Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:12:57 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./FeGe.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 43 33 9 1292 867 136 Max 44 34 10 1297 885 142 Sum 1569 1213 359 46583 31617 5039 bravais-lattice index = 14 lattice parameter (alat) = 11.7733 a.u. unit-cell volume = 751.2016 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.773272 celldm(2)= 1.000000 celldm(3)= 0.790752 celldm(4)= 0.221846 celldm(5)= 0.221846 celldm(6)= 0.800952 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.800952 0.598728 0.000000 ) a(3) = ( 0.175425 0.058320 0.768839 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.337756 -0.126694 ) b(2) = ( 0.000000 1.670207 -0.126694 ) b(3) = ( 0.000000 0.000000 1.300663 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Fe 8.00 55.84500 Fe( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 354 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 2) = ( 0.0178571 0.0059366 -0.0045248), wk = 0.0028249 k( 3) = ( 0.0357143 0.0118732 -0.0090496), wk = 0.0028249 k( 4) = ( 0.0535714 0.0178099 -0.0135743), wk = 0.0028249 k( 5) = ( 0.0714286 0.0237465 -0.0180991), wk = 0.0028249 k( 6) = ( 0.0892857 0.0296831 -0.0226239), wk = 0.0028249 k( 7) = ( 0.1071429 0.0356197 -0.0271487), wk = 0.0028249 k( 8) = ( 0.1250000 0.0415564 -0.0316734), wk = 0.0028249 k( 9) = ( 0.1428571 0.0474930 -0.0361982), wk = 0.0028249 k( 10) = ( 0.1607143 0.0534296 -0.0407230), wk = 0.0028249 k( 11) = ( 0.1785714 0.0593662 -0.0452478), wk = 0.0028249 k( 12) = ( 0.1964286 0.0653029 -0.0497725), wk = 0.0028249 k( 13) = ( 0.2142857 0.0712395 -0.0542973), wk = 0.0028249 k( 14) = ( 0.2321429 0.0771761 -0.0588221), wk = 0.0028249 k( 15) = ( 0.2500000 0.0831127 -0.0633469), wk = 0.0028249 k( 16) = ( 0.2678571 0.0890494 -0.0678716), wk = 0.0028249 k( 17) = ( 0.2857143 0.0949860 -0.0723964), wk = 0.0028249 k( 18) = ( 0.3035714 0.1009226 -0.0769212), wk = 0.0028249 k( 19) = ( 0.3214286 0.1068592 -0.0814460), wk = 0.0028249 k( 20) = ( 0.3392857 0.1127959 -0.0859707), wk = 0.0028249 k( 21) = ( 0.3571429 0.1187325 -0.0904955), wk = 0.0028249 k( 22) = ( 0.3750000 0.1246691 -0.0950203), wk = 0.0028249 k( 23) = ( 0.3928571 0.1306057 -0.0995451), wk = 0.0028249 k( 24) = ( 0.4107143 0.1365424 -0.1040698), wk = 0.0028249 k( 25) = ( 0.4285714 0.1424790 -0.1085946), wk = 0.0028249 k( 26) = ( 0.4464286 0.1484156 -0.1131194), wk = 0.0028249 k( 27) = ( 0.4642857 0.1543522 -0.1176442), wk = 0.0028249 k( 28) = ( 0.4821429 0.1602889 -0.1221689), wk = 0.0028249 k( 29) = ( 0.5000000 0.1662255 -0.1266937), wk = 0.0028249 k( 30) = ( 0.5000000 0.1662255 -0.1266937), wk = 0.0028249 k( 31) = ( 0.5042671 0.1676441 -0.1079923), wk = 0.0028249 k( 32) = ( 0.5085342 0.1690627 -0.0892910), wk = 0.0028249 k( 33) = ( 0.5128012 0.1704813 -0.0705897), wk = 0.0028249 k( 34) = ( 0.5170683 0.1718998 -0.0518883), wk = 0.0028249 k( 35) = ( 0.5213354 0.1733184 -0.0331870), wk = 0.0028249 k( 36) = ( 0.5256024 0.1747370 -0.0144856), wk = 0.0028249 k( 37) = ( 0.5298695 0.1761556 0.0042157), wk = 0.0028249 k( 38) = ( 0.5341366 0.1775742 0.0229171), wk = 0.0028249 k( 39) = ( 0.5384037 0.1789928 0.0416184), wk = 0.0028249 k( 40) = ( 0.5426707 0.1804114 0.0603198), wk = 0.0028249 k( 41) = ( 0.5469378 0.1818300 0.0790211), wk = 0.0028249 k( 42) = ( 0.5512049 0.1832486 0.0977225), wk = 0.0028249 k( 43) = ( 0.5554720 0.1846672 0.1164238), wk = 0.0028249 k( 44) = ( 0.5597390 0.1860858 0.1351252), wk = 0.0028249 k( 45) = ( 0.5640061 0.1875044 0.1538265), wk = 0.0028249 k( 46) = ( 0.5682732 0.1889230 0.1725279), wk = 0.0028249 k( 47) = ( 0.5725402 0.1903415 0.1912292), wk = 0.0028249 k( 48) = ( 0.5768073 0.1917601 0.2099306), wk = 0.0028249 k( 49) = ( 0.5810744 0.1931787 0.2286319), wk = 0.0028249 k( 50) = ( 0.5853415 0.1945973 0.2473333), wk = 0.0028249 k( 51) = ( 0.5896085 0.1960159 0.2660346), wk = 0.0028249 k( 52) = ( 0.5938756 0.1974345 0.2847359), wk = 0.0028249 k( 53) = ( 0.5981427 0.1988531 0.3034373), wk = 0.0028249 k( 54) = ( 0.6024098 0.2002717 0.3221386), wk = 0.0028249 k( 55) = ( 0.6066768 0.2016903 0.3408400), wk = 0.0028249 k( 56) = ( 0.6109439 0.2031089 0.3595413), wk = 0.0028249 k( 57) = ( 0.6152110 0.2045275 0.3782427), wk = 0.0028249 k( 58) = ( 0.6194781 0.2059461 0.3969440), wk = 0.0028249 k( 59) = ( 0.6194781 0.2059461 0.3969440), wk = 0.0028249 k( 60) = ( 0.6075303 0.2019740 0.4096134), wk = 0.0028249 k( 61) = ( 0.5955824 0.1980019 0.4222828), wk = 0.0028249 k( 62) = ( 0.5836346 0.1940299 0.4349522), wk = 0.0028249 k( 63) = ( 0.5716868 0.1900578 0.4476215), wk = 0.0028249 k( 64) = ( 0.5597390 0.1860858 0.4602909), wk = 0.0028249 k( 65) = ( 0.5477912 0.1821137 0.4729603), wk = 0.0028249 k( 66) = ( 0.5358434 0.1781417 0.4856296), wk = 0.0028249 k( 67) = ( 0.5238956 0.1741696 0.4982990), wk = 0.0028249 k( 68) = ( 0.5119478 0.1701975 0.5109684), wk = 0.0028249 k( 69) = ( 0.5000000 0.1662255 0.5236377), wk = 0.0028249 k( 70) = ( 0.5000000 0.1662255 0.5236377), wk = 0.0028249 k( 71) = ( 0.5062414 0.1474517 0.5236377), wk = 0.0028249 k( 72) = ( 0.5124827 0.1286779 0.5236377), wk = 0.0028249 k( 73) = ( 0.5187241 0.1099041 0.5236377), wk = 0.0028249 k( 74) = ( 0.5249654 0.0911303 0.5236377), wk = 0.0028249 k( 75) = ( 0.5312068 0.0723566 0.5236377), wk = 0.0028249 k( 76) = ( 0.5374482 0.0535828 0.5236377), wk = 0.0028249 k( 77) = ( 0.5436895 0.0348090 0.5236377), wk = 0.0028249 k( 78) = ( 0.5499309 0.0160352 0.5236377), wk = 0.0028249 k( 79) = ( 0.5561723 -0.0027386 0.5236377), wk = 0.0028249 k( 80) = ( 0.5624136 -0.0215123 0.5236377), wk = 0.0028249 k( 81) = ( 0.5686550 -0.0402861 0.5236377), wk = 0.0028249 k( 82) = ( 0.5748963 -0.0590599 0.5236377), wk = 0.0028249 k( 83) = ( 0.5811377 -0.0778337 0.5236377), wk = 0.0028249 k( 84) = ( 0.5873791 -0.0966075 0.5236377), wk = 0.0028249 k( 85) = ( 0.5936204 -0.1153812 0.5236377), wk = 0.0028249 k( 86) = ( 0.5998618 -0.1341550 0.5236377), wk = 0.0028249 k( 87) = ( 0.6061031 -0.1529288 0.5236377), wk = 0.0028249 k( 88) = ( 0.6123445 -0.1717026 0.5236377), wk = 0.0028249 k( 89) = ( 0.6185859 -0.1904764 0.5236377), wk = 0.0028249 k( 90) = ( 0.6248272 -0.2092502 0.5236377), wk = 0.0028249 k( 91) = ( 0.6310686 -0.2280239 0.5236377), wk = 0.0028249 k( 92) = ( 0.6373100 -0.2467977 0.5236377), wk = 0.0028249 k( 93) = ( 0.6435513 -0.2655715 0.5236377), wk = 0.0028249 k( 94) = ( 0.6497927 -0.2843453 0.5236377), wk = 0.0028249 k( 95) = ( 0.6560340 -0.3031190 0.5236377), wk = 0.0028249 k( 96) = ( 0.6622754 -0.3218928 0.5236377), wk = 0.0028249 k( 97) = ( 0.6685167 -0.3406666 0.5236377), wk = 0.0028249 k( 98) = ( 0.6747581 -0.3594404 0.5236377), wk = 0.0028249 k( 99) = ( 0.6809995 -0.3782142 0.5236377), wk = 0.0028249 k( 100) = ( 0.6872408 -0.3969880 0.5236377), wk = 0.0028249 k( 101) = ( 0.6934822 -0.4157617 0.5236377), wk = 0.0028249 k( 102) = ( 0.6997236 -0.4345355 0.5236377), wk = 0.0028249 k( 103) = ( 0.7059649 -0.4533093 0.5236377), wk = 0.0028249 k( 104) = ( 0.7122063 -0.4720831 0.5236377), wk = 0.0028249 k( 105) = ( 0.7184476 -0.4908568 0.5236377), wk = 0.0028249 k( 106) = ( 0.7246890 -0.5096307 0.5236377), wk = 0.0028249 k( 107) = ( 0.7309304 -0.5284044 0.5236377), wk = 0.0028249 k( 108) = ( 0.7371717 -0.5471782 0.5236377), wk = 0.0028249 k( 109) = ( 0.2628283 -0.7905776 0.6503314), wk = 0.0028249 k( 110) = ( 0.2567160 -0.7721921 0.6503314), wk = 0.0028249 k( 111) = ( 0.2506037 -0.7538065 0.6503314), wk = 0.0028249 k( 112) = ( 0.2444914 -0.7354210 0.6503314), wk = 0.0028249 k( 113) = ( 0.2383791 -0.7170355 0.6503314), wk = 0.0028249 k( 114) = ( 0.2322668 -0.6986500 0.6503314), wk = 0.0028249 k( 115) = ( 0.2261546 -0.6802644 0.6503314), wk = 0.0028249 k( 116) = ( 0.2200423 -0.6618789 0.6503314), wk = 0.0028249 k( 117) = ( 0.2139300 -0.6434934 0.6503314), wk = 0.0028249 k( 118) = ( 0.2078177 -0.6251079 0.6503314), wk = 0.0028249 k( 119) = ( 0.2017054 -0.6067224 0.6503314), wk = 0.0028249 k( 120) = ( 0.1955931 -0.5883368 0.6503314), wk = 0.0028249 k( 121) = ( 0.1894809 -0.5699513 0.6503314), wk = 0.0028249 k( 122) = ( 0.1833686 -0.5515658 0.6503314), wk = 0.0028249 k( 123) = ( 0.1772563 -0.5331803 0.6503314), wk = 0.0028249 k( 124) = ( 0.1711440 -0.5147947 0.6503314), wk = 0.0028249 k( 125) = ( 0.1650317 -0.4964092 0.6503314), wk = 0.0028249 k( 126) = ( 0.1589194 -0.4780237 0.6503314), wk = 0.0028249 k( 127) = ( 0.1528071 -0.4596381 0.6503314), wk = 0.0028249 k( 128) = ( 0.1466948 -0.4412526 0.6503314), wk = 0.0028249 k( 129) = ( 0.1405826 -0.4228671 0.6503314), wk = 0.0028249 k( 130) = ( 0.1344703 -0.4044816 0.6503314), wk = 0.0028249 k( 131) = ( 0.1283580 -0.3860960 0.6503314), wk = 0.0028249 k( 132) = ( 0.1222457 -0.3677105 0.6503314), wk = 0.0028249 k( 133) = ( 0.1161334 -0.3493250 0.6503314), wk = 0.0028249 k( 134) = ( 0.1100211 -0.3309395 0.6503314), wk = 0.0028249 k( 135) = ( 0.1039088 -0.3125539 0.6503314), wk = 0.0028249 k( 136) = ( 0.0977966 -0.2941684 0.6503314), wk = 0.0028249 k( 137) = ( 0.0916843 -0.2757829 0.6503314), wk = 0.0028249 k( 138) = ( 0.0855720 -0.2573974 0.6503314), wk = 0.0028249 k( 139) = ( 0.0794597 -0.2390118 0.6503314), wk = 0.0028249 k( 140) = ( 0.0733474 -0.2206263 0.6503314), wk = 0.0028249 k( 141) = ( 0.0672351 -0.2022408 0.6503314), wk = 0.0028249 k( 142) = ( 0.0611228 -0.1838552 0.6503314), wk = 0.0028249 k( 143) = ( 0.0550106 -0.1654697 0.6503314), wk = 0.0028249 k( 144) = ( 0.0488983 -0.1470842 0.6503314), wk = 0.0028249 k( 145) = ( 0.0427860 -0.1286987 0.6503314), wk = 0.0028249 k( 146) = ( 0.0366737 -0.1103131 0.6503314), wk = 0.0028249 k( 147) = ( 0.0305614 -0.0919276 0.6503314), wk = 0.0028249 k( 148) = ( 0.0244491 -0.0735421 0.6503314), wk = 0.0028249 k( 149) = ( 0.0183369 -0.0551566 0.6503314), wk = 0.0028249 k( 150) = ( 0.0122246 -0.0367710 0.6503314), wk = 0.0028249 k( 151) = ( 0.0061123 -0.0183855 0.6503314), wk = 0.0028249 k( 152) = ( 0.0000000 0.0000000 0.6503314), wk = 0.0028249 k( 153) = ( 0.0000000 0.0000000 0.6503314), wk = 0.0028249 k( 154) = ( 0.0181201 0.0060240 0.6503314), wk = 0.0028249 k( 155) = ( 0.0362402 0.0120481 0.6503314), wk = 0.0028249 k( 156) = ( 0.0543603 0.0180721 0.6503314), wk = 0.0028249 k( 157) = ( 0.0724804 0.0240962 0.6503314), wk = 0.0028249 k( 158) = ( 0.0906005 0.0301202 0.6503314), wk = 0.0028249 k( 159) = ( 0.1087205 0.0361442 0.6503314), wk = 0.0028249 k( 160) = ( 0.1268406 0.0421683 0.6503314), wk = 0.0028249 k( 161) = ( 0.1449607 0.0481923 0.6503314), wk = 0.0028249 k( 162) = ( 0.1630808 0.0542164 0.6503314), wk = 0.0028249 k( 163) = ( 0.1812009 0.0602404 0.6503314), wk = 0.0028249 k( 164) = ( 0.1993210 0.0662645 0.6503314), wk = 0.0028249 k( 165) = ( 0.2174411 0.0722885 0.6503314), wk = 0.0028249 k( 166) = ( 0.2355612 0.0783125 0.6503314), wk = 0.0028249 k( 167) = ( 0.2536813 0.0843366 0.6503314), wk = 0.0028249 k( 168) = ( 0.2718014 0.0903606 0.6503314), wk = 0.0028249 k( 169) = ( 0.2899215 0.0963847 0.6503314), wk = 0.0028249 k( 170) = ( 0.3080416 0.1024087 0.6503314), wk = 0.0028249 k( 171) = ( 0.3261617 0.1084328 0.6503315), wk = 0.0028249 k( 172) = ( 0.3442818 0.1144568 0.6503314), wk = 0.0028249 k( 173) = ( 0.3624019 0.1204808 0.6503314), wk = 0.0028249 k( 174) = ( 0.3805219 0.1265049 0.6503314), wk = 0.0028249 k( 175) = ( 0.5000000 0.1662255 -0.1266937), wk = 0.0028249 k( 176) = ( 0.5061325 0.1477790 -0.1266937), wk = 0.0028249 k( 177) = ( 0.5122651 0.1293325 -0.1266937), wk = 0.0028249 k( 178) = ( 0.5183976 0.1108861 -0.1266937), wk = 0.0028249 k( 179) = ( 0.5245302 0.0924396 -0.1266937), wk = 0.0028249 k( 180) = ( 0.5306627 0.0739932 -0.1266937), wk = 0.0028249 k( 181) = ( 0.5367953 0.0555467 -0.1266937), wk = 0.0028249 k( 182) = ( 0.5429278 0.0371002 -0.1266937), wk = 0.0028249 k( 183) = ( 0.5490604 0.0186537 -0.1266937), wk = 0.0028249 k( 184) = ( 0.5551929 0.0002073 -0.1266937), wk = 0.0028249 k( 185) = ( 0.5613255 -0.0182392 -0.1266937), wk = 0.0028249 k( 186) = ( 0.5674580 -0.0366856 -0.1266937), wk = 0.0028249 k( 187) = ( 0.5735905 -0.0551321 -0.1266937), wk = 0.0028249 k( 188) = ( 0.5797231 -0.0735786 -0.1266937), wk = 0.0028249 k( 189) = ( 0.5858556 -0.0920250 -0.1266937), wk = 0.0028249 k( 190) = ( 0.5919882 -0.1104715 -0.1266937), wk = 0.0028249 k( 191) = ( 0.5981207 -0.1289179 -0.1266937), wk = 0.0028249 k( 192) = ( 0.6042533 -0.1473644 -0.1266937), wk = 0.0028249 k( 193) = ( 0.6103858 -0.1658109 -0.1266937), wk = 0.0028249 k( 194) = ( 0.6165183 -0.1842574 -0.1266937), wk = 0.0028249 k( 195) = ( 0.6226509 -0.2027038 -0.1266937), wk = 0.0028249 k( 196) = ( 0.6287834 -0.2211503 -0.1266937), wk = 0.0028249 k( 197) = ( 0.6349160 -0.2395967 -0.1266937), wk = 0.0028249 k( 198) = ( 0.6410485 -0.2580432 -0.1266937), wk = 0.0028249 k( 199) = ( 0.6471811 -0.2764897 -0.1266937), wk = 0.0028249 k( 200) = ( 0.6533136 -0.2949361 -0.1266937), wk = 0.0028249 k( 201) = ( 0.6594462 -0.3133826 -0.1266937), wk = 0.0028249 k( 202) = ( 0.6655787 -0.3318291 -0.1266937), wk = 0.0028249 k( 203) = ( 0.6717112 -0.3502755 -0.1266937), wk = 0.0028249 k( 204) = ( 0.6778438 -0.3687220 -0.1266937), wk = 0.0028249 k( 205) = ( 0.6839763 -0.3871685 -0.1266937), wk = 0.0028249 k( 206) = ( 0.6901089 -0.4056149 -0.1266937), wk = 0.0028249 k( 207) = ( 0.6962414 -0.4240614 -0.1266937), wk = 0.0028249 k( 208) = ( 0.7023740 -0.4425078 -0.1266937), wk = 0.0028249 k( 209) = ( 0.7085065 -0.4609543 -0.1266937), wk = 0.0028249 k( 210) = ( 0.7146391 -0.4794008 -0.1266937), wk = 0.0028249 k( 211) = ( 0.7207716 -0.4978472 -0.1266937), wk = 0.0028249 k( 212) = ( 0.2792284 -0.8399086 -0.0000000), wk = 0.0028249 k( 213) = ( 0.2730233 -0.8212439 -0.0000000), wk = 0.0028249 k( 214) = ( 0.2668182 -0.8025793 -0.0000000), wk = 0.0028249 k( 215) = ( 0.2606132 -0.7839147 -0.0000000), wk = 0.0028249 k( 216) = ( 0.2544081 -0.7652500 -0.0000000), wk = 0.0028249 k( 217) = ( 0.2482030 -0.7465854 -0.0000000), wk = 0.0028249 k( 218) = ( 0.2419979 -0.7279207 -0.0000000), wk = 0.0028249 k( 219) = ( 0.2357929 -0.7092561 -0.0000000), wk = 0.0028249 k( 220) = ( 0.2295878 -0.6905915 -0.0000000), wk = 0.0028249 k( 221) = ( 0.2233827 -0.6719269 -0.0000000), wk = 0.0028249 k( 222) = ( 0.2171776 -0.6532622 -0.0000000), wk = 0.0028249 k( 223) = ( 0.2109726 -0.6345976 -0.0000000), wk = 0.0028249 k( 224) = ( 0.2047675 -0.6159329 -0.0000000), wk = 0.0028249 k( 225) = ( 0.1985624 -0.5972683 -0.0000000), wk = 0.0028249 k( 226) = ( 0.1923573 -0.5786037 -0.0000000), wk = 0.0028249 k( 227) = ( 0.1861523 -0.5599390 -0.0000000), wk = 0.0028249 k( 228) = ( 0.1799472 -0.5412744 -0.0000000), wk = 0.0028249 k( 229) = ( 0.1737421 -0.5226098 -0.0000000), wk = 0.0028249 k( 230) = ( 0.1675370 -0.5039451 -0.0000000), wk = 0.0028249 k( 231) = ( 0.1613320 -0.4852805 -0.0000000), wk = 0.0028249 k( 232) = ( 0.1551269 -0.4666159 -0.0000000), wk = 0.0028249 k( 233) = ( 0.1489218 -0.4479512 -0.0000000), wk = 0.0028249 k( 234) = ( 0.1427167 -0.4292866 -0.0000000), wk = 0.0028249 k( 235) = ( 0.1365117 -0.4106220 -0.0000000), wk = 0.0028249 k( 236) = ( 0.1303066 -0.3919573 -0.0000000), wk = 0.0028249 k( 237) = ( 0.1241015 -0.3732927 -0.0000000), wk = 0.0028249 k( 238) = ( 0.1178964 -0.3546280 -0.0000000), wk = 0.0028249 k( 239) = ( 0.1116914 -0.3359634 -0.0000000), wk = 0.0028249 k( 240) = ( 0.1054863 -0.3172988 -0.0000000), wk = 0.0028249 k( 241) = ( 0.0992812 -0.2986342 -0.0000000), wk = 0.0028249 k( 242) = ( 0.0930761 -0.2799695 -0.0000000), wk = 0.0028249 k( 243) = ( 0.0868711 -0.2613049 -0.0000000), wk = 0.0028249 k( 244) = ( 0.0806660 -0.2426402 -0.0000000), wk = 0.0028249 k( 245) = ( 0.0744609 -0.2239756 -0.0000000), wk = 0.0028249 k( 246) = ( 0.0682558 -0.2053110 -0.0000000), wk = 0.0028249 k( 247) = ( 0.0620508 -0.1866463 -0.0000000), wk = 0.0028249 k( 248) = ( 0.0558457 -0.1679817 -0.0000000), wk = 0.0028249 k( 249) = ( 0.0496406 -0.1493171 -0.0000000), wk = 0.0028249 k( 250) = ( 0.0434355 -0.1306524 -0.0000000), wk = 0.0028249 k( 251) = ( 0.0372304 -0.1119878 -0.0000000), wk = 0.0028249 k( 252) = ( 0.0310254 -0.0933232 -0.0000000), wk = 0.0028249 k( 253) = ( 0.0248203 -0.0746585 -0.0000000), wk = 0.0028249 k( 254) = ( 0.0186152 -0.0559939 -0.0000000), wk = 0.0028249 k( 255) = ( 0.0124102 -0.0373293 -0.0000000), wk = 0.0028249 k( 256) = ( 0.0062051 -0.0186646 -0.0000000), wk = 0.0028249 k( 257) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 258) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 259) = ( 0.0116279 -0.0155553 -0.0014732), wk = 0.0028249 k( 260) = ( 0.0232558 -0.0311106 -0.0029464), wk = 0.0028249 k( 261) = ( 0.0348837 -0.0466659 -0.0044195), wk = 0.0028249 k( 262) = ( 0.0465116 -0.0622212 -0.0058927), wk = 0.0028249 k( 263) = ( 0.0581395 -0.0777765 -0.0073659), wk = 0.0028249 k( 264) = ( 0.0697674 -0.0933318 -0.0088391), wk = 0.0028249 k( 265) = ( 0.0813954 -0.1088871 -0.0103123), wk = 0.0028249 k( 266) = ( 0.0930233 -0.1244424 -0.0117855), wk = 0.0028249 k( 267) = ( 0.1046512 -0.1399977 -0.0132586), wk = 0.0028249 k( 268) = ( 0.1162791 -0.1555530 -0.0147318), wk = 0.0028249 k( 269) = ( 0.1279070 -0.1711083 -0.0162050), wk = 0.0028249 k( 270) = ( 0.1395349 -0.1866636 -0.0176782), wk = 0.0028249 k( 271) = ( 0.1511628 -0.2022189 -0.0191514), wk = 0.0028249 k( 272) = ( 0.1627907 -0.2177742 -0.0206246), wk = 0.0028249 k( 273) = ( 0.1744186 -0.2333295 -0.0220977), wk = 0.0028249 k( 274) = ( 0.1860465 -0.2488848 -0.0235709), wk = 0.0028249 k( 275) = ( 0.1976744 -0.2644401 -0.0250441), wk = 0.0028249 k( 276) = ( 0.2093023 -0.2799954 -0.0265173), wk = 0.0028249 k( 277) = ( 0.2209302 -0.2955507 -0.0279905), wk = 0.0028249 k( 278) = ( 0.2325581 -0.3111060 -0.0294637), wk = 0.0028249 k( 279) = ( 0.2441860 -0.3266613 -0.0309368), wk = 0.0028249 k( 280) = ( 0.2558140 -0.3422166 -0.0324100), wk = 0.0028249 k( 281) = ( 0.2674419 -0.3577719 -0.0338832), wk = 0.0028249 k( 282) = ( 0.2790698 -0.3733272 -0.0353564), wk = 0.0028249 k( 283) = ( 0.2906977 -0.3888825 -0.0368296), wk = 0.0028249 k( 284) = ( 0.3023256 -0.4044378 -0.0383027), wk = 0.0028249 k( 285) = ( 0.3139535 -0.4199931 -0.0397759), wk = 0.0028249 k( 286) = ( 0.3255814 -0.4355484 -0.0412491), wk = 0.0028249 k( 287) = ( 0.3372093 -0.4511037 -0.0427223), wk = 0.0028249 k( 288) = ( 0.3488372 -0.4666590 -0.0441955), wk = 0.0028249 k( 289) = ( 0.3604651 -0.4822143 -0.0456687), wk = 0.0028249 k( 290) = ( 0.3720930 -0.4977696 -0.0471418), wk = 0.0028249 k( 291) = ( 0.3837209 -0.5133249 -0.0486150), wk = 0.0028249 k( 292) = ( 0.3953488 -0.5288802 -0.0500882), wk = 0.0028249 k( 293) = ( 0.4069767 -0.5444355 -0.0515614), wk = 0.0028249 k( 294) = ( 0.4186047 -0.5599908 -0.0530346), wk = 0.0028249 k( 295) = ( 0.4302326 -0.5755461 -0.0545078), wk = 0.0028249 k( 296) = ( 0.4418605 -0.5911014 -0.0559809), wk = 0.0028249 k( 297) = ( 0.4534884 -0.6066567 -0.0574541), wk = 0.0028249 k( 298) = ( 0.4651163 -0.6222120 -0.0589273), wk = 0.0028249 k( 299) = ( 0.4767442 -0.6377673 -0.0604005), wk = 0.0028249 k( 300) = ( 0.4883721 -0.6533226 -0.0618737), wk = 0.0028249 k( 301) = ( 0.5000000 -0.6688779 -0.0633469), wk = 0.0028249 k( 302) = ( 0.5000000 -0.6688779 0.5869846), wk = 0.0028249 k( 303) = ( 0.4903846 -0.6560149 0.5756964), wk = 0.0028249 k( 304) = ( 0.4807692 -0.6431518 0.5644083), wk = 0.0028249 k( 305) = ( 0.4711538 -0.6302888 0.5531201), wk = 0.0028249 k( 306) = ( 0.4615385 -0.6174258 0.5418319), wk = 0.0028249 k( 307) = ( 0.4519231 -0.6045627 0.5305438), wk = 0.0028249 k( 308) = ( 0.4423077 -0.5916997 0.5192556), wk = 0.0028249 k( 309) = ( 0.4326923 -0.5788366 0.5079674), wk = 0.0028249 k( 310) = ( 0.4230769 -0.5659736 0.4966793), wk = 0.0028249 k( 311) = ( 0.4134615 -0.5531106 0.4853911), wk = 0.0028249 k( 312) = ( 0.4038462 -0.5402475 0.4741029), wk = 0.0028249 k( 313) = ( 0.3942308 -0.5273845 0.4628148), wk = 0.0028249 k( 314) = ( 0.3846154 -0.5145215 0.4515266), wk = 0.0028249 k( 315) = ( 0.3750000 -0.5016584 0.4402384), wk = 0.0028249 k( 316) = ( 0.3653846 -0.4887954 0.4289503), wk = 0.0028249 k( 317) = ( 0.3557692 -0.4759324 0.4176621), wk = 0.0028249 k( 318) = ( 0.3461538 -0.4630693 0.4063740), wk = 0.0028249 k( 319) = ( 0.3365385 -0.4502063 0.3950858), wk = 0.0028249 k( 320) = ( 0.3269231 -0.4373432 0.3837976), wk = 0.0028249 k( 321) = ( 0.3173077 -0.4244802 0.3725094), wk = 0.0028249 k( 322) = ( 0.3076923 -0.4116172 0.3612213), wk = 0.0028249 k( 323) = ( 0.2980769 -0.3987541 0.3499331), wk = 0.0028249 k( 324) = ( 0.2884615 -0.3858911 0.3386450), wk = 0.0028249 k( 325) = ( 0.2788462 -0.3730281 0.3273568), wk = 0.0028249 k( 326) = ( 0.2692308 -0.3601650 0.3160686), wk = 0.0028249 k( 327) = ( 0.2596154 -0.3473020 0.3047805), wk = 0.0028249 k( 328) = ( 0.2500000 -0.3344390 0.2934923), wk = 0.0028249 k( 329) = ( 0.2403846 -0.3215759 0.2822041), wk = 0.0028249 k( 330) = ( 0.2307692 -0.3087129 0.2709160), wk = 0.0028249 k( 331) = ( 0.2211539 -0.2958498 0.2596278), wk = 0.0028249 k( 332) = ( 0.2115385 -0.2829868 0.2483396), wk = 0.0028249 k( 333) = ( 0.2019231 -0.2701238 0.2370515), wk = 0.0028249 k( 334) = ( 0.1923077 -0.2572607 0.2257633), wk = 0.0028249 k( 335) = ( 0.1826923 -0.2443977 0.2144751), wk = 0.0028249 k( 336) = ( 0.1730769 -0.2315347 0.2031870), wk = 0.0028249 k( 337) = ( 0.1634615 -0.2186716 0.1918988), wk = 0.0028249 k( 338) = ( 0.1538461 -0.2058086 0.1806106), wk = 0.0028249 k( 339) = ( 0.1442308 -0.1929455 0.1693225), wk = 0.0028249 k( 340) = ( 0.1346154 -0.1800825 0.1580343), wk = 0.0028249 k( 341) = ( 0.1250000 -0.1672195 0.1467461), wk = 0.0028249 k( 342) = ( 0.1153846 -0.1543564 0.1354580), wk = 0.0028249 k( 343) = ( 0.1057692 -0.1414934 0.1241698), wk = 0.0028249 k( 344) = ( 0.0961538 -0.1286304 0.1128817), wk = 0.0028249 k( 345) = ( 0.0865385 -0.1157673 0.1015935), wk = 0.0028249 k( 346) = ( 0.0769231 -0.1029043 0.0903053), wk = 0.0028249 k( 347) = ( 0.0673077 -0.0900413 0.0790172), wk = 0.0028249 k( 348) = ( 0.0576923 -0.0771782 0.0677290), wk = 0.0028249 k( 349) = ( 0.0480769 -0.0643152 0.0564408), wk = 0.0028249 k( 350) = ( 0.0384615 -0.0514521 0.0451527), wk = 0.0028249 k( 351) = ( 0.0288462 -0.0385891 0.0338645), wk = 0.0028249 k( 352) = ( 0.0192308 -0.0257261 0.0225763), wk = 0.0028249 k( 353) = ( 0.0096154 -0.0128630 0.0112882), wk = 0.0028249 k( 354) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 2) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0028249 k( 3) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0028249 k( 4) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0028249 k( 5) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0028249 k( 6) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0028249 k( 7) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0028249 k( 8) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0028249 k( 9) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0028249 k( 10) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0028249 k( 11) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0028249 k( 12) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0028249 k( 13) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0028249 k( 14) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0028249 k( 15) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0028249 k( 16) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0028249 k( 17) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0028249 k( 18) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0028249 k( 19) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0028249 k( 20) = ( 0.3392857 0.3392857 0.0000000), wk = 0.0028249 k( 21) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0028249 k( 22) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0028249 k( 23) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0028249 k( 24) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0028249 k( 25) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0028249 k( 26) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0028249 k( 27) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0028249 k( 28) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0028249 k( 29) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028249 k( 30) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028249 k( 31) = ( 0.5042671 0.5042671 0.0152096), wk = 0.0028249 k( 32) = ( 0.5085342 0.5085342 0.0304192), wk = 0.0028249 k( 33) = ( 0.5128012 0.5128012 0.0456288), wk = 0.0028249 k( 34) = ( 0.5170683 0.5170683 0.0608384), wk = 0.0028249 k( 35) = ( 0.5213354 0.5213354 0.0760480), wk = 0.0028249 k( 36) = ( 0.5256024 0.5256024 0.0912576), wk = 0.0028249 k( 37) = ( 0.5298695 0.5298695 0.1064672), wk = 0.0028249 k( 38) = ( 0.5341366 0.5341366 0.1216769), wk = 0.0028249 k( 39) = ( 0.5384037 0.5384037 0.1368865), wk = 0.0028249 k( 40) = ( 0.5426707 0.5426707 0.1520961), wk = 0.0028249 k( 41) = ( 0.5469378 0.5469378 0.1673057), wk = 0.0028249 k( 42) = ( 0.5512049 0.5512049 0.1825153), wk = 0.0028249 k( 43) = ( 0.5554720 0.5554720 0.1977249), wk = 0.0028249 k( 44) = ( 0.5597390 0.5597390 0.2129345), wk = 0.0028249 k( 45) = ( 0.5640061 0.5640061 0.2281441), wk = 0.0028249 k( 46) = ( 0.5682732 0.5682732 0.2433537), wk = 0.0028249 k( 47) = ( 0.5725402 0.5725402 0.2585633), wk = 0.0028249 k( 48) = ( 0.5768073 0.5768073 0.2737729), wk = 0.0028249 k( 49) = ( 0.5810744 0.5810744 0.2889825), wk = 0.0028249 k( 50) = ( 0.5853415 0.5853415 0.3041921), wk = 0.0028249 k( 51) = ( 0.5896085 0.5896085 0.3194017), wk = 0.0028249 k( 52) = ( 0.5938756 0.5938756 0.3346113), wk = 0.0028249 k( 53) = ( 0.5981427 0.5981427 0.3498210), wk = 0.0028249 k( 54) = ( 0.6024098 0.6024098 0.3650306), wk = 0.0028249 k( 55) = ( 0.6066768 0.6066768 0.3802402), wk = 0.0028249 k( 56) = ( 0.6109439 0.6109439 0.3954498), wk = 0.0028249 k( 57) = ( 0.6152110 0.6152110 0.4106594), wk = 0.0028249 k( 58) = ( 0.6194781 0.6194781 0.4258690), wk = 0.0028249 k( 59) = ( 0.6194781 0.6194781 0.4258690), wk = 0.0028249 k( 60) = ( 0.6075303 0.6075303 0.4332821), wk = 0.0028249 k( 61) = ( 0.5955824 0.5955824 0.4406952), wk = 0.0028249 k( 62) = ( 0.5836346 0.5836346 0.4481083), wk = 0.0028249 k( 63) = ( 0.5716868 0.5716868 0.4555214), wk = 0.0028249 k( 64) = ( 0.5597390 0.5597390 0.4629345), wk = 0.0028249 k( 65) = ( 0.5477912 0.5477912 0.4703476), wk = 0.0028249 k( 66) = ( 0.5358434 0.5358434 0.4777607), wk = 0.0028249 k( 67) = ( 0.5238956 0.5238956 0.4851738), wk = 0.0028249 k( 68) = ( 0.5119478 0.5119478 0.4925869), wk = 0.0028249 k( 69) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028249 k( 70) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028249 k( 71) = ( 0.5062414 0.4937586 0.5000000), wk = 0.0028249 k( 72) = ( 0.5124827 0.4875173 0.5000000), wk = 0.0028249 k( 73) = ( 0.5187241 0.4812759 0.5000000), wk = 0.0028249 k( 74) = ( 0.5249654 0.4750345 0.5000000), wk = 0.0028249 k( 75) = ( 0.5312068 0.4687932 0.5000000), wk = 0.0028249 k( 76) = ( 0.5374482 0.4625518 0.5000000), wk = 0.0028249 k( 77) = ( 0.5436895 0.4563105 0.5000000), wk = 0.0028249 k( 78) = ( 0.5499309 0.4500691 0.5000000), wk = 0.0028249 k( 79) = ( 0.5561723 0.4438277 0.5000000), wk = 0.0028249 k( 80) = ( 0.5624136 0.4375864 0.5000000), wk = 0.0028249 k( 81) = ( 0.5686550 0.4313450 0.5000000), wk = 0.0028249 k( 82) = ( 0.5748963 0.4251037 0.5000000), wk = 0.0028249 k( 83) = ( 0.5811377 0.4188623 0.5000000), wk = 0.0028249 k( 84) = ( 0.5873791 0.4126209 0.5000000), wk = 0.0028249 k( 85) = ( 0.5936204 0.4063796 0.5000000), wk = 0.0028249 k( 86) = ( 0.5998618 0.4001382 0.5000000), wk = 0.0028249 k( 87) = ( 0.6061031 0.3938969 0.5000000), wk = 0.0028249 k( 88) = ( 0.6123445 0.3876555 0.5000000), wk = 0.0028249 k( 89) = ( 0.6185859 0.3814141 0.5000000), wk = 0.0028249 k( 90) = ( 0.6248272 0.3751728 0.5000000), wk = 0.0028249 k( 91) = ( 0.6310686 0.3689314 0.5000000), wk = 0.0028249 k( 92) = ( 0.6373100 0.3626900 0.5000000), wk = 0.0028249 k( 93) = ( 0.6435513 0.3564487 0.5000000), wk = 0.0028249 k( 94) = ( 0.6497927 0.3502073 0.5000000), wk = 0.0028249 k( 95) = ( 0.6560340 0.3439660 0.5000000), wk = 0.0028249 k( 96) = ( 0.6622754 0.3377246 0.5000000), wk = 0.0028249 k( 97) = ( 0.6685167 0.3314832 0.5000000), wk = 0.0028249 k( 98) = ( 0.6747581 0.3252419 0.5000000), wk = 0.0028249 k( 99) = ( 0.6809995 0.3190005 0.5000000), wk = 0.0028249 k( 100) = ( 0.6872408 0.3127592 0.5000000), wk = 0.0028249 k( 101) = ( 0.6934822 0.3065178 0.5000000), wk = 0.0028249 k( 102) = ( 0.6997236 0.3002764 0.5000000), wk = 0.0028249 k( 103) = ( 0.7059649 0.2940351 0.5000000), wk = 0.0028249 k( 104) = ( 0.7122063 0.2877937 0.5000000), wk = 0.0028249 k( 105) = ( 0.7184476 0.2815524 0.5000000), wk = 0.0028249 k( 106) = ( 0.7246890 0.2753110 0.5000000), wk = 0.0028249 k( 107) = ( 0.7309304 0.2690696 0.5000000), wk = 0.0028249 k( 108) = ( 0.7371717 0.2628283 0.5000000), wk = 0.0028249 k( 109) = ( 0.2628283 -0.2628283 0.5000000), wk = 0.0028249 k( 110) = ( 0.2567160 -0.2567160 0.5000000), wk = 0.0028249 k( 111) = ( 0.2506037 -0.2506037 0.5000000), wk = 0.0028249 k( 112) = ( 0.2444914 -0.2444914 0.5000000), wk = 0.0028249 k( 113) = ( 0.2383791 -0.2383791 0.5000000), wk = 0.0028249 k( 114) = ( 0.2322668 -0.2322668 0.5000000), wk = 0.0028249 k( 115) = ( 0.2261546 -0.2261546 0.5000000), wk = 0.0028249 k( 116) = ( 0.2200423 -0.2200423 0.5000000), wk = 0.0028249 k( 117) = ( 0.2139300 -0.2139300 0.5000000), wk = 0.0028249 k( 118) = ( 0.2078177 -0.2078177 0.5000000), wk = 0.0028249 k( 119) = ( 0.2017054 -0.2017054 0.5000000), wk = 0.0028249 k( 120) = ( 0.1955931 -0.1955931 0.5000000), wk = 0.0028249 k( 121) = ( 0.1894809 -0.1894809 0.5000000), wk = 0.0028249 k( 122) = ( 0.1833686 -0.1833686 0.5000000), wk = 0.0028249 k( 123) = ( 0.1772563 -0.1772563 0.5000000), wk = 0.0028249 k( 124) = ( 0.1711440 -0.1711440 0.5000000), wk = 0.0028249 k( 125) = ( 0.1650317 -0.1650317 0.5000000), wk = 0.0028249 k( 126) = ( 0.1589194 -0.1589194 0.5000000), wk = 0.0028249 k( 127) = ( 0.1528071 -0.1528071 0.5000000), wk = 0.0028249 k( 128) = ( 0.1466948 -0.1466948 0.5000000), wk = 0.0028249 k( 129) = ( 0.1405826 -0.1405826 0.5000000), wk = 0.0028249 k( 130) = ( 0.1344703 -0.1344703 0.5000000), wk = 0.0028249 k( 131) = ( 0.1283580 -0.1283580 0.5000000), wk = 0.0028249 k( 132) = ( 0.1222457 -0.1222457 0.5000000), wk = 0.0028249 k( 133) = ( 0.1161334 -0.1161334 0.5000000), wk = 0.0028249 k( 134) = ( 0.1100211 -0.1100211 0.5000000), wk = 0.0028249 k( 135) = ( 0.1039088 -0.1039089 0.5000000), wk = 0.0028249 k( 136) = ( 0.0977966 -0.0977966 0.5000000), wk = 0.0028249 k( 137) = ( 0.0916843 -0.0916843 0.5000000), wk = 0.0028249 k( 138) = ( 0.0855720 -0.0855720 0.5000000), wk = 0.0028249 k( 139) = ( 0.0794597 -0.0794597 0.5000000), wk = 0.0028249 k( 140) = ( 0.0733474 -0.0733474 0.5000000), wk = 0.0028249 k( 141) = ( 0.0672351 -0.0672351 0.5000000), wk = 0.0028249 k( 142) = ( 0.0611228 -0.0611228 0.5000000), wk = 0.0028249 k( 143) = ( 0.0550106 -0.0550106 0.5000000), wk = 0.0028249 k( 144) = ( 0.0488983 -0.0488983 0.5000000), wk = 0.0028249 k( 145) = ( 0.0427860 -0.0427860 0.5000000), wk = 0.0028249 k( 146) = ( 0.0366737 -0.0366737 0.5000000), wk = 0.0028249 k( 147) = ( 0.0305614 -0.0305614 0.5000000), wk = 0.0028249 k( 148) = ( 0.0244491 -0.0244491 0.5000000), wk = 0.0028249 k( 149) = ( 0.0183369 -0.0183369 0.5000000), wk = 0.0028249 k( 150) = ( 0.0122246 -0.0122246 0.5000000), wk = 0.0028249 k( 151) = ( 0.0061123 -0.0061123 0.5000000), wk = 0.0028249 k( 152) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028249 k( 153) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028249 k( 154) = ( 0.0181201 0.0181201 0.5035300), wk = 0.0028249 k( 155) = ( 0.0362402 0.0362402 0.5070601), wk = 0.0028249 k( 156) = ( 0.0543603 0.0543603 0.5105902), wk = 0.0028249 k( 157) = ( 0.0724804 0.0724804 0.5141202), wk = 0.0028249 k( 158) = ( 0.0906005 0.0906005 0.5176502), wk = 0.0028249 k( 159) = ( 0.1087205 0.1087205 0.5211803), wk = 0.0028249 k( 160) = ( 0.1268406 0.1268406 0.5247103), wk = 0.0028249 k( 161) = ( 0.1449607 0.1449607 0.5282404), wk = 0.0028249 k( 162) = ( 0.1630808 0.1630808 0.5317704), wk = 0.0028249 k( 163) = ( 0.1812009 0.1812009 0.5353005), wk = 0.0028249 k( 164) = ( 0.1993210 0.1993210 0.5388305), wk = 0.0028249 k( 165) = ( 0.2174411 0.2174411 0.5423606), wk = 0.0028249 k( 166) = ( 0.2355612 0.2355612 0.5458906), wk = 0.0028249 k( 167) = ( 0.2536813 0.2536813 0.5494207), wk = 0.0028249 k( 168) = ( 0.2718014 0.2718014 0.5529507), wk = 0.0028249 k( 169) = ( 0.2899215 0.2899215 0.5564808), wk = 0.0028249 k( 170) = ( 0.3080416 0.3080416 0.5600108), wk = 0.0028249 k( 171) = ( 0.3261617 0.3261617 0.5635409), wk = 0.0028249 k( 172) = ( 0.3442818 0.3442818 0.5670709), wk = 0.0028249 k( 173) = ( 0.3624019 0.3624019 0.5706010), wk = 0.0028249 k( 174) = ( 0.3805219 0.3805219 0.5741310), wk = 0.0028249 k( 175) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028249 k( 176) = ( 0.5061325 0.4938675 -0.0000000), wk = 0.0028249 k( 177) = ( 0.5122651 0.4877349 -0.0000000), wk = 0.0028249 k( 178) = ( 0.5183976 0.4816024 -0.0000000), wk = 0.0028249 k( 179) = ( 0.5245302 0.4754698 -0.0000000), wk = 0.0028249 k( 180) = ( 0.5306627 0.4693373 -0.0000000), wk = 0.0028249 k( 181) = ( 0.5367953 0.4632047 -0.0000000), wk = 0.0028249 k( 182) = ( 0.5429278 0.4570722 -0.0000000), wk = 0.0028249 k( 183) = ( 0.5490604 0.4509396 -0.0000000), wk = 0.0028249 k( 184) = ( 0.5551929 0.4448071 -0.0000000), wk = 0.0028249 k( 185) = ( 0.5613255 0.4386745 -0.0000000), wk = 0.0028249 k( 186) = ( 0.5674580 0.4325420 -0.0000000), wk = 0.0028249 k( 187) = ( 0.5735905 0.4264095 -0.0000000), wk = 0.0028249 k( 188) = ( 0.5797231 0.4202769 -0.0000000), wk = 0.0028249 k( 189) = ( 0.5858556 0.4141444 -0.0000000), wk = 0.0028249 k( 190) = ( 0.5919882 0.4080118 -0.0000000), wk = 0.0028249 k( 191) = ( 0.5981207 0.4018793 -0.0000000), wk = 0.0028249 k( 192) = ( 0.6042533 0.3957467 -0.0000000), wk = 0.0028249 k( 193) = ( 0.6103858 0.3896142 -0.0000000), wk = 0.0028249 k( 194) = ( 0.6165183 0.3834817 -0.0000000), wk = 0.0028249 k( 195) = ( 0.6226509 0.3773491 -0.0000000), wk = 0.0028249 k( 196) = ( 0.6287834 0.3712166 -0.0000000), wk = 0.0028249 k( 197) = ( 0.6349160 0.3650840 -0.0000000), wk = 0.0028249 k( 198) = ( 0.6410485 0.3589515 -0.0000000), wk = 0.0028249 k( 199) = ( 0.6471811 0.3528189 -0.0000000), wk = 0.0028249 k( 200) = ( 0.6533136 0.3466864 -0.0000000), wk = 0.0028249 k( 201) = ( 0.6594462 0.3405538 -0.0000000), wk = 0.0028249 k( 202) = ( 0.6655787 0.3344213 -0.0000000), wk = 0.0028249 k( 203) = ( 0.6717112 0.3282887 -0.0000000), wk = 0.0028249 k( 204) = ( 0.6778438 0.3221562 -0.0000000), wk = 0.0028249 k( 205) = ( 0.6839763 0.3160237 -0.0000000), wk = 0.0028249 k( 206) = ( 0.6901089 0.3098911 -0.0000000), wk = 0.0028249 k( 207) = ( 0.6962414 0.3037586 -0.0000000), wk = 0.0028249 k( 208) = ( 0.7023740 0.2976260 -0.0000000), wk = 0.0028249 k( 209) = ( 0.7085065 0.2914935 -0.0000000), wk = 0.0028249 k( 210) = ( 0.7146391 0.2853609 -0.0000000), wk = 0.0028249 k( 211) = ( 0.7207716 0.2792284 -0.0000000), wk = 0.0028249 k( 212) = ( 0.2792284 -0.2792284 -0.0000000), wk = 0.0028249 k( 213) = ( 0.2730233 -0.2730233 -0.0000000), wk = 0.0028249 k( 214) = ( 0.2668182 -0.2668182 -0.0000000), wk = 0.0028249 k( 215) = ( 0.2606132 -0.2606132 -0.0000000), wk = 0.0028249 k( 216) = ( 0.2544081 -0.2544081 -0.0000000), wk = 0.0028249 k( 217) = ( 0.2482030 -0.2482030 -0.0000000), wk = 0.0028249 k( 218) = ( 0.2419979 -0.2419979 -0.0000000), wk = 0.0028249 k( 219) = ( 0.2357929 -0.2357929 -0.0000000), wk = 0.0028249 k( 220) = ( 0.2295878 -0.2295878 -0.0000000), wk = 0.0028249 k( 221) = ( 0.2233827 -0.2233827 -0.0000000), wk = 0.0028249 k( 222) = ( 0.2171776 -0.2171776 -0.0000000), wk = 0.0028249 k( 223) = ( 0.2109726 -0.2109726 -0.0000000), wk = 0.0028249 k( 224) = ( 0.2047675 -0.2047675 -0.0000000), wk = 0.0028249 k( 225) = ( 0.1985624 -0.1985624 -0.0000000), wk = 0.0028249 k( 226) = ( 0.1923573 -0.1923573 -0.0000000), wk = 0.0028249 k( 227) = ( 0.1861523 -0.1861523 -0.0000000), wk = 0.0028249 k( 228) = ( 0.1799472 -0.1799472 -0.0000000), wk = 0.0028249 k( 229) = ( 0.1737421 -0.1737421 -0.0000000), wk = 0.0028249 k( 230) = ( 0.1675370 -0.1675370 -0.0000000), wk = 0.0028249 k( 231) = ( 0.1613320 -0.1613320 -0.0000000), wk = 0.0028249 k( 232) = ( 0.1551269 -0.1551269 -0.0000000), wk = 0.0028249 k( 233) = ( 0.1489218 -0.1489218 -0.0000000), wk = 0.0028249 k( 234) = ( 0.1427167 -0.1427167 -0.0000000), wk = 0.0028249 k( 235) = ( 0.1365117 -0.1365117 -0.0000000), wk = 0.0028249 k( 236) = ( 0.1303066 -0.1303066 -0.0000000), wk = 0.0028249 k( 237) = ( 0.1241015 -0.1241015 -0.0000000), wk = 0.0028249 k( 238) = ( 0.1178964 -0.1178964 -0.0000000), wk = 0.0028249 k( 239) = ( 0.1116914 -0.1116914 -0.0000000), wk = 0.0028249 k( 240) = ( 0.1054863 -0.1054863 -0.0000000), wk = 0.0028249 k( 241) = ( 0.0992812 -0.0992812 -0.0000000), wk = 0.0028249 k( 242) = ( 0.0930761 -0.0930761 -0.0000000), wk = 0.0028249 k( 243) = ( 0.0868711 -0.0868711 -0.0000000), wk = 0.0028249 k( 244) = ( 0.0806660 -0.0806660 -0.0000000), wk = 0.0028249 k( 245) = ( 0.0744609 -0.0744609 -0.0000000), wk = 0.0028249 k( 246) = ( 0.0682558 -0.0682558 -0.0000000), wk = 0.0028249 k( 247) = ( 0.0620508 -0.0620508 -0.0000000), wk = 0.0028249 k( 248) = ( 0.0558457 -0.0558457 -0.0000000), wk = 0.0028249 k( 249) = ( 0.0496406 -0.0496406 -0.0000000), wk = 0.0028249 k( 250) = ( 0.0434355 -0.0434355 -0.0000000), wk = 0.0028249 k( 251) = ( 0.0372304 -0.0372304 -0.0000000), wk = 0.0028249 k( 252) = ( 0.0310254 -0.0310254 -0.0000000), wk = 0.0028249 k( 253) = ( 0.0248203 -0.0248203 -0.0000000), wk = 0.0028249 k( 254) = ( 0.0186152 -0.0186152 -0.0000000), wk = 0.0028249 k( 255) = ( 0.0124102 -0.0124102 -0.0000000), wk = 0.0028249 k( 256) = ( 0.0062051 -0.0062051 -0.0000000), wk = 0.0028249 k( 257) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 258) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 k( 259) = ( 0.0116279 -0.0000000 -0.0000000), wk = 0.0028249 k( 260) = ( 0.0232558 -0.0000000 -0.0000000), wk = 0.0028249 k( 261) = ( 0.0348837 -0.0000000 -0.0000000), wk = 0.0028249 k( 262) = ( 0.0465116 -0.0000000 -0.0000000), wk = 0.0028249 k( 263) = ( 0.0581395 -0.0000000 -0.0000000), wk = 0.0028249 k( 264) = ( 0.0697674 -0.0000000 -0.0000000), wk = 0.0028249 k( 265) = ( 0.0813954 -0.0000000 -0.0000000), wk = 0.0028249 k( 266) = ( 0.0930233 -0.0000000 -0.0000000), wk = 0.0028249 k( 267) = ( 0.1046512 -0.0000000 -0.0000000), wk = 0.0028249 k( 268) = ( 0.1162791 -0.0000000 -0.0000000), wk = 0.0028249 k( 269) = ( 0.1279070 -0.0000000 -0.0000000), wk = 0.0028249 k( 270) = ( 0.1395349 -0.0000000 -0.0000000), wk = 0.0028249 k( 271) = ( 0.1511628 -0.0000000 -0.0000000), wk = 0.0028249 k( 272) = ( 0.1627907 -0.0000000 -0.0000000), wk = 0.0028249 k( 273) = ( 0.1744186 -0.0000000 -0.0000000), wk = 0.0028249 k( 274) = ( 0.1860465 -0.0000000 -0.0000000), wk = 0.0028249 k( 275) = ( 0.1976744 -0.0000000 -0.0000000), wk = 0.0028249 k( 276) = ( 0.2093023 -0.0000000 -0.0000000), wk = 0.0028249 k( 277) = ( 0.2209302 -0.0000000 -0.0000000), wk = 0.0028249 k( 278) = ( 0.2325581 -0.0000000 -0.0000000), wk = 0.0028249 k( 279) = ( 0.2441860 -0.0000000 -0.0000000), wk = 0.0028249 k( 280) = ( 0.2558140 -0.0000000 -0.0000000), wk = 0.0028249 k( 281) = ( 0.2674419 -0.0000000 -0.0000000), wk = 0.0028249 k( 282) = ( 0.2790698 -0.0000000 -0.0000000), wk = 0.0028249 k( 283) = ( 0.2906977 -0.0000000 -0.0000000), wk = 0.0028249 k( 284) = ( 0.3023256 -0.0000000 -0.0000000), wk = 0.0028249 k( 285) = ( 0.3139535 -0.0000000 -0.0000000), wk = 0.0028249 k( 286) = ( 0.3255814 -0.0000000 -0.0000000), wk = 0.0028249 k( 287) = ( 0.3372093 -0.0000000 -0.0000000), wk = 0.0028249 k( 288) = ( 0.3488372 -0.0000000 -0.0000000), wk = 0.0028249 k( 289) = ( 0.3604651 -0.0000000 -0.0000000), wk = 0.0028249 k( 290) = ( 0.3720930 -0.0000000 -0.0000000), wk = 0.0028249 k( 291) = ( 0.3837209 -0.0000000 -0.0000000), wk = 0.0028249 k( 292) = ( 0.3953488 -0.0000000 -0.0000000), wk = 0.0028249 k( 293) = ( 0.4069767 -0.0000000 -0.0000000), wk = 0.0028249 k( 294) = ( 0.4186047 0.0000000 -0.0000000), wk = 0.0028249 k( 295) = ( 0.4302326 -0.0000000 -0.0000000), wk = 0.0028249 k( 296) = ( 0.4418605 -0.0000000 -0.0000000), wk = 0.0028249 k( 297) = ( 0.4534884 -0.0000000 -0.0000000), wk = 0.0028249 k( 298) = ( 0.4651163 -0.0000000 -0.0000000), wk = 0.0028249 k( 299) = ( 0.4767442 -0.0000000 -0.0000000), wk = 0.0028249 k( 300) = ( 0.4883721 -0.0000000 -0.0000000), wk = 0.0028249 k( 301) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0028249 k( 302) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0028249 k( 303) = ( 0.4903846 -0.0000000 0.4903846), wk = 0.0028249 k( 304) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0028249 k( 305) = ( 0.4711538 -0.0000000 0.4711538), wk = 0.0028249 k( 306) = ( 0.4615385 -0.0000000 0.4615385), wk = 0.0028249 k( 307) = ( 0.4519231 -0.0000000 0.4519231), wk = 0.0028249 k( 308) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0028249 k( 309) = ( 0.4326923 -0.0000000 0.4326923), wk = 0.0028249 k( 310) = ( 0.4230769 -0.0000000 0.4230769), wk = 0.0028249 k( 311) = ( 0.4134615 -0.0000000 0.4134615), wk = 0.0028249 k( 312) = ( 0.4038462 -0.0000000 0.4038462), wk = 0.0028249 k( 313) = ( 0.3942308 -0.0000000 0.3942308), wk = 0.0028249 k( 314) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0028249 k( 315) = ( 0.3750000 -0.0000000 0.3750000), wk = 0.0028249 k( 316) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0028249 k( 317) = ( 0.3557692 -0.0000000 0.3557692), wk = 0.0028249 k( 318) = ( 0.3461538 -0.0000000 0.3461539), wk = 0.0028249 k( 319) = ( 0.3365385 -0.0000000 0.3365385), wk = 0.0028249 k( 320) = ( 0.3269231 0.0000000 0.3269231), wk = 0.0028249 k( 321) = ( 0.3173077 -0.0000000 0.3173077), wk = 0.0028249 k( 322) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0028249 k( 323) = ( 0.2980769 -0.0000000 0.2980769), wk = 0.0028249 k( 324) = ( 0.2884615 -0.0000000 0.2884615), wk = 0.0028249 k( 325) = ( 0.2788462 -0.0000000 0.2788462), wk = 0.0028249 k( 326) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0028249 k( 327) = ( 0.2596154 -0.0000000 0.2596154), wk = 0.0028249 k( 328) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0028249 k( 329) = ( 0.2403846 -0.0000000 0.2403846), wk = 0.0028249 k( 330) = ( 0.2307692 -0.0000000 0.2307692), wk = 0.0028249 k( 331) = ( 0.2211539 0.0000000 0.2211539), wk = 0.0028249 k( 332) = ( 0.2115385 -0.0000000 0.2115385), wk = 0.0028249 k( 333) = ( 0.2019231 -0.0000000 0.2019231), wk = 0.0028249 k( 334) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0028249 k( 335) = ( 0.1826923 -0.0000000 0.1826923), wk = 0.0028249 k( 336) = ( 0.1730769 -0.0000000 0.1730769), wk = 0.0028249 k( 337) = ( 0.1634615 0.0000000 0.1634615), wk = 0.0028249 k( 338) = ( 0.1538461 -0.0000000 0.1538462), wk = 0.0028249 k( 339) = ( 0.1442308 -0.0000000 0.1442308), wk = 0.0028249 k( 340) = ( 0.1346154 -0.0000000 0.1346154), wk = 0.0028249 k( 341) = ( 0.1250000 -0.0000000 0.1250000), wk = 0.0028249 k( 342) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0028249 k( 343) = ( 0.1057692 -0.0000000 0.1057692), wk = 0.0028249 k( 344) = ( 0.0961538 -0.0000000 0.0961539), wk = 0.0028249 k( 345) = ( 0.0865385 -0.0000000 0.0865385), wk = 0.0028249 k( 346) = ( 0.0769231 -0.0000000 0.0769231), wk = 0.0028249 k( 347) = ( 0.0673077 -0.0000000 0.0673077), wk = 0.0028249 k( 348) = ( 0.0576923 -0.0000000 0.0576923), wk = 0.0028249 k( 349) = ( 0.0480769 -0.0000000 0.0480769), wk = 0.0028249 k( 350) = ( 0.0384615 -0.0000000 0.0384615), wk = 0.0028249 k( 351) = ( 0.0288462 -0.0000000 0.0288462), wk = 0.0028249 k( 352) = ( 0.0192308 -0.0000000 0.0192308), wk = 0.0028249 k( 353) = ( 0.0096154 -0.0000000 0.0096154), wk = 0.0028249 k( 354) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028249 Dense grid: 46583 G-vectors FFT dimensions: ( 60, 60, 45) Smooth grid: 31617 G-vectors FFT dimensions: ( 54, 54, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 226, 58) NL pseudopotentials 0.33 Mb ( 113, 192) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1295) G-vector shells 0.01 Mb ( 1257) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.80 Mb ( 226, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.34 Mb ( 192, 2, 58) The potential is recalculated from file : ./FeGe.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.4 secs Computing kpt #: 3 total cpu time spent up to now is 5.3 secs Computing kpt #: 4 total cpu time spent up to now is 6.4 secs Computing kpt #: 5 total cpu time spent up to now is 7.4 secs Computing kpt #: 6 total cpu time spent up to now is 8.3 secs Computing kpt #: 7 total cpu time spent up to now is 9.2 secs Computing kpt #: 8 total cpu time spent up to now is 10.2 secs Computing kpt #: 9 total cpu time spent up to now is 10.9 secs Computing kpt #: 10 total cpu time spent up to now is 11.7 secs Computing kpt #: 11 total cpu time spent up to now is 12.6 secs Computing kpt #: 12 total cpu time spent up to now is 13.4 secs Computing kpt #: 13 total cpu time spent up to now is 14.2 secs Computing kpt #: 14 total cpu time spent up to now is 15.3 secs Computing kpt #: 15 total cpu time spent up to now is 16.4 secs Computing kpt #: 16 total cpu time spent up to now is 17.5 secs Computing kpt #: 17 total cpu time spent up to now is 18.7 secs Computing kpt #: 18 total cpu time spent up to now is 19.8 secs Computing kpt #: 19 total cpu time spent up to now is 20.9 secs Computing kpt #: 20 total cpu time spent up to now is 22.0 secs Computing kpt #: 21 total cpu time spent up to now is 23.1 secs Computing kpt #: 22 total cpu time spent up to now is 24.2 secs Computing kpt #: 23 total cpu time spent up to now is 25.3 secs Computing kpt #: 24 total cpu time spent up to now is 26.4 secs Computing kpt #: 25 total cpu time spent up to now is 27.5 secs Computing kpt #: 26 total cpu time spent up to now is 28.8 secs Computing kpt #: 27 total cpu time spent up to now is 30.1 secs Computing kpt #: 28 total cpu time spent up to now is 31.4 secs Computing kpt #: 29 total cpu time spent up to now is 32.6 secs Computing kpt #: 30 total cpu time spent up to now is 33.7 secs Computing kpt #: 31 total cpu time spent up to now is 35.0 secs Computing kpt #: 32 total cpu time spent up to now is 36.4 secs Computing kpt #: 33 total cpu time spent up to now is 37.6 secs Computing kpt #: 34 total cpu time spent up to now is 38.7 secs Computing kpt #: 35 total cpu time spent up to now is 39.6 secs Computing kpt #: 36 total cpu time spent up to now is 40.6 secs Computing kpt #: 37 total cpu time spent up to now is 41.5 secs Computing kpt #: 38 total cpu time spent up to now is 42.2 secs Computing kpt #: 39 total cpu time spent up to now is 43.0 secs Computing kpt #: 40 total cpu time spent up to now is 43.8 secs Computing kpt #: 41 total cpu time spent up to now is 44.5 secs Computing kpt #: 42 total cpu time spent up to now is 45.3 secs Computing kpt #: 43 total cpu time spent up to now is 46.1 secs Computing kpt #: 44 total cpu time spent up to now is 47.0 secs Computing kpt #: 45 total cpu time spent up to now is 47.8 secs Computing kpt #: 46 total cpu time spent up to now is 48.6 secs Computing kpt #: 47 total cpu time spent up to now is 49.5 secs Computing kpt #: 48 total cpu time spent up to now is 50.3 secs Computing kpt #: 49 total cpu time spent up to now is 51.1 secs Computing kpt #: 50 total cpu time spent up to now is 51.9 secs Computing kpt #: 51 total cpu time spent up to now is 52.8 secs Computing kpt #: 52 total cpu time spent up to now is 53.8 secs Computing kpt #: 53 total cpu time spent up to now is 55.0 secs Computing kpt #: 54 total cpu time spent up to now is 56.1 secs Computing kpt #: 55 total cpu time spent up to now is 57.0 secs Computing kpt #: 56 total cpu time spent up to now is 57.8 secs Computing kpt #: 57 total cpu time spent up to now is 58.6 secs Computing kpt #: 58 total cpu time spent up to now is 59.4 secs Computing kpt #: 59 total cpu time spent up to now is 60.2 secs Computing kpt #: 60 total cpu time spent up to now is 60.9 secs Computing kpt #: 61 total cpu time spent up to now is 61.6 secs Computing kpt #: 62 total cpu time spent up to now is 62.3 secs Computing kpt #: 63 total cpu time spent up to now is 63.0 secs Computing kpt #: 64 total cpu time spent up to now is 63.7 secs Computing kpt #: 65 total cpu time spent up to now is 64.4 secs Computing kpt #: 66 total cpu time spent up to now is 65.1 secs Computing kpt #: 67 total cpu time spent up to now is 65.7 secs Computing kpt #: 68 total cpu time spent up to now is 66.4 secs Computing kpt #: 69 total cpu time spent up to now is 67.1 secs Computing kpt #: 70 total cpu time spent up to now is 67.8 secs Computing kpt #: 71 total cpu time spent up to now is 68.5 secs Computing kpt #: 72 total cpu time spent up to now is 69.2 secs Computing kpt #: 73 total cpu time spent up to now is 69.9 secs Computing kpt #: 74 total cpu time spent up to now is 70.6 secs Computing kpt #: 75 total cpu time spent up to now is 71.3 secs Computing kpt #: 76 total cpu time spent up to now is 71.9 secs Computing kpt #: 77 total cpu time spent up to now is 72.6 secs Computing kpt #: 78 total cpu time spent up to now is 73.3 secs Computing kpt #: 79 total cpu time spent up to now is 74.0 secs Computing kpt #: 80 total cpu time spent up to now is 74.7 secs Computing kpt #: 81 total cpu time spent up to now is 75.4 secs Computing kpt #: 82 total cpu time spent up to now is 76.2 secs Computing kpt #: 83 total cpu time spent up to now is 77.1 secs Computing kpt #: 84 total cpu time spent up to now is 78.1 secs Computing kpt #: 85 total cpu time spent up to now is 79.1 secs Computing kpt #: 86 total cpu time spent up to now is 80.4 secs Computing kpt #: 87 total cpu time spent up to now is 81.5 secs Computing kpt #: 88 total cpu time spent up to now is 82.9 secs Computing kpt #: 89 total cpu time spent up to now is 84.8 secs Computing kpt #: 90 total cpu time spent up to now is 85.9 secs Computing kpt #: 91 total cpu time spent up to now is 86.9 secs Computing kpt #: 92 total cpu time spent up to now is 87.8 secs Computing kpt #: 93 total cpu time spent up to now is 88.8 secs Computing kpt #: 94 total cpu time spent up to now is 89.9 secs Computing kpt #: 95 total cpu time spent up to now is 90.7 secs Computing kpt #: 96 total cpu time spent up to now is 91.8 secs Computing kpt #: 97 total cpu time spent up to now is 92.6 secs Computing kpt #: 98 total cpu time spent up to now is 93.7 secs Computing kpt #: 99 total cpu time spent up to now is 95.4 secs Computing kpt #: 100 total cpu time spent up to now is 97.2 secs Computing kpt #: 101 total cpu time spent up to now is 99.0 secs Computing kpt #: 102 total cpu time spent up to now is 100.3 secs Computing kpt #: 103 total cpu time spent up to now is 101.4 secs Computing kpt #: 104 total cpu time spent up to now is 102.5 secs Computing kpt #: 105 total cpu time spent up to now is 103.3 secs Computing kpt #: 106 total cpu time spent up to now is 104.1 secs Computing kpt #: 107 total cpu time spent up to now is 104.8 secs Computing kpt #: 108 total cpu time spent up to now is 105.6 secs Computing kpt #: 109 total cpu time spent up to now is 106.4 secs Computing kpt #: 110 total cpu time spent up to now is 107.1 secs Computing kpt #: 111 total cpu time spent up to now is 107.9 secs Computing kpt #: 112 total cpu time spent up to now is 108.7 secs Computing kpt #: 113 total cpu time spent up to now is 109.4 secs Computing kpt #: 114 total cpu time spent up to now is 110.2 secs Computing kpt #: 115 total cpu time spent up to now is 110.9 secs Computing kpt #: 116 total cpu time spent up to now is 111.7 secs Computing kpt #: 117 total cpu time spent up to now is 112.4 secs Computing kpt #: 118 total cpu time spent up to now is 113.2 secs Computing kpt #: 119 total cpu time spent up to now is 113.9 secs Computing kpt #: 120 total cpu time spent up to now is 114.7 secs Computing kpt #: 121 total cpu time spent up to now is 115.5 secs Computing kpt #: 122 total cpu time spent up to now is 116.2 secs Computing kpt #: 123 total cpu time spent up to now is 117.0 secs Computing kpt #: 124 total cpu time spent up to now is 117.7 secs Computing kpt #: 125 total cpu time spent up to now is 118.7 secs Computing kpt #: 126 total cpu time spent up to now is 119.6 secs Computing kpt #: 127 total cpu time spent up to now is 120.7 secs Computing kpt #: 128 total cpu time spent up to now is 121.8 secs Computing kpt #: 129 total cpu time spent up to now is 122.8 secs Computing kpt #: 130 total cpu time spent up to now is 123.7 secs Computing kpt #: 131 total cpu time spent up to now is 124.7 secs Computing kpt #: 132 total cpu time spent up to now is 125.8 secs Computing kpt #: 133 total cpu time spent up to now is 126.8 secs Computing kpt #: 134 total cpu time spent up to now is 127.6 secs Computing kpt #: 135 total cpu time spent up to now is 128.3 secs Computing kpt #: 136 total cpu time spent up to now is 129.0 secs Computing kpt #: 137 total cpu time spent up to now is 129.8 secs Computing kpt #: 138 total cpu time spent up to now is 130.5 secs Computing kpt #: 139 total cpu time spent up to now is 131.3 secs Computing kpt #: 140 total cpu time spent up to now is 132.0 secs Computing kpt #: 141 total cpu time spent up to now is 132.7 secs Computing kpt #: 142 total cpu time spent up to now is 133.4 secs Computing kpt #: 143 total cpu time spent up to now is 134.2 secs Computing kpt #: 144 total cpu time spent up to now is 135.0 secs Computing kpt #: 145 total cpu time spent up to now is 136.1 secs Computing kpt #: 146 total cpu time spent up to now is 136.8 secs Computing kpt #: 147 total cpu time spent up to now is 137.6 secs Computing kpt #: 148 total cpu time spent up to now is 138.3 secs Computing kpt #: 149 total cpu time spent up to now is 139.0 secs Computing kpt #: 150 total cpu time spent up to now is 139.7 secs Computing kpt #: 151 total cpu time spent up to now is 140.4 secs Computing kpt #: 152 total cpu time spent up to now is 141.1 secs Computing kpt #: 153 total cpu time spent up to now is 141.7 secs Computing kpt #: 154 total cpu time spent up to now is 142.4 secs Computing kpt #: 155 total cpu time spent up to now is 143.1 secs Computing kpt #: 156 total cpu time spent up to now is 143.8 secs Computing kpt #: 157 total cpu time spent up to now is 144.5 secs Computing kpt #: 158 total cpu time spent up to now is 145.1 secs Computing kpt #: 159 total cpu time spent up to now is 145.8 secs Computing kpt #: 160 total cpu time spent up to now is 146.5 secs Computing kpt #: 161 total cpu time spent up to now is 147.2 secs Computing kpt #: 162 total cpu time spent up to now is 147.9 secs Computing kpt #: 163 total cpu time spent up to now is 148.6 secs Computing kpt #: 164 total cpu time spent up to now is 149.3 secs Computing kpt #: 165 total cpu time spent up to now is 150.0 secs Computing kpt #: 166 total cpu time spent up to now is 150.7 secs Computing kpt #: 167 total cpu time spent up to now is 151.4 secs Computing kpt #: 168 total cpu time spent up to now is 152.2 secs Computing kpt #: 169 total cpu time spent up to now is 152.9 secs Computing kpt #: 170 total cpu time spent up to now is 153.6 secs Computing kpt #: 171 total cpu time spent up to now is 154.3 secs Computing kpt #: 172 total cpu time spent up to now is 155.1 secs Computing kpt #: 173 total cpu time spent up to now is 155.8 secs Computing kpt #: 174 total cpu time spent up to now is 156.6 secs Computing kpt #: 175 total cpu time spent up to now is 157.7 secs Computing kpt #: 176 total cpu time spent up to now is 159.0 secs Computing kpt #: 177 total cpu time spent up to now is 160.1 secs Computing kpt #: 178 total cpu time spent up to now is 161.0 secs Computing kpt #: 179 total cpu time spent up to now is 161.9 secs Computing kpt #: 180 total cpu time spent up to now is 162.7 secs Computing kpt #: 181 total cpu time spent up to now is 163.6 secs Computing kpt #: 182 total cpu time spent up to now is 164.3 secs Computing kpt #: 183 total cpu time spent up to now is 165.0 secs Computing kpt #: 184 total cpu time spent up to now is 165.6 secs Computing kpt #: 185 total cpu time spent up to now is 166.3 secs Computing kpt #: 186 total cpu time spent up to now is 167.0 secs Computing kpt #: 187 total cpu time spent up to now is 167.7 secs Computing kpt #: 188 total cpu time spent up to now is 168.3 secs Computing kpt #: 189 total cpu time spent up to now is 169.0 secs Computing kpt #: 190 total cpu time spent up to now is 169.7 secs Computing kpt #: 191 total cpu time spent up to now is 170.5 secs Computing kpt #: 192 total cpu time spent up to now is 171.3 secs Computing kpt #: 193 total cpu time spent up to now is 172.1 secs Computing kpt #: 194 total cpu time spent up to now is 172.8 secs Computing kpt #: 195 total cpu time spent up to now is 173.5 secs Computing kpt #: 196 total cpu time spent up to now is 174.2 secs Computing kpt #: 197 total cpu time spent up to now is 174.9 secs Computing kpt #: 198 total cpu time spent up to now is 175.6 secs Computing kpt #: 199 total cpu time spent up to now is 176.2 secs Computing kpt #: 200 total cpu time spent up to now is 176.9 secs Computing kpt #: 201 total cpu time spent up to now is 177.6 secs Computing kpt #: 202 total cpu time spent up to now is 178.2 secs Computing kpt #: 203 total cpu time spent up to now is 178.9 secs Computing kpt #: 204 total cpu time spent up to now is 179.6 secs Computing kpt #: 205 total cpu time spent up to now is 180.3 secs Computing kpt #: 206 total cpu time spent up to now is 181.1 secs Computing kpt #: 207 total cpu time spent up to now is 181.8 secs Computing kpt #: 208 total cpu time spent up to now is 182.7 secs Computing kpt #: 209 total cpu time spent up to now is 183.4 secs Computing kpt #: 210 total cpu time spent up to now is 184.1 secs Computing kpt #: 211 total cpu time spent up to now is 184.8 secs Computing kpt #: 212 total cpu time spent up to now is 185.5 secs Computing kpt #: 213 total cpu time spent up to now is 186.2 secs Computing kpt #: 214 total cpu time spent up to now is 186.9 secs Computing kpt #: 215 total cpu time spent up to now is 187.6 secs Computing kpt #: 216 total cpu time spent up to now is 188.3 secs Computing kpt #: 217 total cpu time spent up to now is 189.0 secs Computing kpt #: 218 total cpu time spent up to now is 189.7 secs Computing kpt #: 219 total cpu time spent up to now is 190.3 secs Computing kpt #: 220 total cpu time spent up to now is 191.0 secs Computing kpt #: 221 total cpu time spent up to now is 191.7 secs Computing kpt #: 222 total cpu time spent up to now is 192.4 secs Computing kpt #: 223 total cpu time spent up to now is 193.1 secs Computing kpt #: 224 total cpu time spent up to now is 193.8 secs Computing kpt #: 225 total cpu time spent up to now is 194.4 secs Computing kpt #: 226 total cpu time spent up to now is 195.1 secs Computing kpt #: 227 total cpu time spent up to now is 195.8 secs Computing kpt #: 228 total cpu time spent up to now is 196.5 secs Computing kpt #: 229 total cpu time spent up to now is 197.1 secs Computing kpt #: 230 total cpu time spent up to now is 197.9 secs Computing kpt #: 231 total cpu time spent up to now is 198.5 secs Computing kpt #: 232 total cpu time spent up to now is 199.2 secs Computing kpt #: 233 total cpu time spent up to now is 199.9 secs Computing kpt #: 234 total cpu time spent up to now is 200.6 secs Computing kpt #: 235 total cpu time spent up to now is 201.3 secs Computing kpt #: 236 total cpu time spent up to now is 202.0 secs Computing kpt #: 237 total cpu time spent up to now is 202.7 secs Computing kpt #: 238 total cpu time spent up to now is 203.4 secs Computing kpt #: 239 total cpu time spent up to now is 204.1 secs Computing kpt #: 240 total cpu time spent up to now is 204.8 secs Computing kpt #: 241 total cpu time spent up to now is 205.5 secs Computing kpt #: 242 total cpu time spent up to now is 206.1 secs Computing kpt #: 243 total cpu time spent up to now is 206.8 secs Computing kpt #: 244 total cpu time spent up to now is 207.5 secs Computing kpt #: 245 total cpu time spent up to now is 208.2 secs Computing kpt #: 246 total cpu time spent up to now is 208.9 secs Computing kpt #: 247 total cpu time spent up to now is 209.6 secs Computing kpt #: 248 total cpu time spent up to now is 210.3 secs Computing kpt #: 249 total cpu time spent up to now is 211.0 secs Computing kpt #: 250 total cpu time spent up to now is 211.8 secs Computing kpt #: 251 total cpu time spent up to now is 212.9 secs Computing kpt #: 252 total cpu time spent up to now is 213.7 secs Computing kpt #: 253 total cpu time spent up to now is 214.8 secs Computing kpt #: 254 total cpu time spent up to now is 215.9 secs Computing kpt #: 255 total cpu time spent up to now is 217.0 secs Computing kpt #: 256 total cpu time spent up to now is 218.1 secs Computing kpt #: 257 total cpu time spent up to now is 219.1 secs Computing kpt #: 258 total cpu time spent up to now is 220.1 secs Computing kpt #: 259 total cpu time spent up to now is 221.2 secs Computing kpt #: 260 total cpu time spent up to now is 222.0 secs Computing kpt #: 261 total cpu time spent up to now is 223.2 secs Computing kpt #: 262 total cpu time spent up to now is 224.2 secs Computing kpt #: 263 total cpu time spent up to now is 225.3 secs Computing kpt #: 264 total cpu time spent up to now is 226.3 secs Computing kpt #: 265 total cpu time spent up to now is 227.0 secs Computing kpt #: 266 total cpu time spent up to now is 227.7 secs Computing kpt #: 267 total cpu time spent up to now is 228.4 secs Computing kpt #: 268 total cpu time spent up to now is 229.2 secs Computing kpt #: 269 total cpu time spent up to now is 230.0 secs Computing kpt #: 270 total cpu time spent up to now is 230.8 secs Computing kpt #: 271 total cpu time spent up to now is 231.5 secs Computing kpt #: 272 total cpu time spent up to now is 232.2 secs Computing kpt #: 273 total cpu time spent up to now is 232.9 secs Computing kpt #: 274 total cpu time spent up to now is 233.6 secs Computing kpt #: 275 total cpu time spent up to now is 234.3 secs Computing kpt #: 276 total cpu time spent up to now is 235.1 secs Computing kpt #: 277 total cpu time spent up to now is 235.8 secs Computing kpt #: 278 total cpu time spent up to now is 236.5 secs Computing kpt #: 279 total cpu time spent up to now is 237.2 secs Computing kpt #: 280 total cpu time spent up to now is 237.9 secs Computing kpt #: 281 total cpu time spent up to now is 238.6 secs Computing kpt #: 282 total cpu time spent up to now is 239.3 secs Computing kpt #: 283 total cpu time spent up to now is 240.0 secs Computing kpt #: 284 total cpu time spent up to now is 240.7 secs Computing kpt #: 285 total cpu time spent up to now is 241.3 secs Computing kpt #: 286 total cpu time spent up to now is 242.0 secs Computing kpt #: 287 total cpu time spent up to now is 242.8 secs Computing kpt #: 288 total cpu time spent up to now is 243.6 secs Computing kpt #: 289 total cpu time spent up to now is 244.4 secs Computing kpt #: 290 total cpu time spent up to now is 245.2 secs Computing kpt #: 291 total cpu time spent up to now is 246.0 secs Computing kpt #: 292 total cpu time spent up to now is 246.8 secs Computing kpt #: 293 total cpu time spent up to now is 247.6 secs Computing kpt #: 294 total cpu time spent up to now is 248.4 secs Computing kpt #: 295 total cpu time spent up to now is 249.2 secs Computing kpt #: 296 total cpu time spent up to now is 250.0 secs Computing kpt #: 297 total cpu time spent up to now is 250.9 secs Computing kpt #: 298 total cpu time spent up to now is 251.7 secs Computing kpt #: 299 total cpu time spent up to now is 252.5 secs Computing kpt #: 300 total cpu time spent up to now is 253.3 secs Computing kpt #: 301 total cpu time spent up to now is 254.1 secs Computing kpt #: 302 total cpu time spent up to now is 254.8 secs Computing kpt #: 303 total cpu time spent up to now is 255.4 secs Computing kpt #: 304 total cpu time spent up to now is 256.1 secs Computing kpt #: 305 total cpu time spent up to now is 256.8 secs Computing kpt #: 306 total cpu time spent up to now is 257.5 secs Computing kpt #: 307 total cpu time spent up to now is 258.2 secs Computing kpt #: 308 total cpu time spent up to now is 258.9 secs Computing kpt #: 309 total cpu time spent up to now is 259.5 secs Computing kpt #: 310 total cpu time spent up to now is 260.2 secs Computing kpt #: 311 total cpu time spent up to now is 260.9 secs Computing kpt #: 312 total cpu time spent up to now is 261.6 secs Computing kpt #: 313 total cpu time spent up to now is 262.3 secs Computing kpt #: 314 total cpu time spent up to now is 263.0 secs Computing kpt #: 315 total cpu time spent up to now is 263.6 secs Computing kpt #: 316 total cpu time spent up to now is 264.3 secs Computing kpt #: 317 total cpu time spent up to now is 265.0 secs Computing kpt #: 318 total cpu time spent up to now is 265.7 secs Computing kpt #: 319 total cpu time spent up to now is 266.4 secs Computing kpt #: 320 total cpu time spent up to now is 267.1 secs Computing kpt #: 321 total cpu time spent up to now is 267.8 secs Computing kpt #: 322 total cpu time spent up to now is 268.5 secs Computing kpt #: 323 total cpu time spent up to now is 269.2 secs Computing kpt #: 324 total cpu time spent up to now is 269.9 secs Computing kpt #: 325 total cpu time spent up to now is 270.6 secs Computing kpt #: 326 total cpu time spent up to now is 271.3 secs Computing kpt #: 327 total cpu time spent up to now is 271.9 secs Computing kpt #: 328 total cpu time spent up to now is 272.6 secs Computing kpt #: 329 total cpu time spent up to now is 273.3 secs Computing kpt #: 330 total cpu time spent up to now is 274.0 secs Computing kpt #: 331 total cpu time spent up to now is 274.7 secs Computing kpt #: 332 total cpu time spent up to now is 275.4 secs Computing kpt #: 333 total cpu time spent up to now is 276.0 secs Computing kpt #: 334 total cpu time spent up to now is 276.7 secs Computing kpt #: 335 total cpu time spent up to now is 277.4 secs Computing kpt #: 336 total cpu time spent up to now is 278.1 secs Computing kpt #: 337 total cpu time spent up to now is 278.9 secs Computing kpt #: 338 total cpu time spent up to now is 279.8 secs Computing kpt #: 339 total cpu time spent up to now is 280.9 secs Computing kpt #: 340 total cpu time spent up to now is 281.9 secs Computing kpt #: 341 total cpu time spent up to now is 283.0 secs Computing kpt #: 342 total cpu time spent up to now is 284.1 secs Computing kpt #: 343 total cpu time spent up to now is 285.3 secs Computing kpt #: 344 total cpu time spent up to now is 286.3 secs Computing kpt #: 345 total cpu time spent up to now is 287.4 secs Computing kpt #: 346 total cpu time spent up to now is 288.5 secs Computing kpt #: 347 total cpu time spent up to now is 289.6 secs Computing kpt #: 348 total cpu time spent up to now is 290.6 secs Computing kpt #: 349 total cpu time spent up to now is 291.7 secs Computing kpt #: 350 total cpu time spent up to now is 292.8 secs Computing kpt #: 351 total cpu time spent up to now is 293.9 secs Computing kpt #: 352 total cpu time spent up to now is 294.9 secs Computing kpt #: 353 total cpu time spent up to now is 296.0 secs Computing kpt #: 354 total cpu time spent up to now is 297.0 secs ethr = 2.08E-08, avg # of iterations = 24.9 total cpu time spent up to now is 297.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3919 PWs) bands (ev): -1.7452 -1.7452 1.4884 1.4884 2.4955 2.4955 3.3576 3.3576 5.6017 5.6017 6.0023 6.0023 7.0202 7.0202 7.0869 7.0869 7.4714 7.4714 7.6997 7.6997 8.0405 8.0405 8.1175 8.1175 8.2288 8.2288 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.6204 9.6204 9.6461 9.6461 9.8519 9.8519 9.9885 9.9885 10.1791 10.1791 10.5369 10.5369 10.7980 10.7980 10.8528 10.8528 11.3718 11.3718 11.6011 11.6011 11.7265 11.7265 11.7276 11.7276 12.3303 12.3303 k = 0.0179 0.0059-0.0045 ( 3917 PWs) bands (ev): -1.7438 -1.7438 1.4790 1.4790 2.5024 2.5024 3.3574 3.3574 5.6041 5.6041 6.0031 6.0031 7.0195 7.0195 7.0871 7.0871 7.4707 7.4707 7.7007 7.7007 8.0413 8.0413 8.1190 8.1190 8.2294 8.2294 8.5592 8.5592 8.7374 8.7374 8.7597 8.7597 9.6140 9.6140 9.6506 9.6506 9.8513 9.8513 9.9878 9.9878 10.1797 10.1797 10.5376 10.5376 10.7984 10.7984 10.8529 10.8529 11.3714 11.3714 11.5758 11.5758 11.7263 11.7263 11.7538 11.7538 12.3272 12.3272 k = 0.0357 0.0119-0.0090 ( 3919 PWs) bands (ev): -1.7397 -1.7397 1.4517 1.4517 2.5221 2.5221 3.3569 3.3569 5.6110 5.6110 6.0056 6.0056 7.0173 7.0173 7.0878 7.0878 7.4688 7.4688 7.7036 7.7036 8.0437 8.0437 8.1238 8.1238 8.2313 8.2313 8.5597 8.5597 8.7385 8.7385 8.7607 8.7607 9.6006 9.6006 9.6584 9.6584 9.8497 9.8497 9.9856 9.9856 10.1812 10.1812 10.5395 10.5395 10.7997 10.7997 10.8532 10.8532 11.3702 11.3702 11.5262 11.5262 11.7247 11.7247 11.8069 11.8069 12.3190 12.3190 k = 0.0536 0.0178-0.0136 ( 3921 PWs) bands (ev): -1.7328 -1.7328 1.4088 1.4088 2.5526 2.5526 3.3560 3.3560 5.6222 5.6222 6.0100 6.0100 7.0139 7.0139 7.0889 7.0889 7.4660 7.4660 7.7083 7.7083 8.0466 8.0466 8.1322 8.1322 8.2344 8.2344 8.5604 8.5604 8.7403 8.7403 8.7624 8.7624 9.5844 9.5844 9.6653 9.6653 9.8469 9.8469 9.9823 9.9823 10.1838 10.1838 10.5427 10.5427 10.8018 10.8018 10.8537 10.8537 11.3681 11.3681 11.4716 11.4716 11.7221 11.7221 11.8675 11.8675 12.3079 12.3079 k = 0.0714 0.0237-0.0181 ( 3922 PWs) bands (ev): -1.7231 -1.7231 1.3529 1.3529 2.5910 2.5910 3.3548 3.3548 5.6371 5.6371 6.0168 6.0168 7.0093 7.0093 7.0908 7.0908 7.4625 7.4625 7.7148 7.7148 8.0491 8.0491 8.1446 8.1446 8.2388 8.2388 8.5614 8.5614 8.7429 8.7429 8.7648 8.7648 9.5667 9.5667 9.6703 9.6703 9.8428 9.8428 9.9778 9.9778 10.1873 10.1873 10.5471 10.5471 10.8045 10.8045 10.8544 10.8544 11.3650 11.3650 11.4165 11.4165 11.7185 11.7185 11.9309 11.9309 12.2957 12.2957 k = 0.0893 0.0297-0.0226 ( 3924 PWs) bands (ev): -1.7107 -1.7107 1.2869 1.2869 2.6347 2.6347 3.3533 3.3533 5.6547 5.6547 6.0267 6.0267 7.0036 7.0036 7.0936 7.0936 7.4589 7.4589 7.7228 7.7228 8.0504 8.0504 8.1609 8.1609 8.2444 8.2444 8.5627 8.5627 8.7463 8.7463 8.7679 8.7679 9.5478 9.5478 9.6731 9.6731 9.8374 9.8374 9.9727 9.9727 10.1916 10.1916 10.5525 10.5525 10.8079 10.8079 10.8555 10.8555 11.3582 11.3582 11.3652 11.3652 11.7138 11.7138 11.9956 11.9956 12.2838 12.2838 k = 0.1071 0.0356-0.0271 ( 3919 PWs) bands (ev): -1.6956 -1.6956 1.2132 1.2132 2.6813 2.6813 3.3516 3.3516 5.6740 5.6740 6.0404 6.0404 6.9970 6.9970 7.0976 7.0976 7.4554 7.4554 7.7322 7.7322 8.0503 8.0503 8.1805 8.1805 8.2513 8.2513 8.5640 8.5640 8.7507 8.7507 8.7719 8.7719 9.5282 9.5282 9.6735 9.6735 9.8306 9.8306 9.9672 9.9672 10.1966 10.1966 10.5589 10.5589 10.8116 10.8116 10.8570 10.8570 11.3090 11.3090 11.3572 11.3572 11.7083 11.7083 12.0610 12.0610 12.2729 12.2729 k = 0.1250 0.0416-0.0317 ( 3918 PWs) bands (ev): -1.6777 -1.6777 1.1336 1.1336 2.7290 2.7290 3.3495 3.3495 5.6934 5.6934 6.0592 6.0592 6.9896 6.9896 7.1032 7.1032 7.4524 7.4524 7.7428 7.7428 8.0486 8.0486 8.2026 8.2026 8.2593 8.2593 8.5652 8.5652 8.7560 8.7560 8.7766 8.7766 9.5081 9.5081 9.6716 9.6716 9.8224 9.8224 9.9617 9.9617 10.2018 10.2018 10.5662 10.5662 10.8155 10.8155 10.8589 10.8589 11.2582 11.2582 11.3517 11.3517 11.7019 11.7019 12.1264 12.1264 12.2637 12.2637 k = 0.1429 0.0475-0.0362 ( 3918 PWs) bands (ev): -1.6570 -1.6570 1.0497 1.0497 2.7766 2.7766 3.3473 3.3473 5.7115 5.7115 6.0840 6.0840 6.9815 6.9815 7.1106 7.1106 7.4501 7.4501 7.7543 7.7543 8.0454 8.0454 8.2260 8.2260 8.2685 8.2685 8.5663 8.5663 8.7622 8.7622 8.7822 8.7822 9.4877 9.4877 9.6674 9.6674 9.8127 9.8127 9.9565 9.9565 10.2072 10.2072 10.5741 10.5741 10.8193 10.8193 10.8614 10.8614 11.2096 11.2096 11.3457 11.3457 11.6947 11.6947 12.1911 12.1911 12.2570 12.2570 k = 0.1607 0.0534-0.0407 ( 3919 PWs) bands (ev): -1.6337 -1.6337 0.9626 0.9626 2.8230 2.8230 3.3448 3.3448 5.7269 5.7269 6.1157 6.1157 6.9731 6.9731 7.1204 7.1204 7.4488 7.4488 7.7667 7.7667 8.0405 8.0405 8.2500 8.2500 8.2788 8.2788 8.5669 8.5669 8.7691 8.7691 8.7891 8.7891 9.4674 9.4674 9.6612 9.6612 9.8015 9.8015 9.9519 9.9519 10.2125 10.2125 10.5824 10.5824 10.8228 10.8228 10.8646 10.8646 11.1633 11.1633 11.3390 11.3390 11.6870 11.6870 12.2418 12.2418 12.2659 12.2659 k = 0.1786 0.0594-0.0452 ( 3915 PWs) bands (ev): -1.6076 -1.6076 0.8732 0.8732 2.8675 2.8675 3.3422 3.3422 5.7389 5.7389 6.1546 6.1546 6.9643 6.9643 7.1328 7.1328 7.4487 7.4487 7.7796 7.7796 8.0341 8.0341 8.2738 8.2738 8.2902 8.2902 8.5671 8.5671 8.7764 8.7764 8.7977 8.7977 9.4473 9.4473 9.6528 9.6528 9.7891 9.7891 9.9481 9.9481 10.2174 10.2174 10.5912 10.5912 10.8258 10.8258 10.8684 10.8684 11.1197 11.1197 11.3317 11.3317 11.6789 11.6789 12.2443 12.2443 12.3245 12.3245 k = 0.1964 0.0653-0.0498 ( 3921 PWs) bands (ev): -1.5789 -1.5789 0.7823 0.7823 2.9097 2.9097 3.3395 3.3395 5.7471 5.7471 6.2004 6.2004 6.9553 6.9553 7.1481 7.1481 7.4497 7.4497 7.7928 7.7928 8.0259 8.0259 8.2964 8.2964 8.3030 8.3030 8.5666 8.5666 8.7835 8.7835 8.8086 8.8086 9.4278 9.4278 9.6426 9.6426 9.7755 9.7755 9.9451 9.9451 10.2215 10.2215 10.6003 10.6003 10.8282 10.8282 10.8726 10.8726 11.0790 11.0790 11.3241 11.3241 11.6704 11.6704 12.2436 12.2436 12.3871 12.3872 k = 0.2143 0.0712-0.0543 ( 3929 PWs) bands (ev): -1.5475 -1.5475 0.6904 0.6904 2.9492 2.9492 3.3367 3.3367 5.7516 5.7516 6.2523 6.2523 6.9463 6.9463 7.1663 7.1663 7.4522 7.4522 7.8062 7.8062 8.0158 8.0158 8.3145 8.3145 8.3197 8.3197 8.5651 8.5651 8.7901 8.7901 8.8219 8.8219 9.4090 9.4090 9.6308 9.6308 9.7612 9.7612 9.9431 9.9431 10.2246 10.2246 10.6094 10.6094 10.8300 10.8300 10.8770 10.8770 11.0413 11.0413 11.3162 11.3162 11.6619 11.6619 12.2445 12.2445 12.4489 12.4489 k = 0.2321 0.0772-0.0588 ( 3928 PWs) bands (ev): -1.5134 -1.5134 0.5980 0.5980 2.9860 2.9860 3.3338 3.3338 5.7530 5.7530 6.3091 6.3091 6.9373 6.9373 7.1877 7.1877 7.4564 7.4564 7.8196 7.8196 8.0040 8.0040 8.3291 8.3291 8.3393 8.3393 8.5624 8.5624 8.7962 8.7962 8.8377 8.8377 9.3912 9.3912 9.6176 9.6176 9.7464 9.7464 9.9418 9.9418 10.2266 10.2266 10.6186 10.6186 10.8313 10.8313 10.8812 10.8812 11.0071 11.0071 11.3085 11.3085 11.6534 11.6534 12.2470 12.2470 12.5089 12.5089 k = 0.2500 0.0831-0.0633 ( 3930 PWs) bands (ev): -1.4767 -1.4767 0.5055 0.5055 3.0198 3.0198 3.3309 3.3309 5.7518 5.7518 6.3695 6.3695 6.9285 6.9285 7.2120 7.2120 7.4624 7.4624 7.8327 7.8327 7.9902 7.9902 8.3439 8.3439 8.3574 8.3574 8.5585 8.5585 8.8015 8.8015 8.8556 8.8556 9.3748 9.3748 9.6032 9.6032 9.7315 9.7315 9.9413 9.9413 10.2271 10.2271 10.6278 10.6278 10.8322 10.8322 10.8845 10.8845 10.9767 10.9767 11.3010 11.3010 11.6451 11.6451 12.2508 12.2508 12.5668 12.5668 k = 0.2679 0.0890-0.0679 ( 3931 PWs) bands (ev): -1.4374 -1.4374 0.4133 0.4133 3.0506 3.0506 3.3281 3.3281 5.7485 5.7485 6.4322 6.4322 6.9200 6.9200 7.2387 7.2387 7.4708 7.4708 7.8454 7.8454 7.9746 7.9746 8.3592 8.3592 8.3736 8.3736 8.5530 8.5530 8.8061 8.8061 8.8752 8.8752 9.3600 9.3600 9.5878 9.5878 9.7166 9.7166 9.9414 9.9414 10.2261 10.2261 10.6368 10.6368 10.8327 10.8327 10.8861 10.8861 10.9508 10.9508 11.2941 11.2941 11.6370 11.6370 12.2555 12.2555 12.6216 12.6216 k = 0.2857 0.0950-0.0724 ( 3931 PWs) bands (ev): -1.3955 -1.3955 0.3216 0.3216 3.0786 3.0786 3.3253 3.3253 5.7438 5.7438 6.4959 6.4959 6.9118 6.9118 7.2670 7.2670 7.4823 7.4823 7.8573 7.8573 7.9575 7.9575 8.3749 8.3749 8.3881 8.3881 8.5460 8.5460 8.8098 8.8098 8.8960 8.8960 9.3470 9.3470 9.5716 9.5716 9.7021 9.7021 9.9420 9.9420 10.2235 10.2235 10.6457 10.6457 10.8328 10.8328 10.8843 10.8843 10.9307 10.9307 11.2880 11.2880 11.6292 11.6292 12.2607 12.2607 12.6722 12.6722 k = 0.3036 0.1009-0.0769 ( 3939 PWs) bands (ev): -1.3511 -1.3511 0.2308 0.2308 3.1038 3.1038 3.3226 3.3226 5.7379 5.7379 6.5594 6.5594 6.9041 6.9041 7.2957 7.2957 7.4976 7.4976 7.8678 7.8678 7.9395 7.9395 8.3905 8.3905 8.4008 8.4008 8.5375 8.5375 8.8125 8.8125 8.9177 8.9177 9.3360 9.3360 9.5549 9.5549 9.6880 9.6880 9.9431 9.9431 10.2193 10.2193 10.6544 10.6544 10.8324 10.8324 10.8772 10.8772 10.9181 10.9181 11.2828 11.2828 11.6215 11.6215 12.2656 12.2656 12.7149 12.7149 k = 0.3214 0.1069-0.0814 ( 3946 PWs) bands (ev): -1.3042 -1.3042 0.1409 0.1409 3.1263 3.1263 3.3200 3.3200 5.7314 5.7314 6.6216 6.6216 6.8969 6.8969 7.3234 7.3234 7.5177 7.5177 7.8751 7.8751 7.9227 7.9227 8.4055 8.4055 8.4125 8.4125 8.5272 8.5272 8.8142 8.8142 8.9396 8.9396 9.3274 9.3274 9.5377 9.5377 9.6748 9.6748 9.9444 9.9444 10.2138 10.2138 10.6628 10.6628 10.8316 10.8316 10.8661 10.8661 10.9117 10.9117 11.2788 11.2788 11.6141 11.6141 12.2697 12.2697 12.7462 12.7462 k = 0.3393 0.1128-0.0860 ( 3942 PWs) bands (ev): -1.2548 -1.2548 0.0523 0.0523 3.1462 3.1462 3.3176 3.3176 5.7245 5.7245 6.6814 6.6814 6.8905 6.8905 7.3487 7.3487 7.5428 7.5428 7.8738 7.8738 7.9130 7.9130 8.4175 8.4175 8.4255 8.4255 8.5155 8.5155 8.8148 8.8148 8.9615 8.9615 9.3212 9.3212 9.5204 9.5204 9.6623 9.6623 9.9459 9.9459 10.2071 10.2071 10.6711 10.6711 10.8302 10.8302 10.8544 10.8544 10.9080 10.9080 11.2760 11.2760 11.6068 11.6068 12.2722 12.2722 12.7716 12.7716 k = 0.3571 0.1187-0.0905 ( 3935 PWs) bands (ev): -1.2031 -1.2031 -0.0348 -0.0348 3.1637 3.1637 3.3154 3.3154 5.7176 5.7176 6.7378 6.7378 6.8849 6.8849 7.3709 7.3709 7.5721 7.5721 7.8611 7.8611 7.9144 7.9144 8.4256 8.4256 8.4402 8.4402 8.5025 8.5025 8.8142 8.8142 8.9828 8.9828 9.3175 9.3175 9.5030 9.5030 9.6509 9.6509 9.9476 9.9476 10.1995 10.1995 10.6792 10.6792 10.8276 10.8276 10.8445 10.8445 10.9048 10.9048 11.2743 11.2743 11.5996 11.5996 12.2728 12.2728 12.7966 12.7966 k = 0.3750 0.1247-0.0950 ( 3940 PWs) bands (ev): -1.1492 -1.1492 -0.1203 -0.1203 3.1788 3.1788 3.3133 3.3133 5.7110 5.7110 6.7896 6.7896 6.8805 6.8805 7.3903 7.3903 7.6023 7.6023 7.8453 7.8453 7.9204 7.9204 8.4311 8.4311 8.4548 8.4548 8.4887 8.4887 8.8125 8.8125 9.0029 9.0029 9.3163 9.3163 9.4856 9.4856 9.6405 9.6405 9.9492 9.9492 10.1915 10.1915 10.6871 10.6871 10.8234 10.8234 10.8376 10.8376 10.9014 10.9014 11.2733 11.2733 11.5924 11.5924 12.2711 12.2711 12.8232 12.8232 k = 0.3929 0.1306-0.0995 ( 3934 PWs) bands (ev): -1.0931 -1.0931 -0.2038 -0.2038 3.1916 3.1916 3.3115 3.3115 5.7048 5.7048 6.8340 6.8340 6.8796 6.8796 7.4077 7.4077 7.6285 7.6285 7.8340 7.8340 7.9270 7.9270 8.4338 8.4338 8.4676 8.4676 8.4765 8.4765 8.8099 8.8099 9.0215 9.0215 9.3177 9.3177 9.4684 9.4684 9.6312 9.6312 9.9507 9.9507 10.1835 10.1835 10.6947 10.6947 10.8181 10.8181 10.8332 10.8332 10.8978 10.8978 11.2731 11.2731 11.5855 11.5855 12.2674 12.2674 12.8522 12.8522 k = 0.4107 0.1365-0.1041 ( 3934 PWs) bands (ev): -1.0352 -1.0352 -0.2852 -0.2852 3.2023 3.2023 3.3100 3.3100 5.6993 5.6993 6.8578 6.8578 6.8944 6.8944 7.4240 7.4240 7.6437 7.6437 7.8331 7.8331 7.9333 7.9333 8.4313 8.4313 8.4639 8.4639 8.4829 8.4829 8.8067 8.8067 9.0382 9.0382 9.3212 9.3212 9.4517 9.4517 9.6231 9.6231 9.9521 9.9521 10.1758 10.1758 10.7019 10.7019 10.8127 10.8127 10.8300 10.8300 10.8942 10.8942 11.2734 11.2734 11.5788 11.5788 12.2621 12.2621 12.8833 12.8833 k = 0.4286 0.1425-0.1086 ( 3937 PWs) bands (ev): -0.9759 -0.9759 -0.3637 -0.3637 3.2109 3.2109 3.3087 3.3087 5.6945 5.6945 6.8603 6.8603 6.9250 6.9250 7.4399 7.4399 7.6440 7.6440 7.8450 7.8450 7.9386 7.9386 8.4217 8.4217 8.4599 8.4599 8.4939 8.4939 8.8032 8.8032 9.0525 9.0525 9.3268 9.3268 9.4356 9.4356 9.6162 9.6162 9.9533 9.9533 10.1689 10.1689 10.7086 10.7086 10.8081 10.8081 10.8272 10.8272 10.8909 10.8909 11.2739 11.2739 11.5726 11.5726 12.2560 12.2560 12.9157 12.9157 k = 0.4464 0.1484-0.1131 ( 3935 PWs) bands (ev): -0.9160 -0.9160 -0.4386 -0.4386 3.2175 3.2175 3.3076 3.3076 5.6907 5.6907 6.8591 6.8591 6.9531 6.9531 7.4558 7.4558 7.6330 7.6330 7.8649 7.8649 7.9429 7.9429 8.4087 8.4087 8.4595 8.4595 8.5032 8.5032 8.7999 8.7999 9.0641 9.0641 9.3340 9.3340 9.4204 9.4204 9.6108 9.6108 9.9543 9.9543 10.1632 10.1632 10.7145 10.7145 10.8042 10.8042 10.8247 10.8247 10.8881 10.8881 11.2745 11.2745 11.5673 11.5673 12.2499 12.2499 12.9470 12.9470 k = 0.4643 0.1544-0.1176 ( 3934 PWs) bands (ev): -0.8578 -0.8578 -0.5075 -0.5075 3.2222 3.2222 3.3069 3.3069 5.6879 5.6879 6.8578 6.8578 6.9742 6.9742 7.4710 7.4710 7.6172 7.6172 7.8852 7.8852 7.9460 7.9460 8.3965 8.3965 8.4600 8.4600 8.5103 8.5103 8.7971 8.7971 9.0726 9.0726 9.3421 9.3421 9.4066 9.4066 9.6067 9.6067 9.9550 9.9550 10.1588 10.1588 10.7193 10.7193 10.8013 10.8013 10.8227 10.8227 10.8859 10.8859 11.2750 11.2750 11.5633 11.5633 12.2449 12.2449 12.9729 12.9729 k = 0.4821 0.1603-0.1222 ( 3930 PWs) bands (ev): -0.8079 -0.8079 -0.5639 -0.5639 3.2250 3.2250 3.3065 3.3065 5.6862 5.6862 6.8568 6.8568 6.9873 6.9873 7.4832 7.4832 7.6032 7.6032 7.8998 7.8998 7.9479 7.9479 8.3879 8.3879 8.4606 8.4606 8.5147 8.5147 8.7953 8.7953 9.0779 9.0779 9.3499 9.3499 9.3955 9.3955 9.6043 9.6043 9.9554 9.9554 10.1561 10.1561 10.7224 10.7224 10.7995 10.7995 10.8213 10.8213 10.8847 10.8847 11.2754 11.2754 11.5607 11.5607 12.2416 12.2416 12.9890 12.9890 k = 0.5000 0.1662-0.1267 ( 3934 PWs) bands (ev): -0.7849 -0.7849 -0.5890 -0.5890 3.2259 3.2259 3.3063 3.3063 5.6856 5.6856 6.8565 6.8565 6.9917 6.9917 7.4882 7.4882 7.5974 7.5974 7.9051 7.9051 7.9485 7.9485 8.3848 8.3848 8.4608 8.4608 8.5162 8.5162 8.7946 8.7946 9.0796 9.0796 9.3535 9.3535 9.3906 9.3906 9.6035 9.6035 9.9555 9.9555 10.1552 10.1552 10.7235 10.7235 10.7988 10.7988 10.8208 10.8208 10.8842 10.8842 11.2755 11.2755 11.5598 11.5598 12.2404 12.2404 12.9942 12.9942 k = 0.5000 0.1662-0.1267 ( 3934 PWs) bands (ev): -0.7849 -0.7849 -0.5890 -0.5890 3.2259 3.2259 3.3063 3.3063 5.6856 5.6856 6.8565 6.8565 6.9917 6.9917 7.4882 7.4882 7.5974 7.5974 7.9051 7.9051 7.9485 7.9485 8.3848 8.3848 8.4608 8.4608 8.5162 8.5162 8.7946 8.7946 9.0796 9.0796 9.3535 9.3535 9.3906 9.3906 9.6035 9.6035 9.9555 9.9555 10.1552 10.1552 10.7235 10.7235 10.7988 10.7988 10.8208 10.8208 10.8842 10.8842 11.2755 11.2755 11.5598 11.5598 12.2404 12.2404 12.9942 12.9942 k = 0.5043 0.1676-0.1080 ( 3933 PWs) bands (ev): -0.7837 -0.7837 -0.5876 -0.5876 3.1892 3.1892 3.3360 3.3360 5.6909 5.6909 6.8570 6.8570 6.9875 6.9875 7.4815 7.4815 7.6070 7.6070 7.9049 7.9049 7.9477 7.9477 8.3688 8.3688 8.4761 8.4761 8.5162 8.5162 8.7934 8.7934 9.0792 9.0792 9.3370 9.3370 9.4095 9.4095 9.6042 9.6042 9.9542 9.9542 10.1556 10.1556 10.7207 10.7207 10.8001 10.8001 10.8232 10.8232 10.8863 10.8863 11.2748 11.2748 11.5625 11.5625 12.2386 12.2386 12.9922 12.9922 k = 0.5085 0.1691-0.0893 ( 3933 PWs) bands (ev): -0.7801 -0.7801 -0.5836 -0.5836 3.1231 3.1231 3.3810 3.3810 5.7068 5.7068 6.8584 6.8584 6.9750 6.9750 7.4667 7.4667 7.6300 7.6300 7.9043 7.9043 7.9452 7.9452 8.3375 8.3375 8.5039 8.5039 8.5180 8.5180 8.7896 8.7896 9.0780 9.0780 9.3119 9.3119 9.4415 9.4415 9.6066 9.6066 9.9504 9.9504 10.1568 10.1568 10.7140 10.7140 10.8020 10.8020 10.8295 10.8295 10.8939 10.8939 11.2728 11.2728 11.5704 11.5704 12.2335 12.2335 12.9813 12.9814 k = 0.5128 0.1705-0.0706 ( 3933 PWs) bands (ev): -0.7740 -0.7740 -0.5769 -0.5769 3.0473 3.0473 3.4221 3.4221 5.7327 5.7327 6.8606 6.8606 6.9551 6.9551 7.4510 7.4510 7.6581 7.6581 7.9033 7.9033 7.9411 7.9411 8.3039 8.3039 8.5126 8.5126 8.5404 8.5404 8.7835 8.7835 9.0762 9.0762 9.2883 9.2883 9.4766 9.4766 9.6104 9.6104 9.9442 9.9442 10.1587 10.1587 10.7054 10.7054 10.8027 10.8027 10.8363 10.8363 10.9095 10.9095 11.2696 11.2696 11.5835 11.5835 12.2250 12.2250 12.9545 12.9545 k = 0.5171 0.1719-0.0519 ( 3935 PWs) bands (ev): -0.7655 -0.7655 -0.5674 -0.5674 2.9649 2.9649 3.4568 3.4568 5.7678 5.7678 6.8631 6.8631 6.9294 6.9294 7.4377 7.4377 7.6861 7.6861 7.9019 7.9019 7.9356 7.9356 8.2721 8.2721 8.5115 8.5115 8.5706 8.5706 8.7752 8.7752 9.0738 9.0738 9.2674 9.2674 9.5133 9.5133 9.6155 9.6155 9.9362 9.9362 10.1613 10.1613 10.6963 10.6963 10.8015 10.8015 10.8415 10.8415 10.9337 10.9337 11.2653 11.2653 11.6016 11.6016 12.2134 12.2134 12.9183 12.9183 k = 0.5213 0.1733-0.0332 ( 3931 PWs) bands (ev): -0.7545 -0.7545 -0.5553 -0.5553 2.8770 2.8770 3.4848 3.4848 5.8110 5.8110 6.8636 6.8636 6.9017 6.9017 7.4277 7.4277 7.7102 7.7102 7.9007 7.9007 7.9292 7.9292 8.2444 8.2444 8.5087 8.5087 8.5992 8.5992 8.7651 8.7651 9.0710 9.0710 9.2496 9.2496 9.5506 9.5506 9.6222 9.6222 9.9269 9.9269 10.1644 10.1644 10.6873 10.6873 10.7979 10.7979 10.8463 10.8463 10.9645 10.9645 11.2602 11.2602 11.6245 11.6245 12.1993 12.1993 12.8808 12.8808 k = 0.5256 0.1747-0.0145 ( 3930 PWs) bands (ev): -0.7412 -0.7412 -0.5406 -0.5406 2.7845 2.7845 3.5059 3.5059 5.8611 5.8611 6.8489 6.8489 6.8867 6.8867 7.4210 7.4210 7.7261 7.7261 7.9004 7.9004 7.9231 7.9231 8.2228 8.2228 8.5043 8.5043 8.6249 8.6249 8.7538 8.7538 9.0681 9.0681 9.2351 9.2351 9.5862 9.5862 9.6319 9.6319 9.9168 9.9168 10.1679 10.1679 10.6786 10.6786 10.7915 10.7915 10.8522 10.8522 10.9992 10.9992 11.2548 11.2548 11.6515 11.6515 12.1829 12.1829 12.8453 12.8453 k = 0.5299 0.1762 0.0042 ( 3928 PWs) bands (ev): -0.7255 -0.7255 -0.5231 -0.5231 2.6881 2.6881 3.5205 3.5205 5.9166 5.9166 6.8166 6.8166 6.8888 6.8888 7.4173 7.4173 7.7296 7.7296 7.8993 7.8993 7.9214 7.9214 8.2088 8.2088 8.4975 8.4975 8.6475 8.6475 8.7418 8.7418 9.0652 9.0652 9.2241 9.2241 9.6126 9.6126 9.6515 9.6515 9.9066 9.9066 10.1717 10.1717 10.6699 10.6699 10.7825 10.7825 10.8599 10.8599 11.0355 11.0355 11.2497 11.2497 11.6821 11.6821 12.1650 12.1650 12.8133 12.8133 k = 0.5341 0.1776 0.0229 ( 3922 PWs) bands (ev): -0.7075 -0.7075 -0.5030 -0.5030 2.5885 2.5885 3.5288 3.5288 5.9757 5.9757 6.7810 6.7810 6.8953 6.8953 7.4160 7.4160 7.7191 7.7191 7.8931 7.8931 7.9296 7.9296 8.2028 8.2028 8.4879 8.4879 8.6665 8.6665 8.7299 8.7299 9.0622 9.0622 9.2165 9.2165 9.6246 9.6246 9.6851 9.6851 9.8971 9.8971 10.1757 10.1757 10.6612 10.6612 10.7714 10.7714 10.8698 10.8698 11.0707 11.0707 11.2462 11.2462 11.7151 11.7151 12.1464 12.1464 12.7855 12.7855 k = 0.5384 0.1790 0.0416 ( 3922 PWs) bands (ev): -0.6872 -0.6872 -0.4803 -0.4803 2.4863 2.4863 3.5311 3.5311 6.0366 6.0366 6.7467 6.7467 6.9037 6.9037 7.4167 7.4167 7.6963 7.6963 7.8835 7.8835 7.9449 7.9449 8.2048 8.2048 8.4751 8.4751 8.6815 8.6815 8.7191 8.7191 9.0593 9.0593 9.2122 9.2122 9.6298 9.6298 9.7243 9.7243 9.8891 9.8891 10.1794 10.1794 10.6524 10.6524 10.7584 10.7584 10.8821 10.8821 11.1015 11.1015 11.2468 11.2468 11.7490 11.7490 12.1278 12.1278 12.7622 12.7622 k = 0.5427 0.1804 0.0603 ( 3927 PWs) bands (ev): -0.6647 -0.6647 -0.4549 -0.4549 2.3820 2.3820 3.5275 3.5275 6.0969 6.0969 6.7164 6.7164 6.9134 6.9134 7.4190 7.4190 7.6643 7.6643 7.8725 7.8725 7.9632 7.9632 8.2136 8.2136 8.4588 8.4588 8.6910 8.6910 8.7114 8.7114 9.0564 9.0564 9.2113 9.2113 9.6316 9.6316 9.7648 9.7648 9.8832 9.8832 10.1829 10.1829 10.6431 10.6431 10.7440 10.7440 10.8968 10.8968 11.1235 11.1235 11.2552 11.2552 11.7818 11.7818 12.1102 12.1102 12.7437 12.7437 k = 0.5469 0.1818 0.0790 ( 3919 PWs) bands (ev): -0.6399 -0.6399 -0.4269 -0.4269 2.2761 2.2761 3.5186 3.5186 6.1538 6.1538 6.6928 6.6928 6.9242 6.9242 7.4225 7.4225 7.6262 7.6262 7.8609 7.8609 7.9828 7.9828 8.2280 8.2280 8.4388 8.4388 8.6911 8.6911 8.7111 8.7111 9.0535 9.0535 9.2134 9.2134 9.6302 9.6302 9.8053 9.8053 9.8804 9.8804 10.1858 10.1858 10.6333 10.6333 10.7284 10.7284 10.9143 10.9143 11.1339 11.1339 11.2736 11.2736 11.8112 11.8112 12.0944 12.0944 12.7307 12.7307 k = 0.5512 0.1832 0.0977 ( 3927 PWs) bands (ev): -0.6130 -0.6130 -0.3963 -0.3963 2.1691 2.1691 3.5044 3.5044 6.2037 6.2037 6.6789 6.6789 6.9360 6.9360 7.4267 7.4267 7.5846 7.5846 7.8488 7.8488 8.0025 8.0025 8.2465 8.2465 8.4154 8.4154 8.6855 8.6855 8.7145 8.7145 9.0503 9.0503 9.2185 9.2185 9.6256 9.6256 9.8436 9.8436 9.8826 9.8826 10.1880 10.1880 10.6226 10.6226 10.7119 10.7119 10.9344 10.9344 11.1344 11.1344 11.2999 11.2999 11.8349 11.8349 12.0807 12.0807 12.7238 12.7238 k = 0.5555 0.1847 0.1164 ( 3933 PWs) bands (ev): -0.5840 -0.5840 -0.3631 -0.3631 2.0614 2.0614 3.4852 3.4852 6.2430 6.2430 6.6778 6.6778 6.9486 6.9486 7.4315 7.4315 7.5415 7.5415 7.8365 7.8365 8.0223 8.0223 8.2680 8.2680 8.3888 8.3888 8.6795 8.6795 8.7166 8.7166 9.0468 9.0468 9.2264 9.2264 9.6179 9.6179 9.8704 9.8704 9.8988 9.8988 10.1892 10.1892 10.6109 10.6109 10.6947 10.6947 10.9575 10.9575 11.1292 11.1292 11.3301 11.3301 11.8514 11.8514 12.0689 12.0689 12.7240 12.7240 k = 0.5597 0.1861 0.1351 ( 3933 PWs) bands (ev): -0.5531 -0.5531 -0.3273 -0.3273 1.9535 1.9535 3.4613 3.4613 6.2691 6.2691 6.6910 6.6910 6.9623 6.9623 7.4359 7.4359 7.4994 7.4994 7.8243 7.8243 8.0421 8.0421 8.2914 8.2914 8.3597 8.3597 8.6740 8.6740 8.7163 8.7163 9.0429 9.0429 9.2370 9.2370 9.6074 9.6074 9.8813 9.8813 9.9331 9.9331 10.1893 10.1893 10.5979 10.5979 10.6770 10.6770 10.9838 10.9838 11.1211 11.1211 11.3611 11.3611 11.8602 11.8602 12.0582 12.0582 12.7324 12.7324 k = 0.5640 0.1875 0.1538 ( 3931 PWs) bands (ev): -0.5202 -0.5202 -0.2890 -0.2890 1.8456 1.8456 3.4330 3.4330 6.2824 6.2824 6.7169 6.7169 6.9768 6.9768 7.4350 7.4350 7.4648 7.4648 7.8122 7.8122 8.0618 8.0618 8.3148 8.3148 8.3296 8.3296 8.6691 8.6691 8.7134 8.7134 9.0387 9.0387 9.2499 9.2499 9.5945 9.5945 9.8906 9.8906 9.9704 9.9704 10.1881 10.1881 10.5833 10.5833 10.6591 10.6591 11.0133 11.0133 11.1119 11.1119 11.3914 11.3914 11.8625 11.8625 12.0470 12.0470 12.7493 12.7493 k = 0.5683 0.1889 0.1725 ( 3929 PWs) bands (ev): -0.4856 -0.4856 -0.2482 -0.2482 1.7381 1.7381 3.4004 3.4004 6.2857 6.2857 6.7507 6.7507 6.9921 6.9921 7.4107 7.4107 7.4577 7.4577 7.8003 7.8003 8.0816 8.0816 8.2945 8.2945 8.3421 8.3421 8.6647 8.6647 8.7080 8.7080 9.0340 9.0340 9.2652 9.2652 9.5796 9.5796 9.9011 9.9011 10.0071 10.0071 10.1854 10.1854 10.5669 10.5669 10.6410 10.6410 11.0460 11.0460 11.1027 11.1027 11.4198 11.4198 11.8596 11.8596 12.0347 12.0347 12.7749 12.7749 k = 0.5725 0.1903 0.1912 ( 3929 PWs) bands (ev): -0.4494 -0.4494 -0.2049 -0.2049 1.6314 1.6314 3.3640 3.3640 6.2828 6.2828 6.7865 6.7865 7.0081 7.0081 7.3805 7.3805 7.4631 7.4631 7.7888 7.7888 8.1012 8.1012 8.2603 8.2603 8.3674 8.3674 8.6605 8.6605 8.7004 8.7004 9.0290 9.0290 9.2825 9.2825 9.5633 9.5633 9.9130 9.9130 10.0424 10.0424 10.1814 10.1814 10.5485 10.5485 10.6229 10.6229 11.0789 11.0789 11.0974 11.0974 11.4454 11.4454 11.8531 11.8531 12.0216 12.0216 12.8087 12.8087 k = 0.5768 0.1918 0.2099 ( 3929 PWs) bands (ev): -0.4117 -0.4117 -0.1592 -0.1592 1.5259 1.5259 3.3241 3.3241 6.2764 6.2764 6.8183 6.8183 7.0247 7.0247 7.3571 7.3571 7.4711 7.4711 7.7778 7.7778 8.1203 8.1203 8.2251 8.2251 8.3927 8.3927 8.6566 8.6566 8.6909 8.6909 9.0238 9.0238 9.3017 9.3017 9.5460 9.5460 9.9261 9.9261 10.0757 10.0757 10.1759 10.1759 10.5278 10.5278 10.6049 10.6049 11.0818 11.0818 11.1265 11.1265 11.4676 11.4676 11.8438 11.8438 12.0091 12.0091 12.8500 12.8500 k = 0.5811 0.1932 0.2286 ( 3933 PWs) bands (ev): -0.3727 -0.3727 -0.1111 -0.1111 1.4218 1.4218 3.2808 3.2808 6.2684 6.2684 6.8413 6.8413 7.0421 7.0421 7.3437 7.3437 7.4812 7.4812 7.7672 7.7672 8.1386 8.1386 8.1892 8.1892 8.4176 8.4176 8.6529 8.6529 8.6799 8.6799 9.0185 9.0185 9.3227 9.3227 9.5280 9.5280 9.9401 9.9401 10.1062 10.1062 10.1697 10.1697 10.5048 10.5048 10.5872 10.5872 11.0750 11.0750 11.1700 11.1700 11.4854 11.4854 11.8320 11.8320 11.9995 11.9995 12.8979 12.8979 k = 0.5853 0.1946 0.2473 ( 3941 PWs) bands (ev): -0.3328 -0.3328 -0.0607 -0.0607 1.3197 1.3197 3.2348 3.2348 6.2597 6.2597 6.8528 6.8528 7.0600 7.0600 7.3411 7.3411 7.4942 7.4942 7.7573 7.7573 8.1496 8.1496 8.1593 8.1593 8.4418 8.4418 8.6490 8.6490 8.6680 8.6680 9.0134 9.0134 9.3453 9.3453 9.5096 9.5096 9.9550 9.9550 10.1304 10.1304 10.1660 10.1660 10.4795 10.4795 10.5698 10.5698 11.0688 11.0688 11.2177 11.2177 11.4982 11.4982 11.8181 11.8181 11.9948 11.9948 12.9514 12.9514 k = 0.5896 0.1960 0.2660 ( 3941 PWs) bands (ev): -0.2923 -0.2923 -0.0081 -0.0081 1.2199 1.2199 3.1862 3.1862 6.2505 6.2505 6.8530 6.8530 7.0787 7.0787 7.3471 7.3471 7.5113 7.5113 7.7479 7.7479 8.1155 8.1155 8.1729 8.1729 8.4648 8.4648 8.6446 8.6446 8.6565 8.6565 9.0088 9.0088 9.3694 9.3694 9.4911 9.4911 9.9704 9.9704 10.1358 10.1358 10.1772 10.1772 10.4520 10.4520 10.5529 10.5529 11.0636 11.0636 11.2693 11.2693 11.5056 11.5056 11.8027 11.8027 11.9964 11.9964 13.0095 13.0095 k = 0.5939 0.1974 0.2847 ( 3945 PWs) bands (ev): -0.2516 -0.2516 0.0465 0.0465 1.1231 1.1231 3.1356 3.1356 6.2404 6.2404 6.8449 6.8449 7.0979 7.0979 7.3572 7.3572 7.5341 7.5341 7.7392 7.7392 8.0792 8.0792 8.1866 8.1866 8.4860 8.4860 8.6381 8.6381 8.6480 8.6480 9.0047 9.0047 9.3946 9.3946 9.4728 9.4728 9.9864 9.9864 10.1266 10.1266 10.1993 10.1993 10.4226 10.4226 10.5365 10.5365 11.0596 11.0596 11.3245 11.3245 11.5072 11.5072 11.7869 11.7869 12.0046 12.0046 13.0698 13.0698 k = 0.5981 0.1989 0.3034 ( 3951 PWs) bands (ev): -0.2115 -0.2115 0.1031 0.1031 1.0301 1.0301 3.0834 3.0834 6.2289 6.2289 6.8323 6.8323 7.1177 7.1177 7.3669 7.3669 7.5631 7.5631 7.7311 7.7311 8.0432 8.0432 8.1978 8.1978 8.5041 8.5041 8.6306 8.6306 8.6433 8.6433 9.0015 9.0015 9.4202 9.4202 9.4554 9.4554 10.0026 10.0026 10.1131 10.1131 10.2219 10.2219 10.3915 10.3915 10.5207 10.5207 11.0567 11.0567 11.3828 11.3828 11.5036 11.5036 11.7715 11.7715 12.0192 12.0192 13.1207 13.1207 k = 0.6024 0.2003 0.3221 ( 3951 PWs) bands (ev): -0.1727 -0.1727 0.1613 0.1613 0.9420 0.9420 3.0299 3.0299 6.2150 6.2150 6.8190 6.8190 7.1378 7.1378 7.3736 7.3736 7.5976 7.5976 7.7237 7.7237 8.0080 8.0080 8.2059 8.2059 8.5173 8.5173 8.6266 8.6266 8.6401 8.6401 8.9994 8.9994 9.4319 9.4319 9.4535 9.4535 10.0190 10.0190 10.0977 10.0977 10.2431 10.2431 10.3592 10.3592 10.5055 10.5055 11.0548 11.0548 11.4435 11.4435 11.4962 11.4962 11.7572 11.7572 12.0396 12.0396 13.0951 13.0951 k = 0.6067 0.2017 0.3408 ( 3958 PWs) bands (ev): -0.1365 -0.1365 0.2207 0.2207 0.8603 0.8603 2.9757 2.9757 6.1981 6.1981 6.8080 6.8080 7.1582 7.1582 7.3763 7.3763 7.6352 7.6352 7.7171 7.7171 7.9739 7.9739 8.2102 8.2102 8.5240 8.5240 8.6289 8.6289 8.6376 8.6376 8.9986 8.9986 9.4169 9.4169 9.4799 9.4799 10.0348 10.0348 10.0815 10.0815 10.2621 10.2621 10.3264 10.3264 10.4908 10.4908 11.0538 11.0538 11.4793 11.4793 11.5132 11.5132 11.7441 11.7441 12.0649 12.0649 13.0382 13.0382 k = 0.6109 0.2031 0.3595 ( 3957 PWs) bands (ev): -0.1047 -0.1047 0.2805 0.2805 0.7875 0.7875 2.9212 2.9212 6.1774 6.1774 6.8015 6.8015 7.1788 7.1788 7.3749 7.3749 7.6715 7.6715 7.7138 7.7138 7.9414 7.9414 8.2108 8.2108 8.5246 8.5246 8.6342 8.6342 8.6391 8.6391 8.9994 8.9994 9.4006 9.4006 9.5091 9.5091 10.0448 10.0448 10.0700 10.0700 10.2757 10.2757 10.2969 10.2969 10.4766 10.4766 11.0538 11.0538 11.4678 11.4678 11.5779 11.5779 11.7321 11.7321 12.0944 12.0944 12.9754 12.9754 k = 0.6152 0.2045 0.3782 ( 3955 PWs) bands (ev): -0.0796 -0.0796 0.3391 0.3391 0.7274 0.7274 2.8668 2.8668 6.1527 6.1527 6.8004 6.8004 7.1995 7.1995 7.3697 7.3697 7.6887 7.6887 7.7287 7.7287 7.9111 7.9111 8.2076 8.2076 8.5211 8.5211 8.6329 8.6329 8.6522 8.6522 9.0018 9.0018 9.3849 9.3849 9.5396 9.5396 10.0345 10.0345 10.0779 10.0779 10.2557 10.2557 10.2992 10.2992 10.4629 10.4629 11.0545 11.0545 11.4538 11.4538 11.6464 11.6464 11.7209 11.7209 12.1273 12.1273 12.9099 12.9099 k = 0.6195 0.2059 0.3969 ( 3953 PWs) bands (ev): -0.0645 -0.0645 0.3938 0.3938 0.6857 0.6857 2.8131 2.8131 6.1241 6.1241 6.8055 6.8055 7.2200 7.2200 7.3610 7.3610 7.6843 7.6843 7.7624 7.7624 7.8840 7.8840 8.2012 8.2012 8.5157 8.5157 8.6315 8.6315 8.6678 8.6678 9.0058 9.0058 9.3703 9.3703 9.5708 9.5708 10.0152 10.0152 10.0937 10.0937 10.2242 10.2242 10.3122 10.3122 10.4497 10.4497 11.0559 11.0559 11.4400 11.4400 11.7082 11.7082 11.7183 11.7183 12.1631 12.1631 12.8434 12.8434 k = 0.6195 0.2059 0.3969 ( 3953 PWs) bands (ev): -0.0645 -0.0645 0.3938 0.3938 0.6857 0.6857 2.8131 2.8131 6.1241 6.1241 6.8055 6.8055 7.2200 7.2200 7.3610 7.3610 7.6843 7.6843 7.7624 7.7624 7.8840 7.8840 8.2012 8.2012 8.5157 8.5157 8.6315 8.6315 8.6678 8.6678 9.0058 9.0058 9.3703 9.3703 9.5708 9.5708 10.0152 10.0152 10.0937 10.0937 10.2242 10.2242 10.3122 10.3122 10.4497 10.4497 11.0559 11.0559 11.4400 11.4400 11.7082 11.7082 11.7183 11.7183 12.1631 12.1631 12.8434 12.8434 k = 0.6075 0.2020 0.4096 ( 3950 PWs) bands (ev): -0.0570 -0.0570 0.4373 0.4373 0.6661 0.6661 2.7326 2.7326 6.1579 6.1579 6.8395 6.8395 7.2341 7.2341 7.3666 7.3666 7.6837 7.6837 7.7643 7.7643 7.8592 7.8592 8.1777 8.1777 8.5022 8.5022 8.6308 8.6308 8.6847 8.6847 9.0158 9.0158 9.3526 9.3526 9.6016 9.6016 10.0093 10.0093 10.0976 10.0976 10.2010 10.2010 10.3133 10.3133 10.4291 10.4291 11.0683 11.0683 11.4267 11.4267 11.7266 11.7266 11.7482 11.7482 12.1737 12.1737 12.7990 12.7990 k = 0.5956 0.1980 0.4223 ( 3952 PWs) bands (ev): -0.0547 -0.0547 0.4846 0.4846 0.6499 0.6499 2.6545 2.6545 6.1911 6.1911 6.8689 6.8689 7.2482 7.2482 7.3705 7.3705 7.6821 7.6821 7.7678 7.7678 7.8369 7.8369 8.1538 8.1538 8.4898 8.4898 8.6301 8.6301 8.7017 8.7017 9.0251 9.0251 9.3351 9.3351 9.6324 9.6324 10.0019 10.0019 10.0997 10.0997 10.1796 10.1796 10.3142 10.3142 10.4101 10.4101 11.0796 11.0796 11.4144 11.4144 11.7433 11.7433 11.7784 11.7784 12.1831 12.1831 12.7555 12.7555 k = 0.5836 0.1940 0.4350 ( 3958 PWs) bands (ev): -0.0556 -0.0556 0.5308 0.5308 0.6393 0.6393 2.5797 2.5797 6.2231 6.2231 6.8936 6.8936 7.2623 7.2623 7.3732 7.3732 7.6792 7.6792 7.7719 7.7719 7.8185 7.8185 8.1301 8.1301 8.4791 8.4791 8.6295 8.6295 8.7182 8.7182 9.0336 9.0336 9.3181 9.3181 9.6630 9.6630 9.9927 9.9927 10.0997 10.0997 10.1609 10.1609 10.3149 10.3149 10.3928 10.3928 11.0898 11.0898 11.4034 11.4034 11.7587 11.7587 11.8079 11.8079 12.1909 12.1909 12.7136 12.7136 k = 0.5717 0.1901 0.4476 ( 3962 PWs) bands (ev): -0.0582 -0.0582 0.5658 0.5658 0.6416 0.6416 2.5097 2.5097 6.2533 6.2533 6.9134 6.9134 7.2760 7.2760 7.3751 7.3751 7.6746 7.6746 7.7739 7.7739 7.8071 7.8071 8.1071 8.1071 8.4701 8.4701 8.6291 8.6291 8.7336 8.7336 9.0412 9.0412 9.3022 9.3022 9.6933 9.6933 9.9816 9.9816 10.0969 10.0969 10.1460 10.1460 10.3154 10.3154 10.3776 10.3776 11.0986 11.0986 11.3936 11.3936 11.7728 11.7728 11.8363 11.8363 12.1973 12.1973 12.6741 12.6741 k = 0.5597 0.1861 0.4603 ( 3968 PWs) bands (ev): -0.0616 -0.0616 0.5775 0.5775 0.6669 0.6669 2.4460 2.4460 6.2808 6.2808 6.9286 6.9286 7.2889 7.2889 7.3768 7.3768 7.6684 7.6684 7.7703 7.7703 7.8059 7.8059 8.0855 8.0855 8.4628 8.4628 8.6286 8.6286 8.7475 8.7475 9.0477 9.0477 9.2875 9.2875 9.7230 9.7230 9.9683 9.9683 10.0909 10.0909 10.1359 10.1359 10.3157 10.3157 10.3646 10.3646 11.1061 11.1061 11.3853 11.3853 11.7852 11.7852 11.8628 11.8628 12.2024 12.2024 12.6378 12.6378 k = 0.5478 0.1821 0.4730 ( 3967 PWs) bands (ev): -0.0651 -0.0651 0.5755 0.5755 0.7033 0.7033 2.3901 2.3901 6.3049 6.3049 6.9394 6.9394 7.3007 7.3007 7.3784 7.3784 7.6609 7.6609 7.7639 7.7639 7.8112 7.8112 8.0659 8.0659 8.4573 8.4573 8.6283 8.6283 8.7594 8.7594 9.0532 9.0532 9.2747 9.2747 9.7521 9.7521 9.9530 9.9530 10.0829 10.0829 10.1301 10.1301 10.3159 10.3159 10.3540 10.3540 11.1122 11.1122 11.3786 11.3786 11.7957 11.7957 11.8866 11.8866 12.2061 12.2061 12.6056 12.6056 k = 0.5358 0.1781 0.4856 ( 3963 PWs) bands (ev): -0.0682 -0.0682 0.5709 0.5709 0.7377 0.7377 2.3439 2.3439 6.3248 6.3248 6.9467 6.9467 7.3106 7.3106 7.3801 7.3801 7.6531 7.6531 7.7585 7.7585 7.8182 7.8182 8.0493 8.0493 8.4532 8.4532 8.6281 8.6281 8.7691 8.7691 9.0576 9.0576 9.2642 9.2642 9.7800 9.7800 9.9358 9.9358 10.0747 10.0747 10.1270 10.1270 10.3160 10.3160 10.3458 10.3458 11.1170 11.1170 11.3733 11.3733 11.8042 11.8042 11.9069 11.9069 12.2088 12.2088 12.5788 12.5788 k = 0.5239 0.1742 0.4983 ( 3965 PWs) bands (ev): -0.0706 -0.0706 0.5668 0.5668 0.7648 0.7648 2.3092 2.3092 6.3397 6.3397 6.9510 6.9510 7.3183 7.3183 7.3816 7.3816 7.6463 7.6463 7.7548 7.7548 7.8247 7.8247 8.0363 8.0363 8.4505 8.4505 8.6279 8.6279 8.7763 8.7763 9.0609 9.0609 9.2563 9.2563 9.8062 9.8062 9.9172 9.9172 10.0680 10.0680 10.1253 10.1253 10.3161 10.3161 10.3399 10.3399 11.1205 11.1205 11.3696 11.3696 11.8104 11.8104 11.9224 11.9224 12.2105 12.2105 12.5584 12.5584 k = 0.5119 0.1702 0.5110 ( 3960 PWs) bands (ev): -0.0720 -0.0720 0.5642 0.5642 0.7821 0.7821 2.2876 2.2876 6.3490 6.3490 6.9532 6.9532 7.3231 7.3231 7.3827 7.3827 7.6416 7.6416 7.7527 7.7527 7.8292 7.8292 8.0280 8.0280 8.4489 8.4489 8.6278 8.6278 8.7807 8.7807 9.0628 9.0628 9.2514 9.2514 9.8288 9.8288 9.8993 9.8993 10.0637 10.0637 10.1246 10.1246 10.3161 10.3161 10.3364 10.3364 11.1225 11.1225 11.3673 11.3673 11.8142 11.8142 11.9323 11.9323 12.2116 12.2116 12.5456 12.5456 k = 0.5000 0.1662 0.5236 ( 3964 PWs) bands (ev): -0.0726 -0.0726 0.5633 0.5633 0.7880 0.7880 2.2803 2.2803 6.3521 6.3521 6.9539 6.9539 7.3248 7.3248 7.3831 7.3831 7.6399 7.6399 7.7521 7.7521 7.8307 7.8307 8.0252 8.0252 8.4484 8.4484 8.6276 8.6276 8.7821 8.7821 9.0635 9.0635 9.2498 9.2498 9.8398 9.8398 9.8897 9.8897 10.0623 10.0623 10.1244 10.1244 10.3162 10.3162 10.3352 10.3352 11.1232 11.1232 11.3666 11.3666 11.8155 11.8155 11.9356 11.9356 12.2119 12.2119 12.5413 12.5413 k = 0.5000 0.1662 0.5236 ( 3964 PWs) bands (ev): -0.0726 -0.0726 0.5633 0.5633 0.7880 0.7880 2.2803 2.2803 6.3521 6.3521 6.9539 6.9539 7.3248 7.3248 7.3831 7.3831 7.6399 7.6399 7.7521 7.7521 7.8307 7.8307 8.0252 8.0252 8.4484 8.4484 8.6276 8.6276 8.7821 8.7821 9.0635 9.0635 9.2498 9.2498 9.8398 9.8398 9.8897 9.8897 10.0623 10.0623 10.1244 10.1244 10.3162 10.3162 10.3352 10.3352 11.1232 11.1232 11.3666 11.3666 11.8155 11.8155 11.9356 11.9356 12.2119 12.2119 12.5413 12.5413 k = 0.5062 0.1475 0.5236 ( 3960 PWs) bands (ev): -0.0713 -0.0713 0.5645 0.5645 0.7891 0.7891 2.2811 2.2811 6.3501 6.3501 6.9515 6.9515 7.3225 7.3225 7.3828 7.3828 7.6376 7.6376 7.7347 7.7347 7.8298 7.8298 8.0424 8.0424 8.4469 8.4469 8.6306 8.6306 8.7823 8.7823 9.0636 9.0636 9.2505 9.2505 9.8393 9.8393 9.8885 9.8885 10.0637 10.0637 10.1236 10.1236 10.3145 10.3145 10.3367 10.3367 11.1228 11.1228 11.3672 11.3672 11.8150 11.8150 11.9284 11.9284 12.2089 12.2089 12.5455 12.5455 k = 0.5125 0.1287 0.5236 ( 3962 PWs) bands (ev): -0.0674 -0.0674 0.5682 0.5682 0.7923 0.7923 2.2838 2.2838 6.3440 6.3440 6.9442 6.9442 7.3153 7.3153 7.3817 7.3817 7.6307 7.6307 7.6905 7.6905 7.8297 7.8297 8.0837 8.0837 8.4429 8.4429 8.6385 8.6385 8.7827 8.7827 9.0641 9.0641 9.2528 9.2528 9.8376 9.8376 9.8846 9.8846 10.0678 10.0678 10.1214 10.1214 10.3099 10.3099 10.3407 10.3407 11.1216 11.1216 11.3692 11.3692 11.8129 11.8129 11.9081 11.9081 12.2005 12.2005 12.5575 12.5575 k = 0.5187 0.1099 0.5236 ( 3960 PWs) bands (ev): -0.0609 -0.0609 0.5743 0.5743 0.7975 0.7975 2.2881 2.2881 6.3337 6.3337 6.9318 6.9318 7.3025 7.3025 7.3801 7.3801 7.6184 7.6184 7.6353 7.6353 7.8316 7.8316 8.1346 8.1346 8.4371 8.4371 8.6506 8.6506 8.7835 8.7835 9.0647 9.0647 9.2566 9.2566 9.8348 9.8348 9.8781 9.8781 10.0745 10.0745 10.1182 10.1182 10.3030 10.3030 10.3468 10.3468 11.1194 11.1194 11.3723 11.3723 11.8055 11.8055 11.8800 11.8800 12.1884 12.1884 12.5756 12.5756 k = 0.5250 0.0911 0.5236 ( 3966 PWs) bands (ev): -0.0518 -0.0518 0.5828 0.5828 0.8049 0.8049 2.2941 2.2941 6.3187 6.3187 6.9139 6.9139 7.2825 7.2825 7.3778 7.3778 7.5719 7.5719 7.6084 7.6084 7.8351 7.8351 8.1876 8.1876 8.4305 8.4305 8.6660 8.6660 8.7845 8.7845 9.0657 9.0657 9.2618 9.2618 9.8308 9.8308 9.8691 9.8691 10.0836 10.0836 10.1140 10.1140 10.2941 10.2941 10.3545 10.3545 11.1163 11.1163 11.3763 11.3763 11.7820 11.7820 11.8572 11.8572 12.1744 12.1744 12.5978 12.5978 k = 0.5312 0.0724 0.5236 ( 3962 PWs) bands (ev): -0.0402 -0.0402 0.5938 0.5938 0.8143 0.8143 2.3018 2.3018 6.2986 6.2986 6.8901 6.8901 7.2535 7.2535 7.3749 7.3749 7.5161 7.5161 7.5924 7.5924 7.8398 7.8398 8.2396 8.2396 8.4240 8.4240 8.6835 8.6835 8.7859 8.7859 9.0668 9.0668 9.2681 9.2681 9.8258 9.8258 9.8578 9.8578 10.0947 10.0947 10.1093 10.1093 10.2837 10.2837 10.3638 10.3638 11.1121 11.1121 11.3810 11.3810 11.7358 11.7358 11.8487 11.8487 12.1600 12.1600 12.6222 12.6222 k = 0.5374 0.0536 0.5236 ( 3964 PWs) bands (ev): -0.0259 -0.0259 0.6072 0.6072 0.8258 0.8258 2.3111 2.3111 6.2729 6.2729 6.8600 6.8600 7.2133 7.2133 7.3709 7.3709 7.4681 7.4681 7.5760 7.5760 7.8453 7.8453 8.2888 8.2888 8.4181 8.4181 8.7026 8.7026 8.7879 8.7879 9.0683 9.0683 9.2753 9.2753 9.8194 9.8194 9.8442 9.8442 10.1029 10.1029 10.1091 10.1091 10.2723 10.2723 10.3742 10.3742 11.1068 11.1068 11.3860 11.3860 11.6758 11.6758 11.8480 11.8480 12.1466 12.1466 12.6474 12.6474 k = 0.5437 0.0348 0.5236 ( 3966 PWs) bands (ev): -0.0091 -0.0091 0.6229 0.6229 0.8392 0.8392 2.3219 2.3219 6.2408 6.2408 6.8232 6.8232 7.1621 7.1621 7.3656 7.3656 7.4307 7.4307 7.5599 7.5599 7.8515 7.8515 8.3343 8.3343 8.4133 8.4133 8.7227 8.7227 8.7904 8.7904 9.0699 9.0699 9.2834 9.2834 9.8116 9.8116 9.8287 9.8287 10.0985 10.0985 10.1229 10.1229 10.2601 10.2601 10.3858 10.3858 11.1002 11.1002 11.3909 11.3909 11.6089 11.6089 11.8503 11.8503 12.1349 12.1349 12.6724 12.6724 k = 0.5499 0.0160 0.5236 ( 3966 PWs) bands (ev): 0.0103 0.0103 0.6409 0.6409 0.8547 0.8547 2.3341 2.3341 6.2019 6.2019 6.7794 6.7794 7.1025 7.1025 7.3584 7.3584 7.4034 7.4034 7.5449 7.5449 7.8586 7.8586 8.3746 8.3746 8.4105 8.4105 8.7433 8.7433 8.7937 8.7937 9.0717 9.0717 9.2920 9.2920 9.8012 9.8012 9.8127 9.8127 10.0939 10.0939 10.1385 10.1385 10.2478 10.2478 10.3982 10.3982 11.0924 11.0924 11.3951 11.3951 11.5385 11.5385 11.8542 11.8542 12.1254 12.1254 12.6964 12.6964 k = 0.5562-0.0027 0.5236 ( 3966 PWs) bands (ev): 0.0322 0.0322 0.6613 0.6613 0.8720 0.8720 2.3477 2.3477 6.1556 6.1556 6.7286 6.7286 7.0381 7.0381 7.3493 7.3493 7.3840 7.3840 7.5319 7.5319 7.8663 7.8663 8.3994 8.3994 8.4199 8.4199 8.7643 8.7643 8.7982 8.7982 9.0737 9.0737 9.3007 9.3007 9.7853 9.7853 9.7993 9.7993 10.0896 10.0896 10.1546 10.1546 10.2357 10.2357 10.4112 10.4112 11.0834 11.0834 11.3975 11.3975 11.4673 11.4673 11.8588 11.8588 12.1184 12.1184 12.7190 12.7190 k = 0.5624-0.0215 0.5236 ( 3964 PWs) bands (ev): 0.0567 0.0567 0.6839 0.6839 0.8912 0.8912 2.3624 2.3624 6.1016 6.1016 6.6708 6.6708 6.9719 6.9719 7.3390 7.3390 7.3699 7.3699 7.5212 7.5212 7.8748 7.8748 8.4015 8.4015 8.4481 8.4481 8.7853 8.7853 8.8044 8.8044 9.0759 9.0759 9.3095 9.3095 9.7647 9.7647 9.7879 9.7879 10.0861 10.0861 10.1707 10.1707 10.2245 10.2245 10.4249 10.4249 11.0731 11.0731 11.3826 11.3826 11.4119 11.4119 11.8638 11.8638 12.1137 12.1137 12.7399 12.7399 k = 0.5687-0.0403 0.5236 ( 3966 PWs) bands (ev): 0.0836 0.0836 0.7087 0.7087 0.9122 0.9122 2.3783 2.3783 6.0401 6.0401 6.6064 6.6064 6.9060 6.9060 7.3288 7.3288 7.3585 7.3585 7.5129 7.5129 7.8840 7.8840 8.4016 8.4016 8.4739 8.4739 8.8049 8.8049 8.8139 8.8139 9.0782 9.0782 9.3179 9.3179 9.7418 9.7418 9.7764 9.7764 10.0833 10.0833 10.1845 10.1845 10.2159 10.2159 10.4389 10.4389 11.0616 11.0616 11.3175 11.3175 11.4057 11.4057 11.8689 11.8689 12.1106 12.1106 12.7588 12.7588 k = 0.5749-0.0591 0.5236 ( 3958 PWs) bands (ev): 0.1132 0.1132 0.7356 0.7356 0.9349 0.9349 2.3950 2.3950 5.9715 5.9715 6.5358 6.5358 6.8415 6.8415 7.3194 7.3194 7.3487 7.3487 7.5068 7.5068 7.8940 7.8940 8.4026 8.4026 8.4942 8.4942 8.8189 8.8189 8.8312 8.8312 9.0806 9.0806 9.3259 9.3259 9.7175 9.7175 9.7645 9.7645 10.0815 10.0815 10.1890 10.1890 10.2172 10.2172 10.4534 10.4534 11.0489 11.0489 11.2477 11.2477 11.4038 11.4038 11.8735 11.8735 12.1081 12.1081 12.7757 12.7757 k = 0.5811-0.0778 0.5236 ( 3960 PWs) bands (ev): 0.1452 0.1452 0.7646 0.7646 0.9593 0.9593 2.4124 2.4124 5.8963 5.8963 6.4597 6.4597 6.7788 6.7788 7.3106 7.3106 7.3402 7.3402 7.5026 7.5026 7.9047 7.9047 8.4046 8.4046 8.5087 8.5087 8.8317 8.8317 8.8520 8.8520 9.0831 9.0831 9.3332 9.3332 9.6923 9.6923 9.7520 9.7520 10.0807 10.0807 10.1826 10.1826 10.2292 10.2292 10.4680 10.4680 11.0351 11.0351 11.1795 11.1795 11.4004 11.4004 11.8773 11.8773 12.1040 12.1040 12.7902 12.7902 k = 0.5874-0.0966 0.5236 ( 3956 PWs) bands (ev): 0.1797 0.1797 0.7956 0.7956 0.9851 0.9851 2.4303 2.4303 5.8157 5.8157 6.3787 6.3787 6.7181 6.7181 7.3014 7.3014 7.3341 7.3341 7.4999 7.4999 7.9162 7.9162 8.4076 8.4076 8.5173 8.5173 8.8462 8.8462 8.8733 8.8733 9.0858 9.0858 9.3394 9.3394 9.6665 9.6665 9.7391 9.7391 10.0810 10.0810 10.1738 10.1738 10.2437 10.2437 10.4828 10.4828 11.0201 11.0201 11.1135 11.1135 11.3949 11.3949 11.8796 11.8796 12.0956 12.0956 12.8017 12.8017 k = 0.5936-0.1154 0.5236 ( 3958 PWs) bands (ev): 0.2166 0.2166 0.8284 0.8284 1.0124 1.0124 2.4484 2.4484 5.7308 5.7308 6.2936 6.2936 6.6592 6.6592 7.2908 7.2908 7.3312 7.3312 7.4982 7.4982 7.9284 7.9284 8.4118 8.4118 8.5201 8.5201 8.8626 8.8626 8.8945 8.8945 9.0885 9.0885 9.3446 9.3446 9.6404 9.6404 9.7259 9.7259 10.0821 10.0821 10.1648 10.1648 10.2580 10.2580 10.4977 10.4977 11.0040 11.0040 11.0505 11.0505 11.3871 11.3871 11.8795 11.8795 12.0792 12.0792 12.8063 12.8063 k = 0.5999-0.1342 0.5236 ( 3958 PWs) bands (ev): 0.2560 0.2560 0.8631 0.8631 1.0411 1.0411 2.4665 2.4665 5.6429 5.6429 6.2051 6.2051 6.6019 6.6019 7.2785 7.2785 7.3317 7.3317 7.4972 7.4972 7.9415 7.9415 8.4170 8.4170 8.5177 8.5177 8.8805 8.8805 8.9155 8.9155 9.0913 9.0913 9.3485 9.3485 9.6144 9.6144 9.7126 9.7126 10.0840 10.0840 10.1564 10.1564 10.2715 10.2715 10.5127 10.5127 10.9843 10.9843 10.9931 10.9931 11.3769 11.3769 11.8761 11.8761 12.0512 12.0512 12.7888 12.7888 k = 0.6061-0.1529 0.5236 ( 3962 PWs) bands (ev): 0.2978 0.2978 0.8994 0.8994 1.0708 1.0708 2.4841 2.4841 5.5533 5.5533 6.1138 6.1138 6.5459 6.5459 7.2646 7.2646 7.3351 7.3351 7.4966 7.4966 7.9552 7.9552 8.4233 8.4233 8.5105 8.5105 8.8995 8.8995 8.9362 8.9362 9.0943 9.0943 9.3510 9.3510 9.5889 9.5889 9.6995 9.6995 10.0864 10.0864 10.1486 10.1486 10.2838 10.2838 10.5276 10.5276 10.9325 10.9325 10.9700 10.9700 11.3642 11.3642 11.8679 11.8679 12.0092 12.0092 12.7572 12.7572 k = 0.6123-0.1717 0.5236 ( 3962 PWs) bands (ev): 0.3419 0.3419 0.9373 0.9373 1.1017 1.1017 2.5009 2.5009 5.4632 5.4632 6.0205 6.0205 6.4911 6.4911 7.2491 7.2491 7.3410 7.3410 7.4959 7.4959 7.9698 7.9698 8.4305 8.4305 8.4990 8.4990 8.9189 8.9189 8.9565 8.9565 9.0975 9.0975 9.3520 9.3520 9.5641 9.5641 9.6869 9.6869 10.0888 10.0888 10.1422 10.1422 10.2947 10.2947 10.5424 10.5424 10.8793 10.8793 10.9508 10.9508 11.3490 11.3490 11.8530 11.8530 11.9539 11.9539 12.7366 12.7366 k = 0.6186-0.1905 0.5236 ( 3952 PWs) bands (ev): 0.3885 0.3885 0.9767 0.9767 1.1333 1.1333 2.5165 2.5165 5.3737 5.3737 5.9258 5.9258 6.4373 6.4373 7.2321 7.2321 7.3491 7.3491 7.4951 7.4951 7.9852 7.9852 8.4386 8.4386 8.4836 8.4836 8.9384 8.9384 8.9763 8.9763 9.1011 9.1011 9.3515 9.3515 9.5403 9.5403 9.6752 9.6752 10.0906 10.0906 10.1375 10.1375 10.3045 10.3045 10.5571 10.5571 10.8296 10.8296 10.9308 10.9308 11.3308 11.3308 11.8292 11.8292 11.8887 11.8887 12.7051 12.7051 k = 0.6248-0.2093 0.5236 ( 3958 PWs) bands (ev): 0.4373 0.4373 1.0172 1.0172 1.1656 1.1656 2.5304 2.5304 5.2861 5.2861 5.8304 5.8304 6.3847 6.3847 7.2136 7.2136 7.3590 7.3590 7.4938 7.4938 8.0014 8.0014 8.4468 8.4468 8.4651 8.4651 8.9574 8.9574 8.9954 8.9954 9.1049 9.1049 9.3495 9.3495 9.5179 9.5179 9.6644 9.6644 10.0907 10.0907 10.1353 10.1353 10.3128 10.3128 10.5713 10.5713 10.7836 10.7836 10.9097 10.9097 11.3094 11.3094 11.7915 11.7915 11.8211 11.8211 12.6479 12.6479 k = 0.6311-0.2280 0.5236 ( 3960 PWs) bands (ev): 0.4884 0.4884 1.0588 1.0588 1.1984 1.1984 2.5422 2.5422 5.2014 5.2014 5.7348 5.7348 6.3332 6.3332 7.1934 7.1934 7.3703 7.3703 7.4919 7.4919 8.0185 8.0185 8.4395 8.4395 8.4596 8.4596 8.9755 8.9755 9.0134 9.0134 9.1094 9.1094 9.3458 9.3458 9.4972 9.4972 9.6552 9.6552 10.0886 10.0886 10.1359 10.1359 10.3198 10.3198 10.5848 10.5848 10.7417 10.7417 10.8874 10.8874 11.2842 11.2842 11.7304 11.7304 11.7638 11.7638 12.6027 12.6027 k = 0.6373-0.2468 0.5236 ( 3960 PWs) bands (ev): 0.5418 0.5418 1.1012 1.1012 1.2314 1.2314 2.5513 2.5513 5.1207 5.1207 5.6398 5.6398 6.2830 6.2830 7.1714 7.1714 7.3830 7.3830 7.4892 7.4892 8.0364 8.0364 8.4141 8.4141 8.4693 8.4693 8.9921 8.9921 9.0304 9.0304 9.1146 9.1146 9.3408 9.3408 9.4785 9.4785 9.6478 9.6478 10.0846 10.0846 10.1389 10.1389 10.3256 10.3256 10.5969 10.5969 10.7048 10.7048 10.8639 10.8639 11.2547 11.2547 11.6592 11.6592 11.7074 11.7074 12.5709 12.5709 k = 0.6436-0.2656 0.5236 ( 3954 PWs) bands (ev): 0.5973 0.5973 1.1442 1.1442 1.2644 1.2644 2.5571 2.5571 5.0449 5.0449 5.5458 5.5458 6.2343 6.2343 7.1475 7.1475 7.3965 7.3965 7.4858 7.4858 8.0552 8.0552 8.3849 8.3849 8.4802 8.4802 9.0069 9.0069 9.0460 9.0460 9.1206 9.1206 9.3345 9.3345 9.4623 9.4623 9.6426 9.6426 10.0792 10.0792 10.1433 10.1433 10.3302 10.3302 10.6052 10.6052 10.6752 10.6752 10.8389 10.8389 11.2201 11.2201 11.5902 11.5902 11.6438 11.6438 12.5521 12.5521 k = 0.6498-0.2843 0.5236 ( 3960 PWs) bands (ev): 0.6549 0.6549 1.1875 1.1875 1.2970 1.2970 2.5592 2.5592 4.9749 4.9749 5.4536 5.4536 6.1873 6.1873 7.1214 7.1214 7.4108 7.4108 7.4815 7.4815 8.0748 8.0748 8.3525 8.3525 8.4914 8.4914 9.0197 9.0197 9.0601 9.0601 9.1274 9.1274 9.3270 9.3270 9.4489 9.4489 9.6398 9.6398 10.0730 10.0730 10.1482 10.1482 10.3338 10.3338 10.6028 10.6028 10.6596 10.6596 10.8121 10.8121 11.1802 11.1802 11.5264 11.5264 11.5738 11.5738 12.5447 12.5447 k = 0.6560-0.3031 0.5236 ( 3956 PWs) bands (ev): 0.7147 0.7147 1.2307 1.2307 1.3291 1.3291 2.5571 2.5571 4.9116 4.9116 5.3637 5.3637 6.1423 6.1423 7.0931 7.0931 7.4256 7.4256 7.4762 7.4762 8.0953 8.0953 8.3171 8.3171 8.5028 8.5028 9.0301 9.0301 9.0727 9.0727 9.1347 9.1347 9.3186 9.3186 9.4388 9.4388 9.6397 9.6397 10.0664 10.0664 10.1529 10.1529 10.3364 10.3364 10.5867 10.5867 10.6610 10.6610 10.7834 10.7834 11.1356 11.1356 11.4675 11.4675 11.5013 11.5013 12.5468 12.5468 k = 0.6623-0.3219 0.5236 ( 3960 PWs) bands (ev): 0.7763 0.7763 1.2734 1.2734 1.3602 1.3602 2.5506 2.5506 4.8556 4.8556 5.2768 5.2768 6.0996 6.0996 7.0623 7.0623 7.4405 7.4405 7.4702 7.4702 8.1165 8.1165 8.2790 8.2790 8.5140 8.5140 9.0382 9.0382 9.0840 9.0840 9.1419 9.1419 9.3096 9.3096 9.4323 9.4323 9.6422 9.6422 10.0594 10.0594 10.1569 10.1569 10.3382 10.3382 10.5662 10.5662 10.6697 10.6697 10.7525 10.7525 11.0875 11.0875 11.4046 11.4046 11.4373 11.4373 12.5564 12.5564 k = 0.6685-0.3407 0.5236 ( 3956 PWs) bands (ev): 0.8399 0.8399 1.3152 1.3152 1.3901 1.3901 2.5393 2.5393 4.8076 4.8076 5.1934 5.1934 6.0597 6.0597 7.0289 7.0289 7.4544 7.4544 7.4643 7.4643 8.1382 8.1382 8.2383 8.2383 8.5247 8.5247 9.0442 9.0442 9.0942 9.0942 9.1484 9.1484 9.3002 9.3002 9.4299 9.4299 9.6476 9.6476 10.0521 10.0521 10.1598 10.1598 10.3393 10.3393 10.5466 10.5466 10.6794 10.6794 10.7203 10.7203 11.0382 11.0382 11.3303 11.3303 11.3902 11.3902 12.5714 12.5714 k = 0.6748-0.3594 0.5236 ( 3956 PWs) bands (ev): 0.9052 0.9052 1.3554 1.3554 1.4184 1.4184 2.5235 2.5235 4.7678 4.7678 5.1141 5.1141 6.0228 6.0228 6.9929 6.9929 7.4535 7.4535 7.4723 7.4723 8.1587 8.1587 8.1971 8.1971 8.5347 8.5347 9.0484 9.0484 9.1038 9.1038 9.1534 9.1534 9.2905 9.2905 9.4319 9.4319 9.6555 9.6555 10.0444 10.0444 10.1612 10.1612 10.3397 10.3397 10.5290 10.5290 10.6736 10.6736 10.7011 10.7011 10.9899 10.9899 11.2532 11.2532 11.3518 11.3518 12.5891 12.5891 k = 0.6810-0.3782 0.5236 ( 3958 PWs) bands (ev): 0.9721 0.9721 1.3934 1.3934 1.4447 1.4447 2.5032 2.5032 4.7365 4.7365 5.0396 5.0396 5.9895 5.9895 6.9541 6.9541 7.4449 7.4449 7.4868 7.4868 8.1436 8.1436 8.1896 8.1896 8.5436 8.5436 9.0510 9.0510 9.1129 9.1129 9.1567 9.1567 9.2809 9.2809 9.4381 9.4381 9.6659 9.6659 10.0359 10.0359 10.1607 10.1607 10.3394 10.3394 10.5137 10.5137 10.6383 10.6383 10.7088 10.7088 10.9446 10.9446 11.1778 11.1778 11.3180 11.3180 12.6040 12.6040 k = 0.6872-0.3970 0.5236 ( 3960 PWs) bands (ev): 1.0403 1.0403 1.4284 1.4284 1.4688 1.4688 2.4793 2.4793 4.7135 4.7135 4.9705 4.9705 5.9601 5.9601 6.9126 6.9126 7.4351 7.4351 7.5012 7.5012 8.0970 8.0970 8.2121 8.2121 8.5511 8.5511 9.0524 9.0524 9.1218 9.1218 9.1583 9.1583 9.2717 9.2717 9.4483 9.4483 9.6783 9.6783 10.0265 10.0265 10.1584 10.1584 10.3387 10.3387 10.5002 10.5002 10.5976 10.5976 10.7194 10.7194 10.9034 10.9034 11.1065 11.1065 11.2872 11.2872 12.5968 12.5969 k = 0.6935-0.4158 0.5236 ( 3964 PWs) bands (ev): 1.1096 1.1096 1.4593 1.4593 1.4905 1.4905 2.4526 2.4526 4.6987 4.6987 4.9074 4.9074 5.9350 5.9350 6.8682 6.8682 7.4244 7.4244 7.5151 7.5151 8.0465 8.0465 8.2367 8.2367 8.5572 8.5572 9.0525 9.0525 9.1310 9.1310 9.1584 9.1584 9.2632 9.2632 9.4620 9.4620 9.6922 9.6922 10.0158 10.0158 10.1540 10.1540 10.3374 10.3374 10.4878 10.4878 10.5556 10.5556 10.7296 10.7296 10.8671 10.8671 11.0410 11.0410 11.2582 11.2582 12.5649 12.5649 k = 0.6997-0.4345 0.5236 ( 3964 PWs) bands (ev): 1.1792 1.1792 1.4850 1.4850 1.5099 1.5099 2.4243 2.4243 4.6916 4.6916 4.8508 4.8508 5.9149 5.9149 6.8212 6.8212 7.4129 7.4129 7.5284 7.5284 7.9938 7.9938 8.2620 8.2620 8.5616 8.5616 9.0518 9.0518 9.1401 9.1401 9.1577 9.1577 9.2557 9.2557 9.4788 9.4788 9.7072 9.7072 10.0031 10.0031 10.1476 10.1476 10.3355 10.3355 10.4755 10.4755 10.5145 10.5145 10.7385 10.7385 10.8355 10.8355 10.9834 10.9834 11.2307 11.2307 12.5238 12.5238 k = 0.7060-0.4533 0.5236 ( 3958 PWs) bands (ev): 1.2481 1.2481 1.5042 1.5042 1.5276 1.5276 2.3960 2.3960 4.6915 4.6915 4.8014 4.8014 5.9000 5.9000 6.7714 6.7714 7.4006 7.4006 7.5410 7.5410 7.9392 7.9392 8.2879 8.2879 8.5643 8.5643 9.0501 9.0501 9.1473 9.1473 9.1582 9.1582 9.2502 9.2502 9.4980 9.4980 9.7226 9.7226 9.9879 9.9879 10.1396 10.1396 10.3330 10.3330 10.4598 10.4598 10.4786 10.4786 10.7453 10.7453 10.8086 10.8086 10.9356 10.9356 11.2043 11.2043 12.4780 12.4780 k = 0.7122-0.4721 0.5236 ( 3958 PWs) bands (ev): 1.3142 1.3142 1.5156 1.5156 1.5452 1.5452 2.3693 2.3693 4.6980 4.6980 4.7596 4.7596 5.8909 5.8909 6.7191 6.7191 7.3876 7.3876 7.5527 7.5527 7.8828 7.8828 8.3140 8.3140 8.5652 8.5652 9.0475 9.0475 9.1486 9.1486 9.1632 9.1632 9.2477 9.2477 9.5191 9.5191 9.7374 9.7374 9.9694 9.9694 10.1302 10.1302 10.3293 10.3293 10.4323 10.4323 10.4573 10.4573 10.7487 10.7487 10.7862 10.7862 10.8999 10.8999 11.1788 11.1788 12.4319 12.4319 k = 0.7184-0.4909 0.5236 ( 3958 PWs) bands (ev): 1.3728 1.3728 1.5178 1.5178 1.5669 1.5669 2.3457 2.3457 4.7100 4.7100 4.7262 4.7262 5.8879 5.8879 6.6643 6.6643 7.3738 7.3738 7.5635 7.5635 7.8250 7.8250 8.3404 8.3404 8.5646 8.5646 9.0443 9.0443 9.1464 9.1464 9.1692 9.1692 9.2500 9.2500 9.5417 9.5417 9.7507 9.7507 9.9472 9.9472 10.1204 10.1204 10.3238 10.3238 10.4024 10.4024 10.4427 10.4427 10.7481 10.7481 10.7681 10.7681 10.8774 10.8774 11.1541 11.1541 12.3875 12.3875 k = 0.7247-0.5096 0.5236 ( 3958 PWs) bands (ev): 1.4159 1.4159 1.5099 1.5099 1.6003 1.6003 2.3266 2.3266 4.7000 4.7000 4.7284 4.7284 5.8914 5.8914 6.6072 6.6072 7.3593 7.3593 7.5733 7.5733 7.7660 7.7660 8.3667 8.3667 8.5626 8.5626 9.0403 9.0403 9.1434 9.1434 9.1723 9.1723 9.2586 9.2586 9.5653 9.5653 9.7610 9.7610 9.9210 9.9210 10.1116 10.1116 10.3148 10.3148 10.3783 10.3783 10.4290 10.4290 10.7443 10.7443 10.7540 10.7540 10.8671 10.8671 11.1303 11.1303 12.3453 12.3453 k = 0.7309-0.5284 0.5236 ( 3960 PWs) bands (ev): 1.4377 1.4377 1.4914 1.4914 1.6510 1.6510 2.3127 2.3127 4.6833 4.6833 4.7505 4.7505 5.9016 5.9016 6.5481 6.5481 7.3442 7.3442 7.5819 7.5819 7.7060 7.7060 8.3928 8.3928 8.5595 8.5595 9.0357 9.0357 9.1401 9.1401 9.1720 9.1720 9.2736 9.2736 9.5894 9.5894 9.7671 9.7671 9.8910 9.8910 10.1051 10.1051 10.3005 10.3005 10.3622 10.3622 10.4165 10.4165 10.7393 10.7393 10.7445 10.7445 10.8658 10.8658 11.1074 11.1074 12.3056 12.3056 k = 0.7372-0.5472 0.5236 ( 3962 PWs) bands (ev): 1.4410 1.4410 1.4627 1.4627 1.7160 1.7160 2.3040 2.3040 4.6753 4.6753 4.7770 4.7770 5.9186 5.9186 6.4871 6.4871 7.3284 7.3284 7.5888 7.5888 7.6460 7.6460 8.4186 8.4186 8.5555 8.5555 9.0306 9.0306 9.1367 9.1367 9.1694 9.1694 9.2939 9.2939 9.6134 9.6134 9.7681 9.7681 9.8580 9.8580 10.1028 10.1028 10.2816 10.2816 10.3530 10.3530 10.4060 10.4060 10.7335 10.7335 10.7408 10.7408 10.8698 10.8698 11.0858 11.0858 12.2685 12.2685 k = 0.2628-0.7906 0.6503 ( 3962 PWs) bands (ev): 1.4410 1.4410 1.4627 1.4627 1.7160 1.7160 2.3040 2.3040 4.6753 4.6753 4.7770 4.7770 5.9186 5.9186 6.4871 6.4871 7.3284 7.3284 7.5888 7.5888 7.6460 7.6460 8.4186 8.4186 8.5555 8.5555 9.0306 9.0306 9.1367 9.1367 9.1694 9.1694 9.2939 9.2939 9.6134 9.6134 9.7681 9.7681 9.8580 9.8580 10.1028 10.1028 10.2816 10.2816 10.3530 10.3530 10.4060 10.4060 10.7335 10.7335 10.7408 10.7408 10.8698 10.8698 11.0858 11.0858 12.2685 12.2685 k = 0.2567-0.7722 0.6503 ( 3956 PWs) bands (ev): 1.4246 1.4246 1.4328 1.4328 1.7878 1.7878 2.2998 2.2998 4.6758 4.6758 4.8068 4.8068 5.9420 5.9420 6.4258 6.4258 7.3123 7.3123 7.5777 7.5777 7.6033 7.6033 8.4434 8.4434 8.5510 8.5510 9.0253 9.0253 9.1333 9.1333 9.1658 9.1658 9.3177 9.3177 9.6352 9.6352 9.7645 9.7645 9.8240 9.8240 10.1053 10.1053 10.2607 10.2607 10.3481 10.3481 10.3986 10.3986 10.7296 10.7296 10.7414 10.7414 10.8766 10.8766 11.0663 11.0663 12.2346 12.2346 k = 0.2506-0.7538 0.6503 ( 3954 PWs) bands (ev): 1.3799 1.3799 1.4148 1.4148 1.8640 1.8640 2.2990 2.2990 4.6846 4.6846 4.8401 4.8401 5.9720 5.9720 6.3632 6.3632 7.2957 7.2957 7.5212 7.5212 7.6048 7.6048 8.4674 8.4674 8.5463 8.5463 9.0196 9.0196 9.1298 9.1298 9.1619 9.1619 9.3444 9.3444 9.6520 9.6520 9.7570 9.7570 9.7918 9.7918 10.1128 10.1128 10.2389 10.2389 10.3452 10.3452 10.3945 10.3945 10.7281 10.7281 10.7448 10.7448 10.8851 10.8851 11.0489 11.0489 12.2029 12.2029 k = 0.2445-0.7354 0.6503 ( 3956 PWs) bands (ev): 1.3284 1.3284 1.3906 1.3906 1.9429 1.9429 2.3003 2.3003 4.7015 4.7015 4.8769 4.8769 6.0083 6.0083 6.2995 6.2995 7.2785 7.2785 7.4607 7.4607 7.6091 7.6091 8.4905 8.4905 8.5414 8.5414 9.0136 9.0136 9.1261 9.1261 9.1580 9.1580 9.3736 9.3736 9.6576 9.6576 9.7383 9.7383 9.7768 9.7768 10.1245 10.1245 10.2165 10.2165 10.3438 10.3438 10.3938 10.3938 10.7285 10.7285 10.7504 10.7504 10.8943 10.8943 11.0342 11.0342 12.1736 12.1736 k = 0.2384-0.7170 0.6503 ( 3960 PWs) bands (ev): 1.2717 1.2717 1.3609 1.3609 2.0234 2.0234 2.3027 2.3027 4.7262 4.7262 4.9169 4.9169 6.0504 6.0504 6.2352 6.2352 7.2607 7.2607 7.3999 7.3999 7.6128 7.6128 8.5121 8.5121 8.5370 8.5370 9.0075 9.0075 9.1223 9.1223 9.1545 9.1545 9.4048 9.4048 9.6472 9.6472 9.7072 9.7072 9.7873 9.7873 10.1391 10.1391 10.1940 10.1940 10.3437 10.3437 10.3964 10.3964 10.7299 10.7299 10.7576 10.7576 10.9041 10.9041 11.0232 11.0232 12.1463 12.1463 k = 0.2323-0.6986 0.6503 ( 3966 PWs) bands (ev): 1.2112 1.2112 1.3265 1.3265 2.1048 2.1048 2.3052 2.3052 4.7584 4.7584 4.9604 4.9604 6.0967 6.0967 6.1718 6.1718 7.2421 7.2421 7.3398 7.3398 7.6157 7.6157 8.5275 8.5275 8.5379 8.5379 9.0013 9.0013 9.1184 9.1184 9.1515 9.1515 9.4372 9.4372 9.6239 9.6239 9.6754 9.6754 9.8107 9.8107 10.1543 10.1543 10.1722 10.1722 10.3451 10.3451 10.4024 10.4024 10.7316 10.7316 10.7656 10.7656 10.9141 10.9141 11.0172 11.0172 12.1211 12.1211 k = 0.2262-0.6803 0.6503 ( 3964 PWs) bands (ev): 1.1477 1.1477 1.2881 1.2881 2.1869 2.1869 2.3070 2.3070 4.7977 4.7977 5.0072 5.0072 6.0974 6.0974 6.1590 6.1590 7.2214 7.2214 7.2818 7.2818 7.6178 7.6178 8.5260 8.5260 8.5546 8.5546 8.9951 8.9951 9.1145 9.1145 9.1491 9.1491 9.4698 9.4698 9.5942 9.5942 9.6459 9.6459 9.8406 9.8406 10.1464 10.1464 10.1736 10.1736 10.3476 10.3476 10.4121 10.4121 10.7323 10.7323 10.7737 10.7737 10.9243 10.9243 11.0173 11.0173 12.0977 12.0977 k = 0.2200-0.6619 0.6503 ( 3968 PWs) bands (ev): 1.0823 1.0823 1.2462 1.2462 2.2689 2.2689 2.3076 2.3076 4.8436 4.8436 5.0573 5.0573 6.0342 6.0342 6.2148 6.2148 7.1922 7.1922 7.2328 7.2328 7.6192 7.6192 8.5224 8.5224 8.5724 8.5724 8.9888 8.9888 9.1103 9.1103 9.1472 9.1472 9.4967 9.4967 9.5671 9.5671 9.6187 9.6187 9.8746 9.8746 10.1238 10.1238 10.1887 10.1887 10.3512 10.3512 10.4263 10.4263 10.7310 10.7310 10.7813 10.7813 10.9347 10.9347 11.0242 11.0242 12.0762 12.0762 k = 0.2139-0.6435 0.6503 ( 3964 PWs) bands (ev): 1.0156 1.0156 1.2013 1.2013 2.3055 2.3055 2.3518 2.3518 4.8959 4.8959 5.1107 5.1107 5.9685 5.9685 6.2776 6.2776 7.1445 7.1445 7.2031 7.2031 7.6199 7.6199 8.5190 8.5190 8.5889 8.5889 8.9828 8.9828 9.1059 9.1059 9.1460 9.1460 9.4940 9.4940 9.5671 9.5671 9.5960 9.5960 9.9114 9.9114 10.1010 10.1010 10.2024 10.2024 10.3552 10.3552 10.4455 10.4455 10.7270 10.7270 10.7886 10.7886 10.9455 10.9455 11.0385 11.0385 12.0565 12.0565 k = 0.2078-0.6251 0.6503 ( 3962 PWs) bands (ev): 0.9482 0.9482 1.1541 1.1541 2.3023 2.3023 2.4335 2.4335 4.9540 4.9540 5.1673 5.1673 5.9024 5.9024 6.3449 6.3449 7.0884 7.0884 7.1829 7.1829 7.6200 7.6200 8.5159 8.5159 8.6038 8.6038 8.9770 8.9770 9.1014 9.1014 9.1451 9.1451 9.4634 9.4634 9.5651 9.5651 9.6059 9.6059 9.9507 9.9507 10.0782 10.0782 10.2139 10.2139 10.3592 10.3592 10.4700 10.4700 10.7201 10.7201 10.7955 10.7955 10.9564 10.9564 11.0597 11.0597 12.0383 12.0383 k = 0.2017-0.6067 0.6503 ( 3968 PWs) bands (ev): 0.8805 0.8805 1.1049 1.1049 2.2968 2.2968 2.5146 2.5146 5.0175 5.0175 5.2270 5.2270 5.8366 5.8366 6.4158 6.4158 7.0310 7.0310 7.1654 7.1654 7.6195 7.6195 8.5132 8.5132 8.6171 8.6171 8.9713 8.9713 9.0966 9.0966 9.1446 9.1446 9.4268 9.4268 9.5458 9.5458 9.6426 9.6426 9.9917 9.9917 10.0564 10.0564 10.2232 10.2232 10.3630 10.3630 10.4997 10.4997 10.7104 10.7104 10.8022 10.8022 10.9675 10.9675 11.0870 11.0870 12.0217 12.0217 k = 0.1956-0.5883 0.6503 ( 3964 PWs) bands (ev): 0.8131 0.8131 1.0541 1.0541 2.2890 2.2890 2.5949 2.5949 5.0861 5.0861 5.2897 5.2897 5.7713 5.7713 6.4897 6.4897 6.9740 6.9740 7.1493 7.1493 7.6186 7.6186 8.5108 8.5108 8.6290 8.6290 8.9659 8.9659 9.0916 9.0916 9.1442 9.1442 9.3890 9.3890 9.5280 9.5280 9.6832 9.6832 10.0233 10.0233 10.0466 10.0466 10.2305 10.2305 10.3666 10.3666 10.5344 10.5344 10.6988 10.6988 10.8089 10.8089 10.9786 10.9786 11.1198 11.1198 12.0065 12.0065 k = 0.1895-0.5700 0.6503 ( 3962 PWs) bands (ev): 0.7462 0.7462 1.0023 1.0023 2.2791 2.2791 2.6741 2.6741 5.1593 5.1593 5.3549 5.3549 5.7067 5.7067 6.5661 6.5661 6.9181 6.9181 7.1345 7.1345 7.6174 7.6174 8.5086 8.5086 8.6395 8.6395 8.9608 8.9608 9.0864 9.0864 9.1436 9.1436 9.3512 9.3512 9.5128 9.5128 9.7254 9.7254 10.0081 10.0081 10.0863 10.0863 10.2363 10.2363 10.3700 10.3700 10.5735 10.5735 10.6857 10.6857 10.8154 10.8154 10.9898 10.9898 11.1570 11.1570 11.9928 11.9928 k = 0.1834-0.5516 0.6503 ( 3964 PWs) bands (ev): 0.6800 0.6800 0.9497 0.9497 2.2672 2.2672 2.7517 2.7517 5.2369 5.2369 5.4223 5.4223 5.6430 5.6430 6.6444 6.6444 6.8637 6.8637 7.1209 7.1209 7.6160 7.6160 8.5065 8.5065 8.6488 8.6488 8.9560 8.9560 9.0807 9.0807 9.1428 9.1428 9.3139 9.3139 9.5008 9.5008 9.7683 9.7683 9.9872 9.9872 10.1343 10.1343 10.2407 10.2407 10.3731 10.3731 10.6163 10.6163 10.6723 10.6723 10.8218 10.8218 11.0010 11.0010 11.1980 11.1980 11.9805 11.9805 k = 0.1773-0.5332 0.6503 ( 3966 PWs) bands (ev): 0.6149 0.6149 0.8967 0.8967 2.2534 2.2534 2.8277 2.8277 5.3183 5.3183 5.4915 5.4915 5.5807 5.5807 6.7230 6.7230 6.8121 6.8121 7.1087 7.1087 7.6145 7.6145 8.5044 8.5044 8.6569 8.6569 8.9515 8.9515 9.0746 9.0746 9.1416 9.1416 9.2775 9.2775 9.4918 9.4918 9.8117 9.8117 9.9665 9.9665 10.1850 10.1850 10.2441 10.2441 10.3762 10.3762 10.6521 10.6521 10.6692 10.6692 10.8281 10.8281 11.0121 11.0121 11.2422 11.2422 11.9695 11.9695 k = 0.1711-0.5148 0.6503 ( 3976 PWs) bands (ev): 0.5509 0.5509 0.8436 0.8436 2.2379 2.2379 2.9017 2.9017 5.4025 5.4025 5.5190 5.5190 5.5635 5.5635 6.7538 6.7538 6.8111 6.8111 7.0979 7.0979 7.6131 7.6131 8.5022 8.5022 8.6641 8.6641 8.9472 8.9472 9.0677 9.0677 9.1398 9.1398 9.2424 9.2424 9.4860 9.4860 9.8549 9.8549 9.9466 9.9466 10.2354 10.2354 10.2488 10.2488 10.3794 10.3794 10.6417 10.6417 10.7157 10.7157 10.8344 10.8344 11.0233 11.0233 11.2891 11.2891 11.9598 11.9598 k = 0.1650-0.4964 0.6503 ( 3980 PWs) bands (ev): 0.4884 0.4884 0.7906 0.7906 2.2209 2.2209 2.9734 2.9734 5.4511 5.4511 5.4996 5.4996 5.6345 5.6345 6.7078 6.7078 6.8895 6.8895 7.0888 7.0888 7.6123 7.6123 8.4998 8.4998 8.6706 8.6706 8.9433 8.9433 9.0598 9.0598 9.1377 9.1377 9.2090 9.2090 9.4832 9.4832 9.8953 9.8953 9.9299 9.9299 10.2467 10.2467 10.2931 10.2931 10.3838 10.3838 10.6281 10.6281 10.7685 10.7685 10.8415 10.8415 11.0345 11.0345 11.3383 11.3383 11.9514 11.9514 k = 0.1589-0.4780 0.6503 ( 3976 PWs) bands (ev): 0.4274 0.4274 0.7381 0.7381 2.2026 2.2026 3.0427 3.0427 5.3968 5.3968 5.5872 5.5872 5.7061 5.7061 6.6621 6.6621 6.9700 6.9700 7.0816 7.0816 7.6122 7.6122 8.4972 8.4972 8.6764 8.6764 8.9395 8.9395 9.0502 9.0502 9.1353 9.1353 9.1781 9.1781 9.4831 9.4831 9.9016 9.9016 9.9473 9.9473 10.2478 10.2478 10.3433 10.3433 10.3939 10.3939 10.6153 10.6153 10.8190 10.8190 10.8547 10.8547 11.0458 11.0458 11.3895 11.3895 11.9445 11.9445 k = 0.1528-0.4596 0.6503 ( 3980 PWs) bands (ev): 0.3680 0.3680 0.6863 0.6863 2.1833 2.1833 3.1093 3.1093 5.3401 5.3401 5.6817 5.6817 5.7769 5.7769 6.6193 6.6193 7.0481 7.0481 7.0778 7.0778 7.6135 7.6135 8.4942 8.4942 8.6816 8.6816 8.9358 8.9358 9.0381 9.0381 9.1327 9.1327 9.1507 9.1507 9.4854 9.4854 9.8847 9.8847 9.9878 9.9878 10.2481 10.2481 10.3704 10.3704 10.4289 10.4289 10.6041 10.6041 10.8417 10.8417 10.8987 10.8987 11.0574 11.0574 11.4421 11.4421 11.9389 11.9389 k = 0.1467-0.4413 0.6503 ( 3982 PWs) bands (ev): 0.3104 0.3104 0.6354 0.6354 2.1632 2.1632 3.1729 3.1729 5.2846 5.2846 5.7793 5.7793 5.8456 5.8456 6.5808 6.5808 7.0701 7.0701 7.1299 7.1299 7.6168 7.6168 8.4908 8.4908 8.6863 8.6863 8.9317 8.9317 9.0227 9.0227 9.1276 9.1276 9.1305 9.1305 9.4897 9.4897 9.8669 9.8669 10.0288 10.0288 10.2479 10.2479 10.3778 10.3778 10.4829 10.4829 10.5970 10.5970 10.8492 10.8492 10.9607 10.9607 11.0697 11.0697 11.4954 11.4954 11.9350 11.9350 k = 0.1406-0.4229 0.6503 ( 3978 PWs) bands (ev): 0.2547 0.2547 0.5855 0.5855 2.1425 2.1425 3.2335 3.2335 5.2309 5.2309 5.8793 5.8793 5.9107 5.9107 6.5478 6.5478 7.0688 7.0688 7.2036 7.2036 7.6234 7.6234 8.4871 8.4871 8.6904 8.6904 8.9269 8.9269 9.0042 9.0042 9.1100 9.1100 9.1281 9.1281 9.4957 9.4957 9.8494 9.8494 10.0688 10.0688 10.2474 10.2474 10.3812 10.3812 10.5295 10.5295 10.6051 10.6051 10.8545 10.8545 11.0251 11.0251 11.0854 11.0854 11.5488 11.5488 11.9328 11.9328 k = 0.1345-0.4045 0.6503 ( 3980 PWs) bands (ev): 0.2009 0.2009 0.5368 0.5368 2.1213 2.1213 3.2907 3.2907 5.1791 5.1791 5.9685 5.9685 5.9828 5.9828 6.5225 6.5225 7.0688 7.0688 7.2723 7.2723 7.6352 7.6352 8.4830 8.4830 8.6939 8.6939 8.9197 8.9197 8.9843 8.9843 9.0968 9.0968 9.1265 9.1265 9.5030 9.5030 9.8323 9.8323 10.1067 10.1067 10.2470 10.2470 10.3837 10.3837 10.5437 10.5437 10.6501 10.6501 10.8591 10.8591 11.0722 11.0722 11.1223 11.1223 11.6007 11.6007 11.9327 11.9327 k = 0.1284-0.3861 0.6503 ( 3978 PWs) bands (ev): 0.1492 0.1492 0.4895 0.4895 2.0999 2.0999 3.3446 3.3446 5.1292 5.1292 6.0185 6.0185 6.0868 6.0868 6.5077 6.5077 7.0706 7.0706 7.3327 7.3327 7.6544 7.6544 8.4785 8.4785 8.6966 8.6966 8.9081 8.9081 8.9666 8.9666 9.0869 9.0869 9.1257 9.1257 9.5113 9.5113 9.8157 9.8157 10.1415 10.1415 10.2479 10.2479 10.3858 10.3858 10.5404 10.5404 10.7166 10.7166 10.8636 10.8636 11.0910 11.0910 11.1911 11.1911 11.6492 11.6492 11.9350 11.9350 k = 0.1222-0.3677 0.6503 ( 3970 PWs) bands (ev): 0.0995 0.0995 0.4437 0.4437 2.0785 2.0785 3.3950 3.3950 5.0815 5.0815 6.0552 6.0552 6.1930 6.1930 6.5065 6.5065 7.0742 7.0742 7.3820 7.3820 7.6838 7.6838 8.4738 8.4738 8.6984 8.6984 8.8899 8.8899 8.9542 8.9542 9.0794 9.0794 9.1258 9.1258 9.5203 9.5203 9.7997 9.7997 10.1709 10.1709 10.2521 10.2521 10.3880 10.3880 10.5336 10.5336 10.7892 10.7892 10.8693 10.8693 11.1035 11.1035 11.2692 11.2692 11.6920 11.6920 11.9402 11.9402 k = 0.1161-0.3493 0.6503 ( 3964 PWs) bands (ev): 0.0519 0.0519 0.3995 0.3995 2.0572 2.0572 3.4419 3.4419 5.0359 5.0359 6.0766 6.0766 6.3007 6.3007 6.5211 6.5211 7.0795 7.0795 7.4187 7.4187 7.7247 7.7247 8.4689 8.4689 8.6992 8.6992 8.8660 8.8660 8.9467 8.9467 9.0736 9.0736 9.1271 9.1271 9.5298 9.5298 9.7842 9.7842 10.1905 10.1905 10.2640 10.2640 10.3904 10.3904 10.5264 10.5264 10.8510 10.8510 10.8897 10.8897 11.1146 11.1146 11.3509 11.3509 11.7265 11.7265 11.9488 11.9488 k = 0.1100-0.3309 0.6503 ( 3968 PWs) bands (ev): 0.0066 0.0066 0.3571 0.3571 2.0362 2.0362 3.4852 3.4852 4.9926 4.9926 6.0830 6.0830 6.4094 6.4094 6.5506 6.5506 7.0864 7.0864 7.4440 7.4440 7.7755 7.7755 8.4638 8.4638 8.6988 8.6988 8.8391 8.8391 8.9417 8.9417 9.0690 9.0690 9.1294 9.1294 9.5396 9.5396 9.7692 9.7692 10.1986 10.1986 10.2848 10.2848 10.3935 10.3935 10.5193 10.5193 10.8660 10.8660 10.9598 10.9598 11.1254 11.1254 11.4338 11.4338 11.7514 11.7514 11.9616 11.9616 k = 0.1039-0.3126 0.6503 ( 3970 PWs) bands (ev): -0.0365 -0.0365 0.3165 0.3165 2.0156 2.0156 3.5249 3.5249 4.9516 4.9516 6.0778 6.0778 6.5188 6.5188 6.5916 6.5916 7.0947 7.0947 7.4610 7.4610 7.8332 7.8332 8.4585 8.4585 8.6970 8.6970 8.8110 8.8110 8.9378 8.9378 9.0655 9.0655 9.1329 9.1329 9.5495 9.5495 9.7547 9.7547 10.1992 10.1992 10.3103 10.3103 10.3976 10.3976 10.5129 10.5129 10.8701 10.8701 11.0421 11.0421 11.1374 11.1374 11.5157 11.5157 11.7677 11.7677 11.9806 11.9806 k = 0.0978-0.2942 0.6503 ( 3970 PWs) bands (ev): -0.0773 -0.0773 0.2779 0.2779 1.9956 1.9956 3.5611 3.5611 4.9130 4.9130 6.0647 6.0647 6.6268 6.6268 6.6416 6.6416 7.1044 7.1044 7.4727 7.4727 7.8944 7.8944 8.4532 8.4532 8.6938 8.6938 8.7825 8.7825 8.9342 8.9342 9.0630 9.0630 9.1376 9.1376 9.5594 9.5594 9.7408 9.7408 10.1963 10.1963 10.3357 10.3357 10.4039 10.4039 10.5070 10.5070 10.8728 10.8728 11.1160 11.1160 11.1617 11.1617 11.5931 11.5931 11.7775 11.7775 12.0089 12.0089 k = 0.0917-0.2758 0.6503 ( 3966 PWs) bands (ev): -0.1158 -0.1158 0.2412 0.2412 1.9762 1.9762 3.5939 3.5939 4.8768 4.8768 6.0471 6.0471 6.6899 6.6899 6.7398 6.7398 7.1153 7.1153 7.4816 7.4816 7.9569 7.9569 8.4480 8.4480 8.6890 8.6890 8.7542 8.7542 8.9302 8.9302 9.0614 9.0614 9.1434 9.1434 9.5692 9.5692 9.7274 9.7274 10.1915 10.1915 10.3574 10.3574 10.4145 10.4145 10.5017 10.5017 10.8747 10.8747 11.1431 11.1431 11.2353 11.2353 11.6613 11.6613 11.7830 11.7830 12.0509 12.0509 k = 0.0856-0.2574 0.6503 ( 3966 PWs) bands (ev): -0.1520 -0.1520 0.2066 0.2066 1.9576 1.9576 3.6233 3.6233 4.8430 4.8430 6.0270 6.0270 6.7425 6.7425 6.8487 6.8487 7.1274 7.1274 7.4889 7.4889 8.0191 8.0191 8.4428 8.4428 8.6825 8.6825 8.7265 8.7265 8.9254 8.9254 9.0609 9.0609 9.1501 9.1501 9.5787 9.5787 9.7145 9.7145 10.1856 10.1856 10.3727 10.3727 10.4312 10.4312 10.4969 10.4969 10.8762 10.8762 11.1540 11.1540 11.3269 11.3269 11.7161 11.7161 11.7866 11.7866 12.1107 12.1107 k = 0.0795-0.2390 0.6503 ( 3968 PWs) bands (ev): -0.1858 -0.1858 0.1742 0.1742 1.9399 1.9399 3.6496 3.6496 4.8117 4.8117 6.0061 6.0061 6.7940 6.7940 6.9562 6.9562 7.1410 7.1410 7.4959 7.4959 8.0798 8.0798 8.4377 8.4377 8.6742 8.6742 8.6996 8.6996 8.9196 8.9196 9.0613 9.0613 9.1576 9.1576 9.5879 9.5879 9.7023 9.7023 10.1791 10.1791 10.3824 10.3824 10.4532 10.4532 10.4927 10.4927 10.8773 10.8773 11.1626 11.1626 11.4218 11.4218 11.7552 11.7552 11.7910 11.7910 12.1892 12.1892 k = 0.0733-0.2206 0.6503 ( 3968 PWs) bands (ev): -0.2171 -0.2171 0.1440 0.1440 1.9232 1.9232 3.6728 3.6728 4.7829 4.7829 5.9852 5.9852 6.8431 6.8431 7.0590 7.0590 7.1582 7.1582 7.5032 7.5032 8.1383 8.1383 8.4329 8.4329 8.6633 8.6633 8.6746 8.6746 8.9127 8.9127 9.0627 9.0627 9.1657 9.1657 9.5966 9.5966 9.6907 9.6907 10.1721 10.1721 10.3892 10.3892 10.4771 10.4771 10.4892 10.4892 10.8781 10.8781 11.1701 11.1701 11.5168 11.5168 11.7779 11.7779 11.8016 11.8016 12.2838 12.2838 k = 0.0672-0.2022 0.6503 ( 3966 PWs) bands (ev): -0.2460 -0.2460 0.1160 0.1160 1.9075 1.9075 3.6932 3.6932 4.7566 4.7566 5.9650 5.9650 6.8890 6.8890 7.1372 7.1372 7.1983 7.1983 7.5111 7.5111 8.1940 8.1940 8.4283 8.4283 8.6460 8.6460 8.6555 8.6555 8.9045 8.9045 9.0650 9.0650 9.1743 9.1743 9.6049 9.6049 9.6798 9.6798 10.1649 10.1649 10.3946 10.3946 10.4844 10.4844 10.5035 10.5035 10.8785 10.8785 11.1769 11.1769 11.6069 11.6069 11.7927 11.7927 11.8182 11.8182 12.3904 12.3904 k = 0.0611-0.1839 0.6503 ( 3966 PWs) bands (ev): -0.2725 -0.2725 0.0903 0.0903 1.8930 1.8930 3.7109 3.7109 4.7327 4.7327 5.9458 5.9458 6.9311 6.9311 7.1651 7.1651 7.2859 7.2859 7.5199 7.5199 8.2465 8.2465 8.4240 8.4240 8.6241 8.6241 8.6408 8.6408 8.8949 8.8949 9.0681 9.0681 9.1830 9.1830 9.6125 9.6125 9.6698 9.6698 10.1576 10.1576 10.3995 10.3995 10.4813 10.4813 10.5282 10.5282 10.8786 10.8786 11.1830 11.1830 11.6784 11.6784 11.8198 11.8198 11.8370 11.8370 12.5058 12.5058 k = 0.0550-0.1655 0.6503 ( 3968 PWs) bands (ev): -0.2965 -0.2965 0.0669 0.0669 1.8796 1.8796 3.7262 3.7262 4.7113 4.7113 5.9279 5.9279 6.9688 6.9688 7.1803 7.1803 7.3825 7.3825 7.5299 7.5299 8.2951 8.2951 8.4200 8.4200 8.6036 8.6036 8.6251 8.6251 8.8839 8.8839 9.0718 9.0718 9.1917 9.1917 9.6191 9.6191 9.6607 9.6607 10.1504 10.1504 10.4042 10.4042 10.4783 10.4783 10.5525 10.5525 10.8784 10.8784 11.1884 11.1884 11.7146 11.7146 11.8424 11.8424 11.8928 11.8928 12.6272 12.6272 k = 0.0489-0.1471 0.6503 ( 3966 PWs) bands (ev): -0.3181 -0.3181 0.0459 0.0459 1.8675 1.8675 3.7392 3.7392 4.6923 4.6923 5.9115 5.9115 7.0019 7.0019 7.1930 7.1930 7.4768 7.4768 7.5411 7.5411 8.3389 8.3389 8.4165 8.4165 8.5859 8.5859 8.6077 8.6077 8.8716 8.8716 9.0758 9.0758 9.2001 9.2001 9.6245 9.6245 9.6533 9.6533 10.1435 10.1435 10.4089 10.4089 10.4753 10.4753 10.5758 10.5758 10.8781 10.8781 11.1933 11.1933 11.7267 11.7267 11.8544 11.8544 11.9808 11.9808 12.7524 12.7524 k = 0.0428-0.1287 0.6503 ( 3962 PWs) bands (ev): -0.3371 -0.3371 0.0273 0.0273 1.8568 1.8568 3.7501 3.7501 4.6757 4.6757 5.8968 5.8968 7.0303 7.0303 7.2042 7.2042 7.5494 7.5494 7.5703 7.5703 8.3763 8.3763 8.4138 8.4138 8.5727 8.5727 8.5888 8.5888 8.8580 8.8580 9.0801 9.0801 9.2081 9.2081 9.6273 9.6273 9.6486 9.6486 10.1370 10.1370 10.4135 10.4135 10.4725 10.4725 10.5978 10.5978 10.8776 10.8776 11.1975 11.1975 11.7301 11.7301 11.8644 11.8644 12.0766 12.0766 12.8763 12.8763 k = 0.0367-0.1103 0.6503 ( 3958 PWs) bands (ev): -0.3536 -0.3536 0.0112 0.0112 1.8473 1.8473 3.7591 3.7591 4.6614 4.6614 5.8840 5.8840 7.0541 7.0541 7.2142 7.2142 7.5631 7.5631 7.6531 7.6531 8.4019 8.4019 8.4153 8.4153 8.5653 8.5653 8.5692 8.5692 8.8432 8.8432 9.0844 9.0844 9.2155 9.2155 9.6262 9.6262 9.6480 9.6480 10.1309 10.1309 10.4180 10.4180 10.4697 10.4697 10.6181 10.6181 10.8770 10.8770 11.2011 11.2011 11.7306 11.7306 11.8733 11.8733 12.1723 12.1723 12.9105 12.9105 k = 0.0306-0.0919 0.6503 ( 3960 PWs) bands (ev): -0.3676 -0.3676 -0.0026 -0.0026 1.8393 1.8393 3.7664 3.7664 4.6493 4.6493 5.8730 5.8730 7.0734 7.0734 7.2229 7.2229 7.5749 7.5749 7.7304 7.7304 8.4050 8.4050 8.4289 8.4289 8.5464 8.5464 8.5694 8.5694 8.8274 8.8274 9.0884 9.0884 9.2220 9.2220 9.6225 9.6225 9.6503 9.6503 10.1255 10.1255 10.4224 10.4224 10.4669 10.4669 10.6363 10.6363 10.8763 10.8763 11.2040 11.2040 11.7299 11.7299 11.8812 11.8812 12.2639 12.2639 12.8504 12.8504 k = 0.0244-0.0735 0.6503 ( 3958 PWs) bands (ev): -0.3790 -0.3790 -0.0138 -0.0138 1.8327 1.8327 3.7722 3.7722 4.6396 4.6396 5.8639 5.8639 7.0887 7.0887 7.2302 7.2302 7.5856 7.5856 7.7992 7.7992 8.4035 8.4035 8.4371 8.4371 8.5248 8.5248 8.5816 8.5816 8.8110 8.8110 9.0920 9.0920 9.2276 9.2276 9.6185 9.6185 9.6534 9.6534 10.1209 10.1209 10.4266 10.4266 10.4642 10.4642 10.6522 10.6522 10.8756 10.8756 11.2064 11.2064 11.7289 11.7289 11.8881 11.8881 12.3477 12.3477 12.7946 12.7946 k = 0.0183-0.0552 0.6503 ( 3958 PWs) bands (ev): -0.3880 -0.3880 -0.0226 -0.0226 1.8275 1.8275 3.7765 3.7765 4.6320 4.6320 5.8568 5.8568 7.1001 7.1001 7.2360 7.2360 7.5947 7.5947 7.8573 7.8573 8.4019 8.4019 8.4386 8.4386 8.5042 8.5042 8.5995 8.5995 8.7946 8.7946 9.0950 9.0950 9.2320 9.2320 9.6148 9.6148 9.6561 9.6561 10.1172 10.1172 10.4304 10.4304 10.4616 10.4616 10.6651 10.6651 10.8749 10.8749 11.2082 11.2082 11.7278 11.7278 11.8939 11.8939 12.4199 12.4199 12.7487 12.7487 k = 0.0122-0.0368 0.6503 ( 3958 PWs) bands (ev): -0.3943 -0.3943 -0.0288 -0.0288 1.8238 1.8238 3.7795 3.7795 4.6267 4.6267 5.8517 5.8517 7.1081 7.1081 7.2401 7.2401 7.6016 7.6016 7.9021 7.9021 8.4005 8.4005 8.4373 8.4373 8.4868 8.4868 8.6180 8.6180 8.7794 8.7794 9.0973 9.0973 9.2353 9.2353 9.6121 9.6121 9.6582 9.6582 10.1145 10.1145 10.4336 10.4336 10.4593 10.4593 10.6747 10.6747 10.8744 10.8744 11.2095 11.2095 11.7270 11.7270 11.8984 11.8984 12.4761 12.4761 12.7145 12.7145 k = 0.0061-0.0184 0.6503 ( 3954 PWs) bands (ev): -0.3982 -0.3982 -0.0326 -0.0326 1.8216 1.8216 3.7813 3.7813 4.6235 4.6235 5.8486 5.8486 7.1127 7.1127 7.2427 7.2427 7.6060 7.6060 7.9307 7.9307 8.3996 8.3996 8.4356 8.4356 8.4749 8.4749 8.6323 8.6323 8.7677 8.7677 9.0987 9.0987 9.2372 9.2372 9.6104 9.6104 9.6595 9.6595 10.1128 10.1128 10.4359 10.4359 10.4576 10.4576 10.6806 10.6806 10.8741 10.8741 11.2103 11.2103 11.7264 11.7264 11.9012 11.9012 12.5121 12.5121 12.6935 12.6935 k = 0.0000 0.0000 0.6503 ( 3960 PWs) bands (ev): -0.3994 -0.3994 -0.0339 -0.0339 1.8208 1.8208 3.7819 3.7819 4.6224 4.6224 5.8476 5.8476 7.1143 7.1143 7.2435 7.2435 7.6075 7.6075 7.9406 7.9406 8.3992 8.3992 8.4349 8.4349 8.4706 8.4706 8.6378 8.6378 8.7632 8.7632 9.0991 9.0991 9.2379 9.2379 9.6098 9.6098 9.6600 9.6600 10.1122 10.1122 10.4367 10.4367 10.4569 10.4569 10.6826 10.6826 10.8740 10.8740 11.2105 11.2105 11.7263 11.7263 11.9022 11.9022 12.5245 12.5245 12.6864 12.6864 k = 0.0000 0.0000 0.6503 ( 3960 PWs) bands (ev): -0.3994 -0.3994 -0.0339 -0.0339 1.8208 1.8208 3.7819 3.7819 4.6224 4.6224 5.8476 5.8476 7.1143 7.1143 7.2435 7.2435 7.6075 7.6075 7.9406 7.9406 8.3992 8.3992 8.4349 8.4349 8.4706 8.4706 8.6378 8.6378 8.7632 8.7632 9.0991 9.0991 9.2379 9.2379 9.6098 9.6098 9.6600 9.6600 10.1122 10.1122 10.4367 10.4367 10.4569 10.4569 10.6826 10.6826 10.8740 10.8740 11.2105 11.2105 11.7263 11.7263 11.9022 11.9022 12.5245 12.5245 12.6864 12.6864 k = 0.0181 0.0060 0.6503 ( 3956 PWs) bands (ev): -0.3984 -0.3984 -0.0326 -0.0326 1.8149 1.8149 3.7790 3.7790 4.6275 4.6275 5.8527 5.8527 7.1145 7.1145 7.2434 7.2434 7.6077 7.6077 7.9407 7.9407 8.3942 8.3942 8.4342 8.4342 8.4746 8.4746 8.6379 8.6379 8.7634 8.7634 9.0942 9.0942 9.2424 9.2424 9.6051 9.6051 9.6655 9.6655 10.1120 10.1120 10.4357 10.4357 10.4567 10.4567 10.6819 10.6819 10.8745 10.8745 11.2123 11.2123 11.7238 11.7238 11.9056 11.9056 12.5103 12.5103 12.6986 12.6986 k = 0.0362 0.0120 0.6503 ( 3961 PWs) bands (ev): -0.3953 -0.3953 -0.0288 -0.0288 1.7975 1.7975 3.7700 3.7700 4.6431 4.6431 5.8677 5.8677 7.1152 7.1152 7.2431 7.2431 7.6080 7.6080 7.9410 7.9410 8.3811 8.3811 8.4327 8.4327 8.4838 8.4838 8.6378 8.6378 8.7639 8.7639 9.0809 9.0809 9.2544 9.2544 9.5946 9.5946 9.6784 9.6784 10.1112 10.1112 10.4326 10.4326 10.4559 10.4559 10.6797 10.6797 10.8759 10.8759 11.2177 11.2177 11.7168 11.7168 11.9153 11.9153 12.4762 12.4762 12.7264 12.7264 k = 0.0544 0.0181 0.6503 ( 3957 PWs) bands (ev): -0.3901 -0.3901 -0.0226 -0.0226 1.7691 1.7691 3.7547 3.7547 4.6693 4.6693 5.8921 5.8921 7.1164 7.1164 7.2426 7.2426 7.6086 7.6086 7.9414 7.9414 8.3632 8.3632 8.4308 8.4308 8.4946 8.4946 8.6377 8.6377 8.7647 8.7647 9.0627 9.0627 9.2705 9.2705 9.5825 9.5825 9.6946 9.6946 10.1100 10.1100 10.4277 10.4277 10.4543 10.4543 10.6760 10.6760 10.8782 10.8782 11.2267 11.2267 11.7066 11.7066 11.9301 11.9301 12.4331 12.4331 12.7586 12.7586 k = 0.0725 0.0241 0.6503 ( 3954 PWs) bands (ev): -0.3829 -0.3829 -0.0138 -0.0138 1.7307 1.7307 3.7327 3.7327 4.7063 4.7063 5.9250 5.9250 7.1182 7.1182 7.2419 7.2419 7.6095 7.6095 7.9419 7.9419 8.3423 8.3423 8.4286 8.4286 8.5051 8.5051 8.6375 8.6375 8.7654 8.7654 9.0424 9.0424 9.2884 9.2884 9.5705 9.5705 9.7123 9.7123 10.1085 10.1085 10.4213 10.4213 10.4520 10.4520 10.6708 10.6708 10.8815 10.8815 11.2388 11.2388 11.6941 11.6941 11.9489 11.9489 12.3861 12.3861 12.7898 12.7898 k = 0.0906 0.0301 0.6503 ( 3959 PWs) bands (ev): -0.3736 -0.3736 -0.0026 -0.0026 1.6834 1.6834 3.7038 3.7038 4.7541 4.7541 5.9653 5.9653 7.1207 7.1207 7.2409 7.2409 7.6107 7.6107 7.9424 7.9424 8.3192 8.3192 8.4259 8.4259 8.5146 8.5146 8.6372 8.6372 8.7656 8.7656 9.0216 9.0216 9.3065 9.3065 9.5591 9.5591 9.7309 9.7309 10.1066 10.1066 10.4135 10.4135 10.4488 10.4488 10.6644 10.6644 10.8855 10.8855 11.2538 11.2538 11.6802 11.6802 11.9706 11.9706 12.3374 12.3374 12.8173 12.8173 k = 0.1087 0.0361 0.6503 ( 3961 PWs) bands (ev): -0.3624 -0.3624 0.0110 0.0110 1.6285 1.6285 3.6683 3.6683 4.8120 4.8120 6.0119 6.0119 7.1239 7.1239 7.2398 7.2398 7.6122 7.6122 7.9428 7.9428 8.2943 8.2943 8.4227 8.4227 8.5224 8.5224 8.6369 8.6369 8.7649 8.7649 9.0018 9.0018 9.3241 9.3241 9.5488 9.5488 9.7502 9.7502 10.1047 10.1047 10.4045 10.4045 10.4448 10.4448 10.6565 10.6565 10.8904 10.8904 11.2712 11.2712 11.6656 11.6656 11.9944 11.9944 12.2882 12.2882 12.8398 12.8398 k = 0.1268 0.0422 0.6503 ( 3957 PWs) bands (ev): -0.3492 -0.3492 0.0271 0.0271 1.5672 1.5672 3.6268 3.6268 4.8792 4.8792 6.0636 6.0636 7.1280 7.1280 7.2386 7.2386 7.6142 7.6142 7.9432 7.9432 8.2679 8.2679 8.4191 8.4191 8.5284 8.5284 8.6366 8.6366 8.7628 8.7628 8.9840 8.9840 9.3405 9.3405 9.5397 9.5397 9.7699 9.7699 10.1028 10.1028 10.3945 10.3945 10.4400 10.4400 10.6476 10.6476 10.8962 10.8962 11.2907 11.2907 11.6507 11.6507 12.0197 12.0197 12.2391 12.2391 12.8567 12.8567 k = 0.1450 0.0482 0.6503 ( 3953 PWs) bands (ev): -0.3341 -0.3341 0.0456 0.0456 1.5007 1.5007 3.5799 3.5799 4.9546 4.9546 6.1192 6.1192 7.1332 7.1332 7.2372 7.2372 7.6164 7.6164 7.9433 7.9433 8.2400 8.2400 8.4148 8.4148 8.5324 8.5324 8.6362 8.6362 8.7589 8.7589 8.9693 8.9693 9.3555 9.3555 9.5321 9.5321 9.7898 9.7898 10.1011 10.1011 10.3837 10.3837 10.4343 10.4343 10.6374 10.6374 10.9028 10.9028 11.3121 11.3121 11.6357 11.6357 12.0459 12.0459 12.1907 12.1907 12.8682 12.8682 k = 0.1631 0.0542 0.6503 ( 3955 PWs) bands (ev): -0.3172 -0.3172 0.0664 0.0664 1.4302 1.4302 3.5286 3.5286 5.0369 5.0369 6.1775 6.1775 7.1398 7.1398 7.2358 7.2358 7.6191 7.6191 7.9431 7.9431 8.2107 8.2107 8.4097 8.4097 8.5342 8.5342 8.6357 8.6357 8.7530 8.7530 8.9581 8.9581 9.3688 9.3688 9.5258 9.5258 9.8097 9.8097 10.0997 10.0997 10.3720 10.3720 10.4278 10.4278 10.6262 10.6262 10.9103 10.9103 11.3345 11.3345 11.6210 11.6210 12.0721 12.0721 12.1435 12.1435 12.8748 12.8748 k = 0.1812 0.0602 0.6503 ( 3953 PWs) bands (ev): -0.2986 -0.2986 0.0895 0.0895 1.3567 1.3567 3.4738 3.4738 5.1249 5.1249 6.2376 6.2376 7.1478 7.1478 7.2342 7.2342 7.6223 7.6223 7.9424 7.9424 8.1798 8.1798 8.4033 8.4033 8.5341 8.5341 8.6352 8.6352 8.7454 8.7454 8.9508 8.9508 9.3801 9.3801 9.5212 9.5212 9.8298 9.8298 10.0987 10.0987 10.3597 10.3597 10.4205 10.4205 10.6141 10.6141 10.9186 10.9186 11.3578 11.3578 11.6066 11.6066 12.0905 12.0905 12.1050 12.1050 12.8773 12.8773 k = 0.1993 0.0663 0.6503 ( 3950 PWs) bands (ev): -0.2784 -0.2784 0.1147 0.1147 1.2812 1.2812 3.4161 3.4161 5.2173 5.2173 6.2984 6.2984 7.1576 7.1576 7.2327 7.2327 7.6259 7.6259 7.9412 7.9412 8.1474 8.1474 8.3953 8.3953 8.5325 8.5325 8.6347 8.6347 8.7363 8.7363 8.9471 8.9471 9.3895 9.3895 9.5181 9.5181 9.8496 9.8496 10.0982 10.0982 10.3467 10.3467 10.4126 10.4126 10.6012 10.6012 10.9278 10.9278 11.3814 11.3814 11.5931 11.5931 12.0507 12.0507 12.1251 12.1251 12.8768 12.8768 k = 0.2174 0.0723 0.6503 ( 3951 PWs) bands (ev): -0.2566 -0.2566 0.1421 0.1421 1.2046 1.2046 3.3564 3.3564 5.3129 5.3129 6.3590 6.3590 7.1694 7.1694 7.2312 7.2312 7.6299 7.6299 7.9394 7.9394 8.1133 8.1133 8.3851 8.3851 8.5301 8.5301 8.6341 8.6341 8.7265 8.7265 8.9464 8.9464 9.3966 9.3966 9.5167 9.5167 9.8692 9.8692 10.0982 10.0982 10.3332 10.3332 10.4039 10.4039 10.5875 10.5875 10.9378 10.9378 11.4047 11.4047 11.5811 11.5811 12.0076 12.0076 12.1481 12.1481 12.8740 12.8740 k = 0.2356 0.0783 0.6503 ( 3956 PWs) bands (ev): -0.2337 -0.2337 0.1713 0.1713 1.1278 1.1278 3.2953 3.2953 5.4105 5.4105 6.4185 6.4185 7.1834 7.1834 7.2299 7.2299 7.6344 7.6344 7.9368 7.9368 8.0776 8.0776 8.3722 8.3722 8.5277 8.5277 8.6335 8.6335 8.7164 8.7164 8.9483 8.9483 9.4017 9.4017 9.5168 9.5168 9.8885 9.8885 10.0988 10.0988 10.3191 10.3191 10.3946 10.3946 10.5731 10.5731 10.9485 10.9485 11.4267 11.4267 11.5714 11.5714 11.9662 11.9662 12.1686 12.1686 12.8698 12.8698 k = 0.2537 0.0843 0.6503 ( 3959 PWs) bands (ev): -0.2096 -0.2096 0.2023 0.2023 1.0517 1.0517 3.2334 3.2334 5.5090 5.5090 6.4762 6.4762 7.1993 7.1993 7.2291 7.2291 7.6394 7.6394 7.9334 7.9334 8.0401 8.0401 8.3564 8.3564 8.5262 8.5262 8.6329 8.6329 8.7062 8.7062 8.9523 8.9523 9.4045 9.4045 9.5185 9.5185 9.9073 9.9073 10.0999 10.0999 10.3048 10.3048 10.3848 10.3848 10.5583 10.5583 10.9601 10.9601 11.4457 11.4457 11.5659 11.5659 11.9267 11.9267 12.1854 12.1854 12.8649 12.8649 k = 0.2718 0.0904 0.6503 ( 3950 PWs) bands (ev): -0.1849 -0.1849 0.2346 0.2346 0.9774 0.9774 3.1712 3.1712 5.6074 5.6074 6.5317 6.5317 7.2152 7.2152 7.2313 7.2313 7.6449 7.6449 7.9290 7.9290 8.0011 8.0011 8.3378 8.3378 8.5260 8.5260 8.6324 8.6324 8.6962 8.6962 8.9578 8.9578 9.4053 9.4053 9.5218 9.5218 9.9256 9.9256 10.1013 10.1013 10.2903 10.2903 10.3746 10.3746 10.5431 10.5431 10.9725 10.9725 11.4591 11.4591 11.5675 11.5675 11.8893 11.8893 12.1977 12.1977 12.8599 12.8599 k = 0.2899 0.0964 0.6503 ( 3951 PWs) bands (ev): -0.1599 -0.1599 0.2678 0.2678 0.9060 0.9060 3.1091 3.1091 5.7043 5.7043 6.5844 6.5844 7.2214 7.2214 7.2455 7.2455 7.6508 7.6508 7.9232 7.9232 7.9609 7.9609 8.3168 8.3168 8.5269 8.5269 8.6320 8.6320 8.6865 8.6865 8.9644 8.9644 9.4040 9.4040 9.5266 9.5266 9.9432 9.9432 10.1028 10.1028 10.2759 10.2759 10.3640 10.3640 10.5276 10.5276 10.9855 10.9855 11.4647 11.4647 11.5782 11.5782 11.8542 11.8542 12.2047 12.2047 12.8551 12.8551 k = 0.3080 0.1024 0.6503 ( 3948 PWs) bands (ev): -0.1353 -0.1353 0.3010 0.3010 0.8393 0.8393 3.0475 3.0475 5.7986 5.7986 6.6342 6.6342 7.2216 7.2216 7.2681 7.2681 7.6571 7.6571 7.9111 7.9111 7.9249 7.9249 8.2941 8.2941 8.5285 8.5285 8.6317 8.6317 8.6775 8.6775 8.9719 8.9719 9.4006 9.4006 9.5329 9.5329 9.9600 9.9600 10.1041 10.1041 10.2619 10.2619 10.3532 10.3532 10.5120 10.5120 10.9990 10.9990 11.4636 11.4636 11.5972 11.5972 11.8215 11.8215 12.2062 12.2062 12.8508 12.8508 k = 0.3262 0.1084 0.6503 ( 3950 PWs) bands (ev): -0.1120 -0.1120 0.3328 0.3328 0.7797 0.7797 2.9868 2.9868 5.8891 5.8891 6.6810 6.6810 7.2211 7.2211 7.2929 7.2929 7.6638 7.6638 7.8740 7.8740 7.9125 7.9125 8.2706 8.2706 8.5298 8.5298 8.6315 8.6315 8.6698 8.6698 8.9800 8.9800 9.3953 9.3953 9.5406 9.5406 9.9757 9.9757 10.1044 10.1044 10.2489 10.2489 10.3424 10.3424 10.4962 10.4962 11.0130 11.0130 11.4588 11.4588 11.6218 11.6218 11.7913 11.7913 12.2021 12.2021 12.8474 12.8474 k = 0.3443 0.1145 0.6503 ( 3949 PWs) bands (ev): -0.0911 -0.0911 0.3609 0.3609 0.7309 0.7309 2.9273 2.9273 5.9744 5.9744 6.7251 6.7251 7.2206 7.2206 7.3181 7.3181 7.6707 7.6707 7.8331 7.8331 7.9038 7.9038 8.2469 8.2469 8.5292 8.5292 8.6314 8.6314 8.6648 8.6648 8.9885 8.9885 9.3883 9.3883 9.5495 9.5495 9.9903 9.9903 10.1034 10.1034 10.2378 10.2378 10.3318 10.3318 10.4805 10.4805 11.0273 11.0273 11.4525 11.4525 11.6496 11.6496 11.7637 11.7637 12.1928 12.1928 12.8449 12.8449 k = 0.3624 0.1205 0.6503 ( 3955 PWs) bands (ev): -0.0745 -0.0745 0.3821 0.3821 0.6980 0.6980 2.8693 2.8693 6.0531 6.0531 6.7666 6.7666 7.2202 7.2202 7.3416 7.3416 7.6776 7.6776 7.7948 7.7948 7.8943 7.8943 8.2236 8.2236 8.5249 8.5249 8.6313 8.6313 8.6637 8.6637 8.9971 8.9971 9.3798 9.3798 9.5596 9.5596 10.0035 10.0035 10.1000 10.1000 10.2292 10.2292 10.3216 10.3216 10.4650 10.4650 11.0416 11.0416 11.4459 11.4459 11.6791 11.6791 11.7390 11.7390 12.1793 12.1793 12.8435 12.8435 k = 0.3805 0.1265 0.6503 ( 3953 PWs) bands (ev): -0.0645 -0.0645 0.3938 0.3938 0.6857 0.6857 2.8131 2.8131 6.1241 6.1241 6.8055 6.8055 7.2200 7.2200 7.3610 7.3610 7.6843 7.6843 7.7624 7.7624 7.8840 7.8840 8.2012 8.2012 8.5157 8.5157 8.6315 8.6315 8.6678 8.6678 9.0058 9.0058 9.3703 9.3703 9.5708 9.5708 10.0152 10.0152 10.0937 10.0937 10.2242 10.2242 10.3122 10.3122 10.4497 10.4497 11.0559 11.0559 11.4400 11.4400 11.7082 11.7082 11.7183 11.7183 12.1631 12.1631 12.8434 12.8434 k = 0.5000 0.1662-0.1267 ( 3934 PWs) bands (ev): -0.7849 -0.7849 -0.5890 -0.5890 3.2259 3.2259 3.3063 3.3063 5.6856 5.6856 6.8565 6.8565 6.9917 6.9917 7.4882 7.4882 7.5974 7.5974 7.9051 7.9051 7.9485 7.9485 8.3848 8.3848 8.4608 8.4608 8.5162 8.5162 8.7946 8.7946 9.0796 9.0796 9.3535 9.3535 9.3906 9.3906 9.6035 9.6035 9.9555 9.9555 10.1552 10.1552 10.7235 10.7235 10.7988 10.7988 10.8208 10.8208 10.8842 10.8842 11.2755 11.2755 11.5598 11.5598 12.2404 12.2404 12.9942 12.9942 k = 0.5061 0.1478-0.1267 ( 3928 PWs) bands (ev): -0.7836 -0.7836 -0.5877 -0.5877 3.2260 3.2260 3.3050 3.3050 5.6863 5.6863 6.8553 6.8553 6.9927 6.9927 7.4902 7.4902 7.5831 7.5831 7.9015 7.9015 7.9623 7.9623 8.3855 8.3855 8.4615 8.4615 8.5135 8.5135 8.7942 8.7942 9.0811 9.0811 9.3488 9.3488 9.3895 9.3895 9.6065 9.6065 9.9568 9.9568 10.1549 10.1549 10.7232 10.7232 10.7982 10.7982 10.8207 10.8207 10.8841 10.8841 11.2754 11.2754 11.5608 11.5608 12.2425 12.2425 12.9779 12.9779 k = 0.5123 0.1293-0.1267 ( 3928 PWs) bands (ev): -0.7796 -0.7796 -0.5837 -0.5837 3.2261 3.2261 3.3011 3.3011 5.6885 5.6885 6.8518 6.8518 6.9956 6.9956 7.4950 7.4950 7.5459 7.5459 7.8963 7.8963 7.9937 7.9937 8.3875 8.3875 8.4637 8.4637 8.5057 8.5057 8.7930 8.7930 9.0854 9.0854 9.3352 9.3352 9.3861 9.3861 9.6150 9.6150 9.9605 9.9605 10.1538 10.1538 10.7224 10.7224 10.7961 10.7961 10.8204 10.8204 10.8836 10.8836 11.2750 11.2750 11.5637 11.5637 12.2486 12.2486 12.9289 12.9289 k = 0.5184 0.1109-0.1267 ( 3928 PWs) bands (ev): -0.7729 -0.7729 -0.5771 -0.5771 3.2262 3.2262 3.2946 3.2946 5.6921 5.6921 6.8461 6.8461 7.0003 7.0003 7.4783 7.4783 7.5182 7.5182 7.8921 7.8921 8.0317 8.0317 8.3906 8.3906 8.4670 8.4670 8.4938 8.4938 8.7910 8.7910 9.0923 9.0923 9.3147 9.3147 9.3802 9.3802 9.6273 9.6273 9.9665 9.9665 10.1520 10.1520 10.7209 10.7209 10.7927 10.7927 10.8198 10.8198 10.8828 10.8828 11.2743 11.2743 11.5685 11.5685 12.2586 12.2586 12.8540 12.8540 k = 0.5245 0.0924-0.1267 ( 3930 PWs) bands (ev): -0.7635 -0.7635 -0.5679 -0.5679 3.2263 3.2263 3.2854 3.2854 5.6970 5.6970 6.8387 6.8387 7.0066 7.0066 7.4174 7.4174 7.5291 7.5291 7.8882 7.8882 8.0708 8.0708 8.3941 8.3941 8.4676 8.4676 8.4827 8.4827 8.7885 8.7885 9.1012 9.1012 9.2890 9.2890 9.3720 9.3720 9.6418 9.6418 9.9743 9.9743 10.1495 10.1495 10.7189 10.7189 10.7878 10.7878 10.8191 10.8191 10.8818 10.8818 11.2732 11.2732 11.5749 11.5749 12.2720 12.2720 12.7624 12.7624 k = 0.5307 0.0740-0.1267 ( 3936 PWs) bands (ev): -0.7514 -0.7514 -0.5560 -0.5560 3.2265 3.2265 3.2733 3.2733 5.7031 5.7031 6.8298 6.8298 7.0144 7.0144 7.3477 7.3477 7.5473 7.5473 7.8839 7.8839 8.1077 8.1077 8.3961 8.3961 8.4553 8.4553 8.4852 8.4852 8.7855 8.7855 9.1116 9.1116 9.2599 9.2599 9.3612 9.3612 9.6573 9.6573 9.9837 9.9837 10.1463 10.1463 10.7163 10.7163 10.7816 10.7816 10.8181 10.8181 10.8806 10.8806 11.2716 11.2716 11.5827 11.5827 12.2885 12.2885 12.6604 12.6604 k = 0.5368 0.0555-0.1267 ( 3940 PWs) bands (ev): -0.7366 -0.7366 -0.5415 -0.5415 3.2267 3.2267 3.2582 3.2582 5.7104 5.7104 6.8200 6.8200 7.0226 7.0226 7.2759 7.2759 7.5689 7.5689 7.8788 7.8788 8.1407 8.1407 8.3908 8.3908 8.4436 8.4436 8.4940 8.4940 8.7825 8.7825 9.1227 9.1227 9.2289 9.2289 9.3483 9.3483 9.6729 9.6729 9.9942 9.9942 10.1427 10.1427 10.7131 10.7131 10.7740 10.7740 10.8170 10.8170 10.8791 10.8791 11.2696 11.2696 11.5917 11.5917 12.3071 12.3071 12.5523 12.5523 k = 0.5429 0.0371-0.1267 ( 3942 PWs) bands (ev): -0.7192 -0.7192 -0.5245 -0.5245 3.2268 3.2268 3.2399 3.2399 5.7186 5.7186 6.8098 6.8098 7.0288 7.0288 7.2068 7.2068 7.5931 7.5931 7.8725 7.8725 8.1689 8.1689 8.3723 8.3723 8.4429 8.4429 8.5050 8.5050 8.7798 8.7798 9.1331 9.1331 9.1977 9.1977 9.3332 9.3332 9.6878 9.6878 10.0054 10.0054 10.1385 10.1385 10.7092 10.7092 10.7651 10.7651 10.8156 10.8156 10.8774 10.8774 11.2669 11.2669 11.6017 11.6017 12.3265 12.3265 12.4417 12.4417 k = 0.5491 0.0187-0.1267 ( 3938 PWs) bands (ev): -0.6992 -0.6992 -0.5049 -0.5049 3.2181 3.2181 3.2270 3.2270 5.7276 5.7276 6.7996 6.7996 7.0245 7.0245 7.1506 7.1506 7.6191 7.6191 7.8647 7.8647 8.1920 8.1920 8.3444 8.3444 8.4502 8.4502 8.5174 8.5174 8.7778 8.7778 9.1366 9.1366 9.1733 9.1733 9.3160 9.3160 9.7015 9.7015 10.0171 10.0171 10.1340 10.1340 10.7043 10.7043 10.7553 10.7553 10.8141 10.8141 10.8756 10.8756 11.2636 11.2636 11.6123 11.6123 12.3213 12.3213 12.3550 12.3550 k = 0.5552 0.0002-0.1267 ( 3938 PWs) bands (ev): -0.6765 -0.6765 -0.4827 -0.4827 3.1928 3.1928 3.2270 3.2270 5.7370 5.7370 6.7897 6.7897 6.9924 6.9924 7.1259 7.1259 7.6463 7.6463 7.8551 7.8551 8.2100 8.2100 8.3120 8.3120 8.4614 8.4614 8.5303 8.5303 8.7770 8.7770 9.1173 9.1173 9.1716 9.1716 9.2969 9.2969 9.7138 9.7138 10.0288 10.0288 10.1291 10.1291 10.6982 10.6982 10.7449 10.7449 10.8123 10.8123 10.8736 10.8736 11.2594 11.2594 11.6235 11.6235 12.2148 12.2148 12.3692 12.3692 k = 0.5613-0.0182-0.1267 ( 3944 PWs) bands (ev): -0.6511 -0.6511 -0.4580 -0.4580 3.1637 3.1637 3.2269 3.2269 5.7466 5.7466 6.7803 6.7803 6.9364 6.9364 7.1299 7.1299 7.6738 7.6738 7.8431 7.8431 8.2231 8.2231 8.2777 8.2777 8.4747 8.4747 8.5425 8.5425 8.7781 8.7781 9.0874 9.0874 9.1810 9.1810 9.2760 9.2760 9.7243 9.7243 10.0403 10.0403 10.1241 10.1241 10.6902 10.6902 10.7346 10.7346 10.8103 10.8103 10.8714 10.8714 11.2542 11.2542 11.6349 11.6349 12.1050 12.1050 12.3854 12.3854 k = 0.5675-0.0367-0.1267 ( 3946 PWs) bands (ev): -0.6231 -0.6231 -0.4307 -0.4307 3.1306 3.1306 3.2266 3.2266 5.7559 5.7559 6.7716 6.7716 6.8743 6.8743 7.1460 7.1460 7.7006 7.7006 7.8285 7.8285 8.2280 8.2280 8.2466 8.2466 8.4896 8.4896 8.5532 8.5532 8.7816 8.7816 9.0570 9.0570 9.1918 9.1918 9.2535 9.2535 9.7328 9.7328 10.0513 10.0513 10.1192 10.1192 10.6796 10.6796 10.7252 10.7252 10.8082 10.8082 10.8691 10.8691 11.2480 11.2480 11.6465 11.6465 11.9976 11.9976 12.3973 12.3973 k = 0.5736-0.0551-0.1267 ( 3944 PWs) bands (ev): -0.5925 -0.5925 -0.4011 -0.4011 3.0931 3.0931 3.2262 3.2262 5.7646 5.7646 6.7633 6.7633 6.8148 6.8148 7.1676 7.1676 7.7256 7.7256 7.8109 7.8109 8.2027 8.2027 8.2429 8.2429 8.5056 8.5056 8.5616 8.5616 8.7881 8.7881 9.0282 9.0282 9.2020 9.2020 9.2300 9.2300 9.7390 9.7390 10.0614 10.0614 10.1148 10.1148 10.6661 10.6661 10.7173 10.7173 10.8059 10.8059 10.8666 10.8666 11.2405 11.2405 11.6581 11.6581 11.8934 11.8934 12.4024 12.4024 k = 0.5797-0.0736-0.1267 ( 3940 PWs) bands (ev): -0.5593 -0.5593 -0.3689 -0.3689 3.0513 3.0513 3.2255 3.2255 5.7720 5.7720 6.7458 6.7458 6.7702 6.7702 7.1927 7.1927 7.7465 7.7465 7.7905 7.7905 8.1702 8.1702 8.2458 8.2458 8.5224 8.5224 8.5673 8.5673 8.7973 8.7973 9.0020 9.0020 9.2009 9.2009 9.2160 9.2160 9.7426 9.7426 10.0696 10.0696 10.1119 10.1119 10.6496 10.6496 10.7108 10.7108 10.8033 10.8033 10.8640 10.8640 11.2318 11.2318 11.6692 11.6692 11.7932 11.7932 12.3983 12.3983 k = 0.5859-0.0920-0.1267 ( 3948 PWs) bands (ev): -0.5236 -0.5236 -0.3344 -0.3344 3.0048 3.0048 3.2246 3.2246 5.7776 5.7776 6.7022 6.7022 6.7595 6.7595 7.2205 7.2205 7.7542 7.7542 7.7737 7.7737 8.1414 8.1414 8.2472 8.2472 8.5397 8.5397 8.5704 8.5704 8.8089 8.8089 8.9792 8.9792 9.1763 9.1763 9.2234 9.2234 9.7437 9.7437 10.0743 10.0743 10.1120 10.1120 10.6307 10.6307 10.7054 10.7054 10.8006 10.8006 10.8611 10.8611 11.2216 11.2216 11.6745 11.6745 11.7026 11.7026 12.3827 12.3827 k = 0.5920-0.1105-0.1267 ( 3954 PWs) bands (ev): -0.4852 -0.4852 -0.2976 -0.2976 2.9537 2.9537 3.2233 3.2233 5.7809 5.7809 6.6600 6.6600 6.7564 6.7564 7.2506 7.2506 7.7310 7.7310 7.7748 7.7748 8.1200 8.1200 8.2472 8.2472 8.5564 8.5564 8.5721 8.5721 8.8216 8.8216 8.9608 8.9608 9.1493 9.1493 9.2314 9.2314 9.7420 9.7420 10.0745 10.0745 10.1163 10.1163 10.6097 10.6097 10.7010 10.7010 10.7976 10.7976 10.8580 10.8580 11.2100 11.2100 11.6005 11.6005 11.6952 11.6952 12.3537 12.3537 k = 0.5981-0.1289-0.1267 ( 3950 PWs) bands (ev): -0.4444 -0.4444 -0.2585 -0.2585 2.8979 2.8979 3.2217 3.2217 5.7813 5.7813 6.6254 6.6254 6.7558 6.7558 7.2828 7.2828 7.6983 7.6983 7.7696 7.7696 8.1091 8.1091 8.2463 8.2463 8.5661 8.5661 8.5792 8.5792 8.8339 8.8339 8.9482 8.9482 9.1216 9.1216 9.2384 9.2384 9.7376 9.7376 10.0710 10.0710 10.1240 10.1240 10.5871 10.5871 10.6972 10.6972 10.7945 10.7945 10.8547 10.8547 11.1969 11.1969 11.5128 11.5128 11.7055 11.7055 12.3106 12.3106 k = 0.6043-0.1474-0.1267 ( 3954 PWs) bands (ev): -0.4010 -0.4010 -0.2171 -0.2171 2.8373 2.8373 3.2198 3.2198 5.7784 5.7784 6.5991 6.5991 6.7574 6.7574 7.3168 7.3168 7.6609 7.6609 7.7518 7.7518 8.1099 8.1099 8.2445 8.2445 8.5658 8.5658 8.5949 8.5949 8.8431 8.8431 8.9431 8.9431 9.0938 9.0938 9.2442 9.2442 9.7303 9.7303 10.0655 10.0655 10.1333 10.1333 10.5632 10.5632 10.6939 10.6939 10.7913 10.7913 10.8513 10.8513 11.1822 11.1822 11.4289 11.4289 11.7161 11.7161 12.2540 12.2540 k = 0.6104-0.1658-0.1267 ( 3948 PWs) bands (ev): -0.3551 -0.3551 -0.1736 -0.1736 2.7722 2.7722 3.2174 3.2174 5.7720 5.7720 6.5816 6.5816 6.7611 6.7611 7.3525 7.3525 7.6199 7.6199 7.7225 7.7225 8.1213 8.1213 8.2422 8.2422 8.5635 8.5635 8.6112 8.6112 8.8478 8.8478 8.9468 8.9468 9.0663 9.0663 9.2489 9.2489 9.7204 9.7204 10.0588 10.0588 10.1435 10.1435 10.5383 10.5383 10.6910 10.6910 10.7879 10.7879 10.8476 10.8476 11.1659 11.1659 11.3491 11.3491 11.7264 11.7264 12.1854 12.1854 k = 0.6165-0.1843-0.1267 ( 3954 PWs) bands (ev): -0.3067 -0.3067 -0.1281 -0.1281 2.7025 2.7025 3.2146 3.2146 5.7620 5.7620 6.5726 6.5726 6.7669 6.7669 7.3892 7.3892 7.5763 7.5763 7.6839 7.6839 8.1405 8.1405 8.2395 8.2395 8.5607 8.5607 8.6262 8.6262 8.8484 8.8484 8.9580 8.9580 9.0398 9.0398 9.2522 9.2522 9.7079 9.7079 10.0512 10.0512 10.1540 10.1540 10.5126 10.5126 10.6885 10.6885 10.7843 10.7843 10.8436 10.8436 11.1481 11.1481 11.2736 11.2736 11.7361 11.7361 12.1074 12.1074 k = 0.6227-0.2027-0.1267 ( 3952 PWs) bands (ev): -0.2559 -0.2559 -0.0805 -0.0805 2.6286 2.6286 3.2113 3.2113 5.7485 5.7485 6.5719 6.5719 6.7748 6.7748 7.4253 7.4253 7.5325 7.5325 7.6390 7.6390 8.1650 8.1650 8.2365 8.2365 8.5578 8.5578 8.6392 8.6392 8.8471 8.8471 8.9740 8.9740 9.0152 9.0152 9.2542 9.2542 9.6929 9.6929 10.0430 10.0430 10.1648 10.1648 10.4865 10.4865 10.6863 10.6863 10.7804 10.7804 10.8393 10.8393 11.1287 11.1287 11.2026 11.2026 11.7452 11.7452 12.0220 12.0220 k = 0.6288-0.2212-0.1267 ( 3954 PWs) bands (ev): -0.2026 -0.2026 -0.0311 -0.0311 2.5507 2.5507 3.2075 3.2075 5.7318 5.7318 6.5785 6.5785 6.7847 6.7847 7.4470 7.4470 7.5029 7.5029 7.5895 7.5895 8.1924 8.1924 8.2332 8.2332 8.5550 8.5550 8.6492 8.6492 8.8458 8.8458 8.9864 8.9864 8.9997 8.9997 9.2548 9.2548 9.6756 9.6756 10.0339 10.0339 10.1756 10.1756 10.4602 10.4602 10.6844 10.6844 10.7764 10.7764 10.8347 10.8347 11.1066 11.1066 11.1373 11.1373 11.7532 11.7532 11.9318 11.9318 k = 0.6349-0.2396-0.1267 ( 3950 PWs) bands (ev): -0.1470 -0.1470 0.0200 0.0200 2.4692 2.4692 3.2032 3.2032 5.7122 5.7122 6.5917 6.5917 6.7965 6.7965 7.4178 7.4178 7.5245 7.5245 7.5373 7.5373 8.2189 8.2189 8.2320 8.2320 8.5524 8.5524 8.6553 8.6553 8.8457 8.8457 8.9716 8.9716 9.0162 9.0162 9.2541 9.2541 9.6564 9.6564 10.0238 10.0238 10.1863 10.1863 10.4343 10.4343 10.6827 10.6827 10.7718 10.7718 10.8295 10.8295 11.0670 11.0670 11.0927 11.0927 11.7582 11.7582 11.8403 11.8403 k = 0.6410-0.2580-0.1267 ( 3952 PWs) bands (ev): -0.0891 -0.0891 0.0728 0.0728 2.3844 2.3844 3.1984 3.1984 5.6897 5.6897 6.6106 6.6106 6.8102 6.8102 7.3720 7.3720 7.4821 7.4821 7.5649 7.5649 8.2218 8.2218 8.2545 8.2545 8.5498 8.5498 8.6566 8.6566 8.8473 8.8473 8.9576 8.9576 9.0371 9.0371 9.2520 9.2520 9.6356 9.6356 10.0126 10.0126 10.1969 10.1969 10.4090 10.4090 10.6809 10.6809 10.7665 10.7665 10.8234 10.8234 11.0112 11.0112 11.0683 11.0683 11.7277 11.7277 11.7812 11.7812 k = 0.6472-0.2765-0.1267 ( 3946 PWs) bands (ev): -0.0288 -0.0288 0.1269 0.1269 2.2968 2.2968 3.1930 3.1930 5.6647 5.6647 6.6344 6.6344 6.8256 6.8256 7.3250 7.3250 7.4261 7.4261 7.6082 7.6082 8.2162 8.2162 8.2843 8.2843 8.5475 8.5475 8.6526 8.6526 8.8509 8.8509 8.9486 8.9486 9.0582 9.0582 9.2486 9.2486 9.6135 9.6135 10.0000 10.0000 10.2072 10.2072 10.3849 10.3849 10.6791 10.6791 10.7597 10.7597 10.8159 10.8159 10.9595 10.9596 11.0453 11.0453 11.6367 11.6367 11.7807 11.7807 k = 0.6533-0.2949-0.1267 ( 3940 PWs) bands (ev): 0.0337 0.0337 0.1822 0.1822 2.2069 2.2069 3.1870 3.1870 5.6370 5.6370 6.6623 6.6623 6.8426 6.8426 7.2794 7.2794 7.3692 7.3692 7.6529 7.6529 8.2089 8.2089 8.3138 8.3138 8.5453 8.5453 8.6434 8.6434 8.8569 8.8569 8.9449 8.9449 9.0787 9.0787 9.2438 9.2438 9.5907 9.5907 9.9859 9.9859 10.2172 10.2172 10.3624 10.3624 10.6770 10.6770 10.7498 10.7498 10.8063 10.8063 10.9156 10.9156 11.0224 11.0224 11.5404 11.5404 11.7848 11.7848 k = 0.6594-0.3134-0.1267 ( 3936 PWs) bands (ev): 0.0985 0.0985 0.2384 0.2384 2.1152 2.1152 3.1805 3.1805 5.6066 5.6066 6.6936 6.6936 6.8607 6.8607 7.2366 7.2366 7.3120 7.3120 7.6983 7.6983 8.2000 8.2000 8.3418 8.3418 8.5433 8.5433 8.6301 8.6301 8.8652 8.8652 8.9463 8.9463 9.0980 9.0980 9.2378 9.2378 9.5676 9.5676 9.9698 9.9698 10.2267 10.2267 10.3419 10.3419 10.6742 10.6742 10.7335 10.7335 10.7951 10.7951 10.8824 10.8824 10.9997 10.9997 11.4445 11.4445 11.7886 11.7886 k = 0.6656-0.3318-0.1267 ( 3940 PWs) bands (ev): 0.1654 0.1654 0.2952 0.2952 2.0223 2.0223 3.1734 3.1734 5.5735 5.5735 6.7277 6.7277 6.8795 6.8795 7.1973 7.1973 7.2552 7.2552 7.7437 7.7437 8.1894 8.1894 8.3673 8.3673 8.5412 8.5412 8.6144 8.6144 8.8758 8.8758 8.9517 8.9517 9.1155 9.1155 9.2305 9.2305 9.5449 9.5449 9.9518 9.9518 10.2354 10.2354 10.3238 10.3238 10.6699 10.6699 10.7083 10.7083 10.7847 10.7847 10.8606 10.8606 10.9775 10.9775 11.3507 11.3507 11.7915 11.7915 k = 0.6717-0.3503-0.1267 ( 3938 PWs) bands (ev): 0.2345 0.2345 0.3521 0.3521 1.9289 1.9289 3.1657 3.1657 5.5375 5.5375 6.7641 6.7641 6.8981 6.8981 7.1622 7.1622 7.1997 7.1997 7.7886 7.7886 8.1773 8.1773 8.3888 8.3888 8.5392 8.5392 8.5987 8.5987 8.8888 8.8888 8.9604 8.9604 9.1306 9.1306 9.2221 9.2221 9.5234 9.5234 9.9320 9.9320 10.2431 10.2431 10.3087 10.3087 10.6583 10.6583 10.6808 10.6808 10.7768 10.7768 10.8472 10.8472 10.9562 10.9562 11.2601 11.2601 11.7932 11.7932 k = 0.6778-0.3687-0.1267 ( 3944 PWs) bands (ev): 0.3056 0.3056 0.4085 0.4085 1.8358 1.8358 3.1573 3.1573 5.4987 5.4987 6.8022 6.8022 6.9151 6.9151 7.1317 7.1317 7.1472 7.1472 7.8318 7.8318 8.1641 8.1641 8.4042 8.4042 8.5373 8.5373 8.5857 8.5857 8.9040 8.9040 8.9715 8.9715 9.1423 9.1423 9.2129 9.2129 9.5040 9.5040 9.9103 9.9103 10.2489 10.2489 10.2967 10.2967 10.6260 10.6260 10.6684 10.6684 10.7712 10.7712 10.8384 10.8384 10.9360 10.9360 11.1738 11.1738 11.7938 11.7938 k = 0.6840-0.3872-0.1267 ( 3942 PWs) bands (ev): 0.3787 0.3787 0.4635 0.4635 1.7440 1.7440 3.1485 3.1485 5.4571 5.4571 6.8414 6.8414 6.9266 6.9266 7.0994 7.0994 7.1086 7.1086 7.8717 7.8717 8.1510 8.1510 8.4109 8.4109 8.5363 8.5363 8.5777 8.5777 8.9213 8.9213 8.9845 8.9845 9.1499 9.1499 9.2032 9.2032 9.4877 9.4877 9.8872 9.8872 10.2518 10.2518 10.2887 10.2887 10.5860 10.5860 10.6612 10.6612 10.7669 10.7669 10.8322 10.8322 10.9173 10.9173 11.0930 11.0930 11.7932 11.7932 k = 0.6901-0.4056-0.1267 ( 3942 PWs) bands (ev): 0.4537 0.4537 0.5160 0.5160 1.6549 1.6549 3.1390 3.1390 5.4130 5.4130 6.8807 6.8807 6.9248 6.9248 7.0680 7.0680 7.0893 7.0893 7.9052 7.9052 8.1405 8.1405 8.4073 8.4073 8.5371 8.5371 8.5756 8.5756 8.9406 8.9406 8.9988 8.9988 9.1526 9.1526 9.1933 9.1933 9.4751 9.4751 9.8629 9.8629 10.2508 10.2508 10.2850 10.2850 10.5453 10.5453 10.6536 10.6536 10.7634 10.7634 10.8272 10.8272 10.9002 10.9002 11.0191 11.0191 11.7915 11.7915 k = 0.6962-0.4241-0.1267 ( 3942 PWs) bands (ev): 0.5306 0.5306 0.5643 0.5643 1.5704 1.5704 3.1290 3.1290 5.3665 5.3665 6.8991 6.8991 6.9215 6.9215 7.0568 7.0568 7.0786 7.0786 7.9274 7.9274 8.1372 8.1372 8.3953 8.3953 8.5394 8.5394 8.5785 8.5785 8.9615 8.9615 9.0139 9.0139 9.1504 9.1504 9.1834 9.1834 9.4667 9.4667 9.8379 9.8379 10.2467 10.2467 10.2836 10.2836 10.5061 10.5061 10.6452 10.6452 10.7605 10.7605 10.8230 10.8230 10.8844 10.8844 10.9535 10.9535 11.7887 11.7887 k = 0.7024-0.4425-0.1267 ( 3946 PWs) bands (ev): 0.6047 0.6047 0.6102 0.6102 1.4929 1.4929 3.1184 3.1184 5.3183 5.3183 6.8599 6.8599 6.9560 6.9560 7.0585 7.0585 7.0807 7.0807 7.9329 7.9329 8.1457 8.1457 8.3779 8.3779 8.5418 8.5418 8.5847 8.5847 8.9835 8.9835 9.0289 9.0289 9.1447 9.1447 9.1735 9.1735 9.4625 9.4625 9.8125 9.8125 10.2409 10.2409 10.2817 10.2817 10.4703 10.4703 10.6358 10.6358 10.7580 10.7580 10.8188 10.8188 10.8684 10.8684 10.8990 10.8990 11.7850 11.7850 k = 0.7085-0.4610-0.1267 ( 3942 PWs) bands (ev): 0.6365 0.6365 0.6898 0.6898 1.4262 1.4262 3.1073 3.1073 5.2686 5.2686 6.8126 6.8126 6.9829 6.9829 7.0677 7.0677 7.0958 7.0958 7.9209 7.9209 8.1669 8.1669 8.3580 8.3580 8.5440 8.5440 8.5919 8.5919 9.0057 9.0057 9.0428 9.0428 9.1376 9.1376 9.1641 9.1641 9.4618 9.4618 9.7872 9.7872 10.2345 10.2345 10.2768 10.2768 10.4401 10.4401 10.6257 10.6257 10.7557 10.7557 10.8126 10.8126 10.8429 10.8429 10.8674 10.8674 11.7806 11.7806 k = 0.7146-0.4794-0.1267 ( 3946 PWs) bands (ev): 0.6526 0.6526 0.7718 0.7718 1.3747 1.3747 3.0957 3.0957 5.2182 5.2182 6.7630 6.7630 6.9973 6.9973 7.0874 7.0874 7.1190 7.1190 7.8952 7.8952 8.1961 8.1961 8.3377 8.3377 8.5459 8.5459 8.5984 8.5984 9.0248 9.0248 9.0542 9.0542 9.1308 9.1308 9.1584 9.1584 9.4631 9.4631 9.7624 9.7624 10.2269 10.2269 10.2675 10.2675 10.4179 10.4179 10.6151 10.6151 10.7533 10.7533 10.7944 10.7944 10.8229 10.8229 10.8540 10.8540 11.7755 11.7755 k = 0.7208-0.4978-0.1267 ( 3952 PWs) bands (ev): 0.6492 0.6492 0.8553 0.8553 1.3430 1.3430 3.0835 3.0835 5.1677 5.1677 6.7131 6.7131 7.0031 7.0031 7.1106 7.1106 7.1501 7.1501 7.8603 7.8603 8.2288 8.2288 8.3183 8.3183 8.5477 8.5477 8.6032 8.6032 9.0344 9.0344 9.0639 9.0639 9.1266 9.1266 9.1615 9.1615 9.4652 9.4652 9.7383 9.7383 10.2175 10.2175 10.2551 10.2551 10.4047 10.4047 10.6044 10.6044 10.7494 10.7494 10.7707 10.7707 10.8172 10.8172 10.8444 10.8444 11.7699 11.7699 k = 0.2792-0.8399-0.0000 ( 3952 PWs) bands (ev): 0.6492 0.6492 0.8553 0.8553 1.3430 1.3430 3.0835 3.0835 5.1677 5.1677 6.7131 6.7131 7.0031 7.0031 7.1106 7.1106 7.1501 7.1501 7.8603 7.8603 8.2288 8.2288 8.3183 8.3183 8.5477 8.5477 8.6032 8.6032 9.0344 9.0344 9.0639 9.0639 9.1266 9.1266 9.1615 9.1615 9.4652 9.4652 9.7383 9.7383 10.2175 10.2175 10.2551 10.2551 10.4047 10.4047 10.6044 10.6044 10.7494 10.7494 10.7707 10.7707 10.8172 10.8172 10.8444 10.8444 11.7699 11.7699 k = 0.2730-0.8212-0.0000 ( 3958 PWs) bands (ev): 0.6237 0.6237 0.9412 0.9412 1.3331 1.3331 3.0707 3.0707 5.1172 5.1172 6.6635 6.6635 7.0056 7.0056 7.1309 7.1309 7.1888 7.1888 7.8186 7.8186 8.2613 8.2613 8.3015 8.3015 8.5494 8.5494 8.6057 8.6057 9.0316 9.0316 9.0664 9.0664 9.1330 9.1330 9.1742 9.1742 9.4669 9.4669 9.7150 9.7150 10.2054 10.2054 10.2429 10.2429 10.3991 10.3991 10.5937 10.5937 10.7396 10.7396 10.7587 10.7587 10.8140 10.8140 10.8366 10.8366 11.7639 11.7639 k = 0.2668-0.8026-0.0000 ( 3956 PWs) bands (ev): 0.5778 0.5778 1.0284 1.0284 1.3435 1.3435 3.0574 3.0574 5.0680 5.0680 6.6152 6.6152 7.0069 7.0069 7.1474 7.1474 7.2311 7.2311 7.7723 7.7723 8.2771 8.2771 8.3023 8.3023 8.5511 8.5511 8.6057 8.6057 9.0215 9.0215 9.0566 9.0566 9.1535 9.1535 9.1933 9.1933 9.4670 9.4670 9.6931 9.6931 10.1927 10.1927 10.2333 10.2333 10.3993 10.3993 10.5833 10.5833 10.7287 10.7287 10.7558 10.7558 10.8111 10.8111 10.8306 10.8306 11.7577 11.7577 k = 0.2606-0.7839-0.0000 ( 3962 PWs) bands (ev): 0.5161 0.5161 1.1167 1.1167 1.3696 1.3696 3.0436 3.0436 5.0209 5.0209 6.5687 6.5687 7.0073 7.0073 7.1602 7.1602 7.2746 7.2746 7.7229 7.7229 8.2672 8.2672 8.3288 8.3288 8.5528 8.5528 8.6032 8.6032 9.0080 9.0080 9.0408 9.0408 9.1810 9.1810 9.2160 9.2160 9.4649 9.4649 9.6727 9.6727 10.1829 10.1829 10.2256 10.2256 10.4036 10.4036 10.5733 10.5733 10.7229 10.7229 10.7552 10.7552 10.8077 10.8077 10.8267 10.8267 11.7515 11.7515 k = 0.2544-0.7653-0.0000 ( 3962 PWs) bands (ev): 0.4434 0.4434 1.2061 1.2061 1.4061 1.4061 3.0294 3.0294 4.9766 4.9766 6.5243 6.5243 7.0065 7.0065 7.1693 7.1693 7.3174 7.3174 7.6724 7.6724 8.2573 8.2573 8.3546 8.3546 8.5544 8.5544 8.5985 8.5985 8.9930 8.9930 9.0228 9.0228 9.2108 9.2108 9.2409 9.2409 9.4607 9.4607 9.6543 9.6543 10.1786 10.1786 10.2193 10.2193 10.4112 10.4112 10.5638 10.5638 10.7229 10.7229 10.7558 10.7558 10.8039 10.8039 10.8251 10.8251 11.7453 11.7453 k = 0.2482-0.7466-0.0000 ( 3968 PWs) bands (ev): 0.3638 0.3638 1.2963 1.2963 1.4488 1.4488 3.0147 3.0147 4.9359 4.9359 6.4822 6.4822 7.0040 7.0040 7.1744 7.1744 7.3568 7.3568 7.6234 7.6234 8.2499 8.2499 8.3764 8.3764 8.5561 8.5561 8.5919 8.5919 8.9774 8.9774 9.0042 9.0042 9.2403 9.2403 9.2670 9.2670 9.4555 9.4555 9.6382 9.6382 10.1801 10.1801 10.2145 10.2145 10.4217 10.4217 10.5545 10.5545 10.7274 10.7274 10.7582 10.7582 10.8001 10.8001 10.8256 10.8256 11.7391 11.7391 k = 0.2420-0.7279-0.0000 ( 3968 PWs) bands (ev): 0.2800 0.2800 1.3873 1.3873 1.4946 1.4946 2.9997 2.9997 4.8995 4.8995 6.4428 6.4428 6.9992 6.9992 7.1755 7.1755 7.3867 7.3867 7.5827 7.5827 8.2449 8.2449 8.3933 8.3933 8.5579 8.5579 8.5840 8.5840 8.9616 8.9616 8.9859 8.9859 9.2669 9.2669 9.2942 9.2942 9.4518 9.4518 9.6248 9.6248 10.1846 10.1846 10.2137 10.2137 10.4350 10.4350 10.5453 10.5453 10.7343 10.7343 10.7633 10.7633 10.7972 10.7972 10.8285 10.8285 11.7332 11.7332 k = 0.2358-0.7093-0.0000 ( 3976 PWs) bands (ev): 0.1937 0.1937 1.4787 1.4787 1.5413 1.5413 2.9842 2.9842 4.8681 4.8681 6.4063 6.4063 6.9913 6.9913 7.1728 7.1728 7.3933 7.3933 7.5643 7.5643 8.2419 8.2419 8.4048 8.4048 8.5598 8.5598 8.5754 8.5754 8.9459 8.9459 8.9683 8.9683 9.2875 9.2875 9.3207 9.3207 9.4540 9.4540 9.6145 9.6145 10.1855 10.1855 10.2220 10.2220 10.4510 10.4510 10.5359 10.5359 10.7406 10.7406 10.7721 10.7721 10.7964 10.7964 10.8349 10.8349 11.7276 11.7276 k = 0.2296-0.6906-0.0000 ( 3976 PWs) bands (ev): 0.1064 0.1064 1.5702 1.5702 1.5875 1.5875 2.9685 2.9685 4.8424 4.8424 6.3728 6.3728 6.9797 6.9797 7.1663 7.1663 7.3681 7.3681 7.5777 7.5777 8.2402 8.2402 8.4109 8.4109 8.5611 8.5611 8.5678 8.5678 8.9304 8.9304 8.9515 8.9515 9.2999 9.2999 9.3438 9.3438 9.4674 9.4674 9.6079 9.6079 10.1815 10.1815 10.2394 10.2394 10.4696 10.4696 10.5264 10.5264 10.7449 10.7449 10.7818 10.7818 10.7996 10.7996 10.8475 10.8475 11.7222 11.7222 k = 0.2234-0.6719-0.0000 ( 3972 PWs) bands (ev): 0.0188 0.0188 1.6312 1.6312 1.6623 1.6623 2.9524 2.9524 4.8231 4.8231 6.3426 6.3426 6.9633 6.9633 7.1565 7.1565 7.3243 7.3243 7.6102 7.6102 8.2388 8.2388 8.4117 8.4117 8.5570 8.5570 8.5664 8.5664 8.9153 8.9153 8.9358 8.9358 9.3034 9.3034 9.3623 9.3623 9.4942 9.4942 9.6058 9.6058 10.1756 10.1756 10.2613 10.2613 10.4893 10.4893 10.5176 10.5176 10.7482 10.7482 10.7877 10.7877 10.8073 10.8073 10.8702 10.8702 11.7173 11.7173 k = 0.2172-0.6533-0.0000 ( 3970 PWs) bands (ev): -0.0685 -0.0685 1.6723 1.6723 1.7539 1.7539 2.9360 2.9360 4.8106 4.8106 6.3160 6.3160 6.9416 6.9416 7.1436 7.1436 7.2745 7.2745 7.6501 7.6501 8.2366 8.2366 8.4079 8.4079 8.5509 8.5509 8.5685 8.5685 8.9007 8.9007 8.9212 8.9212 9.3000 9.3000 9.3767 9.3767 9.5313 9.5313 9.6090 9.6090 10.1688 10.1688 10.2849 10.2849 10.4973 10.4973 10.5217 10.5217 10.7513 10.7513 10.7924 10.7924 10.8156 10.8156 10.9041 10.9041 11.7126 11.7126 k = 0.2110-0.6346-0.0000 ( 3976 PWs) bands (ev): -0.1549 -0.1549 1.7097 1.7097 1.8451 1.8451 2.9193 2.9193 4.8056 4.8056 6.2931 6.2931 6.9136 6.9136 7.1282 7.1282 7.2243 7.2243 7.6925 7.6925 8.2325 8.2325 8.4002 8.4002 8.5465 8.5465 8.5709 8.5709 8.8864 8.8864 8.9077 8.9077 9.2929 9.2929 9.3877 9.3877 9.5730 9.5730 9.6197 9.6197 10.1616 10.1616 10.3085 10.3085 10.4873 10.4873 10.5440 10.5440 10.7546 10.7546 10.7980 10.7980 10.8236 10.8236 10.9478 10.9478 11.7084 11.7084 k = 0.2048-0.6159-0.0000 ( 3976 PWs) bands (ev): -0.2403 -0.2403 1.7428 1.7428 1.9356 1.9356 2.9025 2.9025 4.8083 4.8083 6.2741 6.2741 6.8790 6.8790 7.1105 7.1105 7.1764 7.1764 7.7355 7.7355 8.2257 8.2257 8.3893 8.3893 8.5444 8.5444 8.5730 8.5730 8.8725 8.8725 8.8950 8.8950 9.2850 9.2850 9.3957 9.3957 9.6077 9.6077 9.6468 9.6468 10.1543 10.1543 10.3312 10.3312 10.4740 10.4740 10.5692 10.5692 10.7582 10.7582 10.8053 10.8053 10.8323 10.8323 11.0002 11.0002 11.7045 11.7045 k = 0.1986-0.5973-0.0000 ( 3972 PWs) bands (ev): -0.3242 -0.3242 1.7712 1.7712 2.0252 2.0252 2.8854 2.8854 4.8191 4.8191 6.2593 6.2593 6.8378 6.8378 7.0905 7.0905 7.1323 7.1323 7.7782 7.7782 8.2157 8.2157 8.3761 8.3761 8.5448 8.5448 8.5749 8.5749 8.8591 8.8591 8.8831 8.8831 9.2775 9.2775 9.4012 9.4012 9.6293 9.6293 9.6943 9.6943 10.1469 10.1469 10.3527 10.3527 10.4594 10.4594 10.5942 10.5942 10.7623 10.7623 10.8147 10.8147 10.8422 10.8422 11.0601 11.0601 11.7011 11.7011 k = 0.1924-0.5786-0.0000 ( 3972 PWs) bands (ev): -0.4065 -0.4065 1.7947 1.7947 2.1135 2.1135 2.8683 2.8683 4.8381 4.8381 6.2489 6.2489 6.7906 6.7906 7.0669 7.0669 7.0938 7.0938 7.8200 7.8200 8.2024 8.2024 8.3612 8.3612 8.5472 8.5472 8.5763 8.5763 8.8462 8.8462 8.8716 8.8716 9.2716 9.2716 9.4050 9.4050 9.6484 9.6484 9.7501 9.7501 10.1395 10.1395 10.3726 10.3726 10.4440 10.4440 10.6177 10.6177 10.7667 10.7667 10.8264 10.8264 10.8536 10.8536 11.1269 11.1269 11.6981 11.6981 k = 0.1862-0.5599-0.0000 ( 3970 PWs) bands (ev): -0.4871 -0.4871 1.8129 1.8129 2.2002 2.2002 2.8511 2.8511 4.8652 4.8652 6.2431 6.2431 6.7385 6.7385 7.0368 7.0368 7.0641 7.0641 7.8605 7.8605 8.1859 8.1859 8.3453 8.3453 8.5509 8.5509 8.5775 8.5775 8.8340 8.8340 8.8603 8.8603 9.2676 9.2676 9.4078 9.4078 9.6680 9.6680 9.8096 9.8096 10.1322 10.1322 10.3909 10.3909 10.4282 10.4282 10.6389 10.6389 10.7713 10.7713 10.8405 10.8405 10.8667 10.8667 11.1997 11.1997 11.6955 11.6955 k = 0.1799-0.5413-0.0000 ( 3972 PWs) bands (ev): -0.5657 -0.5657 1.8261 1.8261 2.2849 2.2849 2.8339 2.8339 4.9004 4.9004 6.2420 6.2420 6.6830 6.6830 7.0019 7.0019 7.0408 7.0408 7.8994 7.8994 8.1666 8.1666 8.3289 8.3289 8.5550 8.5550 8.5784 8.5784 8.8227 8.8227 8.8491 8.8491 9.2659 9.2659 9.4102 9.4102 9.6882 9.6882 9.8714 9.8714 10.1250 10.1250 10.4057 10.4057 10.4142 10.4142 10.6573 10.6573 10.7758 10.7758 10.8572 10.8572 10.8818 10.8818 11.2775 11.2775 11.6935 11.6935 k = 0.1737-0.5226-0.0000 ( 3974 PWs) bands (ev): -0.6423 -0.6423 1.8344 1.8344 2.3673 2.3673 2.8168 2.8168 4.9433 4.9433 6.2459 6.2459 6.6251 6.6251 6.9661 6.9661 7.0200 7.0200 7.9363 7.9363 8.1450 8.1450 8.3123 8.3123 8.5587 8.5587 8.5790 8.5790 8.8124 8.8124 8.8379 8.8379 9.2665 9.2665 9.4127 9.4127 9.7088 9.7088 9.9343 9.9343 10.1185 10.1185 10.3946 10.3946 10.4249 10.4249 10.6729 10.6729 10.7803 10.7803 10.8758 10.8758 10.8990 10.8990 11.3594 11.3594 11.6919 11.6919 k = 0.1675-0.5039-0.0000 ( 3968 PWs) bands (ev): -0.7168 -0.7168 1.8379 1.8379 2.4470 2.4470 2.7999 2.7999 4.9935 4.9935 6.2548 6.2548 6.5660 6.5660 6.9305 6.9305 7.0005 7.0005 7.9711 7.9711 8.1214 8.1214 8.2960 8.2960 8.5612 8.5612 8.5796 8.5796 8.8033 8.8033 8.8267 8.8267 9.2695 9.2695 9.4157 9.4157 9.7294 9.7294 9.9966 9.9966 10.1142 10.1142 10.3787 10.3787 10.4395 10.4395 10.6860 10.6860 10.7847 10.7847 10.8953 10.8953 10.9188 10.9188 11.4442 11.4442 11.6911 11.6911 k = 0.1613-0.4853-0.0000 ( 3964 PWs) bands (ev): -0.7891 -0.7891 1.8371 1.8371 2.5234 2.5234 2.7836 2.7836 5.0503 5.0503 6.2690 6.2690 6.5065 6.5065 6.8952 6.8952 6.9823 6.9823 8.0034 8.0034 8.0963 8.0963 8.2801 8.2801 8.5617 8.5617 8.5802 8.5802 8.7955 8.7955 8.8158 8.8158 9.2746 9.2746 9.4193 9.4193 9.7498 9.7498 10.0500 10.0500 10.1199 10.1199 10.3630 10.3630 10.4533 10.4533 10.6973 10.6973 10.7889 10.7889 10.9147 10.9147 10.9416 10.9416 11.5306 11.5306 11.6914 11.6914 k = 0.1551-0.4666-0.0000 ( 3964 PWs) bands (ev): -0.8591 -0.8591 1.8324 1.8324 2.5955 2.5955 2.7686 2.7686 5.1132 5.1132 6.2882 6.2882 6.4473 6.4473 6.8604 6.8604 6.9655 6.9655 8.0330 8.0330 8.0700 8.0700 8.2647 8.2647 8.5601 8.5601 8.5805 8.5805 8.7886 8.7886 8.8053 8.8053 9.2819 9.2819 9.4236 9.4236 9.7698 9.7698 10.0708 10.0708 10.1587 10.1587 10.3478 10.3478 10.4663 10.4663 10.7071 10.7071 10.7929 10.7929 10.9335 10.9335 10.9668 10.9668 11.6149 11.6149 11.6957 11.6957 k = 0.1489-0.4480-0.0000 ( 3970 PWs) bands (ev): -0.9267 -0.9267 1.8241 1.8241 2.6599 2.6599 2.7582 2.7582 5.1814 5.1814 6.3118 6.3118 6.3896 6.3896 6.8264 6.8264 6.9503 6.9503 8.0422 8.0422 8.0601 8.0601 8.2499 8.2499 8.5563 8.5563 8.5807 8.5807 8.7820 8.7820 8.7962 8.7962 9.2912 9.2912 9.4287 9.4287 9.7893 9.7893 10.0692 10.0692 10.2198 10.2198 10.3333 10.3333 10.4787 10.4787 10.7161 10.7161 10.7970 10.7970 10.9520 10.9520 10.9937 10.9937 11.6706 11.6706 11.7295 11.7295 k = 0.1427-0.4293-0.0000 ( 3968 PWs) bands (ev): -0.9918 -0.9918 1.8128 1.8128 2.6993 2.6993 2.7694 2.7694 5.2539 5.2539 6.3216 6.3216 6.3520 6.3520 6.7936 6.7936 6.9369 6.9369 8.0143 8.0143 8.0835 8.0835 8.2359 8.2359 8.5503 8.5503 8.5808 8.5808 8.7746 8.7746 8.7896 8.7896 9.3022 9.3022 9.4346 9.4346 9.8081 9.8081 10.0626 10.0626 10.2853 10.2853 10.3197 10.3197 10.4910 10.4910 10.7247 10.7247 10.8010 10.8010 10.9704 10.9704 11.0215 11.0215 11.6805 11.6805 11.8093 11.8093 k = 0.1365-0.4106-0.0000 ( 3960 PWs) bands (ev): -1.0546 -1.0546 1.7990 1.7990 2.6993 2.6993 2.8165 2.8165 5.3299 5.3299 6.2713 6.2713 6.3810 6.3810 6.7624 6.7624 6.9255 6.9255 7.9857 7.9857 8.1035 8.1035 8.2229 8.2229 8.5424 8.5424 8.5809 8.5809 8.7661 8.7661 8.7855 8.7855 9.3149 9.3149 9.4413 9.4413 9.8262 9.8262 10.0545 10.0545 10.3060 10.3060 10.3513 10.3513 10.5042 10.5042 10.7333 10.7333 10.8051 10.8051 10.9889 10.9889 11.0498 11.0498 11.6830 11.6830 11.8957 11.8957 k = 0.1303-0.3920-0.0000 ( 3964 PWs) bands (ev): -1.1147 -1.1147 1.7831 1.7831 2.6872 2.6872 2.8721 2.8721 5.4082 5.4082 6.2172 6.2172 6.4200 6.4200 6.7334 6.7334 6.9163 6.9163 7.9568 7.9568 8.1195 8.1195 8.2111 8.2111 8.5328 8.5328 8.5809 8.5809 8.7573 8.7573 8.7829 8.7829 9.3290 9.3290 9.4486 9.4486 9.8434 9.8434 10.0457 10.0457 10.2939 10.2939 10.4119 10.4119 10.5210 10.5210 10.7424 10.7424 10.8093 10.8093 11.0077 11.0077 11.0780 11.0780 11.6846 11.6846 11.9812 11.9812 k = 0.1241-0.3733-0.0000 ( 3962 PWs) bands (ev): -1.1724 -1.1724 1.7655 1.7655 2.6729 2.6729 2.9262 2.9262 5.4876 5.4876 6.1646 6.1646 6.4638 6.4638 6.7075 6.7075 6.9096 6.9096 7.9279 7.9279 8.1309 8.1309 8.2009 8.2009 8.5219 8.5219 8.5810 8.5810 8.7490 8.7490 8.7812 8.7812 9.3443 9.3443 9.4564 9.4564 9.8597 9.8597 10.0366 10.0366 10.2825 10.2825 10.4597 10.4597 10.5487 10.5487 10.7526 10.7526 10.8139 10.8139 11.0269 11.0269 11.1059 11.1059 11.6862 11.6862 12.0642 12.0642 k = 0.1179-0.3546-0.0000 ( 3960 PWs) bands (ev): -1.2274 -1.2274 1.7467 1.7467 2.6581 2.6581 2.9772 2.9772 5.5667 5.5667 6.1140 6.1140 6.5112 6.5112 6.6855 6.6855 6.9058 6.9058 7.8992 7.8992 8.1366 8.1366 8.1933 8.1933 8.5100 8.5100 8.5809 8.5809 8.7416 8.7416 8.7798 8.7798 9.3608 9.3608 9.4648 9.4648 9.8749 9.8749 10.0275 10.0275 10.2717 10.2717 10.4874 10.4874 10.5927 10.5927 10.7650 10.7650 10.8193 10.8193 11.0466 11.0466 11.1333 11.1333 11.6879 11.6879 12.1432 12.1432 k = 0.1117-0.3360-0.0000 ( 3958 PWs) bands (ev): -1.2797 -1.2797 1.7270 1.7270 2.6434 2.6434 3.0245 3.0245 5.6438 5.6438 6.0658 6.0658 6.5610 6.5610 6.6688 6.6688 6.9054 6.9054 7.8711 7.8711 8.1361 8.1361 8.1888 8.1888 8.4973 8.4973 8.5808 8.5808 8.7354 8.7354 8.7785 8.7785 9.3781 9.3781 9.4735 9.4735 9.8888 9.8888 10.0186 10.0186 10.2615 10.2615 10.5020 10.5020 10.6426 10.6426 10.7811 10.7811 10.8273 10.8273 11.0670 11.0670 11.1600 11.1600 11.6899 11.6899 12.2172 12.2172 k = 0.1055-0.3173-0.0000 ( 3958 PWs) bands (ev): -1.3294 -1.3294 1.7067 1.7067 2.6290 2.6290 3.0679 3.0679 5.7164 5.7164 6.0207 6.0207 6.6107 6.6107 6.6598 6.6598 6.9092 6.9092 7.8439 7.8439 8.1300 8.1300 8.1867 8.1867 8.4841 8.4841 8.5804 8.5804 8.7303 8.7303 8.7772 8.7772 9.3962 9.3962 9.4827 9.4827 9.9013 9.9013 10.0102 10.0102 10.2520 10.2520 10.5110 10.5110 10.6855 10.6855 10.7997 10.7997 10.8442 10.8442 11.0884 11.0884 11.1858 11.1858 11.6921 11.6921 12.2850 12.2850 k = 0.0993-0.2986-0.0000 ( 3958 PWs) bands (ev): -1.3764 -1.3764 1.6863 1.6863 2.6151 2.6151 3.1076 3.1076 5.7813 5.7813 5.9801 5.9801 6.6463 6.6463 6.6723 6.6723 6.9182 6.9182 7.8181 7.8181 8.1202 8.1202 8.1851 8.1851 8.4705 8.4705 8.5797 8.5797 8.7266 8.7266 8.7757 8.7757 9.4149 9.4149 9.4921 9.4921 9.9119 9.9119 10.0027 10.0027 10.2430 10.2430 10.5174 10.5174 10.7150 10.7150 10.8128 10.8128 10.8812 10.8812 11.1107 11.1107 11.2108 11.2108 11.6946 11.6946 12.3457 12.3457 k = 0.0931-0.2800-0.0000 ( 3958 PWs) bands (ev): -1.4207 -1.4207 1.6660 1.6660 2.6016 2.6016 3.1436 3.1436 5.8312 5.8312 5.9490 5.9490 6.6587 6.6587 6.7145 6.7145 6.9341 6.9341 7.7944 7.7944 8.1080 8.1080 8.1827 8.1827 8.4567 8.4567 8.5788 8.5788 8.7241 8.7241 8.7741 8.7741 9.4340 9.4340 9.5017 9.5017 9.9202 9.9202 9.9964 9.9964 10.2345 10.2345 10.5222 10.5222 10.7337 10.7337 10.8201 10.8201 10.9348 10.9348 11.1343 11.1343 11.2348 11.2348 11.6973 11.6973 12.3982 12.3982 k = 0.0869-0.2613-0.0000 ( 3956 PWs) bands (ev): -1.4622 -1.4622 1.6460 1.6460 2.5888 2.5888 3.1760 3.1760 5.8479 5.8479 5.9439 5.9439 6.6781 6.6781 6.7548 6.7548 6.9582 6.9582 7.7736 7.7736 8.0940 8.0940 8.1790 8.1790 8.4427 8.4427 8.5775 8.5775 8.7229 8.7229 8.7724 8.7724 9.4534 9.4534 9.5116 9.5116 9.9255 9.9255 9.9919 9.9919 10.2265 10.2265 10.5259 10.5259 10.7463 10.7463 10.8251 10.8251 10.9958 10.9958 11.1593 11.1593 11.2581 11.2581 11.7003 11.7003 12.4421 12.4421 k = 0.0807-0.2426-0.0000 ( 3952 PWs) bands (ev): -1.5009 -1.5009 1.6265 1.6265 2.5766 2.5766 3.2050 3.2050 5.8293 5.8293 5.9657 5.9657 6.7090 6.7090 6.7883 6.7883 6.9904 6.9904 7.7568 7.7568 8.0782 8.0782 8.1742 8.1742 8.4286 8.4286 8.5760 8.5760 8.7227 8.7227 8.7706 8.7706 9.4727 9.4727 9.5218 9.5218 9.9274 9.9274 9.9897 9.9897 10.2191 10.2191 10.5289 10.5289 10.7556 10.7556 10.8290 10.8290 11.0591 11.0591 11.1858 11.1858 11.2808 11.2808 11.7035 11.7035 12.4768 12.4768 k = 0.0745-0.2240-0.0000 ( 3946 PWs) bands (ev): -1.5369 -1.5369 1.6078 1.6078 2.5651 2.5651 3.2308 3.2308 5.8005 5.8005 5.9892 5.9892 6.7512 6.7512 6.8154 6.8154 7.0279 7.0279 7.7453 7.7453 8.0604 8.0604 8.1684 8.1684 8.4143 8.4143 8.5743 8.5743 8.7233 8.7233 8.7688 8.7688 9.4917 9.4917 9.5323 9.5323 9.9260 9.9260 9.9897 9.9897 10.2122 10.2122 10.5312 10.5312 10.7632 10.7632 10.8326 10.8326 11.1219 11.1219 11.2141 11.2141 11.3038 11.3038 11.7068 11.7068 12.5025 12.5025 k = 0.0683-0.2053-0.0000 ( 3940 PWs) bands (ev): -1.5700 -1.5700 1.5901 1.5901 2.5544 2.5544 3.2536 3.2536 5.7708 5.7708 6.0064 6.0064 6.8013 6.8013 6.8404 6.8404 7.0662 7.0662 7.7408 7.7408 8.0405 8.0405 8.1620 8.1620 8.3999 8.3999 8.5724 8.5724 8.7245 8.7245 8.7670 8.7670 9.5101 9.5101 9.5432 9.5432 9.9219 9.9219 9.9909 9.9909 10.2058 10.2058 10.5330 10.5330 10.7695 10.7695 10.8358 10.8358 11.1815 11.1815 11.2442 11.2442 11.3284 11.3284 11.7103 11.7103 12.5197 12.5197 k = 0.0621-0.1866-0.0000 ( 3944 PWs) bands (ev): -1.6003 -1.6003 1.5734 1.5734 2.5445 2.5445 3.2736 3.2736 5.7425 5.7425 6.0166 6.0166 6.8435 6.8435 6.8787 6.8787 7.1006 7.1006 7.7446 7.7446 8.0180 8.0180 8.1554 8.1554 8.3852 8.3852 8.5705 8.5705 8.7261 8.7261 8.7653 8.7653 9.5274 9.5274 9.5548 9.5548 9.9160 9.9160 9.9926 9.9926 10.2001 10.2001 10.5344 10.5344 10.7750 10.7750 10.8387 10.8387 11.2342 11.2342 11.2763 11.2763 11.3573 11.3573 11.7137 11.7137 12.5290 12.5290 k = 0.0558-0.1680-0.0000 ( 3942 PWs) bands (ev): -1.6278 -1.6278 1.5579 1.5579 2.5354 2.5354 3.2910 3.2910 5.7164 5.7164 6.0214 6.0214 6.8667 6.8667 6.9409 6.9409 7.1277 7.1277 7.7581 7.7581 7.9928 7.9928 8.1489 8.1489 8.3700 8.3700 8.5686 8.5686 8.7278 8.7278 8.7638 8.7638 9.5431 9.5431 9.5672 9.5672 9.9089 9.9089 9.9940 9.9940 10.1952 10.1952 10.5353 10.5353 10.7796 10.7796 10.8413 10.8413 11.2757 11.2757 11.3106 11.3106 11.3944 11.3944 11.7171 11.7171 12.5316 12.5316 k = 0.0496-0.1493-0.0000 ( 3936 PWs) bands (ev): -1.6523 -1.6523 1.5438 1.5438 2.5272 2.5272 3.3060 3.3060 5.6927 5.6927 6.0223 6.0223 6.8857 6.8857 7.0106 7.0106 7.1456 7.1456 7.7811 7.7811 7.9648 7.9648 8.1428 8.1428 8.3544 8.3544 8.5668 8.5668 8.7297 8.7297 8.7625 8.7625 9.5571 9.5571 9.5804 9.5804 9.9012 9.9012 9.9947 9.9947 10.1910 10.1910 10.5360 10.5360 10.7837 10.7837 10.8437 10.8437 11.3048 11.3048 11.3471 11.3471 11.4400 11.4400 11.7205 11.7205 12.5286 12.5286 k = 0.0434-0.1307-0.0000 ( 3934 PWs) bands (ev): -1.6741 -1.6741 1.5312 1.5312 2.5199 2.5199 3.3188 3.3188 5.6716 5.6716 6.0207 6.0207 6.9042 6.9042 7.0826 7.0826 7.1542 7.1542 7.8122 7.8122 7.9341 7.9341 8.1372 8.1372 8.3381 8.3381 8.5651 8.5651 8.7315 8.7315 8.7614 8.7614 9.5696 9.5696 9.5938 9.5938 9.8930 9.8930 9.9948 9.9948 10.1875 10.1875 10.5365 10.5365 10.7872 10.7872 10.8458 10.8458 11.3248 11.3248 11.3854 11.3854 11.4902 11.4902 11.7236 11.7236 12.5212 12.5212 k = 0.0372-0.1120-0.0000 ( 3926 PWs) bands (ev): -1.6929 -1.6929 1.5200 1.5200 2.5135 2.5135 3.3296 3.3296 5.6532 5.6532 6.0176 6.0176 6.9229 6.9229 7.1516 7.1516 7.1577 7.1577 7.8482 7.8482 7.9019 7.9019 8.1322 8.1322 8.3210 8.3210 8.5636 8.5636 8.7330 8.7330 8.7606 8.7606 9.5809 9.5809 9.6067 9.6067 9.8847 9.8847 9.9942 9.9942 10.1848 10.1848 10.5368 10.5368 10.7902 10.7902 10.8477 10.8477 11.3392 11.3392 11.4250 11.4250 11.5408 11.5408 11.7265 11.7265 12.5105 12.5105 k = 0.0310-0.0933-0.0000 ( 3916 PWs) bands (ev): -1.7089 -1.7089 1.5105 1.5105 2.5080 2.5080 3.3384 3.3384 5.6375 5.6375 6.0139 6.0139 6.9419 6.9419 7.1476 7.1476 7.2262 7.2262 7.8576 7.8576 7.8970 7.8970 8.1279 8.1279 8.3030 8.3030 8.5623 8.5623 8.7344 8.7344 8.7601 8.7601 9.5912 9.5912 9.6184 9.6184 9.8766 9.8766 9.9932 9.9932 10.1828 10.1828 10.5370 10.5370 10.7927 10.7927 10.8493 10.8493 11.3501 11.3501 11.4654 11.4654 11.5889 11.5889 11.7290 11.7290 12.4978 12.4978 k = 0.0248-0.0747-0.0000 ( 3928 PWs) bands (ev): -1.7220 -1.7220 1.5026 1.5026 2.5035 2.5035 3.3454 3.3454 5.6247 5.6247 6.0102 6.0102 6.9612 6.9612 7.1363 7.1363 7.2942 7.2942 7.8218 7.8218 7.9356 7.9356 8.1243 8.1243 8.2843 8.2843 8.5611 8.5611 8.7354 8.7354 8.7596 8.7596 9.6004 9.6004 9.6282 9.6282 9.8688 9.8688 9.9919 9.9919 10.1812 10.1812 10.5370 10.5370 10.7946 10.7946 10.8505 10.8505 11.3583 11.3583 11.5049 11.5049 11.6320 11.6320 11.7310 11.7310 12.4840 12.4840 k = 0.0186-0.0560-0.0000 ( 3926 PWs) bands (ev): -1.7321 -1.7321 1.4964 1.4964 2.5000 2.5000 3.3508 3.3508 5.6147 5.6147 6.0070 6.0070 6.9804 6.9804 7.1220 7.1220 7.3575 7.3575 7.7824 7.7824 7.9743 7.9743 8.1215 8.1215 8.2655 8.2655 8.5602 8.5602 8.7361 8.7361 8.7594 8.7594 9.6084 9.6084 9.6361 9.6361 9.8620 9.8620 9.9906 9.9906 10.1802 10.1802 10.5370 10.5370 10.7961 10.7961 10.8515 10.8515 11.3643 11.3643 11.5417 11.5417 11.6686 11.6686 11.7324 11.7324 12.4379 12.4379 k = 0.0124-0.0373-0.0000 ( 3926 PWs) bands (ev): -1.7394 -1.7394 1.4920 1.4920 2.4975 2.4975 3.3546 3.3546 5.6075 5.6075 6.0045 6.0045 6.9987 6.9987 7.1066 7.1066 7.4131 7.4131 7.7440 7.7440 8.0078 8.0078 8.1194 8.1194 8.2478 8.2478 8.5595 8.5595 8.7366 8.7366 8.7593 8.7593 9.6147 9.6147 9.6417 9.6417 9.8566 9.8566 9.9895 9.9895 10.1795 10.1795 10.5369 10.5369 10.7971 10.7971 10.8522 10.8522 11.3685 11.3685 11.5726 11.5726 11.6969 11.6969 11.7329 11.7329 12.3806 12.3806 k = 0.0062-0.0187-0.0000 ( 3921 PWs) bands (ev): -1.7438 -1.7438 1.4893 1.4893 2.4960 2.4960 3.3568 3.3568 5.6032 5.6032 6.0029 6.0029 7.0137 7.0137 7.0930 7.0930 7.4548 7.4548 7.7128 7.7128 8.0316 8.0316 8.1180 8.1180 8.2341 8.2341 8.5592 8.5592 8.7369 8.7369 8.7593 8.7593 9.6189 9.6189 9.6450 9.6450 9.8531 9.8531 9.9887 9.9887 10.1793 10.1793 10.5369 10.5369 10.7978 10.7978 10.8527 10.8527 11.3710 11.3710 11.5936 11.5936 11.7162 11.7162 11.7317 11.7317 12.3433 12.3433 k = 0.0000 0.0000 0.0000 ( 3919 PWs) bands (ev): -1.7452 -1.7452 1.4884 1.4884 2.4955 2.4955 3.3576 3.3576 5.6017 5.6017 6.0023 6.0023 7.0202 7.0202 7.0869 7.0869 7.4714 7.4714 7.6997 7.6997 8.0405 8.0405 8.1175 8.1175 8.2288 8.2288 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.6204 9.6204 9.6461 9.6461 9.8519 9.8519 9.9885 9.9885 10.1791 10.1791 10.5369 10.5369 10.7980 10.7980 10.8528 10.8528 11.3718 11.3718 11.6011 11.6011 11.7265 11.7265 11.7276 11.7276 12.3303 12.3303 k = 0.0000 0.0000 0.0000 ( 3919 PWs) bands (ev): -1.7452 -1.7452 1.4884 1.4884 2.4955 2.4955 3.3576 3.3576 5.6017 5.6017 6.0023 6.0023 7.0202 7.0202 7.0869 7.0869 7.4714 7.4714 7.6997 7.6997 8.0405 8.0405 8.1175 8.1175 8.2288 8.2288 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.6204 9.6204 9.6461 9.6461 9.8519 9.8519 9.9885 9.9885 10.1791 10.1791 10.5369 10.5369 10.7980 10.7980 10.8528 10.8528 11.3718 11.3718 11.6011 11.6011 11.7265 11.7265 11.7276 11.7276 12.3303 12.3303 k = 0.0116-0.0156-0.0015 ( 3920 PWs) bands (ev): -1.7438 -1.7438 1.4882 1.4882 2.4967 2.4967 3.3569 3.3569 5.6032 5.6032 6.0029 6.0029 7.0144 7.0144 7.0923 7.0923 7.4567 7.4567 7.7114 7.7114 8.0328 8.0328 8.1181 8.1181 8.2336 8.2336 8.5592 8.5592 8.7370 8.7370 8.7594 8.7594 9.6183 9.6183 9.6457 9.6457 9.8529 9.8529 9.9886 9.9886 10.1793 10.1793 10.5370 10.5370 10.7979 10.7979 10.8527 10.8527 11.3710 11.3710 11.5914 11.5914 11.7190 11.7190 11.7328 11.7328 12.3414 12.3414 k = 0.0233-0.0311-0.0029 ( 3922 PWs) bands (ev): -1.7395 -1.7395 1.4875 1.4875 2.5002 2.5002 3.3549 3.3549 5.6078 5.6078 6.0045 6.0045 7.0007 7.0007 7.1045 7.1045 7.4191 7.4191 7.7398 7.7398 8.0121 8.0121 8.1197 8.1197 8.2460 8.2460 8.5596 8.5596 8.7368 8.7368 8.7595 8.7595 9.6126 9.6126 9.6442 9.6442 9.8558 9.8558 9.9891 9.9891 10.1797 10.1797 10.5372 10.5372 10.7974 10.7974 10.8524 10.8524 11.3687 11.3687 11.5653 11.5653 11.7077 11.7077 11.7359 11.7359 12.3725 12.3725 k = 0.0349-0.0467-0.0044 ( 3923 PWs) bands (ev): -1.7324 -1.7324 1.4865 1.4865 2.5060 2.5060 3.3515 3.3515 5.6153 5.6153 6.0073 6.0073 6.9840 6.9840 7.1183 7.1183 7.3685 7.3685 7.7753 7.7753 7.9830 7.9830 8.1220 8.1220 8.2624 8.2624 8.5602 8.5602 8.7366 8.7366 8.7598 8.7598 9.6040 9.6040 9.6412 9.6412 9.8604 9.8604 9.9897 9.9897 10.1805 10.1805 10.5376 10.5376 10.7967 10.7967 10.8518 10.8518 11.3647 11.3647 11.5283 11.5283 11.6909 11.6909 11.7366 11.7366 12.4163 12.4163 k = 0.0465-0.0622-0.0059 ( 3928 PWs) bands (ev): -1.7225 -1.7225 1.4852 1.4852 2.5140 2.5140 3.3466 3.3466 5.6258 5.6258 6.0109 6.0109 6.9665 6.9665 7.1307 7.1307 7.3108 7.3108 7.8120 7.8120 7.9498 7.9498 8.1251 8.1251 8.2802 8.2802 8.5612 8.5612 8.7361 8.7361 8.7603 8.7603 9.5933 9.5933 9.6364 9.6364 9.8662 9.8662 9.9906 9.9906 10.1815 10.1815 10.5381 10.5381 10.7957 10.7957 10.8510 10.8510 11.3587 11.3587 11.4855 11.4855 11.6678 11.6678 11.7356 11.7356 12.4542 12.4542 k = 0.0581-0.0778-0.0074 ( 3928 PWs) bands (ev): -1.7097 -1.7097 1.4835 1.4835 2.5240 2.5240 3.3402 3.3402 5.6393 5.6393 6.0153 6.0153 6.9491 6.9491 7.1388 7.1388 7.2498 7.2498 7.8445 7.8445 7.9182 7.9182 8.1291 8.1291 8.2978 8.2978 8.5624 8.5624 8.7355 8.7355 8.7611 8.7611 9.5808 9.5808 9.6298 9.6298 9.8728 9.8728 9.9915 9.9915 10.1829 10.1829 10.5387 10.5387 10.7943 10.7943 10.8499 10.8499 11.3498 11.3498 11.4410 11.4410 11.6386 11.6386 11.7337 11.7337 12.4758 12.4758 k = 0.0698-0.0933-0.0088 ( 3927 PWs) bands (ev): -1.6940 -1.6940 1.4817 1.4817 2.5360 2.5360 3.3323 3.3323 5.6557 5.6557 6.0202 6.0202 6.9321 6.9321 7.1349 7.1349 7.1936 7.1936 7.8531 7.8531 7.9093 7.9093 8.1340 8.1340 8.3148 8.3148 8.5639 8.5639 8.7346 8.7346 8.7623 8.7623 9.5669 9.5669 9.6217 9.6217 9.8800 9.8800 9.9924 9.9924 10.1846 10.1846 10.5394 10.5394 10.7926 10.7926 10.8486 10.8486 11.3353 11.3353 11.3993 11.3993 11.6045 11.6045 11.7313 11.7313 12.4912 12.4912 k = 0.0814-0.1089-0.0103 ( 3931 PWs) bands (ev): -1.6756 -1.6756 1.4798 1.4798 2.5498 2.5498 3.3225 3.3225 5.6748 5.6748 6.0254 6.0254 6.9154 6.9154 7.0946 7.0946 7.1666 7.1666 7.8285 7.8285 7.9340 7.9340 8.1397 8.1397 8.3307 8.3307 8.5656 8.5656 8.7335 8.7335 8.7638 8.7638 9.5516 9.5516 9.6123 9.6123 9.8872 9.8872 9.9932 9.9932 10.1865 10.1865 10.5401 10.5401 10.7904 10.7904 10.8470 10.8470 11.3091 11.3091 11.3676 11.3676 11.5667 11.5667 11.7285 11.7285 12.5040 12.5040 k = 0.0930-0.1244-0.0118 ( 3936 PWs) bands (ev): -1.6543 -1.6543 1.4780 1.4780 2.5651 2.5651 3.3109 3.3109 5.6968 5.6968 6.0304 6.0304 6.8984 6.8984 7.0318 7.0318 7.1557 7.1557 7.8000 7.8000 7.9645 7.9645 8.1465 8.1465 8.3456 8.3456 8.5676 8.5676 8.7323 8.7323 8.7658 8.7658 9.5350 9.5350 9.6020 9.6020 9.8944 9.8944 9.9936 9.9936 10.1888 10.1888 10.5409 10.5409 10.7877 10.7877 10.8452 10.8452 11.2698 11.2698 11.3475 11.3475 11.5264 11.5264 11.7255 11.7255 12.5142 12.5142 k = 0.1047-0.1400-0.0133 ( 3938 PWs) bands (ev): -1.6303 -1.6303 1.4762 1.4762 2.5818 2.5818 3.2973 3.2973 5.7214 5.7214 6.0346 6.0346 6.8782 6.8782 6.9689 6.9689 7.1416 7.1416 7.7754 7.7754 7.9949 7.9949 8.1540 8.1540 8.3595 8.3595 8.5697 8.5697 8.7310 8.7310 8.7683 8.7683 9.5174 9.5174 9.5911 9.5911 9.9013 9.9013 9.9936 9.9936 10.1914 10.1914 10.5416 10.5416 10.7845 10.7845 10.8431 10.8431 11.2245 11.2245 11.3322 11.3322 11.4848 11.4848 11.7225 11.7225 12.5214 12.5214 k = 0.1163-0.1556-0.0147 ( 3940 PWs) bands (ev): -1.6034 -1.6034 1.4747 1.4747 2.5996 2.5996 3.2814 3.2814 5.7486 5.7486 6.0372 6.0372 6.8458 6.8458 6.9188 6.9188 7.1216 7.1216 7.7567 7.7567 8.0242 8.0242 8.1621 8.1621 8.3727 8.3727 8.5719 8.5719 8.7298 8.7298 8.7712 8.7712 9.4987 9.4987 9.5796 9.5796 9.9077 9.9077 9.9931 9.9931 10.1944 10.1944 10.5423 10.5423 10.7806 10.7806 10.8408 10.8408 11.1772 11.1772 11.3177 11.3177 11.4430 11.4430 11.7196 11.7196 12.5246 12.5246 k = 0.1279-0.1711-0.0162 ( 3943 PWs) bands (ev): -1.5737 -1.5737 1.4734 1.4734 2.6183 2.6183 3.2631 3.2631 5.7782 5.7782 6.0371 6.0371 6.7947 6.7947 6.8898 6.8898 7.0963 7.0963 7.7440 7.7440 8.0524 8.0524 8.1706 8.1706 8.3851 8.3851 8.5742 8.5742 8.7287 8.7287 8.7745 8.7745 9.4791 9.4791 9.5677 9.5677 9.9135 9.9135 9.9921 9.9921 10.1977 10.1977 10.5429 10.5429 10.7760 10.7760 10.8382 10.8382 11.1290 11.1290 11.3026 11.3026 11.4017 11.4017 11.7168 11.7168 12.5229 12.5229 k = 0.1395-0.1867-0.0177 ( 3943 PWs) bands (ev): -1.5413 -1.5413 1.4726 1.4726 2.6377 2.6377 3.2422 3.2422 5.8101 5.8101 6.0329 6.0329 6.7369 6.7369 6.8706 6.8706 7.0680 7.0680 7.7367 7.7367 8.0800 8.0800 8.1789 8.1789 8.3969 8.3969 8.5765 8.5765 8.7278 8.7278 8.7781 8.7781 9.4588 9.4588 9.5556 9.5556 9.9184 9.9184 9.9908 9.9908 10.2015 10.2015 10.5433 10.5433 10.7703 10.7703 10.8353 10.8353 11.0806 11.0806 11.2863 11.2863 11.3618 11.3618 11.7142 11.7142 12.5153 12.5153 k = 0.1512-0.2022-0.0192 ( 3946 PWs) bands (ev): -1.5061 -1.5061 1.4722 1.4722 2.6576 2.6576 3.2183 3.2183 5.8439 5.8439 6.0229 6.0229 6.6824 6.6824 6.8518 6.8518 7.0404 7.0404 7.7339 7.7339 8.1072 8.1072 8.1868 8.1868 8.4084 8.4084 8.5787 8.5787 8.7274 8.7274 8.7820 8.7820 9.4378 9.4378 9.5430 9.5430 9.9220 9.9220 9.9895 9.9895 10.2056 10.2056 10.5435 10.5435 10.7633 10.7633 10.8320 10.8320 11.0322 11.0322 11.2685 11.2685 11.3241 11.3241 11.7120 11.7120 12.5006 12.5006 k = 0.1628-0.2178-0.0206 ( 3949 PWs) bands (ev): -1.4682 -1.4682 1.4724 1.4724 2.6776 2.6776 3.1914 3.1914 5.8794 5.8794 6.0054 6.0054 6.6359 6.6359 6.8285 6.8285 7.0178 7.0178 7.7343 7.7343 8.1344 8.1344 8.1936 8.1936 8.4194 8.4194 8.5808 8.5808 8.7276 8.7276 8.7862 8.7862 9.4164 9.4164 9.5302 9.5302 9.9236 9.9236 9.9888 9.9888 10.2102 10.2102 10.5434 10.5434 10.7541 10.7541 10.8281 10.8281 10.9848 10.9848 11.2484 11.2484 11.2893 11.2893 11.7103 11.7103 12.4780 12.4780 k = 0.1744-0.2333-0.0221 ( 3948 PWs) bands (ev): -1.4276 -1.4276 1.4731 1.4731 2.6975 2.6975 3.1612 3.1612 5.9147 5.9147 5.9805 5.9805 6.6002 6.6002 6.7982 6.7982 7.0038 7.0038 7.7368 7.7368 8.1616 8.1616 8.1992 8.1992 8.4303 8.4303 8.5829 8.5829 8.7284 8.7284 8.7906 8.7906 9.3948 9.3948 9.5170 9.5170 9.9228 9.9228 9.9892 9.9892 10.2153 10.2153 10.5429 10.5429 10.7419 10.7419 10.8235 10.8235 10.9398 10.9398 11.2253 11.2253 11.2587 11.2587 11.7092 11.7092 12.4469 12.4469 k = 0.1860-0.2489-0.0236 ( 3948 PWs) bands (ev): -1.3842 -1.3842 1.4745 1.4745 2.7171 2.7171 3.1274 3.1274 5.9283 5.9283 5.9692 5.9692 6.5766 6.5766 6.7614 6.7614 6.9990 6.9990 7.7405 7.7405 8.1879 8.1879 8.2042 8.2042 8.4409 8.4409 8.5849 8.5849 8.7298 8.7298 8.7951 8.7951 9.3730 9.3730 9.5035 9.5035 9.9190 9.9190 9.9910 9.9910 10.2210 10.2210 10.5419 10.5419 10.7244 10.7244 10.8178 10.8178 10.9000 10.9000 11.1989 11.1989 11.2323 11.2323 11.7087 11.7087 12.4069 12.4069 k = 0.1977-0.2644-0.0250 ( 3947 PWs) bands (ev): -1.3382 -1.3382 1.4766 1.4766 2.7362 2.7362 3.0899 3.0899 5.8893 5.8893 6.0028 6.0028 6.5649 6.5649 6.7204 6.7204 7.0026 7.0026 7.7447 7.7447 8.2000 8.2000 8.2214 8.2214 8.4512 8.4512 8.5870 8.5870 8.7319 8.7319 8.7998 8.7998 9.3513 9.3513 9.4896 9.4896 9.9124 9.9124 9.9943 9.9943 10.2273 10.2273 10.5402 10.5402 10.6993 10.6993 10.8101 10.8101 10.8687 10.8687 11.1707 11.1707 11.2086 11.2086 11.7089 11.7089 12.3582 12.3582 k = 0.2093-0.2800-0.0265 ( 3951 PWs) bands (ev): -1.2895 -1.2895 1.4792 1.4792 2.7543 2.7543 3.0487 3.0487 5.8372 5.8372 6.0432 6.0432 6.5632 6.5632 6.6784 6.6784 7.0130 7.0130 7.7491 7.7491 8.1995 8.1995 8.2490 8.2490 8.4611 8.4611 8.5894 8.5894 8.7346 8.7346 8.8047 8.8047 9.3299 9.3299 9.4754 9.4754 9.9031 9.9031 9.9986 9.9986 10.2343 10.2343 10.5371 10.5371 10.6655 10.6655 10.8003 10.8003 10.8479 10.8479 11.1422 11.1422 11.1861 11.1861 11.7098 11.7098 12.3015 12.3015 k = 0.2209-0.2956-0.0280 ( 3954 PWs) bands (ev): -1.2382 -1.2382 1.4825 1.4825 2.7711 2.7711 3.0037 3.0037 5.7795 5.7795 6.0851 6.0851 6.5668 6.5668 6.6406 6.6406 7.0290 7.0290 7.7533 7.7533 8.1952 8.1952 8.2776 8.2776 8.4705 8.4705 8.5923 8.5923 8.7377 8.7377 8.8097 8.8097 9.3088 9.3088 9.4610 9.4610 9.8917 9.8917 10.0036 10.0036 10.2422 10.2422 10.5316 10.5316 10.6255 10.6255 10.7897 10.7897 10.8353 10.8353 11.1143 11.1143 11.1638 11.1638 11.7115 11.7115 12.2375 12.2375 k = 0.2326-0.3111-0.0295 ( 3958 PWs) bands (ev): -1.1843 -1.1843 1.4864 1.4864 2.7858 2.7858 2.9555 2.9555 5.7187 5.7187 6.1277 6.1277 6.5596 6.5596 6.6230 6.6230 7.0499 7.0499 7.7572 7.7572 8.1878 8.1878 8.3058 8.3058 8.4790 8.4790 8.5961 8.5961 8.7412 8.7412 8.8149 8.8149 9.2882 9.2882 9.4463 9.4463 9.8785 9.8785 10.0087 10.0087 10.2508 10.2508 10.5195 10.5195 10.5859 10.5859 10.7799 10.7799 10.8272 10.8272 11.0872 11.0872 11.1414 11.1414 11.7139 11.7139 12.1671 12.1671 k = 0.2442-0.3267-0.0309 ( 3957 PWs) bands (ev): -1.1279 -1.1279 1.4908 1.4908 2.7965 2.7965 2.9058 2.9058 5.6566 5.6566 6.1704 6.1704 6.5302 6.5302 6.6368 6.6368 7.0749 7.0749 7.7607 7.7607 8.1774 8.1774 8.3332 8.3332 8.4864 8.4864 8.6013 8.6013 8.7448 8.7448 8.8203 8.8203 9.2683 9.2683 9.4316 9.4316 9.8637 9.8637 10.0137 10.0137 10.2603 10.2603 10.4911 10.4911 10.5589 10.5589 10.7711 10.7711 10.8211 10.8211 11.0608 11.0608 11.1190 11.1190 11.7171 11.7171 12.0914 12.0914 k = 0.2558-0.3422-0.0324 ( 3958 PWs) bands (ev): -1.0689 -1.0689 1.4957 1.4957 2.7939 2.7939 2.8637 2.8637 5.5948 5.5948 6.2130 6.2130 6.4950 6.4950 6.6654 6.6654 7.1038 7.1038 7.7638 7.7638 8.1641 8.1641 8.3591 8.3591 8.4921 8.4921 8.6083 8.6083 8.7483 8.7483 8.8261 8.8261 9.2491 9.2491 9.4170 9.4170 9.8477 9.8477 10.0183 10.0183 10.2707 10.2707 10.4462 10.4462 10.5461 10.5461 10.7630 10.7630 10.8159 10.8159 11.0352 11.0352 11.0964 11.0964 11.7209 11.7209 12.0115 12.0115 k = 0.2674-0.3578-0.0339 ( 3957 PWs) bands (ev): -1.0074 -1.0074 1.5008 1.5008 2.7570 2.7570 2.8504 2.8504 5.5342 5.5342 6.2553 6.2553 6.4611 6.4611 6.7016 6.7016 7.1361 7.1361 7.7664 7.7664 8.1481 8.1481 8.3827 8.3827 8.4956 8.4956 8.6175 8.6175 8.7517 8.7517 8.8322 8.8322 9.2309 9.2309 9.4027 9.4027 9.8306 9.8306 10.0223 10.0223 10.2819 10.2819 10.3953 10.3953 10.5384 10.5384 10.7553 10.7553 10.8111 10.8111 11.0105 11.0105 11.0738 11.0738 11.7251 11.7251 11.9282 11.9282 k = 0.2791-0.3733-0.0354 ( 3960 PWs) bands (ev): -0.9435 -0.9435 1.5060 1.5060 2.6977 2.6977 2.8541 2.8541 5.4755 5.4755 6.2969 6.2969 6.4304 6.4304 6.7434 6.7434 7.1716 7.1716 7.7688 7.7688 8.1295 8.1295 8.4035 8.4035 8.4964 8.4964 8.6294 8.6294 8.7547 8.7547 8.8388 8.8388 9.2137 9.2137 9.3891 9.3891 9.8127 9.8127 10.0254 10.0254 10.2934 10.2934 10.3432 10.3432 10.5319 10.5319 10.7476 10.7476 10.8064 10.8064 10.9865 10.9865 11.0512 11.0512 11.7295 11.7295 11.8426 11.8426 k = 0.2907-0.3889-0.0368 ( 3958 PWs) bands (ev): -0.8772 -0.8772 1.5110 1.5110 2.6306 2.6306 2.8605 2.8605 5.4192 5.4192 6.3368 6.3368 6.4045 6.4045 6.7899 6.7899 7.2098 7.2098 7.7707 7.7707 8.1088 8.1088 8.4209 8.4209 8.4942 8.4942 8.6439 8.6439 8.7574 8.7574 8.8457 8.8457 9.1975 9.1975 9.3765 9.3765 9.7943 9.7943 10.0273 10.0273 10.2871 10.2871 10.3099 10.3099 10.5255 10.5255 10.7397 10.7397 10.8018 10.8018 10.9635 10.9635 11.0287 11.0287 11.7319 11.7319 11.7573 11.7573 k = 0.3023-0.4044-0.0383 ( 3961 PWs) bands (ev): -0.8086 -0.8086 1.5155 1.5155 2.5593 2.5593 2.8664 2.8664 5.3657 5.3657 6.3634 6.3634 6.3957 6.3957 6.8403 6.8403 7.2505 7.2505 7.7724 7.7724 8.0862 8.0862 8.4344 8.4344 8.4888 8.4888 8.6608 8.6608 8.7597 8.7597 8.8529 8.8529 9.1824 9.1824 9.3653 9.3653 9.7755 9.7755 10.0274 10.0274 10.2387 10.2387 10.3210 10.3210 10.5185 10.5185 10.7312 10.7312 10.7972 10.7972 10.9417 10.9417 11.0063 11.0063 11.6653 11.6653 11.7398 11.7398 k = 0.3140-0.4200-0.0398 ( 3965 PWs) bands (ev): -0.7377 -0.7377 1.5190 1.5190 2.4853 2.4853 2.8710 2.8710 5.3153 5.3153 6.3529 6.3529 6.4276 6.4276 6.8940 6.8940 7.2931 7.2931 7.7738 7.7738 8.0621 8.0621 8.4433 8.4433 8.4809 8.4809 8.6791 8.6791 8.7618 8.7618 8.8603 8.8603 9.1683 9.1683 9.3557 9.3557 9.7566 9.7566 10.0243 10.0243 10.1922 10.1922 10.3340 10.3340 10.5108 10.5108 10.7219 10.7219 10.7925 10.7925 10.9214 10.9214 10.9843 10.9843 11.5774 11.5774 11.7427 11.7427 k = 0.3256-0.4355-0.0412 ( 3962 PWs) bands (ev): -0.6645 -0.6645 1.5209 1.5209 2.4098 2.4098 2.8741 2.8741 5.2679 5.2679 6.3383 6.3383 6.4676 6.4676 6.9504 6.9504 7.3371 7.3371 7.7750 7.7750 8.0374 8.0374 8.4446 8.4446 8.4734 8.4734 8.6982 8.6982 8.7640 8.7640 8.8677 8.8677 9.1552 9.1552 9.3481 9.3481 9.7380 9.7380 10.0157 10.0157 10.1522 10.1522 10.3472 10.3472 10.5021 10.5021 10.7117 10.7117 10.7878 10.7878 10.9027 10.9027 10.9626 10.9626 11.4899 11.4899 11.7447 11.7447 k = 0.3372-0.4511-0.0427 ( 3963 PWs) bands (ev): -0.5893 -0.5893 1.5203 1.5203 2.3340 2.3340 2.8756 2.8756 5.2238 5.2238 6.3265 6.3265 6.5087 6.5087 7.0090 7.0090 7.3817 7.3817 7.7759 7.7759 8.0125 8.0125 8.4341 8.4341 8.4707 8.4707 8.7166 8.7166 8.7667 8.7667 8.8749 8.8749 9.1431 9.1431 9.3427 9.3427 9.7201 9.7201 9.9978 9.9978 10.1230 10.1230 10.3600 10.3600 10.4919 10.4919 10.7004 10.7004 10.7831 10.7831 10.8859 10.8859 10.9415 10.9415 11.4038 11.4038 11.7450 11.7450 k = 0.3488-0.4667-0.0442 ( 3963 PWs) bands (ev): -0.5120 -0.5120 1.5161 1.5161 2.2593 2.2593 2.8755 2.8755 5.1829 5.1829 6.3180 6.3180 6.5502 6.5502 7.0692 7.0692 7.4260 7.4260 7.7768 7.7768 7.9884 7.9884 8.4147 8.4147 8.4702 8.4702 8.7328 8.7328 8.7707 8.7707 8.8819 8.8819 9.1320 9.1320 9.3393 9.3393 9.7033 9.7033 9.9693 9.9693 10.1065 10.1065 10.3719 10.3719 10.4802 10.4802 10.6885 10.6885 10.7785 10.7785 10.8709 10.8709 10.9210 10.9210 11.3200 11.3200 11.7430 11.7430 k = 0.3605-0.4822-0.0457 ( 3961 PWs) bands (ev): -0.4327 -0.4327 1.5066 1.5066 2.1878 2.1878 2.8740 2.8740 5.1452 5.1452 6.3127 6.3127 6.5922 6.5922 7.1304 7.1304 7.4683 7.4683 7.7782 7.7782 7.9662 7.9662 8.3899 8.3899 8.4688 8.4688 8.7448 8.7448 8.7775 8.7775 8.8886 8.8886 9.1222 9.1222 9.3376 9.3376 9.6881 9.6881 9.9338 9.9338 10.0995 10.0995 10.3823 10.3823 10.4667 10.4667 10.6765 10.6765 10.7741 10.7741 10.8575 10.8575 10.9014 10.9014 11.2395 11.2395 11.7386 11.7386 k = 0.3721-0.4978-0.0471 ( 3961 PWs) bands (ev): -0.3517 -0.3517 1.4900 1.4900 2.1215 2.1215 2.8712 2.8712 5.1108 5.1108 6.3102 6.3102 6.6344 6.6344 7.1920 7.1920 7.5063 7.5063 7.7811 7.7811 7.9471 7.9471 8.3609 8.3609 8.4654 8.4654 8.7519 8.7519 8.7871 8.7871 8.8949 8.8949 9.1137 9.1137 9.3369 9.3369 9.6752 9.6752 9.8956 9.8956 10.0979 10.0979 10.3897 10.3897 10.4523 10.4523 10.6648 10.6648 10.7699 10.7699 10.8452 10.8452 10.8829 10.8829 11.1630 11.1630 11.7316 11.7316 k = 0.3837-0.5133-0.0486 ( 3963 PWs) bands (ev): -0.2689 -0.2689 1.4642 1.4642 2.0629 2.0629 2.8673 2.8673 5.0795 5.0795 6.3101 6.3101 6.6769 6.6769 7.2534 7.2534 7.5370 7.5370 7.7877 7.7877 7.9322 7.9322 8.3286 8.3286 8.4598 8.4598 8.7558 8.7558 8.7972 8.7972 8.9009 8.9009 9.1068 9.1068 9.3362 9.3362 9.6653 9.6653 9.8578 9.8578 10.0996 10.0996 10.3906 10.3906 10.4400 10.4400 10.6540 10.6540 10.7658 10.7658 10.8335 10.8335 10.8660 10.8660 11.0917 11.0917 11.7224 11.7224 k = 0.3953-0.5289-0.0501 ( 3962 PWs) bands (ev): -0.1847 -0.1847 1.4275 1.4275 2.0139 2.0139 2.8625 2.8625 5.0515 5.0515 6.3122 6.3122 6.7194 6.7194 7.3135 7.3135 7.5569 7.5569 7.8006 7.8006 7.9224 7.9224 8.2936 8.2936 8.4519 8.4519 8.7582 8.7582 8.8057 8.8057 8.9068 8.9068 9.1019 9.1019 9.3346 9.3346 9.6587 9.6587 9.8222 9.8222 10.1031 10.1031 10.3794 10.3794 10.4351 10.4351 10.6442 10.6442 10.7619 10.7619 10.8217 10.8217 10.8510 10.8510 11.0268 11.0268 11.7113 11.7113 k = 0.4070-0.5444-0.0516 ( 3957 PWs) bands (ev): -0.0993 -0.0993 1.3792 1.3792 1.9756 1.9756 2.8571 2.8571 5.0265 5.0265 6.3158 6.3158 6.7617 6.7617 7.3707 7.3707 7.5656 7.5656 7.8209 7.8209 7.9180 7.9180 8.2564 8.2564 8.4419 8.4419 8.7600 8.7600 8.8115 8.8115 8.9126 8.9126 9.0990 9.0990 9.3310 9.3310 9.6555 9.6555 9.7903 9.7903 10.1079 10.1079 10.3575 10.3575 10.4367 10.4367 10.6350 10.6350 10.7579 10.7579 10.8096 10.8096 10.8380 10.8380 10.9697 10.9697 11.6991 11.6991 k = 0.4186-0.5600-0.0530 ( 3962 PWs) bands (ev): -0.0130 -0.0130 1.3199 1.3199 1.9476 1.9476 2.8514 2.8514 5.0046 5.0046 6.3205 6.3205 6.8035 6.8035 7.4208 7.4208 7.5682 7.5682 7.8455 7.8455 7.9199 7.9199 8.2177 8.2177 8.4300 8.4300 8.7616 8.7616 8.8145 8.8145 8.9181 8.9181 9.0982 9.0982 9.3248 9.3248 9.6547 9.6547 9.7639 9.7639 10.1135 10.1135 10.3301 10.3301 10.4403 10.4403 10.6256 10.6256 10.7537 10.7537 10.7975 10.7975 10.8265 10.8265 10.9218 10.9218 11.6864 11.6864 k = 0.4302-0.5755-0.0545 ( 3965 PWs) bands (ev): 0.0737 0.0737 1.2519 1.2519 1.9282 1.9282 2.8457 2.8457 4.9858 4.9858 6.3258 6.3258 6.8442 6.8442 7.4539 7.4539 7.5780 7.5780 7.8681 7.8681 7.9298 7.9298 8.1786 8.1786 8.4166 8.4166 8.7631 8.7631 8.8148 8.8148 8.9231 8.9231 9.0994 9.0994 9.3162 9.3162 9.6536 9.6536 9.7459 9.7459 10.1194 10.1194 10.3002 10.3002 10.4441 10.4441 10.6149 10.6149 10.7494 10.7494 10.7862 10.7862 10.8160 10.8160 10.8843 10.8843 11.6740 11.6740 k = 0.4419-0.5911-0.0560 ( 3962 PWs) bands (ev): 0.1602 0.1602 1.1778 1.1778 1.9155 1.9155 2.8402 2.8402 4.9699 4.9699 6.3313 6.3313 6.8831 6.8831 7.4600 7.4600 7.6083 7.6083 7.8834 7.8834 7.9474 7.9474 8.1406 8.1406 8.4025 8.4025 8.7645 8.7645 8.8132 8.8132 8.9273 8.9273 9.1024 9.1024 9.3057 9.3057 9.6486 9.6486 9.7391 9.7391 10.1250 10.1250 10.2701 10.2701 10.4475 10.4475 10.6022 10.6022 10.7453 10.7453 10.7767 10.7767 10.8056 10.8056 10.8575 10.8575 11.6624 11.6624 k = 0.4535-0.6067-0.0575 ( 3958 PWs) bands (ev): 0.2451 0.2451 1.1006 1.1006 1.9076 1.9076 2.8353 2.8353 4.9570 4.9570 6.3365 6.3365 6.9192 6.9192 7.4477 7.4477 7.6532 7.6532 7.8921 7.8921 7.9651 7.9651 8.1072 8.1072 8.3885 8.3885 8.7659 8.7659 8.8104 8.8104 8.9306 8.9306 9.1067 9.1067 9.2943 9.2943 9.6394 9.6394 9.7428 9.7428 10.1292 10.1292 10.2423 10.2423 10.4504 10.4504 10.5878 10.5878 10.7420 10.7420 10.7695 10.7695 10.7954 10.7954 10.8400 10.8400 11.6523 11.6523 k = 0.4651-0.6222-0.0589 ( 3961 PWs) bands (ev): 0.3262 0.3262 1.0241 1.0241 1.9028 1.9028 2.8312 2.8312 4.9469 4.9469 6.3409 6.3409 6.9509 6.9509 7.4295 7.4295 7.7027 7.7027 7.8961 7.8961 7.9711 7.9711 8.0855 8.0855 8.3756 8.3756 8.7671 8.7671 8.8069 8.8069 8.9329 8.9329 9.1116 9.1116 9.2832 9.2832 9.6290 9.6290 9.7524 9.7524 10.1307 10.1307 10.2194 10.2194 10.4529 10.4529 10.5732 10.5732 10.7400 10.7400 10.7643 10.7643 10.7862 10.7862 10.8291 10.8291 11.6440 11.6440 k = 0.4767-0.6378-0.0604 ( 3958 PWs) bands (ev): 0.3990 0.3990 0.9538 0.9538 1.9002 1.9002 2.8281 2.8281 4.9398 4.9398 6.3444 6.3444 6.9762 6.9762 7.4121 7.4121 7.7523 7.7523 7.8939 7.8939 7.9597 7.9597 8.0807 8.0807 8.3650 8.3650 8.7681 8.7681 8.8038 8.8038 8.9344 8.9344 9.1162 9.1162 9.2738 9.2738 9.6202 9.6202 9.7632 9.7632 10.1287 10.1287 10.2041 10.2041 10.4549 10.4549 10.5605 10.5605 10.7394 10.7394 10.7610 10.7610 10.7790 10.7790 10.8226 10.8226 11.6378 11.6378 k = 0.4884-0.6533-0.0619 ( 3958 PWs) bands (ev): 0.4543 0.4543 0.8999 0.8999 1.8989 1.8989 2.8262 2.8262 4.9355 4.9355 6.3466 6.3466 6.9929 6.9929 7.3997 7.3997 7.7994 7.7994 7.8785 7.8785 7.9447 7.9447 8.0841 8.0841 8.3579 8.3579 8.7688 8.7688 8.8015 8.8015 8.9352 8.9352 9.1195 9.1195 9.2674 9.2674 9.6144 9.6144 9.7714 9.7714 10.1249 10.1249 10.1963 10.1963 10.4563 10.4563 10.5518 10.5518 10.7395 10.7395 10.7592 10.7592 10.7742 10.7742 10.8190 10.8190 11.6341 11.6341 k = 0.5000-0.6689-0.0633 ( 3954 PWs) bands (ev): 0.4761 0.4761 0.8785 0.8785 1.8985 1.8985 2.8255 2.8255 4.9341 4.9341 6.3473 6.3473 6.9988 6.9988 7.3952 7.3952 7.8333 7.8333 7.8546 7.8546 7.9395 7.9395 8.0862 8.0862 8.3555 8.3555 8.7690 8.7690 8.8007 8.8007 8.9354 8.9354 9.1208 9.1208 9.2651 9.2651 9.6125 9.6125 9.7744 9.7744 10.1229 10.1229 10.1942 10.1942 10.4568 10.4568 10.5487 10.5487 10.7397 10.7397 10.7587 10.7587 10.7725 10.7725 10.8178 10.8178 11.6328 11.6328 k = 0.5000-0.6689 0.5870 ( 3966 PWs) bands (ev): 1.3461 1.3461 1.4442 1.4442 1.8648 1.8648 2.3119 2.3119 4.5284 4.5284 5.0046 5.0046 5.9225 5.9225 6.4878 6.4878 7.2244 7.2244 7.4373 7.4373 7.6486 7.6486 8.3634 8.3634 8.7209 8.7209 8.9405 8.9405 9.1357 9.1357 9.1810 9.1810 9.3614 9.3614 9.6305 9.6305 9.7486 9.7486 9.8277 9.8277 9.9994 9.9994 10.2149 10.2149 10.3373 10.3373 10.5122 10.5122 10.7081 10.7081 10.7578 10.7578 10.8861 10.8861 11.0996 11.0996 12.0582 12.0582 k = 0.4904-0.6560 0.5757 ( 3971 PWs) bands (ev): 1.3276 1.3276 1.4466 1.4466 1.8784 1.8784 2.3130 2.3130 4.5296 4.5296 5.0086 5.0086 5.9163 5.9163 6.4945 6.4945 7.2123 7.2123 7.4467 7.4467 7.6494 7.6494 8.3640 8.3640 8.7206 8.7206 8.9407 8.9407 9.1310 9.1310 9.1863 9.1863 9.3611 9.3611 9.6285 9.6285 9.7423 9.7423 9.8360 9.8360 9.9954 9.9954 10.2195 10.2195 10.3380 10.3380 10.5116 10.5116 10.7080 10.7080 10.7594 10.7594 10.8857 10.8857 11.1007 11.1007 12.0538 12.0538 k = 0.4808-0.6432 0.5644 ( 3973 PWs) bands (ev): 1.2795 1.2795 1.4507 1.4507 1.9148 1.9148 2.3164 2.3164 4.5332 4.5332 5.0204 5.0204 5.8990 5.8990 6.5132 6.5132 7.1817 7.1817 7.4695 7.4695 7.6519 7.6519 8.3658 8.3658 8.7198 8.7198 8.9415 8.9415 9.1205 9.1205 9.1984 9.1984 9.3601 9.3601 9.6229 9.6229 9.7280 9.7280 9.8563 9.8563 9.9845 9.9845 10.2322 10.2322 10.3400 10.3400 10.5099 10.5099 10.7077 10.7077 10.7642 10.7642 10.8843 10.8843 11.1037 11.1037 12.0422 12.0422 k = 0.4712-0.6303 0.5531 ( 3973 PWs) bands (ev): 1.2130 1.2130 1.4541 1.4541 1.9648 1.9648 2.3222 2.3222 4.5394 4.5394 5.0399 5.0399 5.8733 5.8733 6.5402 6.5402 7.1420 7.1420 7.4975 7.4975 7.6560 7.6560 8.3687 8.3687 8.7185 8.7185 8.9426 8.9426 9.1082 9.1082 9.2135 9.2135 9.3581 9.3581 9.6145 9.6145 9.7116 9.7116 9.8821 9.8821 9.9692 9.9692 10.2507 10.2507 10.3431 10.3431 10.5075 10.5075 10.7075 10.7075 10.7715 10.7715 10.8825 10.8825 11.1088 11.1088 12.0268 12.0268 k = 0.4615-0.6174 0.5418 ( 3975 PWs) bands (ev): 1.1352 1.1352 1.4568 1.4568 2.0208 2.0208 2.3312 2.3312 4.5481 4.5481 5.0667 5.0667 5.8422 5.8422 6.5706 6.5706 7.1008 7.1008 7.5254 7.5254 7.6620 7.6620 8.3722 8.3722 8.7168 8.7168 8.9441 8.9441 9.0953 9.0953 9.2300 9.2300 9.3547 9.3547 9.6045 9.6045 9.6950 9.6950 9.9099 9.9099 9.9527 9.9527 10.2723 10.2723 10.3470 10.3470 10.5054 10.5054 10.7075 10.7075 10.7805 10.7805 10.8805 10.8805 11.1157 11.1157 12.0106 12.0106 k = 0.4519-0.6046 0.5305 ( 3973 PWs) bands (ev): 1.0505 1.0505 1.4593 1.4593 2.0771 2.0771 2.3442 2.3442 4.5597 4.5597 5.1003 5.1003 5.8087 5.8087 6.5981 6.5981 7.0644 7.0644 7.5509 7.5509 7.6697 7.6697 8.3760 8.3760 8.7150 8.7150 8.9456 8.9456 9.0824 9.0824 9.2474 9.2474 9.3496 9.3496 9.5938 9.5938 9.6794 9.6794 9.9228 9.9228 9.9521 9.9521 10.2948 10.2948 10.3515 10.3515 10.5044 10.5044 10.7074 10.7074 10.7904 10.7904 10.8792 10.8792 11.1245 11.1245 11.9957 11.9958 k = 0.4423-0.5917 0.5193 ( 3975 PWs) bands (ev): 0.9613 0.9613 1.4617 1.4617 2.1295 2.1295 2.3625 2.3625 4.5742 4.5742 5.1399 5.1399 5.7751 5.7751 6.6151 6.6151 7.0399 7.0399 7.5730 7.5730 7.6789 7.6789 8.3797 8.3797 8.7132 8.7132 8.9472 8.9472 9.0694 9.0694 9.2651 9.2651 9.3422 9.3422 9.5831 9.5831 9.6656 9.6656 9.9073 9.9073 9.9815 9.9815 10.3154 10.3154 10.3569 10.3569 10.5062 10.5062 10.7070 10.7070 10.8003 10.8003 10.8794 10.8794 11.1350 11.1350 11.9834 11.9834 k = 0.4327-0.5788 0.5080 ( 3975 PWs) bands (ev): 0.8694 0.8694 1.4643 1.4643 2.1748 2.1748 2.3875 2.3875 4.5918 4.5918 5.1847 5.1847 5.7436 5.7436 6.6146 6.6146 7.0341 7.0341 7.5916 7.5916 7.6894 7.6894 8.3828 8.3828 8.7113 8.7113 8.9485 8.9485 9.0563 9.0563 9.2824 9.2824 9.3328 9.3328 9.5723 9.5723 9.6550 9.6550 9.8889 9.8889 10.0158 10.0158 10.3295 10.3295 10.3661 10.3661 10.5120 10.5120 10.7057 10.7057 10.8096 10.8096 10.8820 10.8820 11.1472 11.1472 11.9742 11.9742 k = 0.4231-0.5660 0.4967 ( 3972 PWs) bands (ev): 0.7757 0.7757 1.4671 1.4671 2.2115 2.2115 2.4197 2.4197 4.6125 4.6125 5.2332 5.2332 5.7161 5.7161 6.5939 6.5939 7.0491 7.0491 7.6072 7.6072 7.7006 7.7006 8.3851 8.3851 8.7095 8.7095 8.9495 8.9495 9.0430 9.0430 9.2963 9.2963 9.3239 9.3239 9.5610 9.5610 9.6489 9.6489 9.8711 9.8711 10.0516 10.0516 10.3338 10.3338 10.3811 10.3811 10.5228 10.5228 10.7029 10.7029 10.8182 10.8182 10.8873 10.8873 11.1611 11.1611 11.9688 11.9688 k = 0.4135-0.5531 0.4854 ( 3966 PWs) bands (ev): 0.6810 0.6810 1.4702 1.4702 2.2400 2.2400 2.4580 2.4580 4.6365 4.6365 5.2833 5.2833 5.6951 5.6951 6.5564 6.5564 7.0812 7.0812 7.6205 7.6205 7.7120 7.7120 8.3864 8.3864 8.7075 8.7075 8.9502 8.9502 9.0293 9.0293 9.2930 9.2930 9.3291 9.3291 9.5489 9.5489 9.6478 9.6478 9.8547 9.8547 10.0882 10.0882 10.3313 10.3313 10.3989 10.3989 10.5389 10.5389 10.6981 10.6981 10.8265 10.8265 10.8953 10.8953 11.1763 11.1763 11.9672 11.9672 k = 0.4038-0.5402 0.4741 ( 3961 PWs) bands (ev): 0.5858 0.5858 1.4735 1.4735 2.2623 2.2623 2.4997 2.4997 4.6638 4.6638 5.3318 5.3318 5.6839 5.6839 6.5078 6.5078 7.1245 7.1245 7.6318 7.6318 7.7232 7.7232 8.3865 8.3865 8.7054 8.7054 8.9505 8.9505 9.0151 9.0151 9.2754 9.2754 9.3448 9.3448 9.5366 9.5366 9.6516 9.6516 9.8401 9.8401 10.1246 10.1246 10.3259 10.3259 10.4168 10.4168 10.5594 10.5594 10.6909 10.6909 10.8354 10.8354 10.9051 10.9051 11.1928 11.1928 11.9697 11.9698 k = 0.3942-0.5274 0.4628 ( 3962 PWs) bands (ev): 0.4906 0.4906 1.4772 1.4772 2.2805 2.2805 2.5423 2.5423 4.6945 4.6945 5.3740 5.3740 5.6870 5.6870 6.4531 6.4531 7.1739 7.1739 7.6416 7.6416 7.7345 7.7345 8.3855 8.3855 8.7030 8.7030 8.9503 8.9503 9.0002 9.0002 9.2528 9.2528 9.3619 9.3619 9.5245 9.5245 9.6595 9.6595 9.8279 9.8279 10.1589 10.1589 10.3206 10.3206 10.4342 10.4342 10.5833 10.5833 10.6815 10.6815 10.8457 10.8457 10.9159 10.9159 11.2103 11.2103 11.9764 11.9764 k = 0.3846-0.5145 0.4515 ( 3960 PWs) bands (ev): 0.3956 0.3956 1.4811 1.4811 2.2964 2.2964 2.5840 2.5840 4.7284 4.7284 5.4054 5.4054 5.7086 5.7086 6.3957 6.3957 7.2258 7.2258 7.6497 7.6497 7.7461 7.7461 8.3834 8.3834 8.7000 8.7000 8.9495 8.9495 8.9849 8.9849 9.2269 9.2269 9.3785 9.3785 9.5133 9.5133 9.6708 9.6708 9.8187 9.8187 10.1878 10.1878 10.3201 10.3201 10.4510 10.4510 10.6094 10.6094 10.6701 10.6701 10.8578 10.8578 10.9272 10.9272 11.2287 11.2287 11.9870 11.9870 k = 0.3750-0.5017 0.4402 ( 3967 PWs) bands (ev): 0.3013 0.3013 1.4853 1.4853 2.3108 2.3108 2.6235 2.6235 4.7656 4.7656 5.4244 5.4244 5.7492 5.7492 6.3382 6.3382 7.2781 7.2781 7.6561 7.6561 7.7587 7.7587 8.3804 8.3804 8.6962 8.6962 8.9476 8.9476 8.9698 8.9698 9.1981 9.1981 9.3938 9.3938 9.5035 9.5035 9.6844 9.6844 9.8128 9.8128 10.2052 10.2052 10.3306 10.3306 10.4672 10.4672 10.6354 10.6354 10.6584 10.6584 10.8718 10.8718 10.9385 10.9385 11.2476 11.2476 12.0015 12.0015 k = 0.3654-0.4888 0.4290 ( 3966 PWs) bands (ev): 0.2079 0.2079 1.4897 1.4897 2.3245 2.3245 2.6602 2.6602 4.8060 4.8060 5.4345 5.4345 5.8041 5.8041 6.2828 6.2828 7.3288 7.3288 7.6605 7.6605 7.7730 7.7730 8.3767 8.3767 8.6915 8.6915 8.9418 8.9418 8.9579 8.9579 9.1671 9.1671 9.4072 9.4072 9.4953 9.4953 9.6997 9.6997 9.8109 9.8109 10.2085 10.2085 10.3552 10.3552 10.4828 10.4828 10.6384 10.6384 10.6694 10.6694 10.8876 10.8876 10.9500 10.9500 11.2669 11.2669 12.0193 12.0193 k = 0.3558-0.4759 0.4177 ( 3966 PWs) bands (ev): 0.1155 0.1155 1.4943 1.4943 2.3378 2.3378 2.6936 2.6936 4.8494 4.8494 5.4402 5.4402 5.8657 5.8657 6.2331 6.2331 7.3767 7.3767 7.6628 7.6628 7.7899 7.7899 8.3725 8.3725 8.6857 8.6857 8.9281 8.9281 8.9531 8.9531 9.1343 9.1343 9.4176 9.4176 9.4894 9.4894 9.7158 9.7158 9.8135 9.8135 10.2020 10.2020 10.3898 10.3898 10.4977 10.4977 10.6238 10.6238 10.6977 10.6977 10.9050 10.9050 10.9616 10.9616 11.2865 11.2865 12.0399 12.0399 k = 0.3462-0.4631 0.4064 ( 3966 PWs) bands (ev): 0.0243 0.0243 1.4991 1.4991 2.3510 2.3510 2.7237 2.7237 4.8958 4.8958 5.4451 5.4451 5.9235 5.9235 6.1962 6.1962 7.4205 7.4205 7.6629 7.6629 7.8095 7.8095 8.3680 8.3680 8.6787 8.6787 8.9109 8.9109 8.9512 8.9512 9.1003 9.1003 9.4236 9.4236 9.4871 9.4871 9.7319 9.7319 9.8210 9.8210 10.1908 10.1908 10.4290 10.4290 10.5112 10.5112 10.6085 10.6085 10.7273 10.7273 10.9234 10.9234 10.9740 10.9740 11.3065 11.3065 12.0624 12.0624 k = 0.3365-0.4502 0.3951 ( 3964 PWs) bands (ev): -0.0655 -0.0655 1.5040 1.5040 2.3642 2.3642 2.7504 2.7504 4.9449 4.9449 5.4513 5.4513 5.9598 5.9598 6.1875 6.1875 7.4594 7.4594 7.6613 7.6613 7.8322 7.8322 8.3632 8.3632 8.6703 8.6703 8.8926 8.8926 8.9501 8.9501 9.0656 9.0656 9.4242 9.4242 9.4888 9.4888 9.7476 9.7476 9.8334 9.8334 10.1775 10.1775 10.4695 10.4695 10.5222 10.5222 10.5952 10.5952 10.7571 10.7571 10.9420 10.9420 10.9880 10.9880 11.3270 11.3270 12.0857 12.0857 k = 0.3269-0.4373 0.3838 ( 3968 PWs) bands (ev): -0.1538 -0.1538 1.5089 1.5089 2.3774 2.3774 2.7739 2.7739 4.9965 4.9965 5.4597 5.4597 5.9593 5.9593 6.2210 6.2210 7.4927 7.4927 7.6584 7.6584 7.8577 7.8577 8.3583 8.3583 8.6604 8.6604 8.8738 8.8738 8.9490 8.9490 9.0308 9.0308 9.4203 9.4203 9.4940 9.4940 9.7626 9.7626 9.8503 9.8503 10.1638 10.1638 10.5072 10.5072 10.5277 10.5277 10.5893 10.5893 10.7870 10.7870 10.9595 10.9595 11.0047 11.0047 11.3485 11.3485 12.1086 12.1086 k = 0.3173-0.4245 0.3725 ( 3970 PWs) bands (ev): -0.2403 -0.2403 1.5138 1.5138 2.3908 2.3908 2.7942 2.7942 5.0504 5.0504 5.4709 5.4709 5.9340 5.9340 6.2841 6.2841 7.5197 7.5197 7.6549 7.6549 7.8854 7.8854 8.3534 8.3534 8.6490 8.6490 8.8546 8.8546 8.9475 8.9475 8.9971 8.9971 9.4136 9.4136 9.5008 9.5008 9.7774 9.7774 9.8707 9.8707 10.1506 10.1506 10.5166 10.5166 10.5446 10.5446 10.5986 10.5986 10.8167 10.8167 10.9751 10.9751 11.0252 11.0252 11.3715 11.3715 12.1298 12.1298 k = 0.3077-0.4116 0.3612 ( 3966 PWs) bands (ev): -0.3251 -0.3251 1.5187 1.5187 2.4042 2.4042 2.8118 2.8118 5.1061 5.1061 5.4849 5.4849 5.9008 5.9008 6.3591 6.3591 7.5398 7.5398 7.6521 7.6521 7.9144 7.9144 8.3487 8.3487 8.6360 8.6360 8.8351 8.8351 8.9427 8.9427 8.9678 8.9678 9.4054 9.4054 9.5081 9.5081 9.7921 9.7921 9.8935 9.8935 10.1388 10.1388 10.5024 10.5024 10.5664 10.5664 10.6242 10.6242 10.8463 10.8463 10.9890 10.9890 11.0489 11.0489 11.3970 11.3970 12.1478 12.1478 k = 0.2981-0.3988 0.3499 ( 3966 PWs) bands (ev): -0.4081 -0.4081 1.5234 1.5234 2.4178 2.4178 2.8268 2.8268 5.1632 5.1632 5.5012 5.5012 5.8680 5.8680 6.4379 6.4379 7.5521 7.5521 7.6515 7.6515 7.9439 7.9439 8.3442 8.3442 8.6213 8.6213 8.8153 8.8153 8.9237 8.9237 8.9544 8.9544 9.3966 9.3966 9.5151 9.5151 9.8070 9.8070 9.9173 9.9173 10.1294 10.1294 10.4837 10.4837 10.5813 10.5813 10.6578 10.6578 10.8755 10.8755 11.0019 11.0019 11.0747 11.0747 11.4260 11.4260 12.1614 12.1614 k = 0.2885-0.3859 0.3386 ( 3967 PWs) bands (ev): -0.4890 -0.4890 1.5278 1.5278 2.4314 2.4314 2.8397 2.8397 5.2212 5.2212 5.5192 5.5192 5.8396 5.8396 6.5166 6.5166 7.5563 7.5563 7.6541 7.6541 7.9727 7.9727 8.3401 8.3401 8.6050 8.6050 8.7950 8.7950 8.8967 8.8967 8.9512 8.9512 9.3878 9.3878 9.5216 9.5216 9.8219 9.8219 9.9407 9.9407 10.1236 10.1236 10.4631 10.4631 10.5931 10.5931 10.6928 10.6928 10.9041 10.9041 11.0149 11.0149 11.1012 11.1012 11.4599 11.4599 12.1698 12.1698 k = 0.2788-0.3730 0.3274 ( 3973 PWs) bands (ev): -0.5679 -0.5679 1.5319 1.5319 2.4450 2.4450 2.8507 2.8507 5.2792 5.2792 5.5374 5.5374 5.8186 5.8186 6.5933 6.5933 7.5531 7.5531 7.6597 7.6597 7.9999 7.9999 8.3365 8.3365 8.5872 8.5872 8.7745 8.7745 8.8708 8.8708 8.9495 8.9495 9.3794 9.3794 9.5275 9.5275 9.8368 9.8368 9.9617 9.9617 10.1233 10.1233 10.4416 10.4416 10.6031 10.6031 10.7262 10.7262 10.9317 10.9317 11.0287 11.0287 11.1269 11.1269 11.4998 11.4998 12.1728 12.1728 k = 0.2692-0.3602 0.3161 ( 3976 PWs) bands (ev): -0.6446 -0.6446 1.5356 1.5356 2.4585 2.4585 2.8603 2.8603 5.3363 5.3363 5.5540 5.5540 5.8082 5.8082 6.6666 6.6666 7.5444 7.5444 7.6670 7.6670 8.0249 8.0249 8.3336 8.3336 8.5678 8.5678 8.7542 8.7542 8.8474 8.8474 8.9478 8.9478 9.3716 9.3716 9.5329 9.5329 9.8514 9.8514 9.9782 9.9782 10.1307 10.1307 10.4197 10.4197 10.6117 10.6117 10.7572 10.7572 10.9578 10.9578 11.0442 11.0442 11.1508 11.1508 11.5469 11.5469 12.1705 12.1705 k = 0.2596-0.3473 0.3048 ( 3975 PWs) bands (ev): -0.7191 -0.7191 1.5389 1.5389 2.4718 2.4718 2.8689 2.8689 5.3909 5.3909 5.5677 5.5677 5.8112 5.8112 6.7353 6.7353 7.5320 7.5320 7.6748 7.6748 8.0471 8.0471 8.3315 8.3315 8.5469 8.5469 8.7347 8.7347 8.8266 8.8266 8.9457 8.9457 9.3647 9.3647 9.5379 9.5379 9.8652 9.8652 9.9889 9.9889 10.1469 10.1469 10.3976 10.3976 10.6190 10.6190 10.7853 10.7853 10.9818 10.9818 11.0620 11.0620 11.1723 11.1723 11.6019 11.6019 12.1637 12.1637 k = 0.2500-0.3344 0.2935 ( 3977 PWs) bands (ev): -0.7914 -0.7914 1.5416 1.5416 2.4848 2.4848 2.8769 2.8769 5.4401 5.4401 5.5795 5.5795 5.8288 5.8288 6.7986 6.7986 7.5169 7.5169 7.6824 7.6824 8.0663 8.0663 8.3301 8.3301 8.5248 8.5248 8.7165 8.7165 8.8083 8.8083 8.9430 8.9430 9.3588 9.3588 9.5428 9.5428 9.8780 9.8780 9.9949 9.9949 10.1712 10.1712 10.3756 10.3756 10.6250 10.6250 10.8106 10.8106 11.0034 11.0034 11.0825 11.0825 11.1910 11.1910 11.6650 11.6650 12.1532 12.1532 k = 0.2404-0.3216 0.2822 ( 3978 PWs) bands (ev): -0.8613 -0.8613 1.5438 1.5438 2.4973 2.4973 2.8848 2.8848 5.4793 5.4793 5.5946 5.5946 5.8601 5.8601 6.8559 6.8559 7.4997 7.4997 7.6893 7.6893 8.0825 8.0825 8.3294 8.3294 8.5017 8.5017 8.7000 8.7000 8.7920 8.7920 8.9395 8.9395 9.3541 9.3541 9.5477 9.5477 9.8890 9.8890 9.9982 9.9982 10.2015 10.2015 10.3537 10.3537 10.6297 10.6297 10.8330 10.8330 11.0227 11.0227 11.1056 11.1056 11.2069 11.2069 11.7357 11.7357 12.1399 12.1399 k = 0.2308-0.3087 0.2709 ( 3974 PWs) bands (ev): -0.9288 -0.9288 1.5453 1.5453 2.5090 2.5090 2.8931 2.8931 5.5037 5.5037 5.6195 5.6195 5.9027 5.9027 6.9068 6.9068 7.4812 7.4812 7.6955 7.6955 8.0963 8.0963 8.3291 8.3291 8.4777 8.4777 8.6853 8.6853 8.7779 8.7779 8.9350 8.9350 9.3507 9.3507 9.5528 9.5528 9.8981 9.8981 10.0007 10.0007 10.2357 10.2357 10.3325 10.3325 10.6332 10.6332 10.8525 10.8525 11.0404 11.0404 11.1308 11.1308 11.2206 11.2206 11.8132 11.8132 12.1246 12.1246 k = 0.2212-0.2958 0.2596 ( 3975 PWs) bands (ev): -0.9938 -0.9938 1.5462 1.5462 2.5198 2.5198 2.9021 2.9021 5.5153 5.5153 5.6537 5.6537 5.9540 5.9540 6.9509 6.9509 7.4617 7.4617 7.7008 7.7008 8.1081 8.1081 8.3288 8.3288 8.4529 8.4529 8.6720 8.6720 8.7657 8.7657 8.9294 8.9294 9.3488 9.3488 9.5585 9.5585 9.9047 9.9047 10.0039 10.0039 10.2712 10.2712 10.3130 10.3130 10.6355 10.6355 10.8693 10.8693 11.0571 11.0571 11.1572 11.1572 11.2326 11.2326 11.8964 11.8964 12.1082 12.1082 k = 0.2115-0.2830 0.2483 ( 3972 PWs) bands (ev): -1.0564 -1.0564 1.5464 1.5464 2.5294 2.5294 2.9124 2.9124 5.5214 5.5214 5.6912 5.6912 6.0120 6.0120 6.9881 6.9881 7.4419 7.4419 7.7052 7.7052 8.1186 8.1186 8.3282 8.3282 8.4276 8.4276 8.6599 8.6599 8.7556 8.7556 8.9226 8.9226 9.3484 9.3484 9.5647 9.5647 9.9091 9.9091 10.0081 10.0081 10.2858 10.2858 10.3166 10.3166 10.6366 10.6366 10.8835 10.8835 11.0734 11.0734 11.1843 11.1843 11.2436 11.2436 11.9832 11.9832 12.0917 12.0917 k = 0.2019-0.2701 0.2371 ( 3973 PWs) bands (ev): -1.1165 -1.1165 1.5460 1.5460 2.5375 2.5375 2.9243 2.9243 5.5265 5.5265 5.7280 5.7280 6.0748 6.0748 7.0184 7.0184 7.4228 7.4228 7.7088 7.7088 8.1282 8.1282 8.3270 8.3270 8.4018 8.4018 8.6483 8.6483 8.7478 8.7478 8.9146 8.9146 9.3496 9.3496 9.5716 9.5716 9.9116 9.9116 10.0130 10.0130 10.2689 10.2689 10.3535 10.3535 10.6367 10.6367 10.8950 10.8950 11.0898 11.0898 11.2109 11.2109 11.2546 11.2546 12.0542 12.0542 12.0935 12.0935 k = 0.1923-0.2573 0.2258 ( 3972 PWs) bands (ev): -1.1739 -1.1739 1.5449 1.5449 2.5441 2.5441 2.9381 2.9381 5.5331 5.5331 5.7620 5.7620 6.1411 6.1411 7.0419 7.0419 7.4052 7.4052 7.7117 7.7117 8.1372 8.1372 8.3247 8.3247 8.3759 8.3759 8.6370 8.6370 8.7423 8.7423 8.9053 8.9053 9.3524 9.3524 9.5792 9.5792 9.9126 9.9126 10.0181 10.0181 10.2511 10.2511 10.3929 10.3929 10.6359 10.6359 10.9039 10.9039 11.1067 11.1067 11.2355 11.2355 11.2676 11.2676 12.0464 12.0464 12.1749 12.1749 k = 0.1827-0.2444 0.2145 ( 3972 PWs) bands (ev): -1.2288 -1.2288 1.5432 1.5432 2.5489 2.5489 2.9541 2.9541 5.5421 5.5421 5.7919 5.7919 6.2097 6.2097 7.0589 7.0589 7.3905 7.3905 7.7138 7.7138 8.1454 8.1454 8.3199 8.3199 8.3513 8.3513 8.6257 8.6257 8.7387 8.7387 8.8950 8.8950 9.3570 9.3570 9.5877 9.5877 9.9128 9.9128 10.0227 10.0227 10.2344 10.2344 10.4322 10.4322 10.6342 10.6342 10.9102 10.9102 11.1241 11.1241 11.2548 11.2548 11.2860 11.2860 12.0270 12.0270 12.2666 12.2666 k = 0.1731-0.2315 0.2032 ( 3967 PWs) bands (ev): -1.2810 -1.2810 1.5409 1.5409 2.5519 2.5519 2.9724 2.9724 5.5540 5.5540 5.8169 5.8169 6.2798 6.2798 7.0697 7.0697 7.3795 7.3795 7.7154 7.7154 8.1524 8.1524 8.3069 8.3069 8.3340 8.3340 8.6147 8.6147 8.7367 8.7367 8.8836 8.8836 9.3632 9.3632 9.5968 9.5968 9.9125 9.9125 10.0261 10.0261 10.2195 10.2195 10.4709 10.4709 10.6319 10.6319 10.9139 10.9139 11.1424 11.1424 11.2684 11.2684 11.3105 11.3105 12.0061 12.0061 12.3563 12.3563 k = 0.1635-0.2187 0.1919 ( 3962 PWs) bands (ev): -1.3306 -1.3306 1.5382 1.5382 2.5532 2.5532 2.9930 2.9930 5.5689 5.5689 5.8364 5.8364 6.3505 6.3505 7.0750 7.0750 7.3731 7.3731 7.7166 7.7166 8.1577 8.1577 8.2829 8.2829 8.3271 8.3271 8.6041 8.6041 8.7360 8.7360 8.8714 8.8714 9.3709 9.3709 9.6066 9.6066 9.9119 9.9119 10.0276 10.0276 10.2069 10.2069 10.5083 10.5083 10.6291 10.6291 10.9152 10.9152 11.1614 11.1614 11.2797 11.2797 11.3379 11.3379 11.9844 11.9844 12.4406 12.4406 k = 0.1538-0.2058 0.1806 ( 3953 PWs) bands (ev): -1.3775 -1.3775 1.5350 1.5350 2.5529 2.5529 3.0157 3.0157 5.5869 5.5869 5.8498 5.8498 6.4212 6.4212 7.0758 7.0758 7.3713 7.3713 7.7178 7.7178 8.1603 8.1603 8.2553 8.2553 8.3241 8.3241 8.5943 8.5943 8.7361 8.7361 8.8586 8.8586 9.3801 9.3801 9.6170 9.6170 9.9113 9.9113 10.0269 10.0269 10.1969 10.1969 10.5434 10.5434 10.6266 10.6266 10.9142 10.9142 11.1813 11.1813 11.2906 11.2906 11.3664 11.3664 11.9620 11.9620 12.5159 12.5159 k = 0.1442-0.1929 0.1693 ( 3951 PWs) bands (ev): -1.4216 -1.4216 1.5315 1.5315 2.5513 2.5513 3.0403 3.0403 5.6076 5.6076 5.8571 5.8571 6.4913 6.4913 7.0736 7.0736 7.3733 7.3733 7.7195 7.7195 8.1587 8.1587 8.2280 8.2280 8.3224 8.3224 8.5856 8.5856 8.7367 8.7367 8.8454 8.8454 9.3906 9.3906 9.6278 9.6278 9.9104 9.9104 10.0239 10.0239 10.1895 10.1895 10.5741 10.5741 10.6261 10.6261 10.9111 10.9111 11.2018 11.2018 11.3018 11.3018 11.3954 11.3954 11.9392 11.9392 12.5774 12.5774 k = 0.1346-0.1801 0.1580 ( 3951 PWs) bands (ev): -1.4630 -1.4630 1.5277 1.5277 2.5484 2.5484 3.0665 3.0665 5.6307 5.6307 5.8583 5.8583 6.5602 6.5602 7.0697 7.0697 7.3779 7.3779 7.7223 7.7223 8.1502 8.1502 8.2041 8.2041 8.3214 8.3214 8.5781 8.5781 8.7374 8.7374 8.8322 8.8322 9.4022 9.4022 9.6387 9.6387 9.9092 9.9092 10.0188 10.0188 10.1845 10.1845 10.5934 10.5934 10.6346 10.6346 10.9062 10.9062 11.2229 11.2229 11.3138 11.3138 11.4246 11.4246 11.9164 11.9164 12.6076 12.6076 k = 0.1250-0.1672 0.1467 ( 3949 PWs) bands (ev): -1.5016 -1.5016 1.5237 1.5237 2.5445 2.5445 3.0940 3.0940 5.6556 5.6556 5.8540 5.8540 6.6273 6.6273 7.0655 7.0655 7.3833 7.3833 7.7272 7.7272 8.1315 8.1315 8.1876 8.1876 8.3208 8.3208 8.5720 8.5720 8.7382 8.7382 8.8193 8.8193 9.4148 9.4148 9.6498 9.6498 9.9074 9.9074 10.0122 10.0122 10.1816 10.1816 10.5968 10.5968 10.6565 10.6565 10.8996 10.8996 11.2441 11.2441 11.3270 11.3270 11.4539 11.4539 11.8940 11.8940 12.5925 12.5925 k = 0.1154-0.1544 0.1355 ( 3946 PWs) bands (ev): -1.5375 -1.5375 1.5197 1.5197 2.5400 2.5400 3.1223 3.1223 5.6810 5.6810 5.8456 5.8456 6.6919 6.6919 7.0623 7.0623 7.3877 7.3877 7.7352 7.7352 8.1047 8.1047 8.1770 8.1770 8.3200 8.3200 8.5673 8.5673 8.7390 8.7390 8.8071 8.8071 9.4283 9.4283 9.6606 9.6606 9.9048 9.9048 10.0051 10.0051 10.1803 10.1803 10.5936 10.5936 10.6824 10.6824 10.8919 10.8919 11.2648 11.2648 11.3419 11.3419 11.4831 11.4831 11.8722 11.8722 12.5684 12.5684 k = 0.1058-0.1415 0.1242 ( 3942 PWs) bands (ev): -1.5705 -1.5705 1.5156 1.5156 2.5350 2.5350 3.1511 3.1511 5.7050 5.7050 5.8357 5.8357 6.7531 6.7531 7.0610 7.0610 7.3895 7.3895 7.7469 7.7469 8.0742 8.0742 8.1686 8.1686 8.3184 8.3184 8.5639 8.5639 8.7396 8.7396 8.7958 8.7958 9.4426 9.4426 9.6710 9.6710 9.9010 9.9010 9.9983 9.9983 10.1799 10.1799 10.5884 10.5884 10.7075 10.7075 10.8832 10.8832 11.2843 11.2843 11.3592 11.3592 11.5121 11.5121 11.8514 11.8514 12.5442 12.5442 k = 0.0962-0.1286 0.1129 ( 3944 PWs) bands (ev): -1.6007 -1.6007 1.5115 1.5115 2.5297 2.5297 3.1798 3.1798 5.7227 5.7227 5.8295 5.8295 6.8095 6.8095 7.0627 7.0627 7.3879 7.3879 7.7626 7.7626 8.0428 8.0428 8.1610 8.1610 8.3157 8.3157 8.5615 8.5615 8.7398 8.7398 8.7858 8.7858 9.4575 9.4575 9.6805 9.6805 9.8958 9.8958 9.9925 9.9925 10.1801 10.1801 10.5823 10.5823 10.7306 10.7306 10.8740 10.8740 11.3017 11.3017 11.3795 11.3795 11.5407 11.5407 11.8318 11.8318 12.5210 12.5210 k = 0.0865-0.1158 0.1016 ( 3944 PWs) bands (ev): -1.6281 -1.6281 1.5076 1.5076 2.5243 2.5243 3.2080 3.2080 5.7270 5.7270 5.8347 5.8347 6.8593 6.8593 7.0686 7.0686 7.3831 7.3831 7.7814 7.7814 8.0121 8.0121 8.1536 8.1536 8.3114 8.3114 8.5601 8.5601 8.7399 8.7399 8.7773 8.7773 9.4730 9.4730 9.6887 9.6887 9.8892 9.8892 9.9883 9.9883 10.1805 10.1805 10.5759 10.5759 10.7513 10.7513 10.8648 10.8648 11.3166 11.3166 11.4029 11.4029 11.5685 11.5685 11.8137 11.8137 12.4985 12.4985 k = 0.0769-0.1029 0.0903 ( 3940 PWs) bands (ev): -1.6526 -1.6526 1.5040 1.5040 2.5191 2.5191 3.2353 3.2353 5.7168 5.7168 5.8529 5.8529 6.9005 6.9005 7.0793 7.0793 7.3764 7.3764 7.8009 7.8009 7.9841 7.9841 8.1467 8.1467 8.3054 8.3054 8.5594 8.5594 8.7396 8.7396 8.7707 8.7707 9.4891 9.4891 9.6950 9.6950 9.8817 9.8817 9.9857 9.9857 10.1809 10.1809 10.5694 10.5694 10.7694 10.7694 10.8561 10.8561 11.3292 11.3292 11.4289 11.4289 11.5954 11.5954 11.7974 11.7974 12.4766 12.4766 k = 0.0673-0.0900 0.0790 ( 3934 PWs) bands (ev): -1.6743 -1.6743 1.5005 1.5005 2.5141 2.5141 3.2609 3.2609 5.6987 5.6987 5.8780 5.8780 6.9319 6.9319 7.0941 7.0941 7.3707 7.3707 7.8160 7.8160 7.9628 7.9628 8.1403 8.1403 8.2975 8.2975 8.5591 8.5591 8.7391 8.7391 8.7659 8.7659 9.5058 9.5058 9.6989 9.6989 9.8740 9.8740 9.9845 9.9845 10.1811 10.1811 10.5630 10.5630 10.7842 10.7842 10.8485 10.8485 11.3397 11.3397 11.4567 11.4567 11.6210 11.6210 11.7829 11.7829 12.4550 12.4550 k = 0.0577-0.0772 0.0677 ( 3932 PWs) bands (ev): -1.6931 -1.6931 1.4975 1.4975 2.5095 2.5095 3.2846 3.2846 5.6780 5.6780 5.9050 5.9050 6.9546 6.9546 7.1090 7.1090 7.3697 7.3697 7.8190 7.8190 7.9549 7.9549 8.1346 8.1346 8.2878 8.2878 8.5590 8.5590 8.7384 8.7384 8.7627 8.7627 9.5229 9.5229 9.6997 9.6997 9.8668 9.8668 9.9843 9.9843 10.1811 10.1811 10.5569 10.5569 10.7952 10.7952 10.8432 10.8432 11.3485 11.3485 11.4854 11.4854 11.6447 11.6447 11.7702 11.7702 12.4332 12.4332 k = 0.0481-0.0643 0.0564 ( 3929 PWs) bands (ev): -1.7090 -1.7090 1.4948 1.4948 2.5054 2.5054 3.3056 3.3056 5.6574 5.6574 5.9312 5.9312 6.9712 6.9712 7.1184 7.1184 7.3771 7.3771 7.8060 7.8060 7.9632 7.9632 8.1297 8.1297 8.2765 8.2765 8.5590 8.5590 8.7378 8.7378 8.7608 8.7608 9.5405 9.5405 9.6969 9.6969 9.8610 9.8610 9.9849 9.9849 10.1809 10.1809 10.5513 10.5513 10.8015 10.8015 10.8413 10.8413 11.3557 11.3557 11.5140 11.5140 11.6661 11.6661 11.7593 11.7593 12.4111 12.4111 k = 0.0385-0.0515 0.0452 ( 3928 PWs) bands (ev): -1.7220 -1.7220 1.4925 1.4925 2.5019 2.5019 3.3237 3.3237 5.6388 5.6388 5.9549 5.9549 6.9846 6.9846 7.1192 7.1192 7.3942 7.3942 7.7821 7.7821 7.9815 7.9815 8.1255 8.1255 8.2642 8.2642 8.5590 8.5590 8.7374 8.7374 8.7598 8.7598 9.5585 9.5585 9.6903 9.6903 9.8568 9.8568 9.9858 9.9858 10.1804 10.1804 10.5464 10.5464 10.8030 10.8030 10.8430 10.8430 11.3615 11.3615 11.5410 11.5410 11.6846 11.6846 11.7504 11.7504 12.3886 12.3886 k = 0.0288-0.0386 0.0339 ( 3927 PWs) bands (ev): -1.7322 -1.7322 1.4907 1.4907 2.4992 2.4992 3.3382 3.3382 5.6232 5.6232 5.9748 5.9748 6.9966 6.9966 7.1124 7.1124 7.4180 7.4180 7.7543 7.7543 8.0027 8.0027 8.1222 8.1222 8.2516 8.2516 8.5590 8.5590 8.7371 8.7371 8.7594 8.7594 9.5766 9.5766 9.6805 9.6805 9.8541 9.8541 9.9868 9.9868 10.1800 10.1800 10.5424 10.5424 10.8017 10.8017 10.8464 10.8464 11.3660 11.3660 11.5650 11.5650 11.7000 11.7000 11.7432 11.7432 12.3667 12.3667 k = 0.0192-0.0257 0.0226 ( 3924 PWs) bands (ev): -1.7394 -1.7394 1.4894 1.4894 2.4971 2.4971 3.3489 3.3489 5.6114 5.6114 5.9898 5.9898 7.0075 7.0075 7.1016 7.1016 7.4434 7.4434 7.7277 7.7277 8.0219 8.0219 8.1197 8.1197 8.2402 8.2402 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.5944 9.5944 9.6680 9.6680 9.8527 9.8527 9.9877 9.9877 10.1795 10.1795 10.5394 10.5394 10.7999 10.7999 10.8498 10.8498 11.3692 11.3692 11.5842 11.5842 11.7119 11.7119 11.7373 11.7373 12.3479 12.3479 k = 0.0096-0.0129 0.0113 ( 3921 PWs) bands (ev): -1.7438 -1.7438 1.4887 1.4887 2.4959 2.4959 3.3554 3.3554 5.6042 5.6042 5.9991 5.9991 7.0164 7.0164 7.0914 7.0914 7.4635 7.4635 7.7075 7.7075 8.0355 8.0355 8.1181 8.1181 8.2319 8.2319 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.6111 9.6111 9.6544 9.6544 9.8520 9.8520 9.9883 9.9883 10.1793 10.1793 10.5375 10.5375 10.7985 10.7985 10.8520 10.8520 11.3712 11.3712 11.5968 11.5968 11.7206 11.7206 11.7322 11.7322 12.3349 12.3349 k = 0.0000 0.0000 0.0000 ( 3919 PWs) bands (ev): -1.7452 -1.7452 1.4884 1.4884 2.4955 2.4955 3.3576 3.3576 5.6017 5.6017 6.0023 6.0023 7.0202 7.0202 7.0869 7.0869 7.4714 7.4714 7.6997 7.6997 8.0405 8.0405 8.1175 8.1175 8.2288 8.2288 8.5591 8.5591 8.7370 8.7370 8.7593 8.7593 9.6204 9.6204 9.6461 9.6461 9.8519 9.8519 9.9885 9.9885 10.1791 10.1791 10.5369 10.5369 10.7980 10.7980 10.8528 10.8528 11.3718 11.3718 11.6011 11.6011 11.7265 11.7265 11.7276 11.7276 12.3303 12.3303 Writing output data file FeGe.save init_run : 0.23s CPU 0.36s WALL ( 1 calls) electrons : 291.31s CPU 294.82s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 291.31s CPU 294.81s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.07s WALL ( 354 calls) cegterg : 261.13s CPU 263.84s WALL ( 603 calls) Called by sum_band: Called by *egterg: h_psi : 173.45s CPU 175.59s WALL ( 9783 calls) s_psi : 16.58s CPU 16.63s WALL ( 9783 calls) g_psi : 0.30s CPU 0.30s WALL ( 8826 calls) cdiaghg : 73.93s CPU 74.86s WALL ( 9180 calls) cegterg:over : 8.38s CPU 8.24s WALL ( 8826 calls) cegterg:upda : 6.98s CPU 6.97s WALL ( 8826 calls) cegterg:last : 4.18s CPU 4.13s WALL ( 1583 calls) cdiaghg:chol : 4.41s CPU 4.26s WALL ( 9180 calls) cdiaghg:inve : 2.74s CPU 2.91s WALL ( 9180 calls) cdiaghg:para : 4.81s CPU 4.81s WALL ( 18360 calls) Called by h_psi: h_psi:vloc : 152.19s CPU 154.35s WALL ( 9783 calls) h_psi:vnl : 21.00s CPU 20.93s WALL ( 9783 calls) add_vuspsi : 11.22s CPU 11.15s WALL ( 9783 calls) General routines calbec : 9.73s CPU 9.76s WALL ( 9783 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 143.42s CPU 145.42s WALL ( 1121672 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.21s CPU 0.21s WALL ( 708 calls) Parallel routines fft_scatter : 34.92s CPU 35.56s WALL ( 1121695 calls) PWSCF : 5m 8.84s CPU 5m29.53s WALL This run was terminated on: 18:18:27 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=