13.6855 -13.3785 -13.3693 -5.3951 -5.3872 -4.6785 -4.6689 -3.1754 -3.1529 -2.6660 -2.6527 -2.2860 -2.2619 -1.2849 -1.1930 -0.5151 -0.4666 -0.0020 0.0645 0.3663 0.4129 0.9388 1.0066 1.5151 1.5878 1.7832 1.8177 2.4238 2.4381 2.4710 2.5023 2.6149 2.6284 3.0227 3.0364 3.1051 3.1294 3.2554 3.2980 3.4665 3.4721 7.9935 8.5117 9.5624 9.9710 10.6532 10.9217 11.5117 11.5379 12.1722 12.3384 k = 0.2750-0.1037-0.0458 ( 4054 PWs) bands (ev): -16.1503 -16.1489 -14.9843 -14.9757 -14.3593 -14.3531 -13.8909 -13.8865 -13.6896 -13.6864 -13.3857 -13.3765 -5.4165 -5.4085 -4.6794 -4.6698 -3.1582 -3.1348 -2.6581 -2.6454 -2.2764 -2.2516 -1.2703 -1.1802 -0.5251 -0.4788 -0.0033 0.0627 0.3603 0.4114 0.9142 0.9810 1.5111 1.5789 1.7744 1.8124 2.4281 2.4378 2.4702 2.4992 2.6063 2.6223 3.0292 3.0416 3.1224 3.1403 3.2743 3.3236 3.4761 3.4842 7.9915 8.5111 9.5503 9.9627 10.6688 10.9443 11.5384 11.5637 12.1630 12.3314 k = 0.2875-0.1084-0.0479 ( 4054 PWs) bands (ev): -16.1345 -16.1330 -14.9865 -14.9778 -14.3655 -14.3594 -13.8963 -13.8919 -13.6904 -13.6872 -13.3930 -13.3837 -5.4378 -5.4299 -4.6796 -4.6700 -3.1422 -3.1182 -2.6496 -2.6376 -2.2686 -2.2432 -1.2522 -1.1644 -0.5341 -0.4904 -0.0047 0.0612 0.3537 0.4094 0.8906 0.9557 1.5072 1.5701 1.7622 1.8052 2.4271 2.4379 2.4689 2.4978 2.5993 2.6173 3.0331 3.0445 3.1375 3.1499 3.2972 3.3496 3.4872 3.4993 7.9915 8.5091 9.5404 9.9540 10.6843 10.9653 11.5643 11.5891 12.1539 12.3238 k = 0.3000-0.1131-0.0500 ( 4059 PWs) bands (ev): -16.1185 -16.1170 -14.9889 -14.9802 -14.3724 -14.3663 -13.9008 -13.8965 -13.6913 -13.6880 -13.4001 -13.3909 -5.4590 -5.4511 -4.6791 -4.6697 -3.1275 -3.1032 -2.6406 -2.6292 -2.2622 -2.2362 -1.2310 -1.1462 -0.5422 -0.5015 -0.0064 0.0597 0.3465 0.4068 0.8679 0.9310 1.5031 1.5613 1.7472 1.7962 2.4199 2.4382 2.4674 2.4996 2.5939 2.6136 3.0356 3.0460 3.1498 3.1585 3.3226 3.3737 3.5006 3.5183 7.9934 8.5056 9.5326 9.9448 10.6998 10.9843 11.5891 11.6138 12.1449 12.3154 k = 0.3125-0.1178-0.0520 ( 4063 PWs) bands (ev): -16.1026 -16.1011 -14.9915 -14.9829 -14.3799 -14.3738 -13.9044 -13.9001 -13.6921 -13.6888 -13.4072 -13.3980 -5.4798 -5.4719 -4.6781 -4.6689 -3.1143 -3.0900 -2.6311 -2.6205 -2.2566 -2.2301 -1.2070 -1.1259 -0.5493 -0.5120 -0.0080 0.0582 0.3389 0.4036 0.8464 0.9071 1.4984 1.5526 1.7301 1.7853 2.4100 2.4337 2.4686 2.5041 2.5898 2.6107 3.0371 3.0467 3.1595 3.1664 3.3481 3.3944 3.5169 3.5415 7.9973 8.5005 9.5270 9.9349 10.7151 11.0010 11.6128 11.6379 12.1363 12.3062 k = 0.3250-0.1225-0.0541 ( 4062 PWs) bands (ev): -16.0867 -16.0852 -14.9944 -14.9858 -14.3877 -14.3818 -13.9071 -13.9030 -13.6928 -13.6896 -13.4140 -13.4050 -5.4999 -5.4922 -4.6767 -4.6678 -3.1028 -3.0788 -2.6215 -2.6116 -2.2513 -2.2245 -1.1808 -1.1039 -0.5557 -0.5222 -0.0097 0.0568 0.3309 0.3998 0.8263 0.8841 1.4927 1.5436 1.7116 1.7729 2.3989 2.4248 2.4728 2.5098 2.5868 2.6086 3.0380 3.0470 3.1674 3.1736 3.3720 3.4114 3.5367 3.5685 8.0030 8.4937 9.5237 9.9244 10.7302 11.0151 11.6355 11.6611 12.1281 12.2964 k = 0.3375-0.1272-0.0562 ( 4060 PWs) bands (ev): -16.0711 -16.0696 -14.9974 -14.9890 -14.3959 -14.3901 -13.9090 -13.9050 -13.6935 -13.6903 -13.4207 -13.4119 -5.5193 -5.5118 -4.6749 -4.6664 -3.0930 -3.0695 -2.6120 -2.6028 -2.2458 -2.2190 -1.1528 -1.0808 -0.5614 -0.5319 -0.0112 0.0554 0.3228 0.3953 0.8075 0.8624 1.4858 1.5343 1.6925 1.7594 2.3874 2.4137 2.4785 2.5160 2.5848 2.6071 3.0384 3.0469 3.1741 3.1801 3.3927 3.4251 3.5601 3.5981 8.0107 8.4851 9.5228 9.9131 10.7451 11.0264 11.6571 11.6835 12.1204 12.2859 k = 0.3500-0.1319-0.0583 ( 4062 PWs) bands (ev): -16.0558 -16.0543 -15.0007 -14.9925 -14.4042 -14.3986 -13.9102 -13.9064 -13.6942 -13.6911 -13.4271 -13.4185 -5.5377 -5.5305 -4.6730 -4.6649 -3.0848 -3.0622 -2.6030 -2.5944 -2.2396 -2.2131 -1.1238 -1.0570 -0.5666 -0.5411 -0.0124 0.0541 0.3145 0.3901 0.7903 0.8419 1.4774 1.5241 1.6740 1.7451 2.3760 2.4018 2.4847 2.5219 2.5836 2.6061 3.0386 3.0466 3.1799 3.1858 3.4101 3.4362 3.5866 3.6288 8.0201 8.4748 9.5242 9.9010 10.7598 11.0349 11.6775 11.7050 12.1132 12.2747 k = 0.3625-0.1366-0.0604 ( 4064 PWs) bands (ev): -16.0409 -16.0395 -15.0041 -14.9962 -14.4124 -14.4071 -13.9107 -13.9071 -13.6948 -13.6918 -13.4332 -13.4250 -5.5550 -5.5482 -4.6709 -4.6633 -3.0781 -3.0566 -2.5946 -2.5866 -2.2325 -2.2067 -1.0941 -1.0330 -0.5716 -0.5499 -0.0132 0.0528 0.3063 0.3840 0.7747 0.8229 1.4674 1.5123 1.6572 1.7306 2.3652 2.3901 2.4908 2.5272 2.5833 2.6055 3.0387 3.0461 3.1852 3.1909 3.4244 3.4454 3.6152 3.6596 8.0313 8.4626 9.5280 9.8880 10.7744 11.0402 11.6969 11.7255 12.1067 12.2630 k = 0.3750-0.1414-0.0625 ( 4067 PWs) bands (ev): -16.0266 -16.0253 -15.0075 -15.0000 -14.4205 -14.4155 -13.9107 -13.9073 -13.6954 -13.6924 -13.4389 -13.4311 -5.5712 -5.5648 -4.6688 -4.6617 -3.0728 -3.0527 -2.5870 -2.5796 -2.2245 -2.1997 -1.0643 -1.0093 -0.5768 -0.5579 -0.0133 0.0518 0.2981 0.3772 0.7608 0.8054 1.4560 1.4986 1.6429 1.7163 2.3551 2.3788 2.4966 2.5316 2.5839 2.6052 3.0386 3.0456 3.1899 3.1953 3.4361 3.4532 3.6448 3.6895 8.0443 8.4487 9.5341 9.8741 10.7889 11.0426 11.7151 11.7448 12.1009 12.2506 k = 0.3875-0.1461-0.0645 ( 4066 PWs) bands (ev): -16.0131 -16.0119 -15.0110 -15.0039 -14.4283 -14.4236 -13.9103 -13.9072 -13.6959 -13.6931 -13.4442 -13.4369 -5.5861 -5.5801 -4.6667 -4.6601 -3.0688 -3.0502 -2.5804 -2.5736 -2.2154 -2.1920 -1.0350 -0.9862 -0.5823 -0.5652 -0.0126 0.0510 0.2902 0.3694 0.7486 0.7894 1.4435 1.4828 1.6318 1.7026 2.3460 2.3681 2.5020 2.5349 2.5853 2.6052 3.0385 3.0450 3.1941 3.1991 3.4459 3.4599 3.6742 3.7177 8.0588 8.4332 9.5425 9.8592 10.8034 11.0420 11.7322 11.7630 12.0959 12.2377 k = 0.4000-0.1508-0.0666 ( 4067 PWs) bands (ev): -16.0005 -15.9993 -15.0144 -15.0079 -14.4356 -14.4312 -13.9095 -13.9067 -13.6963 -13.6937 -13.4491 -13.4424 -5.5995 -5.5941 -4.6646 -4.6587 -3.0657 -3.0488 -2.5748 -2.5686 -2.2056 -2.1840 -1.0067 -0.9641 -0.5884 -0.5717 -0.0110 0.0505 0.2827 0.3608 0.7382 0.7749 1.4302 1.4653 1.6239 1.6898 2.3379 2.3583 2.5069 2.5370 2.5875 2.6055 3.0384 3.0443 3.1978 3.2024 3.4541 3.4657 3.7027 3.7437 8.0748 8.4160 9.5530 9.8433 10.8180 11.0386 11.7482 11.7799 12.0918 12.2244 k = 0.4125-0.1555-0.0687 ( 4063 PWs) bands (ev): -15.9889 -15.9878 -15.0176 -15.0118 -14.4422 -14.4383 -13.9085 -13.9060 -13.6967 -13.6943 -13.4535 -13.4474 -5.6116 -5.6067 -4.6626 -4.6573 -3.0635 -3.0485 -2.5702 -2.5646 -2.1953 -2.1758 -0.9799 -0.9433 -0.5950 -0.5775 -0.0084 0.0502 0.2760 0.3512 0.7295 0.7621 1.4166 1.4469 1.6188 1.6781 2.3310 2.3494 2.5112 2.5380 2.5902 2.6059 3.0384 3.0437 3.2011 3.2052 3.4611 3.4707 3.7295 3.7671 8.0922 8.3974 9.5654 9.8266 10.8327 11.0326 11.7633 11.7951 12.0889 12.2107 k = 0.4250-0.1602-0.0708 ( 4062 PWs) bands (ev): -15.9784 -15.9775 -15.0207 -15.0155 -14.4482 -14.4447 -13.9074 -13.9052 -13.6970 -13.6949 -13.4573 -13.4519 -5.6220 -5.6178 -4.6608 -4.6562 -3.0619 -3.0488 -2.5664 -2.5616 -2.1849 -2.1678 -0.9551 -0.9241 -0.6015 -0.5830 -0.0047 0.0499 0.2702 0.3409 0.7226 0.7508 1.4034 1.4286 1.6159 1.6675 2.3252 2.3414 2.5150 2.5381 2.5932 2.6065 3.0384 3.0430 3.2039 3.2075 3.4671 3.4749 3.7541 3.7875 8.1110 8.3775 9.5796 9.8089 10.8477 11.0243 11.7772 11.8083 12.0873 12.1968 k = 0.4375-0.1649-0.0729 ( 4061 PWs) bands (ev): -15.9693 -15.9685 -15.0234 -15.0189 -14.4533 -14.4503 -13.9062 -13.9044 -13.6972 -13.6954 -13.4605 -13.4559 -5.6309 -5.6273 -4.6591 -4.6552 -3.0608 -3.0497 -2.5634 -2.5593 -2.1750 -2.1605 -0.9329 -0.9070 -0.6074 -0.5885 0.0001 0.0493 0.2659 0.3299 0.7174 0.7411 1.3910 1.4114 1.6148 1.6581 2.3206 2.3344 2.5184 2.5377 2.5963 2.6071 3.0384 3.0423 3.2063 3.2093 3.4721 3.4784 3.7760 3.8047 8.1308 8.3566 9.5954 9.7904 10.8629 11.0139 11.7902 11.8194 12.0874 12.1827 k = 0.4500-0.1696-0.0749 ( 4059 PWs) bands (ev): -15.9616 -15.9609 -15.0256 -15.0220 -14.4576 -14.4551 -13.9052 -13.9036 -13.6974 -13.6959 -13.4631 -13.4593 -5.6382 -5.6353 -4.6576 -4.6545 -3.0599 -3.0509 -2.5611 -2.5578 -2.1659 -2.1541 -0.9134 -0.8924 -0.6123 -0.5942 0.0058 0.0481 0.2634 0.3186 0.7137 0.7328 1.3802 1.3959 1.6151 1.6498 2.3171 2.3283 2.5214 2.5367 2.5992 2.6076 3.0385 3.0417 3.2083 3.2108 3.4762 3.4812 3.7950 3.8185 8.1517 8.3347 9.6126 9.7713 10.8784 11.0017 11.8019 11.8279 12.0894 12.1687 k = 0.4625-0.1743-0.0770 ( 4056 PWs) bands (ev): -15.9555 -15.9550 -15.0274 -15.0246 -14.4608 -14.4590 -13.9042 -13.9030 -13.6975 -13.6963 -13.4650 -13.4622 -5.6438 -5.6416 -4.6564 -4.6540 -3.0590 -3.0523 -2.5593 -2.5568 -2.1581 -2.1491 -0.8972 -0.8809 -0.6157 -0.6000 0.0121 0.0460 0.2631 0.3072 0.7115 0.7259 1.3715 1.3830 1.6165 1.6425 2.3147 2.3233 2.5240 2.5354 2.6017 2.6079 3.0387 3.0411 3.2099 3.2118 3.4796 3.4832 3.8107 3.8287 8.1735 8.3121 9.6309 9.7515 10.8942 10.9882 11.8123 11.8336 12.0934 12.1548 k = 0.4750-0.1791-0.0791 ( 4055 PWs) bands (ev): -15.9510 -15.9506 -15.0285 -15.0267 -14.4631 -14.4619 -13.9034 -13.9026 -13.6975 -13.6967 -13.4663 -13.4644 -5.6477 -5.6462 -4.6553 -4.6537 -3.0582 -3.0537 -2.5580 -2.5563 -2.1518 -2.1457 -0.8844 -0.8732 -0.6173 -0.6056 0.0190 0.0426 0.2654 0.2961 0.7107 0.7204 1.3654 1.3729 1.6188 1.6361 2.3135 2.3193 2.5263 2.5339 2.6039 2.6079 3.0389 3.0406 3.2112 3.2124 3.4821 3.4845 3.8230 3.8351 8.1959 8.2890 9.6502 9.7313 10.9102 10.9736 11.8213 11.8363 12.0995 12.1415 k = 0.4875-0.1838-0.0812 ( 4057 PWs) bands (ev): -15.9482 -15.9481 -15.0291 -15.0281 -14.4644 -14.4638 -13.9028 -13.9024 -13.6974 -13.6970 -13.4669 -13.4659 -5.6499 -5.6491 -4.6545 -4.6537 -3.0573 -3.0550 -2.5570 -2.5562 -2.1473 -2.1442 -0.8754 -0.8696 -0.6168 -0.6106 0.0258 0.0380 0.2701 0.2859 0.7113 0.7161 1.3623 1.3660 1.6220 1.6306 2.3134 2.3163 2.5285 2.5323 2.6056 2.6076 3.0392 3.0401 3.2120 3.2126 3.4839 3.4851 3.8316 3.8377 8.2189 8.2656 9.6701 9.7108 10.9264 10.9583 11.8284 11.8363 12.1077 12.1290 k = 0.5000-0.1885-0.0833 ( 4056 PWs) bands (ev): -15.9473 -15.9473 -15.0289 -15.0289 -14.4646 -14.4646 -13.9025 -13.9025 -13.6972 -13.6972 -13.4667 -13.4667 -5.6504 -5.6504 -4.6540 -4.6540 -3.0562 -3.0562 -2.5564 -2.5564 -2.1447 -2.1447 -0.8704 -0.8704 -0.6145 -0.6145 0.0323 0.0323 0.2770 0.2770 0.7131 0.7131 1.3625 1.3625 1.6259 1.6259 2.3143 2.3143 2.5304 2.5304 2.6068 2.6068 3.0396 3.0396 3.2125 3.2125 3.4849 3.4849 3.8366 3.8366 8.2422 8.2422 9.6904 9.6904 10.9424 10.9424 11.8335 11.8335 12.1176 12.1176 k = 0.5000-0.1885 0.2632 ( 4068 PWs) bands (ev): -15.9015 -15.9015 -15.0071 -15.0071 -14.6714 -14.6714 -13.8749 -13.8749 -13.6485 -13.6485 -13.3898 -13.3898 -5.8806 -5.8806 -4.2413 -4.2413 -2.7579 -2.7579 -2.6955 -2.6955 -2.3804 -2.3804 -1.2170 -1.2170 -0.5672 -0.5672 0.1021 0.1021 0.2839 0.2839 0.5514 0.5514 1.2358 1.2358 2.0047 2.0047 2.2583 2.2583 2.4258 2.4258 2.7459 2.7459 3.1577 3.1577 3.2810 3.2810 3.4603 3.4603 3.6776 3.6776 8.3176 8.3176 9.7821 9.7821 11.1457 11.1457 11.7155 11.7155 11.9452 11.9452 k = 0.4886-0.1842 0.2572 ( 4064 PWs) bands (ev): -15.9023 -15.9021 -15.0087 -15.0076 -14.6699 -14.6686 -13.8753 -13.8749 -13.6487 -13.6484 -13.3900 -13.3897 -5.8800 -5.8792 -4.2425 -4.2419 -2.7629 -2.7570 -2.6990 -2.6919 -2.3804 -2.3765 -1.2192 -1.2153 -0.5719 -0.5623 0.0833 0.1092 0.2775 0.2989 0.5504 0.5556 1.2338 1.2399 2.0039 2.0060 2.2569 2.2607 2.4244 2.4261 2.7458 2.7478 3.1555 3.1584 3.2795 3.2804 3.4598 3.4606 3.6743 3.6800 8.3034 8.3306 9.7743 9.7889 11.1385 11.1509 11.7139 11.7167 11.9447 11.9476 k = 0.4773-0.1799 0.2512 ( 4060 PWs) bands (ev): -15.9046 -15.9041 -15.0121 -15.0102 -14.6643 -14.6618 -13.8760 -13.8752 -13.6490 -13.6485 -13.3901 -13.3895 -5.8775 -5.8757 -4.2452 -4.2440 -2.7715 -2.7607 -2.7016 -2.6888 -2.3763 -2.3688 -1.2221 -1.2141 -0.5765 -0.5572 0.0569 0.1028 0.2809 0.3188 0.5525 0.5630 1.2339 1.2460 2.0038 2.0079 2.2563 2.2639 2.4220 2.4255 2.7478 2.7516 3.1518 3.1576 3.2757 3.2775 3.4591 3.4607 3.6703 3.6814 8.2883 8.3425 9.7658 9.7950 11.1295 11.1542 11.7119 11.7175 11.9462 11.9518 k = 0.4659-0.1756 0.2453 ( 4058 PWs) bands (ev): -15.9083 -15.9076 -15.0172 -15.0145 -14.6547 -14.6511 -13.8770 -13.8758 -13.6494 -13.6487 -13.3902 -13.3893 -5.8730 -5.8703 -4.2495 -4.2479 -2.7830 -2.7686 -2.7032 -2.6866 -2.3685 -2.3581 -1.2256 -1.2134 -0.5808 -0.5520 0.0264 0.0858 0.2909 0.3404 0.5578 0.5733 1.2361 1.2543 2.0043 2.0103 2.2565 2.2678 2.4188 2.4240 2.7515 2.7570 3.1467 3.1553 3.2699 3.2724 3.4583 3.4605 3.6654 3.6819 8.2724 8.3531 9.7565 9.8001 11.1186 11.1557 11.7095 11.7176 11.9495 11.9578 k = 0.4545-0.1713 0.2393 ( 4056 PWs) bands (ev): -15.9134 -15.9124 -15.0236 -15.0201 -14.6417 -14.6372 -13.8783 -13.8767 -13.6500 -13.6490 -13.3903 -13.3890 -5.8665 -5.8630 -4.2554 -4.2533 -2.7970 -2.7800 -2.7040 -2.6852 -2.3575 -2.3448 -1.2299 -1.2131 -0.5846 -0.5463 -0.0061 0.0629 0.3029 0.3616 0.5662 0.5864 1.2405 1.2647 2.0056 2.0133 2.2574 2.2724 2.4148 2.4218 2.7569 2.7639 3.1403 3.1515 3.2620 3.2650 3.4573 3.4601 3.6599 3.6813 8.2557 8.3623 9.7465 9.8045 11.1058 11.1553 11.7068 11.7172 11.9547 11.9653 k = 0.4432-0.1671 0.2333 ( 4048 PWs) bands (ev): -15.9198 -15.9186 -15.0307 -15.0267 -14.6257 -14.6205 -13.8799 -13.8779 -13.6506 -13.6494 -13.3902 -13.3887 -5.8581 -5.8537 -4.2629 -4.2602 -2.8128 -2.7940 -2.7045 -2.6847 -2.3438 -2.3298 -1.2350 -1.2133 -0.5877 -0.5402 -0.0390 0.0370 0.3142 0.3811 0.5777 0.6017 1.2472 1.2772 2.0078 2.0169 2.2587 2.2775 2.4103 2.4192 2.7636 2.7717 3.1327 3.1465 3.2520 3.2556 3.4562 3.4594 3.6538 3.6798 8.2384 8.3701 9.7362 9.8083 11.0913 11.1530 11.7037 11.7161 11.9614 11.9742 k = 0.4318-0.1628 0.2273 ( 4047 PWs) bands (ev): -15.9275 -15.9261 -15.0382 -15.0339 -14.6072 -14.6014 -13.8819 -13.8795 -13.6514 -13.6500 -13.3901 -13.3883 -5.8478 -5.8426 -4.2717 -4.2687 -2.8301 -2.8099 -2.7051 -2.6848 -2.3284 -2.3135 -1.2411 -1.2141 -0.5900 -0.5333 -0.0715 0.0103 0.3235 0.3980 0.5917 0.6187 1.2562 1.2918 2.0108 2.0211 2.2604 2.2828 2.4055 2.4164 2.7712 2.7803 3.1241 3.1403 3.2402 3.2442 3.4549 3.4585 3.6471 3.6771 8.2207 8.3766 9.7256 9.8115 11.0751 11.1489 11.7002 11.7143 11.9697 11.9843 k = 0.4205-0.1585 0.2213 ( 4044 PWs) bands (ev): -15.9365 -15.9348 -15.0457 -15.0412 -14.5867 -14.5805 -13.8841 -13.8814 -13.6523 -13.6508 -13.3898 -13.3877 -5.8356 -5.8296 -4.2819 -4.2785 -2.8485 -2.8273 -2.7057 -2.6853 -2.3117 -2.2966 -1.2481 -1.2155 -0.5910 -0.5255 -0.1030 -0.0163 0.3305 0.4121 0.6076 0.6366 1.2678 1.3084 2.0146 2.0261 2.2622 2.2881 2.4008 2.4139 2.7794 2.7891 3.1147 3.1330 3.2267 3.2310 3.4535 3.4572 3.6401 3.6735 8.2026 8.3815 9.7149 9.8144 11.0573 11.1430 11.6963 11.7117 11.9792 11.9954 k = 0.4091-0.1542 0.2154 ( 4048 PWs) bands (ev): -15.9466 -15.9447 -15.0531 -15.0483 -14.5646 -14.5580 -13.8866 -13.8836 -13.6534 -13.6518 -13.3893 -13.3870 -5.8216 -5.8149 -4.2934 -4.2898 -2.8676 -2.8458 -2.7066 -2.6862 -2.2945 -2.2795 -1.2562 -1.2175 -0.5906 -0.5165 -0.1330 -0.0419 0.3355 0.4235 0.6246 0.6549 1.2818 1.3270 2.0193 2.0317 2.2638 2.2929 2.3964 2.4118 2.7876 2.7978 3.1046 3.1250 3.2117 3.2163 3.4517 3.4556 3.6326 3.6688 8.1843 8.3851 9.7042 9.8170 11.0381 11.1354 11.6919 11.7083 11.9898 12.0073 k = 0.3977-0.1499 0.2094 ( 4047 PWs) bands (ev): -15.9577 -15.9556 -15.0600 -15.0551 -14.5411 -14.5344 -13.8894 -13.8861 -13.6547 -13.6529 -13.3886 -13.3861 -5.8058 -5.7984 -4.3061 -4.3022 -2.8872 -2.8651 -2.7078 -2.6874 -2.2773 -2.2628 -1.2652 -1.2202 -0.5886 -0.5061 -0.1609 -0.0661 0.3386 0.4325 0.6416 0.6730 1.2982 1.3472 2.0247 2.0381 2.2649 2.2969 2.3929 2.4105 2.7954 2.8059 3.0941 3.1163 3.1954 3.2005 3.4496 3.4535 3.6249 3.6632 8.1660 8.3874 9.6939 9.8196 11.0175 11.1259 11.6868 11.7040 12.0013 12.0198 k = 0.3864-0.1456 0.2034 ( 4045 PWs) bands (ev): -15.9698 -15.9676 -15.0663 -15.0614 -14.5168 -14.5100 -13.8925 -13.8889 -13.6561 -13.6542 -13.3877 -13.3850 -5.7883 -5.7803 -4.3198 -4.3158 -2.9072 -2.8850 -2.7092 -2.6888 -2.2607 -2.2467 -1.2750 -1.2235 -0.5846 -0.4942 -0.1867 -0.0886 0.3402 0.4395 0.6580 0.6906 1.3169 1.3689 2.0306 2.0452 2.2654 2.2995 2.3908 2.4103 2.8021 2.8128 3.0835 3.1073 3.1782 3.1843 3.4468 3.4510 3.6170 3.6567 8.1478 8.3885 9.6841 9.8222 10.9958 11.1148 11.6808 11.6987 12.0135 12.0327 k = 0.3750-0.1414 0.1974 ( 4043 PWs) bands (ev): -15.9828 -15.9804 -15.0719 -15.0669 -14.4918 -14.4851 -13.8958 -13.8920 -13.6576 -13.6557 -13.3865 -13.3835 -5.7692 -5.7605 -4.3345 -4.3304 -2.9275 -2.9053 -2.7109 -2.6904 -2.2450 -2.2318 -1.2855 -1.2275 -0.5785 -0.4807 -0.2098 -0.1091 0.3406 0.4448 0.6732 0.7075 1.3376 1.3916 2.0366 2.0530 2.2651 2.3003 2.3906 2.4114 2.8073 2.8181 3.0730 3.0982 3.1605 3.1681 3.4433 3.4479 3.6089 3.6493 8.1299 8.3885 9.6749 9.8251 10.9731 11.1021 11.6740 11.6923 12.0264 12.0460 k = 0.3636-0.1371 0.1914 ( 4040 PWs) bands (ev): -15.9966 -15.9940 -15.0768 -15.0717 -14.4665 -14.4599 -13.8992 -13.8952 -13.6593 -13.6574 -13.3849 -13.3818 -5.7486 -5.7393 -4.3500 -4.3459 -2.9479 -2.9260 -2.7129 -2.6922 -2.2306 -2.2182 -1.2963 -1.2320 -0.5704 -0.4659 -0.2300 -0.1273 0.3400 0.4486 0.6871 0.7237 1.3600 1.4150 2.0425 2.0612 2.2638 2.2993 2.3927 2.4139 2.8103 2.8211 3.0628 3.0892 3.1430 3.1526 3.4388 3.4442 3.6009 3.6411 8.1125 8.3875 9.6666 9.8282 10.9495 11.0877 11.6661 11.6847 12.0396 12.0594 k = 0.3523-0.1328 0.1854 ( 4044 PWs) bands (ev): -16.0110 -16.0083 -15.0808 -15.0757 -14.4411 -14.4347 -13.9028 -13.8986 -13.6612 -13.6592 -13.3831 -13.3798 -5.7265 -5.7167 -4.3661 -4.3622 -2.9685 -2.9470 -2.7150 -2.6941 -2.2180 -2.2065 -1.3072 -1.2369 -0.5601 -0.4499 -0.2469 -0.1431 0.3386 0.4513 0.6995 0.7392 1.3838 1.4386 2.0477 2.0696 2.2615 2.2966 2.3969 2.4181 2.8105 2.8213 3.0531 3.0804 3.1264 3.1385 3.4329 3.4397 3.5928 3.6322 8.0957 8.3858 9.6592 9.8317 10.9252 11.0718 11.6570 11.6758 12.0531 12.0730 k = 0.3409-0.1285 0.1795 ( 4043 PWs) bands (ev): -16.0260 -16.0232 -15.0839 -15.0788 -14.4158 -14.4097 -13.9064 -13.9021 -13.6631 -13.6612 -13.3809 -13.3774 -5.7030 -5.6927 -4.3828 -4.3790 -2.9892 -2.9681 -2.7174 -2.6961 -2.2075 -2.1968 -1.3178 -1.2421 -0.5478 -0.4335 -0.2597 -0.1563 0.3367 0.4528 0.7106 0.7540 1.4084 1.4621 2.0520 2.0778 2.2583 2.2927 2.4031 2.4238 2.8077 2.8183 3.0440 3.0716 3.1119 3.1264 3.4255 3.4342 3.5850 3.6227 8.0798 8.3836 9.6529 9.8356 10.9004 11.0544 11.6466 11.6656 12.0669 12.0866 k = 0.3295-0.1242 0.1735 ( 4044 PWs) bands (ev): -16.0414 -16.0385 -15.0862 -15.0811 -14.3910 -14.3853 -13.9098 -13.9056 -13.6651 -13.6632 -13.3783 -13.3747 -5.6783 -5.6676 -4.3999 -4.3962 -3.0099 -2.9894 -2.7200 -2.6983 -2.1993 -2.1894 -1.3278 -1.2472 -0.5336 -0.4177 -0.2675 -0.1667 0.3344 0.4535 0.7208 0.7682 1.4334 1.4850 2.0548 2.0850 2.2544 2.2883 2.4108 2.4311 2.8017 2.8120 3.0353 3.0622 3.1004 3.1169 3.4165 3.4275 3.5773 3.6127 8.0648 8.3811 9.6479 9.8400 10.8753 11.0357 11.6348 11.6539 12.0808 12.1003 k = 0.3182-0.1199 0.1675 ( 4039 PWs) bands (ev): -16.0572 -16.0542 -15.0877 -15.0824 -14.3669 -14.3617 -13.9130 -13.9089 -13.6672 -13.6653 -13.3754 -13.3717 -5.6525 -5.6415 -4.4173 -4.4138 -3.0308 -3.0108 -2.7228 -2.7005 -2.1937 -2.1846 -1.3367 -1.2521 -0.5180 -0.4042 -0.2690 -0.1741 0.3320 0.4533 0.7302 0.7822 1.4584 1.5070 2.0558 2.0905 2.2501 2.2840 2.4199 2.4399 2.7925 2.8026 3.0270 3.0520 3.0929 3.1101 3.4057 3.4194 3.5700 3.6024 8.0511 8.3785 9.6442 9.8449 10.8500 11.0158 11.6217 11.6407 12.0946 12.1141 k = 0.3068-0.1157 0.1615 ( 4038 PWs) bands (ev): -16.0733 -16.0702 -15.0883 -15.0830 -14.3439 -14.3392 -13.9157 -13.9118 -13.6693 -13.6675 -13.3722 -13.3683 -5.6257 -5.6144 -4.4346 -4.4314 -3.0518 -3.0322 -2.7257 -2.7028 -2.1910 -2.1824 -1.3442 -1.2565 -0.5013 -0.3944 -0.2628 -0.1784 0.3294 0.4523 0.7393 0.7960 1.4828 1.5275 2.0544 2.0935 2.2460 2.2800 2.4302 2.4501 2.7808 2.7905 3.0191 3.0413 3.0891 3.1060 3.3929 3.4096 3.5629 3.5920 8.0388 8.3759 9.6419 9.8502 10.8247 10.9948 11.6071 11.6260 12.1083 12.1279 k = 0.2955-0.1114 0.1555 ( 4037 PWs) bands (ev): -16.0895 -16.0863 -15.0882 -15.0827 -14.3222 -14.3181 -13.9178 -13.9142 -13.6714 -13.6697 -13.3687 -13.3647 -5.5981 -5.5866 -4.4519 -4.4489 -3.0728 -3.0537 -2.7288 -2.7052 -2.1913 -2.1830 -1.3501 -1.2601 -0.4841 -0.3886 -0.2490 -0.1792 0.3270 0.4507 0.7483 0.8098 1.5063 1.5463 2.0504 2.0931 2.2427 2.2768 2.4413 2.4613 2.7670 2.7766 3.0117 3.0308 3.0880 3.1042 3.3783 3.3980 3.5561 3.5814 8.0281 8.3737 9.6412 9.8560 10.7995 10.9728 11.5910 11.6098 12.1219 12.1417 k = 0.2841-0.1071 0.1496 ( 4040 PWs) bands (ev): -16.1058 -16.1026 -15.0872 -15.0816 -14.3022 -14.2988 -13.9190 -13.9157 -13.6735 -13.6718 -13.3649 -13.3608 -5.5699 -5.5582 -4.4689 -4.4662 -3.0939 -3.0751 -2.7320 -2.7077 -2.1947 -2.1864 -1.3540 -1.2628 -0.4669 -0.3859 -0.2291 -0.1762 0.3247 0.4486 0.7577 0.8240 1.5285 1.5631 2.0436 2.0888 2.2408 2.2743 2.4531 2.4732 2.7522 2.7616 3.0050 3.0211 3.0885 3.1044 3.3617 3.3844 3.5494 3.5709 8.0190 8.3718 9.6420 9.8623 10.7747 10.9501 11.5736 11.5921 12.1351 12.1556 k = 0.2727-0.1028 0.1436 ( 4038 PWs) bands (ev): -16.1220 -16.1188 -15.0855 -15.0798 -14.2844 -14.2815 -13.9189 -13.9162 -13.6755 -13.6739 -13.3608 -13.3566 -5.5412 -5.5294 -4.4855 -4.4830 -3.1149 -3.0965 -2.7353 -2.7102 -2.2013 -2.1926 -1.3560 -1.2643 -0.4502 -0.3846 -0.2051 -0.1691 0.3227 0.4459 0.7677 0.8387 1.5490 1.5775 2.0340 2.0802 2.2403 2.2725 2.4652 2.4855 2.7371 2.7467 2.9990 3.0126 3.0901 3.1059 3.3434 3.3687 3.5428 3.5606 8.0118 8.3706 9.6444 9.8691 10.7502 10.9269 11.5548 11.5730 12.1480 12.1695 k = 0.2614-0.0985 0.1376 ( 4044 PWs) bands (ev): -16.1381 -16.1349 -15.0831 -15.0772 -14.2692 -14.2665 -13.9174 -13.9153 -13.6775 -13.6759 -13.3565 -13.3523 -5.5123 -5.5005 -4.5013 -4.4992 -3.1359 -3.1177 -2.7387 -2.7127 -2.2110 -2.2015 -1.3558 -1.2645 -0.4347 -0.3835 -0.1795 -0.1574 0.3211 0.4429 0.7786 0.8543 1.5676 1.5893 2.0215 2.0676 2.2414 2.2716 2.4771 2.4976 2.7227 2.7326 2.9939 3.0052 3.0919 3.1083 3.3236 3.3508 3.5362 3.5505 8.0066 8.3700 9.6484 9.8763 10.7264 10.9032 11.5347 11.5525 12.1604 12.1834 k = 0.2500-0.0942 0.1316 ( 4046 PWs) bands (ev): -16.1540 -16.1508 -15.0800 -15.0740 -14.2569 -14.2541 -13.9142 -13.9127 -13.6793 -13.6777 -13.3520 -13.3478 -5.4834 -5.4717 -4.5163 -4.5144 -3.1568 -3.1389 -2.7422 -2.7152 -2.2237 -2.2130 -1.3535 -1.2633 -0.4206 -0.3817 -0.1552 -0.1392 0.3200 0.4395 0.7907 0.8710 1.5840 1.5985 2.0065 2.0513 2.2438 2.2715 2.4883 2.5088 2.7099 2.7203 2.9898 2.9991 3.0934 3.1111 3.3026 3.3311 3.5294 3.5405 8.0035 8.3701 9.6542 9.8839 10.7033 10.8795 11.5132 11.5306 12.1723 12.1972 k = 0.2386-0.0900 0.1256 ( 4041 PWs) bands (ev): -16.1697 -16.1665 -15.0763 -15.0702 -14.2478 -14.2443 -13.9092 -13.9082 -13.6809 -13.6794 -13.3474 -13.3431 -5.4547 -5.4431 -4.5301 -4.5285 -3.1776 -3.1598 -2.7457 -2.7177 -2.2392 -2.2270 -1.3492 -1.2608 -0.4083 -0.3786 -0.1341 -0.1142 0.3195 0.4359 0.8042 0.8892 1.5978 1.6050 1.9894 2.0321 2.2471 2.2722 2.4979 2.5182 2.6995 2.7106 2.9864 2.9942 3.0941 3.1139 3.2809 3.3097 3.5225 3.5308 8.0025 8.3709 9.6616 9.8920 10.6810 10.8560 11.4906 11.5076 12.1837 12.2108 k = 0.2273-0.0857 0.1196 ( 4045 PWs) bands (ev): -16.1850 -16.1819 -15.0721 -15.0658 -14.2417 -14.2374 -13.9026 -13.9016 -13.6824 -13.6810 -13.3427 -13.3384 -5.4265 -5.4151 -4.5426 -4.5412 -3.1980 -3.1804 -2.7492 -2.7201 -2.2572 -2.2434 -1.3429 -1.2569 -0.3979 -0.3737 -0.1131 -0.0868 0.3195 0.4322 0.8192 0.9089 1.6065 1.6112 1.9704 2.0106 2.2513 2.2737 2.5053 2.5251 2.6924 2.7042 2.9837 2.9905 3.0933 3.1160 3.2593 3.2871 3.5153 3.5212 8.0036 8.3724 9.6707 9.9005 10.6595 10.8328 11.4666 11.4837 12.1944 12.2242 k = 0.2159-0.0814 0.1137 ( 4051 PWs) bands (ev): -16.1999 -16.1969 -15.0673 -15.0610 -14.2387 -14.2335 -13.8944 -13.8930 -13.6838 -13.6823 -13.3378 -13.3336 -5.3992 -5.3880 -4.5536 -4.5523 -3.2182 -3.2008 -2.7527 -2.7225 -2.2775 -2.2619 -1.3349 -1.2517 -0.3891 -0.3671 -0.0910 -0.0595 0.3202 0.4284 0.8358 0.9306 1.6075 1.6196 1.9501 1.9874 2.2562 2.2760 2.5099 2.5287 2.6890 2.7013 2.9814 2.9878 3.0901 3.1167 3.2389 3.2641 3.5078 3.5118 8.0070 8.3746 9.6815 9.9094 10.6391 10.8103 11.4413 11.4589 12.2046 12.2372 k = 0.2045-0.0771 0.1077 ( 4051 PWs) bands (ev): -16.2144 -16.2114 -15.0620 -15.0557 -14.2383 -14.2323 -13.8847 -13.8828 -13.6849 -13.6835 -13.3330 -13.3287 -5.3729 -5.3620 -4.5629 -4.5616 -3.2380 -3.2207 -2.7561 -2.7247 -2.2997 -2.2823 -1.3254 -1.2454 -0.3812 -0.3591 -0.0679 -0.0334 0.3215 0.4245 0.8541 0.9543 1.6051 1.6261 1.9291 1.9632 2.2616 2.2791 2.5115 2.5288 2.6892 2.7020 2.9789 2.9858 3.0834 3.1149 3.2212 3.2422 3.5000 3.5027 8.0125 8.3773 9.6939 9.9187 10.6196 10.7888 11.4146 11.4335 12.2142 12.2496 k = 0.1932-0.0728 0.1017 ( 4047 PWs) bands (ev): -16.2283 -16.2255 -15.0564 -15.0500 -14.2403 -14.2336 -13.8737 -13.8714 -13.6858 -13.6844 -13.3281 -13.3240 -5.3480 -5.3375 -4.5701 -4.5688 -3.2572 -3.2403 -2.7595 -2.7267 -2.3237 -2.3044 -1.3145 -1.2380 -0.3734 -0.3503 -0.0446 -0.0090 0.3233 0.4208 0.8740 0.9802 1.5999 1.6301 1.9080 1.9388 2.2675 2.2831 2.5102 2.5260 2.6922 2.7054 2.9757 2.9840 3.0727 3.1090 3.2078 3.2233 3.4917 3.4940 8.0201 8.3803 9.7079 9.9284 10.6012 10.7686 11.3867 11.4076 12.2232 12.2615 k = 0.1818-0.0685 0.0957 ( 4045 PWs) bands (ev): -16.2417 -16.2389 -15.0503 -15.0439 -14.2442 -14.2371 -13.8617 -13.8591 -13.6864 -13.6851 -13.3233 -13.3192 -5.3248 -5.3146 -4.5752 -4.5738 -3.2759 -3.2592 -2.7627 -2.7286 -2.3490 -2.3278 -1.3026 -1.2297 -0.3653 -0.3410 -0.0216 0.0133 0.3256 0.4171 0.8955 1.0083 1.5921 1.6318 1.8874 1.9150 2.2738 2.2877 2.5067 2.5208 2.6969 2.7106 2.9706 2.9818 3.0585 3.0977 3.1994 3.2096 3.4830 3.4856 8.0297 8.3835 9.7233 9.9385 10.5839 10.7500 11.3576 11.3814 12.2316 12.2727 k = 0.1705-0.0643 0.0897 ( 4044 PWs) bands (ev): -16.2544 -16.2518 -15.0440 -15.0376 -14.2498 -14.2423 -13.8492 -13.8464 -13.6868 -13.6855 -13.3185 -13.3146 -5.3035 -5.2938 -4.5780 -4.5765 -3.2939 -3.2776 -2.7657 -2.7302 -2.3755 -2.3523 -1.2897 -1.2207 -0.3565 -0.3315 0.0005 0.0334 0.3282 0.4135 0.9183 1.0385 1.5820 1.6311 1.8681 1.8926 2.2804 2.2930 2.5014 2.5140 2.7019 2.7164 2.9618 2.9778 3.0434 3.0819 3.1955 3.2018 3.4743 3.4775 8.0412 8.3867 9.7401 9.9490 10.5676 10.7331 11.3274 11.3549 12.2394 12.2831 k = 0.1591-0.0600 0.0837 ( 4042 PWs) bands (ev): -16.2666 -16.2641 -15.0375 -15.0312 -14.2566 -14.2489 -13.8364 -13.8337 -13.6870 -13.6856 -13.3139 -13.3101 -5.2842 -5.2750 -4.5783 -4.5768 -3.3112 -3.2953 -2.7685 -2.7314 -2.4028 -2.3776 -1.2761 -1.2111 -0.3470 -0.3218 0.0213 0.0512 0.3311 0.4101 0.9422 1.0705 1.5699 1.6283 1.8509 1.8722 2.2873 2.2988 2.4949 2.5061 2.7059 2.7216 2.9476 2.9701 3.0307 3.0649 3.1951 3.1989 3.4657 3.4694 8.0544 8.3897 9.7582 9.9597 10.5525 10.7183 11.2962 11.3282 12.2466 12.2926 k = 0.1477-0.0557 0.0778 ( 4042 PWs) bands (ev): -16.2780 -16.2756 -15.0308 -15.0246 -14.2643 -14.2565 -13.8237 -13.8211 -13.6868 -13.6854 -13.3094 -13.3058 -5.2673 -5.2586 -4.5763 -4.5747 -3.3276 -3.3123 -2.7710 -2.7324 -2.4306 -2.4035 -1.2622 -1.2013 -0.3370 -0.3120 0.0404 0.0668 0.3340 0.4067 0.9667 1.1038 1.5560 1.6237 1.8363 1.8548 2.2943 2.3049 2.4875 2.4975 2.7073 2.7249 2.9284 2.9563 3.0224 3.0511 3.1970 3.1996 3.4574 3.4614 8.0693 8.3923 9.7772 9.9705 10.5385 10.7056 11.2645 11.3014 12.2533 12.3012 k = 0.1364-0.0514 0.0718 ( 4042 PWs) bands (ev): -16.2887 -16.2865 -15.0240 -15.0180 -14.2726 -14.2649 -13.8115 -13.8091 -13.6862 -13.6848 -13.3051 -13.3017 -5.2526 -5.2445 -4.5720 -4.5704 -3.3431 -3.3285 -2.7731 -2.7329 -2.4588 -2.4295 -1.2479 -1.1913 -0.3263 -0.3022 0.0574 0.0806 0.3367 0.4034 0.9914 1.1376 1.5409 1.6178 1.8251 1.8411 2.3013 2.3111 2.4794 2.4885 2.7043 2.7248 2.9074 2.9365 3.0182 3.0423 3.2004 3.2024 3.4494 3.4537 8.0856 8.3942 9.7972 9.9815 10.5260 10.6950 11.2323 11.2745 12.2595 12.3087 k = 0.1250-0.0471 0.0658 ( 4041 PWs) bands (ev): -16.2986 -16.2966 -15.0173 -15.0115 -14.2813 -14.2737 -13.8000 -13.7978 -13.6853 -13.6838 -13.3010 -13.2978 -5.2402 -5.2327 -4.5657 -4.5641 -3.3577 -3.3437 -2.7747 -2.7329 -2.4869 -2.4555 -1.2337 -1.1813 -0.3153 -0.2923 0.0721 0.0927 0.3393 0.4000 1.0158 1.1710 1.5252 1.6112 1.8177 1.8315 2.3081 2.3175 2.4708 2.4792 2.6949 2.7195 2.8882 2.9142 3.0167 3.0373 3.2049 3.2067 3.4418 3.4462 8.1031 8.3953 9.8177 9.9923 10.5151 10.6864 11.2000 11.2477 12.2653 12.3151 k = 0.1136-0.0428 0.0598 ( 4044 PWs) bands (ev): -16.3078 -16.3059 -15.0106 -15.0051 -14.2900 -14.2827 -13.7894 -13.7874 -13.6840 -13.6824 -13.2971 -13.2942 -5.2299 -5.2231 -4.5576 -4.5561 -3.3711 -3.3580 -2.7759 -2.7324 -2.5148 -2.4811 -1.2196 -1.1716 -0.3041 -0.2827 0.0843 0.1035 0.3417 0.3965 1.0393 1.2025 1.5099 1.6043 1.8146 1.8268 2.3147 2.3237 2.4614 2.4698 2.6779 2.7070 2.8736 2.8940 3.0166 3.0346 3.2101 3.2119 3.4346 3.4390 8.1216 8.3953 9.8385 10.0027 10.5061 10.6796 11.1681 11.2210 12.2708 12.3203 k = 0.1023-0.0386 0.0538 ( 4042 PWs) bands (ev): -16.3161 -16.3144 -15.0042 -14.9989 -14.2986 -14.2917 -13.7799 -13.7782 -13.6822 -13.6806 -13.2935 -13.2908 -5.2217 -5.2155 -4.5482 -4.5467 -3.3835 -3.3713 -2.7763 -2.7312 -2.5422 -2.5063 -1.2059 -1.1623 -0.2928 -0.2733 0.0943 0.1132 0.3437 0.3929 1.0615 1.2303 1.4965 1.5977 1.8161 1.8272 2.3210 2.3296 2.4511 2.4601 2.6538 2.6862 2.8643 2.8788 3.0173 3.0330 3.2158 3.2175 3.4280 3.4322 8.1409 8.3940 9.8595 10.0124 10.4995 10.6742 11.1370 11.1947 12.2760 12.3245 k = 0.0909-0.0343 0.0479 ( 4041 PWs) bands (ev): -16.3237 -16.3221 -14.9980 -14.9931 -14.3068 -14.3004 -13.7716 -13.7702 -13.6801 -13.6785 -13.2903 -13.2878 -5.2151 -5.2097 -4.5379 -4.5366 -3.3946 -3.3835 -2.7760 -2.7294 -2.5688 -2.5306 -1.1928 -1.1537 -0.2817 -0.2643 0.1024 0.1216 0.3456 0.3890 1.0819 1.2521 1.4866 1.5914 1.8228 1.8329 2.3268 2.3351 2.4395 2.4501 2.6246 2.6580 2.8594 2.8692 3.0182 3.0319 3.2217 3.2233 3.4218 3.4259 8.1607 8.3914 9.8803 10.0211 10.4957 10.6695 11.1073 11.1688 12.2810 12.3274 k = 0.0795-0.0300 0.0419 ( 4039 PWs) bands (ev): -16.3303 -16.3290 -14.9922 -14.9877 -14.3144 -14.3086 -13.7645 -13.7635 -13.6777 -13.6761 -13.2873 -13.2851 -5.2101 -5.2053 -4.5272 -4.5261 -3.4045 -3.3945 -2.7748 -2.7267 -2.5944 -2.5538 -1.1804 -1.1460 -0.2710 -0.2558 0.1090 0.1286 0.3472 0.3849 1.1005 1.2659 1.4821 1.5855 1.8346 1.8440 2.3318 2.3399 2.4262 2.4392 2.5933 2.6251 2.8575 2.8642 3.0193 3.0310 3.2275 3.2290 3.4163 3.4201 8.1809 8.3872 9.9006 10.0283 10.4951 10.6649 11.0799 11.1436 12.2858 12.3293 k = 0.0682-0.0257 0.0359 ( 4037 PWs) bands (ev): -16.3361 -16.3350 -14.9868 -14.9828 -14.3214 -14.3162 -13.7587 -13.7579 -13.6751 -13.6736 -13.2846 -13.2827 -5.2063 -5.2022 -4.5167 -4.5157 -3.4131 -3.4043 -2.7726 -2.7232 -2.6186 -2.5759 -1.1689 -1.1392 -0.2610 -0.2482 0.1146 0.1341 0.3487 0.3808 1.1173 1.2707 1.4837 1.5798 1.8515 1.8602 2.3357 2.3435 2.4107 2.4271 2.5631 2.5905 2.8573 2.8620 3.0203 3.0303 3.2331 3.2345 3.4115 3.4149 8.2012 8.3815 9.9203 10.0336 10.4981 10.6596 11.0555 11.1194 12.2905 12.3300 k = 0.0568-0.0214 0.0299 ( 4043 PWs) bands (ev): -16.3410 -16.3401 -14.9820 -14.9786 -14.3275 -14.3230 -13.7541 -13.7535 -13.6725 -13.6711 -13.2823 -13.2808 -5.2035 -5.2001 -4.5068 -4.5061 -3.4204 -3.4128 -2.7691 -2.7186 -2.6414 -2.5966 -1.1585 -1.1335 -0.2519 -0.2414 0.1195 0.1380 0.3502 0.3766 1.1326 1.2673 1.4904 1.5740 1.8725 1.8810 2.3374 2.3451 2.3937 2.4129 2.5365 2.5579 2.8580 2.8614 3.0213 3.0295 3.2382 3.2395 3.4073 3.4102 8.2214 8.3741 9.9390 10.0365 10.5047 10.6527 11.0351 11.0963 12.2952 12.3298 k = 0.0455-0.0171 0.0239 ( 4048 PWs) bands (ev): -16.3451 -16.3443 -14.9779 -14.9751 -14.3325 -14.3289 -13.7505 -13.7501 -13.6700 -13.6688 -13.2804 -13.2791 -5.2015 -5.1988 -4.4981 -4.4975 -3.4262 -3.4201 -2.7644 -2.7131 -2.6625 -2.6158 -1.1493 -1.1292 -0.2440 -0.2357 0.1239 0.1405 0.3516 0.3725 1.1469 1.2583 1.5000 1.5681 1.8962 1.9052 2.3338 2.3426 2.3791 2.3972 2.5154 2.5303 2.8591 2.8617 3.0222 3.0287 3.2427 3.2439 3.4038 3.4063 8.2412 8.3651 9.9567 10.0370 10.5149 10.6435 11.0197 11.0748 12.2997 12.3286 k = 0.0341-0.0129 0.0179 ( 4046 PWs) bands (ev): -16.3482 -16.3476 -14.9745 -14.9724 -14.3365 -14.3337 -13.7479 -13.7476 -13.6678 -13.6668 -13.2789 -13.2779 -5.2000 -5.1980 -4.4908 -4.4903 -3.4306 -3.4259 -2.7581 -2.7065 -2.6815 -2.6335 -1.1414 -1.1263 -0.2374 -0.2313 0.1279 0.1415 0.3532 0.3686 1.1607 1.2458 1.5106 1.5618 1.9209 1.9302 2.3206 2.3339 2.3722 2.3836 2.5002 2.5096 2.8603 2.8621 3.0231 3.0279 3.2464 3.2474 3.4012 3.4031 8.2605 8.3544 9.9732 10.0348 10.5285 10.6315 11.0097 11.0552 12.3043 12.3266 k = 0.0227-0.0086 0.0120 ( 4042 PWs) bands (ev): -16.3504 -16.3500 -14.9719 -14.9705 -14.3392 -14.3373 -13.7461 -13.7459 -13.6660 -13.6654 -13.2777 -13.2771 -5.1990 -5.1976 -4.4853 -4.4850 -3.4335 -3.4304 -2.7502 -2.7030 -2.6942 -2.6495 -1.1350 -1.1248 -0.2322 -0.2283 0.1317 0.1413 0.3549 0.3651 1.1743 1.2316 1.5211 1.5551 1.9441 1.9524 2.3036 2.3180 2.3707 2.3761 2.4903 2.4958 2.8613 2.8625 3.0239 3.0271 3.2493 3.2500 3.3994 3.4006 8.2791 8.3421 9.9882 10.0300 10.5446 10.6168 11.0055 11.0380 12.3087 12.3239 k = 0.0114-0.0043 0.0060 ( 4045 PWs) bands (ev): -16.3517 -16.3515 -14.9702 -14.9695 -14.3407 -14.3398 -13.7451 -13.7450 -13.6648 -13.6645 -13.2769 -13.2766 -5.1983 -5.1976 -4.4819 -4.4818 -3.4349 -3.4334 -2.7406 -2.7159 -2.6873 -2.6638 -1.1300 -1.1250 -0.2287 -0.2268 0.1350 0.1400 0.3569 0.3619 1.1881 1.2169 1.5309 1.5478 1.9621 1.9672 2.2917 2.3009 2.3711 2.3732 2.4852 2.4877 2.8621 2.8627 3.0247 3.0263 3.2511 3.2515 3.3984 3.3990 8.2967 8.3283 10.0016 10.0227 10.5626 10.5998 11.0068 11.0238 12.3130 12.3207 k = 0.0000 0.0000 0.0000 ( 4043 PWs) bands (ev): -16.3520 -16.3520 -14.9694 -14.9694 -14.3409 -14.3409 -13.7447 -13.7447 -13.6643 -13.6643 -13.2766 -13.2766 -5.1978 -5.1978 -4.4807 -4.4807 -3.4349 -3.4349 -2.7291 -2.7291 -2.6764 -2.6764 -1.1267 -1.1267 -0.2269 -0.2269 0.1378 0.1378 0.3592 0.3592 1.2024 1.2024 1.5397 1.5397 1.9707 1.9707 2.2906 2.2906 2.3719 2.3719 2.4843 2.4843 2.8626 2.8626 3.0255 3.0255 3.2518 3.2518 3.3983 3.3983 8.3131 8.3131 10.0132 10.0132 10.5814 10.5814 11.0131 11.0131 12.3170 12.3170 Writing output data file BixBO2x3.save init_run : 3.83s CPU 11.74s WALL ( 1 calls) electrons : 877.66s CPU 886.50s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.06s WALL ( 1 calls) potinit : 0.48s CPU 1.61s WALL ( 1 calls) Called by electrons: c_bands : 877.64s CPU 886.16s WALL ( 1 calls) v_of_rho : 0.21s CPU 1.05s WALL ( 1 calls) v_h : 0.01s CPU 0.10s WALL ( 1 calls) v_xc : 0.19s CPU 0.62s WALL ( 1 calls) newd : 0.38s CPU 0.41s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 338 calls) cegterg : 828.37s CPU 833.89s WALL ( 731 calls) Called by sum_band: Called by *egterg: h_psi : 331.77s CPU 339.72s WALL ( 13143 calls) s_psi : 23.85s CPU 24.46s WALL ( 13143 calls) g_psi : 0.86s CPU 0.93s WALL ( 12074 calls) cdiaghg : 349.32s CPU 346.87s WALL ( 12412 calls) cegterg:over : 76.24s CPU 73.22s WALL ( 12074 calls) cegterg:upda : 18.88s CPU 22.41s WALL ( 12074 calls) cegterg:last : 15.85s CPU 16.60s WALL ( 2083 calls) Called by h_psi: h_psi:vloc : 263.60s CPU 270.13s WALL ( 13143 calls) h_psi:vnl : 67.71s CPU 68.64s WALL ( 13143 calls) add_vuspsi : 19.06s CPU 23.03s WALL ( 13143 calls) General routines calbec : 48.60s CPU 45.50s WALL ( 13143 calls) fft : 0.42s CPU 1.80s WALL ( 19 calls) ffts : 0.00s CPU 0.01s WALL ( 4 calls) fftw : 250.56s CPU 254.52s WALL ( 1545392 calls) interpolate : 0.01s CPU 0.02s WALL ( 4 calls) davcio : 0.07s CPU 2.14s WALL ( 676 calls) Parallel routines fft_scatter : 158.51s CPU 160.21s WALL ( 1545415 calls) PWSCF : 15m44.33s CPU 17m21.75s WALL This run was terminated on: 11:48:45 25Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=