Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:51:41 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: ./BaTixBO3x2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S 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 72 71 19 2208 2151 314 Max 73 72 20 2212 2166 319 Sum 2623 2583 719 79559 77705 11425 bravais-lattice index = 14 lattice parameter (alat) = 11.6842 a.u. unit-cell volume = 804.5080 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.684166 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.670340 celldm(5)= 0.670340 celldm(6)= 0.670340 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.670340 0.742054 0.000000 ) a(3) = ( 0.670340 0.297801 0.679676 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.903357 -0.590457 ) b(2) = ( 0.000000 1.347611 -0.590457 ) b(3) = ( 0.000000 0.000000 1.471290 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential Ba 10.00 137.32700 Ba( 1.00) O 6.00 15.99940 O( 1.00) B 3.00 10.81100 B( 1.00) Ti 12.00 47.86700 Ti( 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= 265 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0131579 -0.0118863 -0.0077692), wk = 0.0037736 k( 3) = ( 0.0263158 -0.0237726 -0.0155384), wk = 0.0037736 k( 4) = ( 0.0394737 -0.0356588 -0.0233075), wk = 0.0037736 k( 5) = ( 0.0526316 -0.0475451 -0.0310767), wk = 0.0037736 k( 6) = ( 0.0657895 -0.0594314 -0.0388459), wk = 0.0037736 k( 7) = ( 0.0789474 -0.0713177 -0.0466151), wk = 0.0037736 k( 8) = ( 0.0921053 -0.0832040 -0.0543842), wk = 0.0037736 k( 9) = ( 0.1052632 -0.0950903 -0.0621534), wk = 0.0037736 k( 10) = ( 0.1184210 -0.1069765 -0.0699226), wk = 0.0037736 k( 11) = ( 0.1315790 -0.1188628 -0.0776918), wk = 0.0037736 k( 12) = ( 0.1447368 -0.1307491 -0.0854609), wk = 0.0037736 k( 13) = ( 0.1578947 -0.1426354 -0.0932301), wk = 0.0037736 k( 14) = ( 0.1710526 -0.1545217 -0.1009993), wk = 0.0037736 k( 15) = ( 0.1842105 -0.1664080 -0.1087685), wk = 0.0037736 k( 16) = ( 0.1973684 -0.1782942 -0.1165377), wk = 0.0037736 k( 17) = ( 0.2105263 -0.1901805 -0.1243068), wk = 0.0037736 k( 18) = ( 0.2236842 -0.2020668 -0.1320760), wk = 0.0037736 k( 19) = ( 0.2368421 -0.2139531 -0.1398452), wk = 0.0037736 k( 20) = ( 0.2500000 -0.2258394 -0.1476144), wk = 0.0037736 k( 21) = ( 0.2631579 -0.2377256 -0.1553835), wk = 0.0037736 k( 22) = ( 0.2763158 -0.2496119 -0.1631527), wk = 0.0037736 k( 23) = ( 0.2894737 -0.2614982 -0.1709219), wk = 0.0037736 k( 24) = ( 0.3026316 -0.2733845 -0.1786911), wk = 0.0037736 k( 25) = ( 0.3157895 -0.2852708 -0.1864602), wk = 0.0037736 k( 26) = ( 0.3289474 -0.2971571 -0.1942294), wk = 0.0037736 k( 27) = ( 0.3421053 -0.3090433 -0.2019986), wk = 0.0037736 k( 28) = ( 0.3552632 -0.3209296 -0.2097678), wk = 0.0037736 k( 29) = ( 0.3684211 -0.3328159 -0.2175369), wk = 0.0037736 k( 30) = ( 0.3815789 -0.3447022 -0.2253061), wk = 0.0037736 k( 31) = ( 0.3947368 -0.3565885 -0.2330753), wk = 0.0037736 k( 32) = ( 0.4078947 -0.3684748 -0.2408445), wk = 0.0037736 k( 33) = ( 0.4210526 -0.3803610 -0.2486137), wk = 0.0037736 k( 34) = ( 0.4342105 -0.3922473 -0.2563828), wk = 0.0037736 k( 35) = ( 0.4473684 -0.4041336 -0.2641520), wk = 0.0037736 k( 36) = ( 0.4605263 -0.4160199 -0.2719212), wk = 0.0037736 k( 37) = ( 0.4736842 -0.4279062 -0.2796904), wk = 0.0037736 k( 38) = ( 0.4868421 -0.4397924 -0.2874595), wk = 0.0037736 k( 39) = ( 0.5000000 -0.4516787 -0.2952287), wk = 0.0037736 k( 40) = ( 0.5000000 -0.4516787 -0.2952287), wk = 0.0037736 k( 41) = ( 0.5000000 -0.4410170 -0.3115404), wk = 0.0037736 k( 42) = ( 0.5000000 -0.4303552 -0.3278521), wk = 0.0037736 k( 43) = ( 0.5000000 -0.4196935 -0.3441639), wk = 0.0037736 k( 44) = ( 0.5000000 -0.4090317 -0.3604756), wk = 0.0037736 k( 45) = ( 0.5000000 -0.3983700 -0.3767873), wk = 0.0037736 k( 46) = ( 0.5000000 -0.3877082 -0.3930990), wk = 0.0037736 k( 47) = ( 0.5000000 -0.3770465 -0.4094107), wk = 0.0037736 k( 48) = ( 0.5000000 -0.3663847 -0.4257225), wk = 0.0037736 k( 49) = ( 0.5000000 -0.3557229 -0.4420342), wk = 0.0037736 k( 50) = ( 0.5000000 -0.3450612 -0.4583459), wk = 0.0037736 k( 51) = ( 0.5000000 -0.3343994 -0.4746576), wk = 0.0037736 k( 52) = ( 0.5000000 -0.3237377 -0.4909693), wk = 0.0037736 k( 53) = ( 0.5000000 -0.3130759 -0.5072810), wk = 0.0037736 k( 54) = ( 0.5000000 -0.3024142 -0.5235927), wk = 0.0037736 k( 55) = ( 0.5000000 -0.2917524 -0.5399045), wk = 0.0037736 k( 56) = ( 0.5000000 -0.2810907 -0.5562162), wk = 0.0037736 k( 57) = ( 0.5000000 -0.2704289 -0.5725279), wk = 0.0037736 k( 58) = ( 0.5000000 -0.2597672 -0.5888396), wk = 0.0037736 k( 59) = ( 0.5000000 -0.2491054 -0.6051513), wk = 0.0037736 k( 60) = ( 0.5000000 -0.2384437 -0.6214631), wk = 0.0037736 k( 61) = ( 0.5000000 -0.2277819 -0.6377748), wk = 0.0037736 k( 62) = ( 0.5000000 -0.2171202 -0.6540865), wk = 0.0037736 k( 63) = ( 0.5000000 -0.2064584 -0.6703982), wk = 0.0037736 k( 64) = ( 0.5000000 -0.1957966 -0.6867099), wk = 0.0037736 k( 65) = ( 0.5000000 -0.1851349 -0.7030216), wk = 0.0037736 k( 66) = ( 0.5000000 -0.1744731 -0.7193334), wk = 0.0037736 k( 67) = ( 0.5000000 -0.1638114 -0.7356451), wk = 0.0037736 k( 68) = ( 0.7863869 -0.0365831 -0.4452698), wk = 0.0037736 k( 69) = ( 0.7784317 -0.0293967 -0.4288682), wk = 0.0037736 k( 70) = ( 0.7704765 -0.0222103 -0.4124666), wk = 0.0037736 k( 71) = ( 0.7625213 -0.0150239 -0.3960650), wk = 0.0037736 k( 72) = ( 0.7545661 -0.0078376 -0.3796634), wk = 0.0037736 k( 73) = ( 0.7466109 -0.0006512 -0.3632618), wk = 0.0037736 k( 74) = ( 0.7386557 0.0065352 -0.3468602), wk = 0.0037736 k( 75) = ( 0.7307005 0.0137216 -0.3304587), wk = 0.0037736 k( 76) = ( 0.7227453 0.0209080 -0.3140570), wk = 0.0037736 k( 77) = ( 0.7147902 0.0280944 -0.2976554), wk = 0.0037736 k( 78) = ( 0.7068350 0.0352807 -0.2812538), wk = 0.0037736 k( 79) = ( 0.6988798 0.0424671 -0.2648523), wk = 0.0037736 k( 80) = ( 0.6909246 0.0496535 -0.2484507), wk = 0.0037736 k( 81) = ( 0.6829694 0.0568399 -0.2320491), wk = 0.0037736 k( 82) = ( 0.6750142 0.0640263 -0.2156475), wk = 0.0037736 k( 83) = ( 0.6670590 0.0712126 -0.1992459), wk = 0.0037736 k( 84) = ( 0.6591038 0.0783990 -0.1828443), wk = 0.0037736 k( 85) = ( 0.6511486 0.0855854 -0.1664427), wk = 0.0037736 k( 86) = ( 0.6431934 0.0927718 -0.1500411), wk = 0.0037736 k( 87) = ( 0.6352383 0.0999582 -0.1336395), wk = 0.0037736 k( 88) = ( 0.6272830 0.1071445 -0.1172379), wk = 0.0037736 k( 89) = ( 0.6193279 0.1143309 -0.1008363), wk = 0.0037736 k( 90) = ( 0.6113727 0.1215173 -0.0844347), wk = 0.0037736 k( 91) = ( 0.6034175 0.1287037 -0.0680331), wk = 0.0037736 k( 92) = ( 0.5954623 0.1358901 -0.0516315), wk = 0.0037736 k( 93) = ( 0.5875071 0.1430764 -0.0352299), wk = 0.0037736 k( 94) = ( 0.5795519 0.1502628 -0.0188283), wk = 0.0037736 k( 95) = ( 0.5715967 0.1574492 -0.0024267), wk = 0.0037736 k( 96) = ( 0.5636415 0.1646356 0.0139749), wk = 0.0037736 k( 97) = ( 0.5556863 0.1718220 0.0303765), wk = 0.0037736 k( 98) = ( 0.5477312 0.1790084 0.0467780), wk = 0.0037736 k( 99) = ( 0.5397760 0.1861947 0.0631797), wk = 0.0037736 k( 100) = ( 0.5318208 0.1933811 0.0795813), wk = 0.0037736 k( 101) = ( 0.5238656 0.2005675 0.0959828), wk = 0.0037736 k( 102) = ( 0.5159104 0.2077539 0.1123844), wk = 0.0037736 k( 103) = ( 0.5079552 0.2149403 0.1287860), wk = 0.0037736 k( 104) = ( 0.5000000 0.2221266 0.1451876), wk = 0.0037736 k( 105) = ( 0.5000000 0.2221266 0.1451876), wk = 0.0037736 k( 106) = ( 0.4827586 0.2144671 0.1401812), wk = 0.0037736 k( 107) = ( 0.4655172 0.2068076 0.1351747), wk = 0.0037736 k( 108) = ( 0.4482759 0.1991480 0.1301682), wk = 0.0037736 k( 109) = ( 0.4310345 0.1914885 0.1251617), wk = 0.0037736 k( 110) = ( 0.4137931 0.1838289 0.1201553), wk = 0.0037736 k( 111) = ( 0.3965517 0.1761694 0.1151488), wk = 0.0037736 k( 112) = ( 0.3793103 0.1685099 0.1101423), wk = 0.0037736 k( 113) = ( 0.3620690 0.1608503 0.1051359), wk = 0.0037736 k( 114) = ( 0.3448276 0.1531908 0.1001294), wk = 0.0037736 k( 115) = ( 0.3275862 0.1455312 0.0951229), wk = 0.0037736 k( 116) = ( 0.3103448 0.1378717 0.0901165), wk = 0.0037736 k( 117) = ( 0.2931034 0.1302122 0.0851100), wk = 0.0037736 k( 118) = ( 0.2758621 0.1225526 0.0801035), wk = 0.0037736 k( 119) = ( 0.2586207 0.1148931 0.0750970), wk = 0.0037736 k( 120) = ( 0.2413793 0.1072336 0.0700906), wk = 0.0037736 k( 121) = ( 0.2241379 0.0995740 0.0650841), wk = 0.0037736 k( 122) = ( 0.2068966 0.0919145 0.0600776), wk = 0.0037736 k( 123) = ( 0.1896552 0.0842549 0.0550712), wk = 0.0037736 k( 124) = ( 0.1724138 0.0765954 0.0500647), wk = 0.0037736 k( 125) = ( 0.1551724 0.0689359 0.0450582), wk = 0.0037736 k( 126) = ( 0.1379310 0.0612763 0.0400518), wk = 0.0037736 k( 127) = ( 0.1206897 0.0536168 0.0350453), wk = 0.0037736 k( 128) = ( 0.1034483 0.0459572 0.0300388), wk = 0.0037736 k( 129) = ( 0.0862069 0.0382977 0.0250324), wk = 0.0037736 k( 130) = ( 0.0689655 0.0306382 0.0200259), wk = 0.0037736 k( 131) = ( 0.0517241 0.0229786 0.0150194), wk = 0.0037736 k( 132) = ( 0.0344828 0.0153191 0.0100129), wk = 0.0037736 k( 133) = ( 0.0172414 0.0076595 0.0050065), wk = 0.0037736 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 136) = ( 0.0079290 -0.0071627 -0.0163477), wk = 0.0037736 k( 137) = ( 0.0158581 -0.0143255 -0.0326953), wk = 0.0037736 k( 138) = ( 0.0237871 -0.0214883 -0.0490430), wk = 0.0037736 k( 139) = ( 0.0317161 -0.0286510 -0.0653907), wk = 0.0037736 k( 140) = ( 0.0396452 -0.0358138 -0.0817383), wk = 0.0037736 k( 141) = ( 0.0475742 -0.0429765 -0.0980860), wk = 0.0037736 k( 142) = ( 0.0555032 -0.0501393 -0.1144337), wk = 0.0037736 k( 143) = ( 0.0634323 -0.0573020 -0.1307813), wk = 0.0037736 k( 144) = ( 0.0713613 -0.0644648 -0.1471290), wk = 0.0037736 k( 145) = ( 0.0792903 -0.0716275 -0.1634767), wk = 0.0037736 k( 146) = ( 0.0872194 -0.0787903 -0.1798243), wk = 0.0037736 k( 147) = ( 0.0951484 -0.0859530 -0.1961720), wk = 0.0037736 k( 148) = ( 0.1030775 -0.0931158 -0.2125197), wk = 0.0037736 k( 149) = ( 0.1110065 -0.1002785 -0.2288674), wk = 0.0037736 k( 150) = ( 0.1189355 -0.1074413 -0.2452150), wk = 0.0037736 k( 151) = ( 0.1268646 -0.1146040 -0.2615627), wk = 0.0037736 k( 152) = ( 0.1347936 -0.1217668 -0.2779104), wk = 0.0037736 k( 153) = ( 0.1427226 -0.1289296 -0.2942580), wk = 0.0037736 k( 154) = ( 0.1506517 -0.1360923 -0.3106057), wk = 0.0037736 k( 155) = ( 0.1585807 -0.1432551 -0.3269534), wk = 0.0037736 k( 156) = ( 0.1665097 -0.1504178 -0.3433010), wk = 0.0037736 k( 157) = ( 0.1744388 -0.1575806 -0.3596487), wk = 0.0037736 k( 158) = ( 0.1823678 -0.1647433 -0.3759964), wk = 0.0037736 k( 159) = ( 0.1902968 -0.1719061 -0.3923440), wk = 0.0037736 k( 160) = ( 0.1982259 -0.1790688 -0.4086917), wk = 0.0037736 k( 161) = ( 0.2061549 -0.1862316 -0.4250394), wk = 0.0037736 k( 162) = ( 0.2140839 -0.1933943 -0.4413870), wk = 0.0037736 k( 163) = ( 0.2220130 -0.2005571 -0.4577347), wk = 0.0037736 k( 164) = ( 0.2299420 -0.2077198 -0.4740824), wk = 0.0037736 k( 165) = ( 0.2378710 -0.2148826 -0.4904300), wk = 0.0037736 k( 166) = ( 0.2458001 -0.2220453 -0.5067777), wk = 0.0037736 k( 167) = ( 0.2537291 -0.2292081 -0.5231254), wk = 0.0037736 k( 168) = ( 0.2616581 -0.2363708 -0.5394731), wk = 0.0037736 k( 169) = ( 0.2695872 -0.2435336 -0.5558207), wk = 0.0037736 k( 170) = ( 0.2775162 -0.2506963 -0.5721684), wk = 0.0037736 k( 171) = ( 0.2854452 -0.2578591 -0.5885161), wk = 0.0037736 k( 172) = ( 0.2933743 -0.2650219 -0.6048637), wk = 0.0037736 k( 173) = ( 0.3013033 -0.2721846 -0.6212114), wk = 0.0037736 k( 174) = ( 0.3092324 -0.2793474 -0.6375591), wk = 0.0037736 k( 175) = ( 0.3171614 -0.2865101 -0.6539067), wk = 0.0037736 k( 176) = ( 0.3250904 -0.2936729 -0.6702544), wk = 0.0037736 k( 177) = ( 0.3330195 -0.3008356 -0.6866021), wk = 0.0037736 k( 178) = ( 0.3409485 -0.3079984 -0.7029497), wk = 0.0037736 k( 179) = ( 0.3488775 -0.3151611 -0.7192974), wk = 0.0037736 k( 180) = ( 0.3568066 -0.3223239 -0.7356451), wk = 0.0037736 k( 181) = ( 0.6431934 -0.1001972 -0.5904574), wk = 0.0037736 k( 182) = ( 0.6352383 -0.0822904 -0.5904574), wk = 0.0037736 k( 183) = ( 0.6272830 -0.0643835 -0.5904574), wk = 0.0037736 k( 184) = ( 0.6193279 -0.0464766 -0.5904574), wk = 0.0037736 k( 185) = ( 0.6113727 -0.0285697 -0.5904574), wk = 0.0037736 k( 186) = ( 0.6034175 -0.0106628 -0.5904574), wk = 0.0037736 k( 187) = ( 0.5954623 0.0072441 -0.5904574), wk = 0.0037736 k( 188) = ( 0.5875071 0.0251509 -0.5904574), wk = 0.0037736 k( 189) = ( 0.5795519 0.0430578 -0.5904574), wk = 0.0037736 k( 190) = ( 0.5715967 0.0609647 -0.5904574), wk = 0.0037736 k( 191) = ( 0.5636415 0.0788716 -0.5904574), wk = 0.0037736 k( 192) = ( 0.5556863 0.0967785 -0.5904574), wk = 0.0037736 k( 193) = ( 0.5477312 0.1146853 -0.5904574), wk = 0.0037736 k( 194) = ( 0.5397760 0.1325922 -0.5904574), wk = 0.0037736 k( 195) = ( 0.5318208 0.1504991 -0.5904574), wk = 0.0037736 k( 196) = ( 0.5238656 0.1684060 -0.5904574), wk = 0.0037736 k( 197) = ( 0.5159104 0.1863129 -0.5904574), wk = 0.0037736 k( 198) = ( 0.5079552 0.2042198 -0.5904574), wk = 0.0037736 k( 199) = ( 0.5000000 0.2221266 -0.5904574), wk = 0.0037736 k( 200) = ( 0.5000000 0.2221266 -0.5904574), wk = 0.0037736 k( 201) = ( 0.5130176 0.2279097 -0.5772586), wk = 0.0037736 k( 202) = ( 0.5260352 0.2336928 -0.5640597), wk = 0.0037736 k( 203) = ( 0.5390528 0.2394760 -0.5508608), wk = 0.0037736 k( 204) = ( 0.5520703 0.2452591 -0.5376619), wk = 0.0037736 k( 205) = ( 0.5650879 0.2510422 -0.5244631), wk = 0.0037736 k( 206) = ( 0.5781055 0.2568253 -0.5112642), wk = 0.0037736 k( 207) = ( 0.5911231 0.2626084 -0.4980653), wk = 0.0037736 k( 208) = ( 0.6041407 0.2683915 -0.4848664), wk = 0.0037736 k( 209) = ( 0.6171583 0.2741746 -0.4716676), wk = 0.0037736 k( 210) = ( 0.6301758 0.2799577 -0.4584687), wk = 0.0037736 k( 211) = ( 0.6431934 0.2857408 -0.4452698), wk = 0.0037736 k( 212) = ( 0.6431934 0.2857408 -0.4452698), wk = 0.0037736 k( 213) = ( 0.6387186 0.2837529 -0.4268180), wk = 0.0037736 k( 214) = ( 0.6342439 0.2817649 -0.4083662), wk = 0.0037736 k( 215) = ( 0.6297691 0.2797770 -0.3899144), wk = 0.0037736 k( 216) = ( 0.6252943 0.2777890 -0.3714626), wk = 0.0037736 k( 217) = ( 0.6208195 0.2758011 -0.3530108), wk = 0.0037736 k( 218) = ( 0.6163447 0.2738131 -0.3345590), wk = 0.0037736 k( 219) = ( 0.6118699 0.2718252 -0.3161072), wk = 0.0037736 k( 220) = ( 0.6073951 0.2698373 -0.2976554), wk = 0.0037736 k( 221) = ( 0.6029203 0.2678493 -0.2792036), wk = 0.0037736 k( 222) = ( 0.5984455 0.2658614 -0.2607519), wk = 0.0037736 k( 223) = ( 0.5939707 0.2638734 -0.2423001), wk = 0.0037736 k( 224) = ( 0.5894959 0.2618855 -0.2238483), wk = 0.0037736 k( 225) = ( 0.5850211 0.2598975 -0.2053965), wk = 0.0037736 k( 226) = ( 0.5805463 0.2579096 -0.1869447), wk = 0.0037736 k( 227) = ( 0.5760715 0.2559217 -0.1684929), wk = 0.0037736 k( 228) = ( 0.5715967 0.2539337 -0.1500411), wk = 0.0037736 k( 229) = ( 0.5671219 0.2519458 -0.1315893), wk = 0.0037736 k( 230) = ( 0.5626471 0.2499578 -0.1131375), wk = 0.0037736 k( 231) = ( 0.5581723 0.2479699 -0.0946857), wk = 0.0037736 k( 232) = ( 0.5536975 0.2459819 -0.0762339), wk = 0.0037736 k( 233) = ( 0.5492227 0.2439940 -0.0577821), wk = 0.0037736 k( 234) = ( 0.5447479 0.2420061 -0.0393303), wk = 0.0037736 k( 235) = ( 0.5402731 0.2400181 -0.0208785), wk = 0.0037736 k( 236) = ( 0.5357984 0.2380302 -0.0024267), wk = 0.0037736 k( 237) = ( 0.5313236 0.2360422 0.0160251), wk = 0.0037736 k( 238) = ( 0.5268488 0.2340543 0.0344769), wk = 0.0037736 k( 239) = ( 0.5223740 0.2320663 0.0529287), wk = 0.0037736 k( 240) = ( 0.5178992 0.2300784 0.0713804), wk = 0.0037736 k( 241) = ( 0.5134244 0.2280905 0.0898322), wk = 0.0037736 k( 242) = ( 0.5089496 0.2261025 0.1082840), wk = 0.0037736 k( 243) = ( 0.5044748 0.2241146 0.1267358), wk = 0.0037736 k( 244) = ( 0.5000000 0.2221266 0.1451876), wk = 0.0037736 k( 245) = ( 0.5000000 -0.4516787 -0.2952287), wk = 0.0037736 k( 246) = ( 0.5143193 -0.4405724 -0.2879693), wk = 0.0037736 k( 247) = ( 0.5286387 -0.4294661 -0.2807100), wk = 0.0037736 k( 248) = ( 0.5429580 -0.4183597 -0.2734506), wk = 0.0037736 k( 249) = ( 0.5572774 -0.4072534 -0.2661912), wk = 0.0037736 k( 250) = ( 0.5715967 -0.3961471 -0.2589318), wk = 0.0037736 k( 251) = ( 0.5859161 -0.3850407 -0.2516724), wk = 0.0037736 k( 252) = ( 0.6002354 -0.3739344 -0.2444131), wk = 0.0037736 k( 253) = ( 0.6145548 -0.3628281 -0.2371537), wk = 0.0037736 k( 254) = ( 0.6288741 -0.3517217 -0.2298943), wk = 0.0037736 k( 255) = ( 0.6431934 -0.3406154 -0.2226349), wk = 0.0037736 k( 256) = ( 0.6575128 -0.3295091 -0.2153755), wk = 0.0037736 k( 257) = ( 0.6718321 -0.3184027 -0.2081161), wk = 0.0037736 k( 258) = ( 0.6861515 -0.3072964 -0.2008568), wk = 0.0037736 k( 259) = ( 0.7004708 -0.2961901 -0.1935974), wk = 0.0037736 k( 260) = ( 0.7147902 -0.2850837 -0.1863380), wk = 0.0037736 k( 261) = ( 0.7291095 -0.2739774 -0.1790786), wk = 0.0037736 k( 262) = ( 0.7434288 -0.2628711 -0.1718192), wk = 0.0037736 k( 263) = ( 0.7577482 -0.2517647 -0.1645598), wk = 0.0037736 k( 264) = ( 0.7720675 -0.2406584 -0.1573005), wk = 0.0037736 k( 265) = ( 0.7863869 -0.2295521 -0.1500411), wk = 0.0037736 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0131579 0.0000000 0.0000000), wk = 0.0037736 k( 3) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0037736 k( 4) = ( 0.0394737 0.0000000 0.0000000), wk = 0.0037736 k( 5) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0037736 k( 6) = ( 0.0657895 0.0000000 0.0000000), wk = 0.0037736 k( 7) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0037736 k( 8) = ( 0.0921053 0.0000000 0.0000000), wk = 0.0037736 k( 9) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0037736 k( 10) = ( 0.1184210 0.0000000 0.0000000), wk = 0.0037736 k( 11) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0037736 k( 12) = ( 0.1447368 0.0000000 0.0000000), wk = 0.0037736 k( 13) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0037736 k( 14) = ( 0.1710526 0.0000000 0.0000000), wk = 0.0037736 k( 15) = ( 0.1842105 0.0000000 0.0000000), wk = 0.0037736 k( 16) = ( 0.1973684 0.0000000 0.0000000), wk = 0.0037736 k( 17) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0037736 k( 18) = ( 0.2236842 0.0000000 0.0000000), wk = 0.0037736 k( 19) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0037736 k( 20) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0037736 k( 21) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0037736 k( 22) = ( 0.2763158 0.0000000 0.0000000), wk = 0.0037736 k( 23) = ( 0.2894737 0.0000000 0.0000000), wk = 0.0037736 k( 24) = ( 0.3026316 0.0000000 -0.0000000), wk = 0.0037736 k( 25) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0037736 k( 26) = ( 0.3289474 0.0000000 0.0000000), wk = 0.0037736 k( 27) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0037736 k( 28) = ( 0.3552632 0.0000000 0.0000000), wk = 0.0037736 k( 29) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0037736 k( 30) = ( 0.3815789 0.0000000 0.0000000), wk = 0.0037736 k( 31) = ( 0.3947368 0.0000000 0.0000000), wk = 0.0037736 k( 32) = ( 0.4078947 0.0000000 0.0000000), wk = 0.0037736 k( 33) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0037736 k( 34) = ( 0.4342105 0.0000000 0.0000000), wk = 0.0037736 k( 35) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0037736 k( 36) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0037736 k( 37) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0037736 k( 38) = ( 0.4868421 0.0000000 0.0000000), wk = 0.0037736 k( 39) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 40) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 41) = ( 0.5000000 0.0079116 -0.0079116), wk = 0.0037736 k( 42) = ( 0.5000000 0.0158232 -0.0158232), wk = 0.0037736 k( 43) = ( 0.5000000 0.0237348 -0.0237348), wk = 0.0037736 k( 44) = ( 0.5000000 0.0316464 -0.0316464), wk = 0.0037736 k( 45) = ( 0.5000000 0.0395580 -0.0395580), wk = 0.0037736 k( 46) = ( 0.5000000 0.0474696 -0.0474696), wk = 0.0037736 k( 47) = ( 0.5000000 0.0553812 -0.0553812), wk = 0.0037736 k( 48) = ( 0.5000000 0.0632928 -0.0632928), wk = 0.0037736 k( 49) = ( 0.5000000 0.0712044 -0.0712044), wk = 0.0037736 k( 50) = ( 0.5000000 0.0791160 -0.0791160), wk = 0.0037736 k( 51) = ( 0.5000000 0.0870276 -0.0870276), wk = 0.0037736 k( 52) = ( 0.5000000 0.0949392 -0.0949392), wk = 0.0037736 k( 53) = ( 0.5000000 0.1028508 -0.1028508), wk = 0.0037736 k( 54) = ( 0.5000000 0.1107624 -0.1107624), wk = 0.0037736 k( 55) = ( 0.5000000 0.1186740 -0.1186740), wk = 0.0037736 k( 56) = ( 0.5000000 0.1265856 -0.1265856), wk = 0.0037736 k( 57) = ( 0.5000000 0.1344972 -0.1344971), wk = 0.0037736 k( 58) = ( 0.5000000 0.1424088 -0.1424087), wk = 0.0037736 k( 59) = ( 0.5000000 0.1503204 -0.1503203), wk = 0.0037736 k( 60) = ( 0.5000000 0.1582320 -0.1582319), wk = 0.0037736 k( 61) = ( 0.5000000 0.1661435 -0.1661435), wk = 0.0037736 k( 62) = ( 0.5000000 0.1740551 -0.1740551), wk = 0.0037736 k( 63) = ( 0.5000000 0.1819667 -0.1819667), wk = 0.0037736 k( 64) = ( 0.5000000 0.1898783 -0.1898783), wk = 0.0037736 k( 65) = ( 0.5000000 0.1977899 -0.1977899), wk = 0.0037736 k( 66) = ( 0.5000000 0.2057015 -0.2057015), wk = 0.0037736 k( 67) = ( 0.5000000 0.2136131 -0.2136131), wk = 0.0037736 k( 68) = ( 0.7863869 0.5000000 0.2136131), wk = 0.0037736 k( 69) = ( 0.7784317 0.5000000 0.2215683), wk = 0.0037736 k( 70) = ( 0.7704765 0.5000000 0.2295235), wk = 0.0037736 k( 71) = ( 0.7625213 0.5000000 0.2374787), wk = 0.0037736 k( 72) = ( 0.7545661 0.5000000 0.2454339), wk = 0.0037736 k( 73) = ( 0.7466109 0.5000000 0.2533891), wk = 0.0037736 k( 74) = ( 0.7386557 0.5000000 0.2613443), wk = 0.0037736 k( 75) = ( 0.7307005 0.5000000 0.2692995), wk = 0.0037736 k( 76) = ( 0.7227453 0.5000000 0.2772547), wk = 0.0037736 k( 77) = ( 0.7147902 0.5000000 0.2852099), wk = 0.0037736 k( 78) = ( 0.7068350 0.5000000 0.2931650), wk = 0.0037736 k( 79) = ( 0.6988798 0.5000000 0.3011202), wk = 0.0037736 k( 80) = ( 0.6909246 0.5000000 0.3090754), wk = 0.0037736 k( 81) = ( 0.6829694 0.5000000 0.3170306), wk = 0.0037736 k( 82) = ( 0.6750142 0.5000000 0.3249858), wk = 0.0037736 k( 83) = ( 0.6670590 0.5000000 0.3329410), wk = 0.0037736 k( 84) = ( 0.6591038 0.5000000 0.3408962), wk = 0.0037736 k( 85) = ( 0.6511486 0.5000000 0.3488514), wk = 0.0037736 k( 86) = ( 0.6431934 0.5000000 0.3568066), wk = 0.0037736 k( 87) = ( 0.6352383 0.5000000 0.3647617), wk = 0.0037736 k( 88) = ( 0.6272830 0.5000000 0.3727169), wk = 0.0037736 k( 89) = ( 0.6193279 0.5000000 0.3806721), wk = 0.0037736 k( 90) = ( 0.6113727 0.5000000 0.3886273), wk = 0.0037736 k( 91) = ( 0.6034175 0.5000000 0.3965825), wk = 0.0037736 k( 92) = ( 0.5954623 0.5000000 0.4045377), wk = 0.0037736 k( 93) = ( 0.5875071 0.5000000 0.4124929), wk = 0.0037736 k( 94) = ( 0.5795519 0.5000000 0.4204481), wk = 0.0037736 k( 95) = ( 0.5715967 0.5000000 0.4284033), wk = 0.0037736 k( 96) = ( 0.5636415 0.5000000 0.4363585), wk = 0.0037736 k( 97) = ( 0.5556863 0.5000000 0.4443137), wk = 0.0037736 k( 98) = ( 0.5477312 0.5000000 0.4522689), wk = 0.0037736 k( 99) = ( 0.5397760 0.5000000 0.4602240), wk = 0.0037736 k( 100) = ( 0.5318208 0.5000000 0.4681792), wk = 0.0037736 k( 101) = ( 0.5238656 0.5000000 0.4761344), wk = 0.0037736 k( 102) = ( 0.5159104 0.5000000 0.4840896), wk = 0.0037736 k( 103) = ( 0.5079552 0.5000000 0.4920448), wk = 0.0037736 k( 104) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 105) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 106) = ( 0.4827586 0.4827586 0.4827586), wk = 0.0037736 k( 107) = ( 0.4655172 0.4655172 0.4655172), wk = 0.0037736 k( 108) = ( 0.4482759 0.4482759 0.4482759), wk = 0.0037736 k( 109) = ( 0.4310345 0.4310345 0.4310345), wk = 0.0037736 k( 110) = ( 0.4137931 0.4137931 0.4137931), wk = 0.0037736 k( 111) = ( 0.3965517 0.3965517 0.3965517), wk = 0.0037736 k( 112) = ( 0.3793103 0.3793103 0.3793103), wk = 0.0037736 k( 113) = ( 0.3620690 0.3620690 0.3620690), wk = 0.0037736 k( 114) = ( 0.3448276 0.3448276 0.3448276), wk = 0.0037736 k( 115) = ( 0.3275862 0.3275862 0.3275862), wk = 0.0037736 k( 116) = ( 0.3103448 0.3103448 0.3103448), wk = 0.0037736 k( 117) = ( 0.2931034 0.2931034 0.2931034), wk = 0.0037736 k( 118) = ( 0.2758621 0.2758621 0.2758621), wk = 0.0037736 k( 119) = ( 0.2586207 0.2586207 0.2586207), wk = 0.0037736 k( 120) = ( 0.2413793 0.2413793 0.2413793), wk = 0.0037736 k( 121) = ( 0.2241379 0.2241379 0.2241379), wk = 0.0037736 k( 122) = ( 0.2068966 0.2068966 0.2068966), wk = 0.0037736 k( 123) = ( 0.1896552 0.1896552 0.1896552), wk = 0.0037736 k( 124) = ( 0.1724138 0.1724138 0.1724138), wk = 0.0037736 k( 125) = ( 0.1551724 0.1551724 0.1551724), wk = 0.0037736 k( 126) = ( 0.1379310 0.1379310 0.1379310), wk = 0.0037736 k( 127) = ( 0.1206897 0.1206897 0.1206897), wk = 0.0037736 k( 128) = ( 0.1034483 0.1034483 0.1034483), wk = 0.0037736 k( 129) = ( 0.0862069 0.0862069 0.0862069), wk = 0.0037736 k( 130) = ( 0.0689655 0.0689655 0.0689655), wk = 0.0037736 k( 131) = ( 0.0517241 0.0517241 0.0517241), wk = 0.0037736 k( 132) = ( 0.0344828 0.0344828 0.0344828), wk = 0.0037736 k( 133) = ( 0.0172414 0.0172414 0.0172414), wk = 0.0037736 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 136) = ( 0.0079290 0.0000000 -0.0079290), wk = 0.0037736 k( 137) = ( 0.0158581 0.0000000 -0.0158581), wk = 0.0037736 k( 138) = ( 0.0237871 0.0000000 -0.0237871), wk = 0.0037736 k( 139) = ( 0.0317161 0.0000000 -0.0317161), wk = 0.0037736 k( 140) = ( 0.0396452 0.0000000 -0.0396452), wk = 0.0037736 k( 141) = ( 0.0475742 0.0000000 -0.0475742), wk = 0.0037736 k( 142) = ( 0.0555032 0.0000000 -0.0555032), wk = 0.0037736 k( 143) = ( 0.0634323 0.0000000 -0.0634323), wk = 0.0037736 k( 144) = ( 0.0713613 0.0000000 -0.0713613), wk = 0.0037736 k( 145) = ( 0.0792903 0.0000000 -0.0792903), wk = 0.0037736 k( 146) = ( 0.0872194 0.0000000 -0.0872194), wk = 0.0037736 k( 147) = ( 0.0951484 0.0000000 -0.0951484), wk = 0.0037736 k( 148) = ( 0.1030775 0.0000000 -0.1030774), wk = 0.0037736 k( 149) = ( 0.1110065 0.0000000 -0.1110065), wk = 0.0037736 k( 150) = ( 0.1189355 0.0000000 -0.1189355), wk = 0.0037736 k( 151) = ( 0.1268646 0.0000000 -0.1268646), wk = 0.0037736 k( 152) = ( 0.1347936 0.0000000 -0.1347936), wk = 0.0037736 k( 153) = ( 0.1427226 0.0000000 -0.1427226), wk = 0.0037736 k( 154) = ( 0.1506517 0.0000000 -0.1506517), wk = 0.0037736 k( 155) = ( 0.1585807 0.0000000 -0.1585807), wk = 0.0037736 k( 156) = ( 0.1665097 0.0000000 -0.1665097), wk = 0.0037736 k( 157) = ( 0.1744388 0.0000000 -0.1744388), wk = 0.0037736 k( 158) = ( 0.1823678 0.0000000 -0.1823678), wk = 0.0037736 k( 159) = ( 0.1902968 0.0000000 -0.1902968), wk = 0.0037736 k( 160) = ( 0.1982259 0.0000000 -0.1982259), wk = 0.0037736 k( 161) = ( 0.2061549 0.0000000 -0.2061549), wk = 0.0037736 k( 162) = ( 0.2140839 0.0000000 -0.2140839), wk = 0.0037736 k( 163) = ( 0.2220130 0.0000000 -0.2220130), wk = 0.0037736 k( 164) = ( 0.2299420 0.0000000 -0.2299420), wk = 0.0037736 k( 165) = ( 0.2378710 0.0000000 -0.2378710), wk = 0.0037736 k( 166) = ( 0.2458001 0.0000000 -0.2458001), wk = 0.0037736 k( 167) = ( 0.2537291 0.0000000 -0.2537291), wk = 0.0037736 k( 168) = ( 0.2616581 0.0000000 -0.2616581), wk = 0.0037736 k( 169) = ( 0.2695872 0.0000000 -0.2695872), wk = 0.0037736 k( 170) = ( 0.2775162 0.0000000 -0.2775162), wk = 0.0037736 k( 171) = ( 0.2854452 0.0000000 -0.2854452), wk = 0.0037736 k( 172) = ( 0.2933743 0.0000000 -0.2933743), wk = 0.0037736 k( 173) = ( 0.3013033 0.0000000 -0.3013033), wk = 0.0037736 k( 174) = ( 0.3092324 0.0000000 -0.3092324), wk = 0.0037736 k( 175) = ( 0.3171614 0.0000000 -0.3171614), wk = 0.0037736 k( 176) = ( 0.3250904 0.0000000 -0.3250904), wk = 0.0037736 k( 177) = ( 0.3330195 0.0000000 -0.3330195), wk = 0.0037736 k( 178) = ( 0.3409485 0.0000000 -0.3409485), wk = 0.0037736 k( 179) = ( 0.3488775 0.0000000 -0.3488775), wk = 0.0037736 k( 180) = ( 0.3568066 0.0000000 -0.3568066), wk = 0.0037736 k( 181) = ( 0.6431934 0.3568066 0.0000000), wk = 0.0037736 k( 182) = ( 0.6352383 0.3647618 0.0000000), wk = 0.0037736 k( 183) = ( 0.6272830 0.3727170 0.0000000), wk = 0.0037736 k( 184) = ( 0.6193279 0.3806721 0.0000000), wk = 0.0037736 k( 185) = ( 0.6113727 0.3886273 0.0000000), wk = 0.0037736 k( 186) = ( 0.6034175 0.3965825 -0.0000000), wk = 0.0037736 k( 187) = ( 0.5954623 0.4045377 0.0000000), wk = 0.0037736 k( 188) = ( 0.5875071 0.4124929 -0.0000000), wk = 0.0037736 k( 189) = ( 0.5795519 0.4204481 0.0000000), wk = 0.0037736 k( 190) = ( 0.5715967 0.4284033 -0.0000000), wk = 0.0037736 k( 191) = ( 0.5636415 0.4363585 0.0000000), wk = 0.0037736 k( 192) = ( 0.5556863 0.4443137 0.0000000), wk = 0.0037736 k( 193) = ( 0.5477312 0.4522689 0.0000000), wk = 0.0037736 k( 194) = ( 0.5397760 0.4602241 0.0000000), wk = 0.0037736 k( 195) = ( 0.5318208 0.4681792 -0.0000000), wk = 0.0037736 k( 196) = ( 0.5238656 0.4761344 0.0000000), wk = 0.0037736 k( 197) = ( 0.5159104 0.4840896 -0.0000000), wk = 0.0037736 k( 198) = ( 0.5079552 0.4920448 0.0000000), wk = 0.0037736 k( 199) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0037736 k( 200) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0037736 k( 201) = ( 0.5130176 0.5130176 0.0194194), wk = 0.0037736 k( 202) = ( 0.5260352 0.5260352 0.0388387), wk = 0.0037736 k( 203) = ( 0.5390528 0.5390528 0.0582581), wk = 0.0037736 k( 204) = ( 0.5520703 0.5520703 0.0776775), wk = 0.0037736 k( 205) = ( 0.5650879 0.5650879 0.0970969), wk = 0.0037736 k( 206) = ( 0.5781055 0.5781055 0.1165163), wk = 0.0037736 k( 207) = ( 0.5911231 0.5911231 0.1359356), wk = 0.0037736 k( 208) = ( 0.6041407 0.6041407 0.1553550), wk = 0.0037736 k( 209) = ( 0.6171583 0.6171583 0.1747744), wk = 0.0037736 k( 210) = ( 0.6301758 0.6301758 0.1941937), wk = 0.0037736 k( 211) = ( 0.6431934 0.6431934 0.2136131), wk = 0.0037736 k( 212) = ( 0.6431934 0.6431934 0.2136131), wk = 0.0037736 k( 213) = ( 0.6387186 0.6387186 0.2225627), wk = 0.0037736 k( 214) = ( 0.6342439 0.6342439 0.2315123), wk = 0.0037736 k( 215) = ( 0.6297691 0.6297691 0.2404619), wk = 0.0037736 k( 216) = ( 0.6252943 0.6252943 0.2494115), wk = 0.0037736 k( 217) = ( 0.6208195 0.6208195 0.2583611), wk = 0.0037736 k( 218) = ( 0.6163447 0.6163447 0.2673107), wk = 0.0037736 k( 219) = ( 0.6118699 0.6118699 0.2762603), wk = 0.0037736 k( 220) = ( 0.6073951 0.6073951 0.2852098), wk = 0.0037736 k( 221) = ( 0.6029203 0.6029203 0.2941594), wk = 0.0037736 k( 222) = ( 0.5984455 0.5984455 0.3031090), wk = 0.0037736 k( 223) = ( 0.5939707 0.5939707 0.3120586), wk = 0.0037736 k( 224) = ( 0.5894959 0.5894959 0.3210082), wk = 0.0037736 k( 225) = ( 0.5850211 0.5850211 0.3299578), wk = 0.0037736 k( 226) = ( 0.5805463 0.5805463 0.3389074), wk = 0.0037736 k( 227) = ( 0.5760715 0.5760715 0.3478570), wk = 0.0037736 k( 228) = ( 0.5715967 0.5715967 0.3568066), wk = 0.0037736 k( 229) = ( 0.5671219 0.5671219 0.3657561), wk = 0.0037736 k( 230) = ( 0.5626471 0.5626471 0.3747057), wk = 0.0037736 k( 231) = ( 0.5581723 0.5581723 0.3836553), wk = 0.0037736 k( 232) = ( 0.5536975 0.5536975 0.3926049), wk = 0.0037736 k( 233) = ( 0.5492227 0.5492227 0.4015545), wk = 0.0037736 k( 234) = ( 0.5447479 0.5447479 0.4105041), wk = 0.0037736 k( 235) = ( 0.5402731 0.5402732 0.4194537), wk = 0.0037736 k( 236) = ( 0.5357984 0.5357984 0.4284033), wk = 0.0037736 k( 237) = ( 0.5313236 0.5313236 0.4373529), wk = 0.0037736 k( 238) = ( 0.5268488 0.5268488 0.4463025), wk = 0.0037736 k( 239) = ( 0.5223740 0.5223740 0.4552521), wk = 0.0037736 k( 240) = ( 0.5178992 0.5178992 0.4642016), wk = 0.0037736 k( 241) = ( 0.5134244 0.5134244 0.4731512), wk = 0.0037736 k( 242) = ( 0.5089496 0.5089496 0.4821008), wk = 0.0037736 k( 243) = ( 0.5044748 0.5044748 0.4910504), wk = 0.0037736 k( 244) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 245) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 246) = ( 0.5143193 0.0178403 0.0178403), wk = 0.0037736 k( 247) = ( 0.5286387 0.0356807 0.0356807), wk = 0.0037736 k( 248) = ( 0.5429580 0.0535210 0.0535210), wk = 0.0037736 k( 249) = ( 0.5572774 0.0713613 0.0713613), wk = 0.0037736 k( 250) = ( 0.5715967 0.0892016 0.0892016), wk = 0.0037736 k( 251) = ( 0.5859161 0.1070420 0.1070420), wk = 0.0037736 k( 252) = ( 0.6002354 0.1248823 0.1248823), wk = 0.0037736 k( 253) = ( 0.6145548 0.1427226 0.1427226), wk = 0.0037736 k( 254) = ( 0.6288741 0.1605630 0.1605630), wk = 0.0037736 k( 255) = ( 0.6431934 0.1784033 0.1784033), wk = 0.0037736 k( 256) = ( 0.6575128 0.1962436 0.1962436), wk = 0.0037736 k( 257) = ( 0.6718321 0.2140839 0.2140839), wk = 0.0037736 k( 258) = ( 0.6861515 0.2319243 0.2319243), wk = 0.0037736 k( 259) = ( 0.7004708 0.2497646 0.2497646), wk = 0.0037736 k( 260) = ( 0.7147902 0.2676049 0.2676049), wk = 0.0037736 k( 261) = ( 0.7291095 0.2854453 0.2854452), wk = 0.0037736 k( 262) = ( 0.7434288 0.3032856 0.3032856), wk = 0.0037736 k( 263) = ( 0.7577482 0.3211259 0.3211259), wk = 0.0037736 k( 264) = ( 0.7720675 0.3389662 0.3389662), wk = 0.0037736 k( 265) = ( 0.7863869 0.3568066 0.3568066), wk = 0.0037736 Dense grid: 79559 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 77705 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.65 Mb ( 560, 76) NL pseudopotentials 0.77 Mb ( 280, 181) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2210) G-vector shells 0.01 Mb ( 1853) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.60 Mb ( 560, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.42 Mb ( 181, 2, 76) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./BaTixBO3x2.save/charge-density.dat negative rho (up, down): 3.642E-04 0.000E+00 Starting wfc are 74 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 7.0 secs Computing kpt #: 3 total cpu time spent up to now is 9.7 secs Computing kpt #: 4 total cpu time spent up to now is 13.0 secs Computing kpt #: 5 total cpu time spent up to now is 16.3 secs Computing kpt #: 6 total cpu time spent up to now is 19.5 secs Computing kpt #: 7 total cpu time spent up to now is 22.7 secs Computing kpt #: 8 total cpu time spent up to now is 25.1 secs Computing kpt #: 9 total cpu time spent up to now is 27.3 secs Computing kpt #: 10 total cpu time spent up to now is 29.6 secs Computing kpt #: 11 total cpu time spent up to now is 31.8 secs Computing kpt #: 12 total cpu time spent up to now is 34.1 secs Computing kpt #: 13 total cpu time spent up to now is 36.5 secs Computing kpt #: 14 total cpu time spent up to now is 38.8 secs Computing kpt #: 15 total cpu time spent up to now is 41.1 secs Computing kpt #: 16 total cpu time spent up to now is 43.3 secs Computing kpt #: 17 total cpu time spent up to now is 45.6 secs Computing kpt #: 18 total cpu time spent up to now is 47.8 secs Computing kpt #: 19 total cpu time spent up to now is 50.1 secs Computing kpt #: 20 total cpu time spent up to now is 52.3 secs Computing kpt #: 21 total cpu time spent up to now is 54.5 secs Computing kpt #: 22 total cpu time spent up to now is 56.8 secs Computing kpt #: 23 total cpu time spent up to now is 59.0 secs Computing kpt #: 24 total cpu time spent up to now is 61.3 secs Computing kpt #: 25 total cpu time spent up to now is 64.4 secs Computing kpt #: 26 total cpu time spent up to now is 66.8 secs Computing kpt #: 27 total cpu time spent up to now is 69.1 secs Computing kpt #: 28 total cpu time spent up to now is 71.3 secs Computing kpt #: 29 total cpu time spent up to now is 73.7 secs Computing kpt #: 30 total cpu time spent up to now is 76.0 secs Computing kpt #: 31 total cpu time spent up to now is 78.3 secs Computing kpt #: 32 total cpu time spent up to now is 80.5 secs Computing kpt #: 33 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 84.9 secs Computing kpt #: 34 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 89.2 secs Computing kpt #: 35 total cpu time spent up to now is 92.5 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 96.9 secs Computing kpt #: 37 total cpu time spent up to now is 99.7 secs Computing kpt #: 38 total cpu time spent up to now is 102.0 secs Computing kpt #: 39 total cpu time spent up to now is 104.2 secs Computing kpt #: 40 total cpu time spent up to now is 106.5 secs Computing kpt #: 41 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 110.9 secs Computing kpt #: 42 total cpu time spent up to now is 113.7 secs Computing kpt #: 43 total cpu time spent up to now is 116.5 secs Computing kpt #: 44 total cpu time spent up to now is 119.3 secs Computing kpt #: 45 total cpu time spent up to now is 122.0 secs Computing kpt #: 46 total cpu time spent up to now is 124.8 secs Computing kpt #: 47 total cpu time spent up to now is 127.9 secs Computing kpt #: 48 total cpu time spent up to now is 130.6 secs Computing kpt #: 49 total cpu time spent up to now is 133.3 secs Computing kpt #: 50 total cpu time spent up to now is 135.8 secs Computing kpt #: 51 total cpu time spent up to now is 138.3 secs Computing kpt #: 52 total cpu time spent up to now is 140.8 secs Computing kpt #: 53 total cpu time spent up to now is 143.2 secs Computing kpt #: 54 total cpu time spent up to now is 145.6 secs Computing kpt #: 55 total cpu time spent up to now is 148.1 secs Computing kpt #: 56 total cpu time spent up to now is 150.4 secs Computing kpt #: 57 total cpu time spent up to now is 152.8 secs Computing kpt #: 58 total cpu time spent up to now is 155.2 secs Computing kpt #: 59 total cpu time spent up to now is 157.5 secs Computing kpt #: 60 total cpu time spent up to now is 159.8 secs Computing kpt #: 61 total cpu time spent up to now is 162.1 secs Computing kpt #: 62 total cpu time spent up to now is 164.4 secs Computing kpt #: 63 total cpu time spent up to now is 166.7 secs Computing kpt #: 64 total cpu time spent up to now is 169.0 secs Computing kpt #: 65 total cpu time spent up to now is 171.3 secs Computing kpt #: 66 total cpu time spent up to now is 173.6 secs Computing kpt #: 67 total cpu time spent up to now is 175.9 secs Computing kpt #: 68 total cpu time spent up to now is 178.3 secs Computing kpt #: 69 total cpu time spent up to now is 180.6 secs Computing kpt #: 70 total cpu time spent up to now is 182.9 secs Computing kpt #: 71 total cpu time spent up to now is 185.2 secs Computing kpt #: 72 total cpu time spent up to now is 187.6 secs Computing kpt #: 73 total cpu time spent up to now is 190.0 secs Computing kpt #: 74 total cpu time spent up to now is 192.3 secs Computing kpt #: 75 total cpu time spent up to now is 194.7 secs Computing kpt #: 76 total cpu time spent up to now is 197.1 secs Computing kpt #: 77 total cpu time spent up to now is 199.5 secs Computing kpt #: 78 total cpu time spent up to now is 202.0 secs Computing kpt #: 79 total cpu time spent up to now is 204.6 secs Computing kpt #: 80 total cpu time spent up to now is 207.1 secs Computing kpt #: 81 total cpu time spent up to now is 209.6 secs Computing kpt #: 82 total cpu time spent up to now is 212.2 secs Computing kpt #: 83 total cpu time spent up to now is 214.9 secs Computing kpt #: 84 total cpu time spent up to now is 217.6 secs Computing kpt #: 85 total cpu time spent up to now is 220.3 secs Computing kpt #: 86 total cpu time spent up to now is 223.0 secs Computing kpt #: 87 total cpu time spent up to now is 225.8 secs Computing kpt #: 88 total cpu time spent up to now is 228.6 secs Computing kpt #: 89 total cpu time spent up to now is 231.3 secs Computing kpt #: 90 total cpu time spent up to now is 234.0 secs Computing kpt #: 91 total cpu time spent up to now is 236.7 secs Computing kpt #: 92 total cpu time spent up to now is 239.4 secs Computing kpt #: 93 total cpu time spent up to now is 242.2 secs Computing kpt #: 94 total cpu time spent up to now is 245.0 secs Computing kpt #: 95 total cpu time spent up to now is 247.8 secs Computing kpt #: 96 total cpu time spent up to now is 250.6 secs Computing kpt #: 97 total cpu time spent up to now is 253.4 secs Computing kpt #: 98 total cpu time spent up to now is 256.3 secs Computing kpt #: 99 total cpu time spent up to now is 259.4 secs Computing kpt #: 100 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 263.8 secs Computing kpt #: 101 total cpu time spent up to now is 267.5 secs Computing kpt #: 102 total cpu time spent up to now is 270.8 secs Computing kpt #: 103 total cpu time spent up to now is 273.7 secs Computing kpt #: 104 total cpu time spent up to now is 276.4 secs Computing kpt #: 105 total cpu time spent up to now is 279.2 secs Computing kpt #: 106 total cpu time spent up to now is 281.7 secs Computing kpt #: 107 total cpu time spent up to now is 285.4 secs Computing kpt #: 108 total cpu time spent up to now is 288.4 secs Computing kpt #: 109 total cpu time spent up to now is 291.6 secs Computing kpt #: 110 total cpu time spent up to now is 295.0 secs Computing kpt #: 111 total cpu time spent up to now is 298.2 secs Computing kpt #: 112 total cpu time spent up to now is 301.5 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 306.0 secs Computing kpt #: 114 total cpu time spent up to now is 309.3 secs Computing kpt #: 115 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 313.8 secs Computing kpt #: 116 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 318.1 secs Computing kpt #: 117 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 322.4 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 326.8 secs Computing kpt #: 119 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 331.0 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 335.4 secs Computing kpt #: 121 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 339.6 secs Computing kpt #: 122 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 343.8 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 348.1 secs Computing kpt #: 124 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 352.3 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 356.7 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 361.0 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 365.3 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 369.5 secs Computing kpt #: 129 total cpu time spent up to now is 372.2 secs Computing kpt #: 130 total cpu time spent up to now is 374.8 secs Computing kpt #: 131 total cpu time spent up to now is 377.4 secs Computing kpt #: 132 total cpu time spent up to now is 379.9 secs Computing kpt #: 133 total cpu time spent up to now is 382.1 secs Computing kpt #: 134 total cpu time spent up to now is 384.1 secs Computing kpt #: 135 total cpu time spent up to now is 386.1 secs Computing kpt #: 136 total cpu time spent up to now is 388.7 secs Computing kpt #: 137 total cpu time spent up to now is 392.0 secs Computing kpt #: 138 total cpu time spent up to now is 395.3 secs Computing kpt #: 139 total cpu time spent up to now is 398.5 secs Computing kpt #: 140 total cpu time spent up to now is 401.7 secs Computing kpt #: 141 total cpu time spent up to now is 405.1 secs Computing kpt #: 142 total cpu time spent up to now is 407.4 secs Computing kpt #: 143 total cpu time spent up to now is 409.8 secs Computing kpt #: 144 total cpu time spent up to now is 412.2 secs Computing kpt #: 145 total cpu time spent up to now is 414.6 secs Computing kpt #: 146 total cpu time spent up to now is 416.9 secs Computing kpt #: 147 total cpu time spent up to now is 419.2 secs Computing kpt #: 148 total cpu time spent up to now is 421.9 secs Computing kpt #: 149 total cpu time spent up to now is 424.3 secs Computing kpt #: 150 total cpu time spent up to now is 427.5 secs Computing kpt #: 151 total cpu time spent up to now is 429.8 secs Computing kpt #: 152 total cpu time spent up to now is 432.1 secs Computing kpt #: 153 total cpu time spent up to now is 434.4 secs Computing kpt #: 154 total cpu time spent up to now is 437.1 secs Computing kpt #: 155 total cpu time spent up to now is 439.8 secs Computing kpt #: 156 total cpu time spent up to now is 442.5 secs Computing kpt #: 157 total cpu time spent up to now is 445.0 secs Computing kpt #: 158 total cpu time spent up to now is 447.5 secs Computing kpt #: 159 total cpu time spent up to now is 449.9 secs Computing kpt #: 160 total cpu time spent up to now is 452.4 secs Computing kpt #: 161 total cpu time spent up to now is 454.8 secs Computing kpt #: 162 total cpu time spent up to now is 457.2 secs Computing kpt #: 163 total cpu time spent up to now is 459.6 secs Computing kpt #: 164 total cpu time spent up to now is 462.0 secs Computing kpt #: 165 total cpu time spent up to now is 464.5 secs Computing kpt #: 166 total cpu time spent up to now is 466.8 secs Computing kpt #: 167 total cpu time spent up to now is 469.2 secs Computing kpt #: 168 total cpu time spent up to now is 471.5 secs Computing kpt #: 169 total cpu time spent up to now is 473.9 secs Computing kpt #: 170 total cpu time spent up to now is 476.2 secs Computing kpt #: 171 total cpu time spent up to now is 478.5 secs Computing kpt #: 172 total cpu time spent up to now is 480.8 secs Computing kpt #: 173 total cpu time spent up to now is 483.1 secs Computing kpt #: 174 total cpu time spent up to now is 485.4 secs Computing kpt #: 175 total cpu time spent up to now is 487.7 secs Computing kpt #: 176 total cpu time spent up to now is 490.0 secs Computing kpt #: 177 total cpu time spent up to now is 492.2 secs Computing kpt #: 178 total cpu time spent up to now is 494.3 secs Computing kpt #: 179 total cpu time spent up to now is 496.6 secs Computing kpt #: 180 total cpu time spent up to now is 498.9 secs Computing kpt #: 181 total cpu time spent up to now is 501.2 secs Computing kpt #: 182 total cpu time spent up to now is 503.5 secs Computing kpt #: 183 total cpu time spent up to now is 505.8 secs Computing kpt #: 184 total cpu time spent up to now is 508.1 secs Computing kpt #: 185 total cpu time spent up to now is 510.4 secs Computing kpt #: 186 total cpu time spent up to now is 512.8 secs Computing kpt #: 187 total cpu time spent up to now is 515.1 secs Computing kpt #: 188 total cpu time spent up to now is 517.5 secs Computing kpt #: 189 total cpu time spent up to now is 519.9 secs Computing kpt #: 190 total cpu time spent up to now is 522.3 secs Computing kpt #: 191 total cpu time spent up to now is 524.7 secs Computing kpt #: 192 total cpu time spent up to now is 527.1 secs Computing kpt #: 193 total cpu time spent up to now is 529.5 secs Computing kpt #: 194 total cpu time spent up to now is 532.0 secs Computing kpt #: 195 total cpu time spent up to now is 534.7 secs Computing kpt #: 196 total cpu time spent up to now is 537.3 secs Computing kpt #: 197 total cpu time spent up to now is 540.0 secs Computing kpt #: 198 total cpu time spent up to now is 542.7 secs Computing kpt #: 199 total cpu time spent up to now is 545.1 secs Computing kpt #: 200 total cpu time spent up to now is 547.5 secs Computing kpt #: 201 total cpu time spent up to now is 549.9 secs Computing kpt #: 202 total cpu time spent up to now is 552.6 secs Computing kpt #: 203 total cpu time spent up to now is 555.4 secs Computing kpt #: 204 total cpu time spent up to now is 558.2 secs Computing kpt #: 205 total cpu time spent up to now is 561.0 secs Computing kpt #: 206 total cpu time spent up to now is 563.9 secs Computing kpt #: 207 total cpu time spent up to now is 566.8 secs Computing kpt #: 208 total cpu time spent up to now is 569.4 secs Computing kpt #: 209 total cpu time spent up to now is 572.2 secs Computing kpt #: 210 total cpu time spent up to now is 574.8 secs Computing kpt #: 211 total cpu time spent up to now is 577.6 secs Computing kpt #: 212 total cpu time spent up to now is 580.3 secs Computing kpt #: 213 total cpu time spent up to now is 582.9 secs Computing kpt #: 214 total cpu time spent up to now is 585.7 secs Computing kpt #: 215 total cpu time spent up to now is 588.3 secs Computing kpt #: 216 total cpu time spent up to now is 591.0 secs Computing kpt #: 217 total cpu time spent up to now is 593.7 secs Computing kpt #: 218 total cpu time spent up to now is 596.6 secs Computing kpt #: 219 total cpu time spent up to now is 599.3 secs Computing kpt #: 220 total cpu time spent up to now is 602.3 secs Computing kpt #: 221 total cpu time spent up to now is 605.2 secs Computing kpt #: 222 total cpu time spent up to now is 608.5 secs Computing kpt #: 223 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 612.9 secs Computing kpt #: 224 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 617.3 secs Computing kpt #: 225 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 621.7 secs Computing kpt #: 226 total cpu time spent up to now is 626.0 secs Computing kpt #: 227 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 630.4 secs Computing kpt #: 228 total cpu time spent up to now is 634.6 secs Computing kpt #: 229 total cpu time spent up to now is 637.5 secs Computing kpt #: 230 total cpu time spent up to now is 641.1 secs Computing kpt #: 231 total cpu time spent up to now is 644.1 secs Computing kpt #: 232 total cpu time spent up to now is 647.0 secs Computing kpt #: 233 total cpu time spent up to now is 650.2 secs Computing kpt #: 234 total cpu time spent up to now is 653.1 secs Computing kpt #: 235 total cpu time spent up to now is 656.1 secs Computing kpt #: 236 total cpu time spent up to now is 658.9 secs Computing kpt #: 237 total cpu time spent up to now is 661.8 secs Computing kpt #: 238 total cpu time spent up to now is 664.6 secs Computing kpt #: 239 total cpu time spent up to now is 667.6 secs Computing kpt #: 240 total cpu time spent up to now is 671.5 secs Computing kpt #: 241 total cpu time spent up to now is 674.7 secs Computing kpt #: 242 total cpu time spent up to now is 677.7 secs Computing kpt #: 243 total cpu time spent up to now is 680.3 secs Computing kpt #: 244 total cpu time spent up to now is 683.1 secs Computing kpt #: 245 total cpu time spent up to now is 685.3 secs Computing kpt #: 246 total cpu time spent up to now is 687.7 secs Computing kpt #: 247 total cpu time spent up to now is 690.0 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 694.4 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 698.8 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 703.2 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 707.5 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 711.9 secs Computing kpt #: 253 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 716.3 secs Computing kpt #: 254 total cpu time spent up to now is 720.1 secs Computing kpt #: 255 total cpu time spent up to now is 723.7 secs Computing kpt #: 256 total cpu time spent up to now is 726.2 secs Computing kpt #: 257 total cpu time spent up to now is 729.9 secs Computing kpt #: 258 total cpu time spent up to now is 732.4 secs Computing kpt #: 259 total cpu time spent up to now is 734.8 secs Computing kpt #: 260 total cpu time spent up to now is 737.5 secs Computing kpt #: 261 total cpu time spent up to now is 740.2 secs Computing kpt #: 262 total cpu time spent up to now is 742.9 secs Computing kpt #: 263 total cpu time spent up to now is 745.7 secs Computing kpt #: 264 total cpu time spent up to now is 748.4 secs Computing kpt #: 265 total cpu time spent up to now is 751.2 secs ethr = 1.56E-08, avg # of iterations = 51.5 total cpu time spent up to now is 751.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3817 -12.3817 -11.8383 -11.8383 -10.6896 -10.6896 -10.6893 -10.6893 -10.4039 -10.4039 -10.3929 -10.3929 -5.1172 -5.1172 -3.1819 -3.1819 -3.1145 -3.1145 -0.1465 -0.1465 0.5569 0.5569 1.0866 1.0866 1.0966 1.0966 1.4696 1.4696 2.2861 2.2861 2.3512 2.3512 3.4243 3.4243 3.4269 3.4269 3.8921 3.8921 5.4260 5.4260 5.4472 5.4472 5.5281 5.5281 5.5380 5.5380 5.8825 5.8825 5.9388 5.9388 6.6373 6.6373 7.0050 7.0050 9.6119 9.6119 9.9969 9.9969 10.0104 10.0104 12.1381 12.1381 13.0940 13.0940 13.1138 13.1138 k = 0.0132-0.0119-0.0078 ( 9751 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3813 -12.3813 -11.8385 -11.8385 -10.6896 -10.6896 -10.6890 -10.6890 -10.4044 -10.4044 -10.3933 -10.3933 -5.1171 -5.1171 -3.1818 -3.1818 -3.1146 -3.1146 -0.1453 -0.1453 0.5560 0.5560 1.0878 1.0878 1.0979 1.0979 1.4709 1.4709 2.2854 2.2854 2.3504 2.3504 3.4221 3.4221 3.4269 3.4269 3.8966 3.8966 5.4234 5.4234 5.4447 5.4447 5.5291 5.5291 5.5391 5.5391 5.8810 5.8810 5.9372 5.9372 6.6356 6.6356 7.0041 7.0041 9.6129 9.6129 9.9978 9.9978 10.0113 10.0113 12.1407 12.1407 13.0785 13.0785 13.1075 13.1075 k = 0.0263-0.0238-0.0155 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5058 -18.5058 -12.3802 -12.3802 -11.8393 -11.8393 -10.6896 -10.6896 -10.6882 -10.6882 -10.4058 -10.4058 -10.3944 -10.3944 -5.1170 -5.1170 -3.1814 -3.1814 -3.1149 -3.1149 -0.1416 -0.1416 0.5534 0.5534 1.0913 1.0913 1.1017 1.1017 1.4749 1.4749 2.2833 2.2833 2.3481 2.3481 3.4135 3.4135 3.4296 3.4296 3.9097 3.9097 5.4140 5.4140 5.4398 5.4398 5.5305 5.5305 5.5428 5.5428 5.8761 5.8761 5.9325 5.9325 6.6305 6.6305 7.0015 7.0015 9.6160 9.6160 10.0003 10.0003 10.0143 10.0143 12.1483 12.1483 13.0322 13.0322 13.1055 13.1055 k = 0.0395-0.0357-0.0233 ( 9757 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5056 -18.5056 -12.3783 -12.3783 -11.8405 -11.8405 -10.6895 -10.6895 -10.6868 -10.6868 -10.4085 -10.4085 -10.3960 -10.3960 -5.1167 -5.1167 -3.1807 -3.1807 -3.1155 -3.1155 -0.1356 -0.1356 0.5492 0.5492 1.0967 1.0967 1.1085 1.1085 1.4816 1.4816 2.2794 2.2794 2.3449 2.3449 3.3997 3.3997 3.4344 3.4344 3.9305 3.9305 5.3969 5.3969 5.4355 5.4355 5.5310 5.5310 5.5483 5.5483 5.8677 5.8677 5.9250 5.9250 6.6222 6.6222 6.9972 6.9972 9.6212 9.6212 10.0041 10.0041 10.0197 10.0197 12.1609 12.1609 12.9751 12.9751 13.1056 13.1056 k = 0.0526-0.0475-0.0311 ( 9763 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5053 -18.5053 -12.3757 -12.3757 -11.8422 -11.8422 -10.6895 -10.6895 -10.6848 -10.6848 -10.4129 -10.4129 -10.3975 -10.3975 -5.1164 -5.1164 -3.1797 -3.1797 -3.1163 -3.1163 -0.1271 -0.1271 0.5435 0.5435 1.1035 1.1035 1.1185 1.1185 1.4909 1.4909 2.2733 2.2733 2.3412 2.3412 3.3820 3.3820 3.4411 3.4411 3.9577 3.9577 5.3738 5.3738 5.4315 5.4315 5.5307 5.5307 5.5540 5.5540 5.8554 5.8554 5.9154 5.9154 6.6108 6.6108 6.9910 6.9910 9.6283 9.6283 10.0086 10.0086 10.0279 10.0279 12.1782 12.1782 12.9152 12.9152 13.1065 13.1065 k = 0.0658-0.0594-0.0388 ( 9759 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8223 -25.8223 -18.5050 -18.5050 -12.3723 -12.3723 -11.8444 -11.8444 -10.6895 -10.6895 -10.6823 -10.6823 -10.4191 -10.4191 -10.3990 -10.3990 -5.1159 -5.1159 -3.1785 -3.1785 -3.1173 -3.1173 -0.1164 -0.1164 0.5364 0.5364 1.1117 1.1117 1.1315 1.1315 1.5026 1.5026 2.2647 2.2647 2.3377 2.3377 3.3614 3.3614 3.4498 3.4498 3.9900 3.9900 5.3463 5.3463 5.4271 5.4271 5.5300 5.5300 5.5588 5.5588 5.8387 5.8387 5.9041 5.9041 6.5966 6.5966 6.9832 6.9832 9.6372 9.6372 10.0137 10.0137 10.0387 10.0387 12.2000 12.2000 12.8549 12.8549 13.1077 13.1077 k = 0.0789-0.0713-0.0466 ( 9757 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8223 -25.8223 -18.5046 -18.5046 -12.3681 -12.3681 -11.8470 -11.8470 -10.6894 -10.6894 -10.6792 -10.6792 -10.4270 -10.4270 -10.4003 -10.4003 -5.1154 -5.1154 -3.1770 -3.1770 -3.1184 -3.1184 -0.1035 -0.1035 0.5283 0.5283 1.1213 1.1213 1.1474 1.1474 1.5169 1.5169 2.2533 2.2533 2.3349 2.3349 3.3390 3.3390 3.4604 3.4604 4.0265 4.0265 5.3152 5.3152 5.4220 5.4220 5.5288 5.5288 5.5622 5.5622 5.8177 5.8177 5.8915 5.8915 6.5799 6.5799 6.9736 6.9736 9.6479 9.6479 10.0195 10.0195 10.0521 10.0521 12.2259 12.2259 12.7951 12.7951 13.1093 13.1093 k = 0.0921-0.0832-0.0544 ( 9758 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8223 -25.8223 -18.5041 -18.5041 -12.3633 -12.3633 -11.8501 -11.8501 -10.6894 -10.6894 -10.6755 -10.6755 -10.4365 -10.4365 -10.4017 -10.4017 -5.1148 -5.1148 -3.1753 -3.1753 -3.1198 -3.1198 -0.0884 -0.0884 0.5192 0.5192 1.1323 1.1323 1.1657 1.1657 1.5334 1.5334 2.2392 2.2392 2.3331 2.3331 3.3153 3.3153 3.4728 3.4728 4.0662 4.0662 5.2809 5.2809 5.4160 5.4160 5.5271 5.5271 5.5639 5.5639 5.7926 5.7926 5.8776 5.8776 6.5612 6.5612 6.9622 6.9622 9.6601 9.6601 10.0260 10.0260 10.0677 10.0677 12.2554 12.2554 12.7368 12.7368 13.1113 13.1113 k = 0.1053-0.0951-0.0622 ( 9762 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8224 -25.8224 -18.5035 -18.5035 -12.3576 -12.3576 -11.8536 -11.8536 -10.6893 -10.6893 -10.6713 -10.6713 -10.4475 -10.4475 -10.4031 -10.4031 -5.1141 -5.1141 -3.1733 -3.1733 -3.1212 -3.1212 -0.0713 -0.0713 0.5094 0.5094 1.1447 1.1447 1.1864 1.1864 1.5521 1.5521 2.2228 2.2228 2.3322 2.3322 3.2908 3.2908 3.4870 3.4870 4.1082 4.1082 5.2438 5.2438 5.4089 5.4089 5.5247 5.5247 5.5639 5.5639 5.7642 5.7642 5.8623 5.8623 6.5407 6.5407 6.9492 6.9492 9.6739 9.6739 10.0332 10.0332 10.0853 10.0853 12.2878 12.2878 12.6802 12.6802 13.1137 13.1137 k = 0.1184-0.1070-0.0699 ( 9760 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8224 -25.8224 -18.5029 -18.5029 -12.3513 -12.3513 -11.8576 -11.8576 -10.6892 -10.6892 -10.6666 -10.6666 -10.4601 -10.4601 -10.4046 -10.4046 -5.1133 -5.1133 -3.1711 -3.1711 -3.1228 -3.1228 -0.0524 -0.0524 0.4991 0.4991 1.1585 1.1585 1.2090 1.2090 1.5728 1.5728 2.2047 2.2047 2.3322 2.3322 3.2660 3.2660 3.5030 3.5030 4.1519 4.1519 5.2040 5.2040 5.4005 5.4005 5.5213 5.5213 5.5621 5.5621 5.7331 5.7331 5.8454 5.8454 6.5190 6.5190 6.9344 6.9344 9.6888 9.6888 10.0412 10.0412 10.1046 10.1046 12.3220 12.3220 12.6264 12.6264 13.1164 13.1164 k = 0.1316-0.1189-0.0777 ( 9753 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8225 -25.8225 -18.5023 -18.5023 -12.3443 -12.3443 -11.8619 -11.8619 -10.6891 -10.6891 -10.6614 -10.6614 -10.4740 -10.4740 -10.4062 -10.4062 -5.1124 -5.1124 -3.1687 -3.1687 -3.1244 -3.1244 -0.0318 -0.0318 0.4886 0.4886 1.1735 1.1735 1.2333 1.2333 1.5953 1.5953 2.1855 2.1855 2.3329 2.3329 3.2411 3.2411 3.5208 3.5208 4.1967 4.1967 5.1620 5.1620 5.3908 5.3908 5.5164 5.5164 5.5584 5.5584 5.7005 5.7005 5.8267 5.8267 6.4965 6.4965 6.9180 6.9180 9.7049 9.7049 10.0500 10.0500 10.1254 10.1254 12.3561 12.3561 12.5767 12.5767 13.1195 13.1195 k = 0.1447-0.1307-0.0855 ( 9755 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8225 -25.8225 -18.5016 -18.5016 -12.3366 -12.3366 -11.8665 -11.8665 -10.6890 -10.6890 -10.6556 -10.6556 -10.4892 -10.4892 -10.4078 -10.4078 -5.1115 -5.1115 -3.1662 -3.1662 -3.1260 -3.1260 -0.0096 -0.0096 0.4780 0.4780 1.1898 1.1898 1.2592 1.2592 1.6192 1.6192 2.1659 2.1659 2.3343 2.3343 3.2163 3.2163 3.5403 3.5403 4.2419 4.2419 5.1181 5.1181 5.3795 5.3795 5.5092 5.5092 5.5525 5.5525 5.6680 5.6680 5.8063 5.8063 6.4736 6.4736 6.8999 6.8999 9.7218 9.7218 10.0596 10.0596 10.1474 10.1474 12.3852 12.3852 12.5355 12.5355 13.1231 13.1231 k = 0.1579-0.1426-0.0932 ( 9747 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8226 -25.8226 -18.5008 -18.5008 -12.3282 -12.3282 -11.8714 -11.8714 -10.6889 -10.6889 -10.6494 -10.6494 -10.5057 -10.5057 -10.4096 -10.4096 -5.1105 -5.1105 -3.1637 -3.1637 -3.1276 -3.1276 0.0139 0.0139 0.4676 0.4676 1.2071 1.2071 1.2862 1.2862 1.6441 1.6441 2.1464 2.1464 2.3362 2.3362 3.1917 3.1917 3.5615 3.5615 4.2869 4.2869 5.0727 5.0727 5.3664 5.3664 5.4979 5.4979 5.5444 5.5444 5.6379 5.6379 5.7840 5.7840 6.4508 6.4508 6.8802 6.8802 9.7393 9.7393 10.0699 10.0699 10.1704 10.1704 12.3955 12.3955 12.5160 12.5160 13.1271 13.1271 k = 0.1711-0.1545-0.1010 ( 9748 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8227 -25.8227 -18.5000 -18.5000 -12.3192 -12.3192 -11.8766 -11.8766 -10.6887 -10.6887 -10.6428 -10.6428 -10.5234 -10.5234 -10.4115 -10.4115 -5.1094 -5.1094 -3.1611 -3.1611 -3.1289 -3.1289 0.0384 0.0384 0.4576 0.4576 1.2253 1.2253 1.3141 1.3141 1.6696 1.6696 2.1280 2.1280 2.3388 2.3388 3.1675 3.1675 3.5843 3.5843 4.3310 4.3310 5.0264 5.0264 5.3511 5.3511 5.4803 5.4803 5.5343 5.5343 5.6130 5.6130 5.7601 5.7601 6.4283 6.4283 6.8589 6.8589 9.7573 9.7573 10.0811 10.0811 10.1942 10.1942 12.3753 12.3753 12.5292 12.5292 13.1315 13.1315 k = 0.1842-0.1664-0.1088 ( 9752 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8802 -25.8802 -25.8227 -25.8227 -18.4992 -18.4992 -12.3096 -12.3096 -11.8820 -11.8820 -10.6885 -10.6885 -10.6357 -10.6357 -10.5422 -10.5422 -10.4135 -10.4135 -5.1083 -5.1083 -3.1588 -3.1588 -3.1300 -3.1300 0.0638 0.0638 0.4484 0.4484 1.2444 1.2444 1.3424 1.3424 1.6949 1.6949 2.1116 2.1116 2.3420 2.3420 3.1438 3.1438 3.6087 3.6087 4.3733 4.3733 4.9800 4.9800 5.3333 5.3333 5.4545 5.4545 5.5231 5.5231 5.5945 5.5945 5.7347 5.7347 6.4066 6.4066 6.8363 6.8363 9.7754 9.7754 10.0932 10.0932 10.2185 10.2185 12.3391 12.3391 12.5599 12.5599 13.1363 13.1363 k = 0.1974-0.1783-0.1165 ( 9752 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8803 -25.8803 -25.8228 -25.8228 -18.4983 -18.4983 -12.2994 -12.2994 -11.8875 -11.8875 -10.6883 -10.6883 -10.6284 -10.6284 -10.5621 -10.5621 -10.4155 -10.4155 -5.1072 -5.1072 -3.1569 -3.1569 -3.1305 -3.1305 0.0895 0.0895 0.4404 0.4404 1.2643 1.2643 1.3707 1.3707 1.7194 1.7194 2.0984 2.0984 2.3457 2.3457 3.1206 3.1206 3.6346 3.6346 4.4125 4.4125 4.9347 4.9347 5.3124 5.3124 5.4217 5.4217 5.5115 5.5115 5.5816 5.5816 5.7083 5.7083 6.3858 6.3858 6.8122 6.8122 9.7934 9.7934 10.1062 10.1062 10.2432 10.2432 12.2988 12.2988 12.5955 12.5955 13.1415 13.1415 k = 0.2105-0.1902-0.1243 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8803 -25.8803 -25.8229 -25.8229 -18.4974 -18.4974 -12.2887 -12.2887 -11.8931 -11.8931 -10.6880 -10.6880 -10.6207 -10.6207 -10.5828 -10.5828 -10.4176 -10.4176 -5.1060 -5.1060 -3.1555 -3.1555 -3.1302 -3.1302 0.1151 0.1151 0.4341 0.4341 1.2846 1.2846 1.3983 1.3983 1.7422 1.7422 2.0895 2.0895 2.3501 2.3501 3.0981 3.0981 3.6621 3.6621 4.4470 4.4470 4.8921 4.8921 5.2878 5.2878 5.3847 5.3847 5.4995 5.4995 5.5721 5.5721 5.6813 5.6813 6.3661 6.3661 6.7869 6.7869 9.8110 9.8110 10.1201 10.1201 10.2681 10.2681 12.2585 12.2585 12.6312 12.6312 13.1472 13.1472 k = 0.2237-0.2021-0.1321 ( 9748 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8803 -25.8803 -25.8229 -25.8229 -18.4965 -18.4965 -12.2776 -12.2776 -11.8987 -11.8987 -10.6878 -10.6878 -10.6138 -10.6138 -10.6035 -10.6035 -10.4198 -10.4198 -5.1049 -5.1049 -3.1550 -3.1550 -3.1290 -3.1290 0.1399 0.1399 0.4301 0.4301 1.3054 1.3054 1.4245 1.4245 1.7624 1.7624 2.0864 2.0864 2.3552 2.3552 3.0764 3.0764 3.6910 3.6910 4.4742 4.4742 4.8546 4.8546 5.2586 5.2586 5.3463 5.3463 5.4869 5.4869 5.5642 5.5642 5.6546 5.6546 6.3477 6.3477 6.7605 6.7605 9.8280 9.8280 10.1349 10.1349 10.2930 10.2930 12.2194 12.2194 12.6652 12.6652 13.1532 13.1532 k = 0.2368-0.2140-0.1398 ( 9746 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8230 -25.8230 -18.4956 -18.4956 -12.2661 -12.2661 -11.9042 -11.9042 -10.6875 -10.6875 -10.6278 -10.6278 -10.6036 -10.6036 -10.4220 -10.4220 -5.1037 -5.1037 -3.1553 -3.1553 -3.1269 -3.1269 0.1629 0.1629 0.4293 0.4293 1.3264 1.3264 1.4483 1.4483 1.7798 1.7798 2.0901 2.0901 2.3609 2.3609 3.0553 3.0553 3.7212 3.7212 4.4908 4.4908 4.8256 4.8256 5.2242 5.2242 5.3085 5.3085 5.4735 5.4735 5.5564 5.5564 5.6292 5.6292 6.3306 6.3306 6.7332 6.7332 9.8442 9.8442 10.1508 10.1508 10.3177 10.3177 12.1820 12.1820 12.6965 12.6965 13.1596 13.1596 k = 0.2500-0.2258-0.1476 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8231 -25.8231 -18.4947 -18.4947 -12.2543 -12.2543 -11.9096 -11.9096 -10.6873 -10.6873 -10.6506 -10.6506 -10.5955 -10.5955 -10.4242 -10.4242 -5.1025 -5.1025 -3.1562 -3.1562 -3.1241 -3.1241 0.1832 0.1832 0.4328 0.4328 1.3476 1.3476 1.4684 1.4684 1.7947 1.7947 2.1010 2.1010 2.3673 2.3673 3.0352 3.0352 3.7528 3.7528 4.4933 4.4933 4.8082 4.8082 5.1851 5.1851 5.2719 5.2719 5.4594 5.4594 5.5469 5.5469 5.6068 5.6068 6.3148 6.3148 6.7050 6.7050 9.8594 9.8594 10.1677 10.1677 10.3420 10.3420 12.1467 12.1467 12.7245 12.7245 13.1662 13.1662 k = 0.2632-0.2377-0.1554 ( 9740 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8231 -25.8231 -18.4938 -18.4938 -12.2423 -12.2423 -11.9147 -11.9147 -10.6876 -10.6876 -10.6736 -10.6736 -10.5871 -10.5871 -10.4264 -10.4264 -5.1014 -5.1014 -3.1575 -3.1575 -3.1208 -3.1208 0.1998 0.1998 0.4415 0.4415 1.3687 1.3687 1.4835 1.4835 1.8086 1.8086 2.1185 2.1185 2.3744 2.3744 3.0158 3.0158 3.7855 3.7855 4.4809 4.4809 4.8034 4.8034 5.1423 5.1423 5.2361 5.2361 5.4447 5.4447 5.5338 5.5338 5.5897 5.5897 6.3003 6.3003 6.6763 6.6763 9.8733 9.8733 10.1855 10.1855 10.3658 10.3658 12.1135 12.1135 12.7489 12.7489 13.1731 13.1731 k = 0.2763-0.2496-0.1632 ( 9732 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8232 -25.8232 -18.4928 -18.4928 -12.2302 -12.2302 -11.9194 -11.9194 -10.6996 -10.6996 -10.6854 -10.6854 -10.5786 -10.5786 -10.4286 -10.4286 -5.1002 -5.1002 -3.1591 -3.1591 -3.1171 -3.1171 0.2119 0.2119 0.4560 0.4560 1.3895 1.3895 1.4927 1.4927 1.8232 1.8232 2.1415 2.1415 2.3824 2.3824 2.9974 2.9974 3.8192 3.8192 4.4561 4.4561 4.8081 4.8081 5.0973 5.0973 5.2004 5.2004 5.4295 5.4295 5.5166 5.5166 5.5786 5.5786 6.2872 6.2872 6.6472 6.6472 9.8859 9.8859 10.2042 10.2042 10.3891 10.3891 12.0826 12.0826 12.7697 12.7697 13.1801 13.1801 k = 0.2895-0.2615-0.1709 ( 9730 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8233 -25.8233 -18.4919 -18.4919 -12.2181 -12.2181 -11.9236 -11.9236 -10.7233 -10.7233 -10.6856 -10.6856 -10.5701 -10.5701 -10.4308 -10.4308 -5.0991 -5.0991 -3.1609 -3.1609 -3.1132 -3.1132 0.2196 0.2196 0.4763 0.4763 1.4099 1.4099 1.4952 1.4952 1.8401 1.8401 2.1684 2.1684 2.3913 2.3913 2.9798 2.9798 3.8539 3.8539 4.4235 4.4235 4.8178 4.8178 5.0513 5.0513 5.1646 5.1646 5.4138 5.4138 5.4973 5.4973 5.5719 5.5719 6.2753 6.2753 6.6180 6.6180 9.8971 9.8971 10.2235 10.2235 10.4115 10.4115 12.0540 12.0540 12.7870 12.7870 13.1872 13.1872 k = 0.3026-0.2734-0.1787 ( 9721 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8234 -25.8234 -18.4910 -18.4910 -12.2063 -12.2063 -11.9273 -11.9273 -10.7477 -10.7477 -10.6853 -10.6853 -10.5617 -10.5617 -10.4330 -10.4330 -5.0981 -5.0981 -3.1627 -3.1627 -3.1092 -3.1092 0.2234 0.2234 0.5019 0.5019 1.4298 1.4298 1.4913 1.4913 1.8599 1.8599 2.1978 2.1978 2.4011 2.4011 2.9631 2.9631 3.8892 3.8892 4.3869 4.3869 4.8280 4.8280 5.0055 5.0055 5.1286 5.1286 5.3975 5.3975 5.4784 5.4784 5.5677 5.5677 6.2646 6.2646 6.5889 6.5889 9.9070 9.9070 10.2435 10.2435 10.4331 10.4331 12.0278 12.0278 12.8010 12.8010 13.1943 13.1943 k = 0.3158-0.2853-0.1865 ( 9727 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8234 -25.8234 -18.4902 -18.4902 -12.1948 -12.1948 -11.9303 -11.9303 -10.7720 -10.7720 -10.6849 -10.6849 -10.5535 -10.5535 -10.4350 -10.4350 -5.0970 -5.0970 -3.1646 -3.1646 -3.1052 -3.1052 0.2243 0.2243 0.5317 0.5317 1.4486 1.4486 1.4818 1.4818 1.8826 1.8826 2.2284 2.2284 2.4121 2.4121 2.9471 2.9471 3.9248 3.9248 4.3493 4.3493 4.8354 4.8354 4.9607 4.9607 5.0928 5.0928 5.3802 5.3802 5.4617 5.4617 5.5651 5.5651 6.2551 6.2551 6.5602 6.5602 9.9154 9.9154 10.2637 10.2637 10.4537 10.4537 12.0039 12.0039 12.8120 12.8120 13.2014 13.2014 k = 0.3289-0.2972-0.1942 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8235 -25.8235 -18.4894 -18.4894 -12.1838 -12.1838 -11.9324 -11.9324 -10.7962 -10.7962 -10.6845 -10.6845 -10.5455 -10.5455 -10.4370 -10.4370 -5.0961 -5.0961 -3.1665 -3.1665 -3.1013 -3.1013 0.2230 0.2230 0.5647 0.5647 1.4613 1.4613 1.4728 1.4728 1.9073 1.9073 2.2592 2.2592 2.4245 2.4245 2.9318 2.9318 3.9605 3.9605 4.3127 4.3127 4.8371 4.8371 4.9183 4.9183 5.0579 5.0579 5.3617 5.3617 5.4483 5.4483 5.5635 5.5635 6.2466 6.2466 6.5322 6.5322 9.9226 9.9226 10.2840 10.2840 10.4732 10.4732 11.9823 11.9823 12.8204 12.8204 13.2084 13.2084 k = 0.3421-0.3090-0.2020 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8803 -25.8803 -25.8236 -25.8236 -18.4886 -18.4886 -12.1736 -12.1736 -11.9337 -11.9337 -10.8199 -10.8199 -10.6841 -10.6841 -10.5379 -10.5379 -10.4389 -10.4389 -5.0952 -5.0952 -3.1683 -3.1683 -3.0974 -3.0974 0.2204 0.2204 0.6002 0.6002 1.4465 1.4465 1.4865 1.4865 1.9332 1.9332 2.2892 2.2892 2.4384 2.4384 2.9171 2.9171 3.9956 3.9956 4.2788 4.2788 4.8297 4.8297 4.8807 4.8807 5.0245 5.0245 5.3416 5.3416 5.4386 5.4386 5.5627 5.5627 6.2391 6.2391 6.5051 6.5051 9.9285 9.9285 10.3041 10.3041 10.4916 10.4916 11.9630 11.9630 12.8266 12.8266 13.2152 13.2152 k = 0.3553-0.3209-0.2098 ( 9719 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8236 -25.8236 -18.4878 -18.4878 -12.1641 -12.1641 -11.9340 -11.9340 -10.8430 -10.8430 -10.6837 -10.6837 -10.5306 -10.5306 -10.4406 -10.4406 -5.0943 -5.0943 -3.1700 -3.1700 -3.0937 -3.0937 0.2170 0.2170 0.6374 0.6374 1.4253 1.4253 1.5026 1.5026 1.9594 1.9594 2.3177 2.3177 2.4540 2.4540 2.9027 2.9027 4.0290 4.0290 4.2493 4.2493 4.8094 4.8094 4.8518 4.8518 4.9933 4.9933 5.3203 5.3203 5.4328 5.4328 5.5626 5.5626 6.2327 6.2327 6.4791 6.4791 9.9334 9.9334 10.3238 10.3238 10.5088 10.5088 11.9459 11.9459 12.8308 12.8308 13.2217 13.2217 k = 0.3684-0.3328-0.2175 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8237 -25.8237 -18.4871 -18.4871 -12.1557 -12.1557 -11.9333 -11.9333 -10.8653 -10.8653 -10.6833 -10.6833 -10.5239 -10.5239 -10.4422 -10.4422 -5.0936 -5.0936 -3.1716 -3.1716 -3.0902 -3.0902 0.2132 0.2132 0.6759 0.6759 1.4014 1.4014 1.5178 1.5178 1.9849 1.9849 2.3441 2.3441 2.4716 2.4716 2.8884 2.8884 4.0589 4.0589 4.2263 4.2263 4.7793 4.7793 4.8290 4.8290 4.9645 4.9645 5.2980 5.2980 5.4301 5.4301 5.5632 5.5632 6.2271 6.2271 6.4546 6.4546 9.9372 9.9372 10.3427 10.3427 10.5246 10.5246 11.9308 11.9308 12.8334 12.8334 13.2278 13.2278 k = 0.3816-0.3447-0.2253 ( 9713 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8237 -25.8237 -18.4864 -18.4864 -12.1483 -12.1483 -11.9317 -11.9317 -10.8865 -10.8865 -10.6829 -10.6829 -10.5176 -10.5176 -10.4436 -10.4436 -5.0929 -5.0929 -3.1732 -3.1732 -3.0869 -3.0869 0.2092 0.2092 0.7153 0.7153 1.3757 1.3757 1.5319 1.5319 2.0090 2.0090 2.3682 2.3682 2.4910 2.4910 2.8740 2.8740 4.0816 4.0816 4.2134 4.2134 4.7475 4.7475 4.8060 4.8060 4.9380 4.9380 5.2752 5.2752 5.4299 5.4299 5.5644 5.5644 6.2225 6.2225 6.4317 6.4317 9.9402 9.9402 10.3607 10.3607 10.5391 10.5391 11.9178 11.9178 12.8347 12.8347 13.2335 13.2335 k = 0.3947-0.3566-0.2331 ( 9715 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8238 -25.8238 -18.4858 -18.4858 -12.1420 -12.1420 -11.9292 -11.9292 -10.9065 -10.9065 -10.6826 -10.6826 -10.5119 -10.5119 -10.4448 -10.4448 -5.0922 -5.0922 -3.1746 -3.1746 -3.0838 -3.0838 0.2053 0.2053 0.7552 0.7552 1.3484 1.3484 1.5447 1.5447 2.0310 2.0310 2.3900 2.3900 2.5120 2.5120 2.8591 2.8591 4.0927 4.0927 4.2150 4.2150 4.7176 4.7176 4.7816 4.7816 4.9129 4.9129 5.2524 5.2524 5.4314 5.4314 5.5662 5.5662 6.2187 6.2187 6.4106 6.4106 9.9424 9.9424 10.3775 10.3775 10.5522 10.5522 11.9066 11.9066 12.8351 12.8351 13.2386 13.2386 k = 0.4079-0.3685-0.2408 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8238 -25.8238 -18.4853 -18.4853 -12.1368 -12.1368 -11.9261 -11.9261 -10.9248 -10.9248 -10.6822 -10.6822 -10.5068 -10.5068 -10.4459 -10.4459 -5.0917 -5.0917 -3.1758 -3.1758 -3.0811 -3.0811 0.2017 0.2017 0.7952 0.7952 1.3200 1.3200 1.5561 1.5561 2.0506 2.0506 2.4098 2.4098 2.5342 2.5342 2.8436 2.8436 4.0926 4.0926 4.2299 4.2299 4.6907 4.6907 4.7571 4.7571 4.8886 4.8886 5.2300 5.2300 5.4338 5.4338 5.5686 5.5686 6.2156 6.2156 6.3915 6.3915 9.9440 9.9440 10.3929 10.3929 10.5639 10.5639 11.8972 11.8972 12.8347 12.8347 13.2430 13.2430 k = 0.4211-0.3804-0.2486 ( 9713 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8238 -25.8238 -18.4848 -18.4848 -12.1326 -12.1326 -11.9226 -11.9226 -10.9414 -10.9414 -10.6819 -10.6819 -10.5025 -10.5025 -10.4467 -10.4467 -5.0912 -5.0912 -3.1770 -3.1770 -3.0786 -3.0786 0.1983 0.1983 0.8351 0.8351 1.2905 1.2905 1.5662 1.5662 2.0674 2.0674 2.4276 2.4276 2.5571 2.5571 2.8273 2.8273 4.0869 4.0869 4.2519 4.2519 4.6671 4.6671 4.7343 4.7343 4.8648 4.8648 5.2086 5.2086 5.4365 5.4365 5.5712 5.5712 6.2134 6.2134 6.3746 6.3746 9.9452 9.9452 10.4067 10.4067 10.5740 10.5740 11.8894 11.8894 12.8339 12.8339 13.2464 13.2464 k = 0.4342-0.3922-0.2564 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4844 -18.4844 -12.1294 -12.1294 -11.9190 -11.9190 -10.9559 -10.9559 -10.6816 -10.6816 -10.4988 -10.4988 -10.4473 -10.4473 -5.0908 -5.0908 -3.1779 -3.1779 -3.0765 -3.0765 0.1954 0.1954 0.8746 0.8746 1.2602 1.2602 1.5747 1.5747 2.0814 2.0814 2.4435 2.4435 2.5803 2.5803 2.8099 2.8099 4.0802 4.0802 4.2755 4.2755 4.6463 4.6463 4.7156 4.7156 4.8414 4.8414 5.1888 5.1888 5.4392 5.4392 5.5740 5.5740 6.2117 6.2117 6.3599 6.3599 9.9459 9.9459 10.4186 10.4186 10.5827 10.5827 11.8831 11.8831 12.8328 12.8328 13.2478 13.2479 k = 0.4474-0.4041-0.2642 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4841 -18.4841 -12.1269 -12.1269 -11.9155 -11.9155 -10.9682 -10.9682 -10.6814 -10.6814 -10.4958 -10.4958 -10.4477 -10.4477 -5.0904 -5.0904 -3.1787 -3.1787 -3.0748 -3.0748 0.1930 0.1930 0.9130 0.9130 1.2294 1.2294 1.5817 1.5817 2.0924 2.0924 2.4573 2.4573 2.6036 2.6036 2.7916 2.7916 4.0742 4.0742 4.2977 4.2977 4.6279 4.6279 4.7027 4.7027 4.8187 4.8187 5.1712 5.1712 5.4415 5.4415 5.5767 5.5767 6.2107 6.2107 6.3477 6.3477 9.9464 9.9464 10.4286 10.4286 10.5898 10.5898 11.8781 11.8781 12.8316 12.8316 13.2451 13.2451 k = 0.4605-0.4160-0.2719 ( 9705 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4838 -18.4838 -12.1251 -12.1251 -11.9124 -11.9124 -10.9780 -10.9780 -10.6812 -10.6812 -10.4935 -10.4935 -10.4480 -10.4480 -5.0902 -5.0902 -3.1793 -3.1793 -3.0734 -3.0734 0.1910 0.1910 0.9499 0.9499 1.1987 1.1987 1.5873 1.5873 2.1007 2.1007 2.4686 2.4686 2.6266 2.6266 2.7725 2.7725 4.0697 4.0697 4.3167 4.3167 4.6117 4.6117 4.6967 4.6967 4.7971 4.7971 5.1567 5.1567 5.4434 5.4434 5.5790 5.5790 6.2101 6.2101 6.3379 6.3379 9.9467 9.9467 10.4365 10.4365 10.5954 10.5954 11.8743 11.8743 12.8305 12.8305 13.2384 13.2387 k = 0.4737-0.4279-0.2797 ( 9705 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4836 -18.4836 -12.1240 -12.1240 -11.9100 -11.9100 -10.9851 -10.9851 -10.6811 -10.6811 -10.4919 -10.4919 -10.4482 -10.4482 -5.0900 -5.0900 -3.1798 -3.1798 -3.0724 -3.0724 0.1896 0.1896 0.9839 0.9839 1.1693 1.1693 1.5912 1.5912 2.1064 2.1064 2.4770 2.4770 2.6486 2.6486 2.7531 2.7531 4.0666 4.0666 4.3313 4.3313 4.5985 4.5985 4.6968 4.6968 4.7778 4.7778 5.1457 5.1457 5.4447 5.4447 5.5809 5.5809 6.2098 6.2098 6.3309 6.3309 9.9468 9.9468 10.4422 10.4422 10.5994 10.5994 11.8717 11.8717 12.8296 12.8296 13.2314 13.2314 k = 0.4868-0.4398-0.2875 ( 9700 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1233 -12.1233 -11.9085 -11.9085 -10.9895 -10.9895 -10.6810 -10.6810 -10.4909 -10.4909 -10.4483 -10.4483 -5.0899 -5.0899 -3.1801 -3.1801 -3.0718 -3.0718 0.1888 0.1888 1.0112 1.0112 1.1447 1.1447 1.5936 1.5936 2.1098 2.1098 2.4822 2.4822 2.6680 2.6680 2.7354 2.7354 4.0648 4.0648 4.3405 4.3405 4.5898 4.5898 4.7005 4.7005 4.7629 4.7629 5.1389 5.1389 5.4455 5.4455 5.5821 5.5821 6.2097 6.2097 6.3266 6.3266 9.9469 9.9469 10.4457 10.4457 10.6018 10.6018 11.8702 11.8702 12.8291 12.8291 13.2269 13.2269 k = 0.5000-0.4517-0.2952 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1231 -12.1231 -11.9080 -11.9080 -10.9909 -10.9909 -10.6810 -10.6810 -10.4906 -10.4906 -10.4483 -10.4483 -5.0898 -5.0898 -3.1801 -3.1801 -3.0716 -3.0716 0.1885 0.1885 1.0230 1.0230 1.1339 1.1339 1.5944 1.5944 2.1109 2.1109 2.4840 2.4840 2.6774 2.6774 2.7265 2.7265 4.0642 4.0642 4.3437 4.3437 4.5867 4.5867 4.7029 4.7029 4.7569 4.7569 5.1365 5.1365 5.4458 5.4458 5.5825 5.5825 6.2096 6.2096 6.3251 6.3251 9.9469 9.9469 10.4468 10.4468 10.6026 10.6026 11.8697 11.8697 12.8289 12.8289 13.2253 13.2253 k = 0.5000-0.4517-0.2952 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1231 -12.1231 -11.9080 -11.9080 -10.9909 -10.9909 -10.6810 -10.6810 -10.4906 -10.4906 -10.4483 -10.4483 -5.0898 -5.0898 -3.1801 -3.1801 -3.0716 -3.0716 0.1885 0.1885 1.0230 1.0230 1.1339 1.1339 1.5944 1.5944 2.1109 2.1109 2.4840 2.4840 2.6774 2.6774 2.7265 2.7265 4.0642 4.0642 4.3437 4.3437 4.5867 4.5867 4.7029 4.7029 4.7569 4.7569 5.1365 5.1365 5.4458 5.4458 5.5825 5.5825 6.2096 6.2096 6.3251 6.3251 9.9469 9.9469 10.4468 10.4468 10.6026 10.6026 11.8697 11.8697 12.8289 12.8289 13.2253 13.2253 k = 0.5000-0.4410-0.3115 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1226 -12.1226 -11.9083 -11.9083 -10.9912 -10.9912 -10.6806 -10.6806 -10.4907 -10.4907 -10.4486 -10.4486 -5.0898 -5.0898 -3.1800 -3.1800 -3.0715 -3.0715 0.1897 0.1897 1.0204 1.0204 1.1335 1.1335 1.5964 1.5964 2.1116 2.1116 2.4828 2.4828 2.6783 2.6783 2.7277 2.7277 4.0646 4.0646 4.3406 4.3406 4.5873 4.5873 4.7011 4.7011 4.7573 4.7573 5.1387 5.1387 5.4465 5.4465 5.5833 5.5833 6.2077 6.2077 6.3235 6.3235 9.9484 9.9484 10.4466 10.4466 10.6021 10.6021 11.8706 11.8706 12.8294 12.8294 13.1910 13.1910 k = 0.5000-0.4304-0.3279 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4834 -18.4834 -12.1213 -12.1213 -11.9092 -11.9092 -10.9920 -10.9920 -10.6794 -10.6794 -10.4911 -10.4911 -10.4496 -10.4496 -5.0896 -5.0896 -3.1797 -3.1797 -3.0713 -3.0713 0.1934 0.1934 1.0128 1.0128 1.1323 1.1323 1.6023 1.6023 2.1136 2.1136 2.4793 2.4793 2.6809 2.6809 2.7314 2.7314 4.0657 4.0657 4.3316 4.3316 4.5889 4.5889 4.6960 4.6960 4.7584 4.7584 5.1450 5.1450 5.4487 5.4487 5.5857 5.5857 6.2021 6.2021 6.3188 6.3188 9.9529 9.9529 10.4461 10.4461 10.6004 10.6004 11.8733 11.8733 12.8310 12.8310 13.1411 13.1411 k = 0.5000-0.4197-0.3442 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4834 -18.4834 -12.1190 -12.1190 -11.9108 -11.9108 -10.9933 -10.9933 -10.6774 -10.6774 -10.4918 -10.4918 -10.4513 -10.4513 -5.0893 -5.0893 -3.1792 -3.1792 -3.0710 -3.0710 0.1996 0.1996 1.0006 1.0006 1.1303 1.1303 1.6117 1.6117 2.1170 2.1170 2.4738 2.4738 2.6849 2.6849 2.7374 2.7374 4.0675 4.0675 4.3178 4.3178 4.5906 4.5906 4.6884 4.6884 4.7597 4.7597 5.1555 5.1555 5.4520 5.4520 5.5898 5.5898 6.1932 6.1932 6.3109 6.3109 9.9604 9.9604 10.4452 10.4452 10.5976 10.5976 11.8779 11.8779 12.8334 12.8334 13.0890 13.0890 k = 0.5000-0.4090-0.3605 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4833 -18.4833 -12.1159 -12.1159 -11.9128 -11.9128 -10.9952 -10.9952 -10.6747 -10.6747 -10.4927 -10.4927 -10.4535 -10.4535 -5.0889 -5.0889 -3.1785 -3.1785 -3.0705 -3.0705 0.2082 0.2082 0.9845 0.9845 1.1274 1.1274 1.6240 1.6240 2.1217 2.1217 2.4667 2.4667 2.6903 2.6903 2.7456 2.7456 4.0697 4.0697 4.3003 4.3003 4.5915 4.5915 4.6795 4.6795 4.7608 4.7608 5.1699 5.1699 5.4556 5.4556 5.5954 5.5954 6.1813 6.1813 6.3000 6.3000 9.9705 9.9705 10.4439 10.4439 10.5938 10.5938 11.8843 11.8843 12.8366 12.8366 13.0360 13.0360 k = 0.5000-0.3984-0.3768 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4832 -18.4832 -12.1119 -12.1119 -11.9155 -11.9155 -10.9976 -10.9976 -10.6713 -10.6713 -10.4938 -10.4938 -10.4563 -10.4563 -5.0884 -5.0884 -3.1777 -3.1777 -3.0699 -3.0699 0.2192 0.2192 0.9652 0.9652 1.1236 1.1236 1.6385 1.6385 2.1275 2.1275 2.4583 2.4583 2.6968 2.6968 2.7555 2.7555 4.0719 4.0719 4.2805 4.2805 4.5906 4.5906 4.6702 4.6702 4.7615 4.7615 5.1878 5.1878 5.4586 5.4586 5.6025 5.6025 6.1672 6.1672 6.2861 6.2861 9.9832 9.9832 10.4424 10.4424 10.5888 10.5888 11.8925 11.8925 12.8402 12.8402 12.9826 12.9826 k = 0.5000-0.3877-0.3931 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4831 -18.4831 -12.1071 -12.1071 -11.9186 -11.9186 -11.0005 -11.0005 -10.6673 -10.6673 -10.4951 -10.4951 -10.4597 -10.4597 -5.0877 -5.0877 -3.1766 -3.1766 -3.0692 -3.0692 0.2325 0.2325 0.9433 0.9433 1.1190 1.1190 1.6545 1.6545 2.1343 2.1343 2.4490 2.4490 2.7043 2.7043 2.7670 2.7670 4.0738 4.0738 4.2596 4.2596 4.5870 4.5870 4.6617 4.6617 4.7620 4.7620 5.2087 5.2087 5.4602 5.4602 5.6111 5.6111 6.1516 6.1516 6.2694 6.2694 9.9983 9.9983 10.4405 10.4405 10.5828 10.5828 11.9024 11.9024 12.8427 12.8427 12.9303 12.9303 k = 0.5000-0.3770-0.4094 ( 9704 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4829 -18.4829 -12.1016 -12.1016 -11.9222 -11.9222 -11.0040 -11.0040 -10.6626 -10.6626 -10.4967 -10.4967 -10.4634 -10.4634 -5.0870 -5.0870 -3.1755 -3.1755 -3.0684 -3.0684 0.2480 0.2480 0.9194 0.9194 1.1136 1.1136 1.6713 1.6713 2.1420 2.1420 2.4391 2.4391 2.7128 2.7128 2.7796 2.7796 4.0748 4.0748 4.2386 4.2386 4.5805 4.5805 4.6550 4.6550 4.7622 4.7622 5.2322 5.2322 5.4590 5.4590 5.6211 5.6211 6.1355 6.1355 6.2503 6.2503 10.0153 10.0153 10.4383 10.4383 10.5758 10.5758 11.9140 11.9140 12.8374 12.8374 12.8860 12.8860 k = 0.5000-0.3664-0.4257 ( 9702 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4828 -18.4828 -12.0953 -12.0953 -11.9262 -11.9262 -11.0079 -11.0079 -10.6574 -10.6574 -10.4986 -10.4986 -10.4676 -10.4676 -5.0862 -5.0862 -3.1742 -3.1742 -3.0674 -3.0674 0.2657 0.2657 0.8942 0.8942 1.1075 1.1075 1.6884 1.6884 2.1503 2.1503 2.4288 2.4288 2.7223 2.7223 2.7930 2.7930 4.0742 4.0742 4.2185 4.2185 4.5715 4.5715 4.6503 4.6503 4.7624 4.7624 5.2575 5.2575 5.4542 5.4542 5.6325 5.6325 6.1197 6.1197 6.2290 6.2290 10.0340 10.0340 10.4359 10.4359 10.5677 10.5677 11.9272 11.9272 12.8031 12.8031 12.8711 12.8711 k = 0.5000-0.3557-0.4420 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4826 -18.4826 -12.0884 -12.0884 -11.9306 -11.9306 -11.0124 -11.0124 -10.6518 -10.6518 -10.5006 -10.5006 -10.4719 -10.4719 -5.0853 -5.0853 -3.1727 -3.1727 -3.0664 -3.0664 0.2853 0.2853 0.8681 0.8681 1.1007 1.1007 1.7054 1.7054 2.1590 2.1590 2.4183 2.4183 2.7327 2.7327 2.8070 2.8070 4.0713 4.0713 4.2000 4.2000 4.5609 4.5609 4.6478 4.6478 4.7627 4.7627 5.2840 5.2840 5.4447 5.4447 5.6449 5.6449 6.1050 6.1050 6.2060 6.2060 10.0541 10.0541 10.4333 10.4333 10.5587 10.5587 11.9420 11.9420 12.7525 12.7525 12.8729 12.8729 k = 0.5000-0.3451-0.4583 ( 9694 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4824 -18.4824 -12.0809 -12.0809 -11.9353 -11.9353 -11.0173 -11.0173 -10.6457 -10.6457 -10.5028 -10.5028 -10.4765 -10.4765 -5.0844 -5.0844 -3.1712 -3.1712 -3.0653 -3.0653 0.3069 0.3069 0.8414 0.8414 1.0935 1.0935 1.7218 1.7218 2.1677 2.1677 2.4078 2.4078 2.7441 2.7441 2.8211 2.8211 4.0657 4.0657 4.1839 4.1839 4.5498 4.5498 4.6472 4.6472 4.7634 4.7634 5.3112 5.3112 5.4300 5.4300 5.6582 5.6582 6.0920 6.0920 6.1821 6.1821 10.0751 10.0751 10.4307 10.4307 10.5487 10.5487 11.9582 11.9582 12.6994 12.6994 12.8776 12.8776 k = 0.5000-0.3344-0.4747 ( 9700 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4822 -18.4822 -12.0728 -12.0728 -11.9402 -11.9402 -11.0226 -11.0226 -10.6393 -10.6393 -10.5053 -10.5053 -10.4810 -10.4810 -5.0835 -5.0835 -3.1696 -3.1696 -3.0641 -3.0641 0.3300 0.3300 0.8145 0.8145 1.0858 1.0858 1.7375 1.7375 2.1762 2.1762 2.3975 2.3975 2.7563 2.7563 2.8353 2.8353 4.0569 4.0569 4.1703 4.1703 4.5392 4.5392 4.6486 4.6486 4.7647 4.7647 5.3380 5.3380 5.4100 5.4100 5.6718 5.6718 6.0807 6.0807 6.1582 6.1582 10.0967 10.0967 10.4281 10.4281 10.5379 10.5379 11.9758 11.9758 12.6464 12.6464 12.8828 12.8828 k = 0.5000-0.3237-0.4910 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4820 -18.4820 -12.0644 -12.0644 -11.9453 -11.9453 -11.0282 -11.0282 -10.6328 -10.6328 -10.5080 -10.5080 -10.4855 -10.4855 -5.0824 -5.0824 -3.1680 -3.1680 -3.0629 -3.0629 0.3546 0.3546 0.7876 0.7876 1.0780 1.0780 1.7521 1.7521 2.1840 2.1840 2.3873 2.3873 2.7695 2.7695 2.8491 2.8491 4.0452 4.0452 4.1590 4.1590 4.5296 4.5296 4.6520 4.6520 4.7667 4.7667 5.3625 5.3625 5.3860 5.3860 5.6856 5.6856 6.0705 6.0705 6.1359 6.1359 10.1183 10.1183 10.4257 10.4257 10.5263 10.5263 11.9947 11.9947 12.5942 12.5942 12.8878 12.8878 k = 0.5000-0.3131-0.5073 ( 9702 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4819 -18.4819 -12.0556 -12.0556 -11.9505 -11.9505 -11.0342 -11.0342 -10.6261 -10.6261 -10.5110 -10.5110 -10.4897 -10.4897 -5.0814 -5.0814 -3.1663 -3.1663 -3.0616 -3.0616 0.3804 0.3804 0.7610 0.7610 1.0701 1.0701 1.7655 1.7655 2.1909 2.1909 2.3773 2.3773 2.7836 2.7836 2.8624 2.8624 4.0310 4.0310 4.1500 4.1500 4.5215 4.5215 4.6575 4.6575 4.7699 4.7699 5.3515 5.3515 5.3910 5.3910 5.6990 5.6990 6.0594 6.0594 6.1180 6.1180 10.1394 10.1394 10.4236 10.4236 10.5141 10.5141 12.0148 12.0148 12.5432 12.5432 12.8921 12.8921 k = 0.5000-0.3024-0.5236 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4817 -18.4817 -12.0467 -12.0467 -11.9557 -11.9557 -11.0404 -11.0404 -10.6194 -10.6194 -10.5142 -10.5142 -10.4936 -10.4936 -5.0804 -5.0804 -3.1645 -3.1645 -3.0603 -3.0603 0.4070 0.4070 0.7349 0.7349 1.0625 1.0625 1.7777 1.7777 2.1964 2.1964 2.3677 2.3677 2.7984 2.7984 2.8749 2.8749 4.0148 4.0148 4.1433 4.1433 4.5148 4.5148 4.6646 4.6646 4.7748 4.7748 5.3173 5.3173 5.4122 5.4122 5.7121 5.7121 6.0453 6.0453 6.1070 6.1070 10.1596 10.1596 10.4222 10.4222 10.5014 10.5014 12.0359 12.0359 12.4939 12.4939 12.8956 12.8956 k = 0.5000-0.2918-0.5399 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4815 -18.4815 -12.0376 -12.0376 -11.9610 -11.9610 -11.0466 -11.0466 -10.6128 -10.6128 -10.5178 -10.5178 -10.4969 -10.4969 -5.0794 -5.0794 -3.1628 -3.1628 -3.0591 -3.0591 0.4339 0.4339 0.7093 0.7093 1.0554 1.0554 1.7885 1.7885 2.2003 2.2003 2.3583 2.3583 2.8140 2.8140 2.8864 2.8864 3.9968 3.9968 4.1390 4.1390 4.5094 4.5094 4.6727 4.6727 4.7824 4.7824 5.2791 5.2791 5.4304 5.4304 5.7248 5.7248 6.0284 6.0284 6.1033 6.1033 10.1782 10.1782 10.4216 10.4216 10.4884 10.4884 12.0579 12.0579 12.4465 12.4465 12.8979 12.8979 k = 0.5000-0.2811-0.5562 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4813 -18.4813 -12.0287 -12.0287 -11.9661 -11.9661 -11.0529 -11.0529 -10.6064 -10.6064 -10.5215 -10.5215 -10.4997 -10.4997 -5.0784 -5.0784 -3.1611 -3.1611 -3.0579 -3.0579 0.4608 0.4608 0.6846 0.6846 1.0492 1.0492 1.7980 1.7980 2.2025 2.2025 2.3492 2.3492 2.8301 2.8301 2.8965 2.8965 3.9775 3.9775 4.1377 4.1377 4.5051 4.5051 4.6807 4.6807 4.7936 4.7936 5.2382 5.2382 5.4440 5.4440 5.7373 5.7373 6.0110 6.0110 6.1048 6.1048 10.1946 10.1946 10.4218 10.4218 10.4756 10.4756 12.0808 12.0808 12.4013 12.4013 12.8989 12.8989 k = 0.5000-0.2704-0.5725 ( 9732 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4812 -18.4812 -12.0200 -12.0200 -11.9712 -11.9712 -11.0589 -11.0589 -10.6003 -10.6003 -10.5255 -10.5255 -10.5018 -10.5018 -5.0774 -5.0774 -3.1593 -3.1593 -3.0567 -3.0567 0.4870 0.4870 0.6607 0.6607 1.0442 1.0442 1.8061 1.8061 2.2028 2.2028 2.3402 2.3402 2.8466 2.8466 2.9050 2.9050 3.9572 3.9572 4.1397 4.1397 4.5016 4.5016 4.6875 4.6875 4.8095 4.8095 5.1959 5.1959 5.4520 5.4520 5.7501 5.7501 5.9951 5.9951 6.1095 6.1095 10.2082 10.2082 10.4225 10.4225 10.4638 10.4638 12.1043 12.1043 12.3585 12.3585 12.8983 12.8983 k = 0.5000-0.2598-0.5888 ( 9730 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4811 -18.4811 -12.0116 -12.0116 -11.9760 -11.9760 -11.0647 -11.0647 -10.5947 -10.5947 -10.5295 -10.5295 -10.5032 -10.5032 -5.0764 -5.0764 -3.1576 -3.1576 -3.0557 -3.0557 0.5117 0.5117 0.6378 0.6378 1.0411 1.0411 1.8128 1.8128 2.2013 2.2013 2.3314 2.3314 2.8631 2.8631 2.9118 2.9118 3.9366 3.9366 4.1453 4.1453 4.4986 4.4986 4.6924 4.6924 4.8305 4.8305 5.1530 5.1530 5.4535 5.4535 5.7636 5.7636 5.9817 5.9817 6.1164 6.1164 10.2188 10.2188 10.4217 10.4217 10.4554 10.4554 12.1285 12.1285 12.3185 12.3185 12.8960 12.8960 k = 0.5000-0.2491-0.6052 ( 9736 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4810 -18.4810 -12.0039 -12.0039 -11.9806 -11.9806 -11.0698 -11.0698 -10.5897 -10.5897 -10.5335 -10.5335 -10.5040 -10.5040 -5.0755 -5.0755 -3.1559 -3.1559 -3.0547 -3.0547 0.5343 0.5343 0.6159 0.6159 1.0404 1.0404 1.8182 1.8182 2.1981 2.1981 2.3226 2.3226 2.8792 2.8792 2.9166 2.9166 3.9163 3.9163 4.1545 4.1545 4.4959 4.4959 4.6952 4.6952 4.8565 4.8565 5.1105 5.1105 5.4486 5.4486 5.7779 5.7779 5.9713 5.9713 6.1247 6.1247 10.2259 10.2259 10.4159 10.4159 10.4540 10.4540 12.1531 12.1531 12.2813 12.2813 12.8919 12.8919 k = 0.5000-0.2384-0.6215 ( 9732 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9969 -11.9969 -11.9850 -11.9850 -11.0743 -11.0743 -10.5853 -10.5853 -10.5374 -10.5374 -10.5042 -10.5042 -5.0747 -5.0747 -3.1541 -3.1541 -3.0539 -3.0539 0.5539 0.5539 0.5952 0.5952 1.0426 1.0426 1.8221 1.8221 2.1932 2.1932 2.3137 2.3137 2.8936 2.8936 2.9202 2.9202 3.8970 3.8970 4.1672 4.1672 4.4929 4.4929 4.6965 4.6965 4.8868 4.8868 5.0695 5.0695 5.4376 5.4376 5.7927 5.7927 5.9641 5.9641 6.1339 6.1339 10.2298 10.2298 10.4053 10.4053 10.4592 10.4592 12.1779 12.1779 12.2472 12.2472 12.8859 12.8859 k = 0.5000-0.2278-0.6378 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9909 -11.9909 -11.9889 -11.9889 -11.0779 -11.0779 -10.5816 -10.5816 -10.5411 -10.5411 -10.5036 -10.5036 -5.0740 -5.0740 -3.1524 -3.1524 -3.0533 -3.0533 0.5691 0.5691 0.5763 0.5763 1.0483 1.0483 1.8248 1.8248 2.1870 2.1870 2.3046 2.3046 2.9032 2.9032 2.9251 2.9251 3.8796 3.8796 4.1833 4.1833 4.4894 4.4894 4.6967 4.6967 4.9207 4.9207 5.0307 5.0307 5.4218 5.4218 5.8070 5.8070 5.9602 5.9602 6.1436 6.1436 10.2308 10.2308 10.3928 10.3928 10.4680 10.4680 12.2012 12.2012 12.2181 12.2181 12.8778 12.8778 k = 0.5000-0.2171-0.6541 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9926 -11.9926 -11.9858 -11.9858 -11.0803 -11.0803 -10.5787 -10.5787 -10.5446 -10.5446 -10.5025 -10.5025 -5.0733 -5.0733 -3.1507 -3.1507 -3.0528 -3.0528 0.5569 0.5569 0.5816 0.5816 1.0579 1.0579 1.8261 1.8261 2.1796 2.1796 2.2953 2.2953 2.9039 2.9039 2.9348 2.9348 3.8646 3.8646 4.2025 4.2025 4.4848 4.4848 4.6965 4.6965 4.9573 4.9573 4.9951 4.9951 5.4023 5.4023 5.8193 5.8193 5.9604 5.9604 6.1535 6.1535 10.2292 10.2292 10.3796 10.3796 10.4786 10.4786 12.1866 12.1866 12.2305 12.2305 12.8676 12.8676 k = 0.5000-0.2065-0.6704 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9958 -11.9958 -11.9822 -11.9822 -11.0814 -11.0814 -10.5766 -10.5766 -10.5478 -10.5478 -10.5009 -10.5009 -5.0727 -5.0727 -3.1490 -3.1490 -3.0526 -3.0526 0.5398 0.5398 0.5883 0.5883 1.0715 1.0715 1.8260 1.8260 2.1713 2.1713 2.2858 2.2858 2.8980 2.8980 2.9466 2.9466 3.8527 3.8527 4.2242 4.2242 4.4786 4.4786 4.6966 4.6966 4.9615 4.9615 4.9979 4.9979 5.3805 5.3805 5.8278 5.8278 5.9653 5.9653 6.1634 6.1634 10.2256 10.2256 10.3664 10.3664 10.4899 10.4899 12.1624 12.1624 12.2559 12.2559 12.8553 12.8553 k = 0.5000-0.1958-0.6867 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4810 -18.4810 -11.9985 -11.9985 -11.9800 -11.9800 -11.0809 -11.0809 -10.5752 -10.5752 -10.5506 -10.5506 -10.4989 -10.4989 -5.0722 -5.0722 -3.1473 -3.1473 -3.0526 -3.0526 0.5239 0.5239 0.5902 0.5902 1.0887 1.0887 1.8247 1.8247 2.1622 2.1622 2.2761 2.2761 2.8879 2.8879 2.9578 2.9578 3.8443 3.8443 4.2480 4.2480 4.4707 4.4707 4.6977 4.6977 4.9335 4.9335 5.0387 5.0387 5.3575 5.3575 5.8312 5.8312 5.9755 5.9755 6.1732 6.1732 10.2203 10.2203 10.3534 10.3534 10.5012 10.5012 12.1412 12.1412 12.2818 12.2818 12.8409 12.8409 k = 0.5000-0.1851-0.7030 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4811 -18.4811 -12.0008 -12.0008 -11.9793 -11.9793 -11.0788 -11.0788 -10.5747 -10.5747 -10.5528 -10.5528 -10.4966 -10.4966 -5.0717 -5.0717 -3.1456 -3.1456 -3.0529 -3.0529 0.5093 0.5093 0.5875 0.5875 1.1092 1.1092 1.8221 1.8221 2.1527 2.1527 2.2660 2.2660 2.8745 2.8745 2.9674 2.9674 3.8396 3.8396 4.2728 4.2728 4.4614 4.4614 4.7001 4.7001 4.9092 4.9092 5.0814 5.0814 5.3346 5.3346 5.8292 5.8292 5.9907 5.9907 6.1828 6.1828 10.2138 10.2138 10.3408 10.3408 10.5120 10.5120 12.1233 12.1233 12.3078 12.3078 12.8244 12.8244 k = 0.5000-0.1745-0.7193 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4812 -18.4812 -12.0026 -12.0026 -11.9804 -11.9804 -11.0748 -11.0748 -10.5749 -10.5749 -10.5545 -10.5545 -10.4943 -10.4943 -5.0714 -5.0714 -3.1438 -3.1438 -3.0535 -3.0535 0.4959 0.4959 0.5805 0.5805 1.1321 1.1321 1.8182 1.8182 2.1429 2.1429 2.2555 2.2555 2.8582 2.8582 2.9749 2.9749 3.8388 3.8388 4.2973 4.2973 4.4518 4.4518 4.7042 4.7042 4.8891 4.8891 5.1252 5.1252 5.3125 5.3125 5.8224 5.8224 6.0099 6.0099 6.1921 6.1921 10.2064 10.2064 10.3286 10.3286 10.5220 10.5220 12.1088 12.1088 12.3339 12.3339 12.8059 12.8059 k = 0.5000-0.1638-0.7356 ( 9708 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4815 -18.4815 -12.0038 -12.0038 -11.9831 -11.9831 -11.0690 -11.0690 -10.5759 -10.5759 -10.5555 -10.5555 -10.4920 -10.4920 -5.0712 -5.0712 -3.1420 -3.1420 -3.0543 -3.0543 0.4838 0.4838 0.5698 0.5698 1.1568 1.1568 1.8131 1.8131 2.1330 2.1330 2.2446 2.2446 2.8396 2.8396 2.9800 2.9800 3.8418 3.8418 4.3187 4.3187 4.4448 4.4448 4.7099 4.7099 4.8729 4.8729 5.1698 5.1698 5.2920 5.2920 5.8118 5.8118 6.0320 6.0320 6.2011 6.2011 10.1981 10.1981 10.3170 10.3170 10.5308 10.5308 12.0977 12.0977 12.3601 12.3601 12.7855 12.7855 k = 0.7864-0.0366-0.4453 ( 9708 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4815 -18.4815 -12.0038 -12.0038 -11.9831 -11.9831 -11.0690 -11.0690 -10.5758 -10.5758 -10.5554 -10.5554 -10.4921 -10.4921 -5.0712 -5.0712 -3.1420 -3.1420 -3.0543 -3.0543 0.4838 0.4838 0.5699 0.5699 1.1567 1.1567 1.8131 1.8131 2.1331 2.1331 2.2445 2.2445 2.8396 2.8396 2.9800 2.9800 3.8418 3.8418 4.3185 4.3185 4.4449 4.4449 4.7099 4.7099 4.8729 4.8729 5.1697 5.1697 5.2920 5.2920 5.8118 5.8118 6.0320 6.0320 6.2011 6.2011 10.1981 10.1981 10.3170 10.3170 10.5308 10.5308 12.0977 12.0977 12.3601 12.3601 12.7855 12.7855 k = 0.7784-0.0294-0.4289 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4817 -18.4817 -12.0045 -12.0045 -11.9877 -11.9877 -11.0611 -11.0611 -10.5774 -10.5774 -10.5559 -10.5559 -10.4899 -10.4899 -5.0711 -5.0711 -3.1402 -3.1402 -3.0555 -3.0555 0.4729 0.4729 0.5558 0.5558 1.1825 1.1825 1.8068 1.8068 2.1234 2.1234 2.2329 2.2329 2.8193 2.8193 2.9824 2.9824 3.8486 3.8486 4.3320 4.3320 4.4454 4.4454 4.7172 4.7172 4.8603 4.8603 5.2149 5.2149 5.2737 5.2737 5.7981 5.7981 6.0561 6.0561 6.2100 6.2100 10.1891 10.1891 10.3058 10.3058 10.5383 10.5383 12.0899 12.0899 12.3863 12.3863 12.7633 12.7633 k = 0.7705-0.0222-0.4125 ( 9702 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4820 -18.4820 -12.0046 -12.0046 -11.9940 -11.9940 -11.0513 -11.0513 -10.5793 -10.5793 -10.5559 -10.5559 -10.4879 -10.4879 -5.0711 -5.0711 -3.1383 -3.1383 -3.0571 -3.0571 0.4632 0.4632 0.5389 0.5389 1.2084 1.2084 1.7993 1.7993 2.1140 2.1140 2.2207 2.2207 2.7978 2.7978 2.9819 2.9819 3.8589 3.8589 4.3335 4.3335 4.4577 4.4577 4.7257 4.7257 4.8512 4.8512 5.2544 5.2544 5.2639 5.2639 5.7821 5.7821 6.0814 6.0814 6.2189 6.2189 10.1795 10.1795 10.2952 10.2952 10.5442 10.5442 12.0856 12.0856 12.4124 12.4124 12.7396 12.7396 k = 0.7625-0.0150-0.3961 ( 9702 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4824 -18.4824 -12.0043 -12.0043 -12.0019 -12.0019 -11.0394 -11.0394 -10.5815 -10.5815 -10.5555 -10.5555 -10.4862 -10.4862 -5.0712 -5.0712 -3.1364 -3.1364 -3.0590 -3.0590 0.4547 0.4547 0.5196 0.5196 1.2339 1.2339 1.7907 1.7907 2.1052 2.1052 2.2076 2.2076 2.7760 2.7760 2.9785 2.9785 3.8723 3.8723 4.3251 4.3251 4.4798 4.4798 4.7348 4.7348 4.8455 4.8455 5.2445 5.2445 5.3063 5.3063 5.7644 5.7644 6.1075 6.1075 6.2280 6.2280 10.1694 10.1694 10.2851 10.2851 10.5485 10.5485 12.0846 12.0846 12.4383 12.4383 12.7148 12.7148 k = 0.7546-0.0078-0.3797 ( 9702 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4828 -18.4828 -12.0119 -12.0119 -12.0030 -12.0030 -11.0257 -11.0257 -10.5838 -10.5838 -10.5549 -10.5549 -10.4849 -10.4849 -5.0715 -5.0715 -3.1344 -3.1344 -3.0613 -3.0613 0.4472 0.4472 0.4983 0.4983 1.2584 1.2584 1.7809 1.7809 2.0972 2.0972 2.1936 2.1936 2.7542 2.7542 2.9721 2.9721 3.8887 3.8887 4.3115 4.3115 4.5069 4.5069 4.7441 4.7441 4.8430 4.8430 5.2352 5.2352 5.3509 5.3509 5.7459 5.7459 6.1338 6.1338 6.2377 6.2377 10.1587 10.1587 10.2757 10.2757 10.5509 10.5509 12.0869 12.0869 12.4636 12.4636 12.6895 12.6895 k = 0.7466-0.0007-0.3633 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4832 -18.4832 -12.0230 -12.0230 -12.0014 -12.0014 -11.0101 -11.0101 -10.5863 -10.5863 -10.5540 -10.5540 -10.4839 -10.4839 -5.0718 -5.0718 -3.1324 -3.1324 -3.0639 -3.0639 0.4404 0.4404 0.4757 0.4757 1.2815 1.2815 1.7702 1.7702 2.0900 2.0900 2.1786 2.1786 2.7331 2.7331 2.9629 2.9629 3.9075 3.9075 4.2959 4.2959 4.5360 4.5360 4.7531 4.7531 4.8437 4.8437 5.2292 5.2292 5.3945 5.3945 5.7275 5.7275 6.1597 6.1597 6.2485 6.2485 10.1474 10.1474 10.2668 10.2668 10.5515 10.5515 12.0925 12.0925 12.4875 12.4875 12.6646 12.6646 k = 0.7387 0.0065-0.3469 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4837 -18.4837 -12.0356 -12.0356 -11.9992 -11.9992 -10.9929 -10.9929 -10.5887 -10.5887 -10.5530 -10.5530 -10.4834 -10.4834 -5.0723 -5.0723 -3.1303 -3.1303 -3.0669 -3.0669 0.4322 0.4322 0.4539 0.4539 1.3029 1.3029 1.7585 1.7585 2.0838 2.0838 2.1628 2.1628 2.7130 2.7130 2.9509 2.9509 3.9285 3.9285 4.2797 4.2797 4.5651 4.5651 4.7614 4.7614 4.8476 4.8476 5.2267 5.2267 5.4364 5.4364 5.7102 5.7102 6.1842 6.1842 6.2616 6.2616 10.1353 10.1353 10.2585 10.2585 10.5502 10.5502 12.1012 12.1012 12.5083 12.5083 12.6422 12.6422 k = 0.7307 0.0137-0.3305 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8238 -25.8238 -18.4842 -18.4842 -12.0493 -12.0493 -11.9964 -11.9964 -10.9742 -10.9742 -10.5911 -10.5911 -10.5519 -10.5519 -10.4832 -10.4832 -5.0729 -5.0729 -3.1282 -3.1282 -3.0702 -3.0702 0.4151 0.4151 0.4407 0.4407 1.3222 1.3222 1.7460 1.7460 2.0785 2.0785 2.1463 2.1463 2.6939 2.6939 2.9364 2.9364 3.9513 3.9513 4.2638 4.2638 4.5932 4.5932 4.7684 4.7684 4.8546 4.8546 5.2276 5.2276 5.4756 5.4756 5.6959 5.6959 6.2060 6.2060 6.2783 6.2783 10.1225 10.1225 10.2507 10.2507 10.5469 10.5469 12.1128 12.1128 12.5215 12.5215 12.6273 12.6273 k = 0.7227 0.0209-0.3141 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8238 -25.8238 -18.4848 -18.4848 -12.0641 -12.0641 -11.9931 -11.9931 -10.9542 -10.9542 -10.5935 -10.5935 -10.5508 -10.5508 -10.4835 -10.4835 -5.0736 -5.0736 -3.1260 -3.1260 -3.0738 -3.0738 0.3894 0.3894 0.4359 0.4359 1.3392 1.3392 1.7326 1.7326 2.0738 2.0738 2.1298 2.1298 2.6761 2.6761 2.9196 2.9196 3.9755 3.9755 4.2486 4.2486 4.6196 4.6196 4.7738 4.7738 4.8643 4.8643 5.2318 5.2318 5.5103 5.5103 5.6869 5.6869 6.2242 6.2242 6.2996 6.2996 10.1088 10.1088 10.2434 10.2434 10.5417 10.5417 12.1271 12.1271 12.5203 12.5203 12.6271 12.6271 k = 0.7148 0.0281-0.2977 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8237 -25.8237 -18.4854 -18.4854 -12.0798 -12.0798 -11.9892 -11.9892 -10.9329 -10.9329 -10.5959 -10.5959 -10.5497 -10.5497 -10.4840 -10.4840 -5.0744 -5.0744 -3.1237 -3.1237 -3.0778 -3.0778 0.3606 0.3606 0.4340 0.4340 1.3540 1.3540 1.7185 1.7185 2.0691 2.0691 2.1140 2.1140 2.6594 2.6594 2.9009 2.9009 4.0006 4.0006 4.2346 4.2346 4.6438 4.6438 4.7771 4.7771 4.8765 4.8765 5.2388 5.2388 5.5382 5.5382 5.6867 5.6867 6.2391 6.2391 6.3253 6.3253 10.0943 10.0943 10.2365 10.2365 10.5345 10.5345 12.1436 12.1436 12.5052 12.5052 12.6417 12.6417 k = 0.7068 0.0353-0.2813 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8237 -25.8237 -18.4861 -18.4861 -12.0961 -12.0961 -11.9847 -11.9847 -10.9107 -10.9107 -10.5982 -10.5982 -10.5487 -10.5487 -10.4848 -10.4848 -5.0753 -5.0753 -3.1215 -3.1215 -3.0820 -3.0820 0.3304 0.3304 0.4337 0.4337 1.3663 1.3663 1.7037 1.7037 2.0629 2.0629 2.1009 2.1009 2.6437 2.6437 2.8808 2.8808 4.0255 4.0255 4.2225 4.2225 4.6649 4.6649 4.7782 4.7782 4.8911 4.8911 5.2485 5.2485 5.5574 5.5574 5.6980 5.6980 6.2518 6.2518 6.3544 6.3544 10.0788 10.0788 10.2299 10.2299 10.5255 10.5255 12.1616 12.1616 12.4839 12.4839 12.6644 12.6644 k = 0.6989 0.0425-0.2649 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8236 -25.8236 -18.4868 -18.4868 -12.1130 -12.1130 -11.9798 -11.9798 -10.8876 -10.8876 -10.6004 -10.6004 -10.5479 -10.5479 -10.4857 -10.4857 -5.0763 -5.0763 -3.1194 -3.1194 -3.0864 -3.0864 0.2990 0.2990 0.4347 0.4347 1.3763 1.3763 1.6883 1.6883 2.0532 2.0532 2.0928 2.0928 2.6287 2.6287 2.8595 2.8595 4.0487 4.0487 4.2134 4.2134 4.6818 4.6818 4.7775 4.7775 4.9079 4.9079 5.2601 5.2601 5.5697 5.5697 5.7200 5.7200 6.2634 6.2634 6.3858 6.3858 10.0623 10.0623 10.2236 10.2236 10.5145 10.5145 12.1799 12.1799 12.4621 12.4621 12.6908 12.6908 k = 0.6909 0.0497-0.2485 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8235 -25.8235 -18.4875 -18.4875 -12.1303 -12.1303 -11.9744 -11.9744 -10.8639 -10.8639 -10.6025 -10.6025 -10.5474 -10.5474 -10.4867 -10.4867 -5.0775 -5.0775 -3.1173 -3.1173 -3.0909 -3.0909 0.2667 0.2667 0.4368 0.4368 1.3840 1.3840 1.6724 1.6724 2.0402 2.0402 2.0897 2.0897 2.6141 2.6141 2.8375 2.8375 4.0677 4.0677 4.2098 4.2098 4.6920 4.6920 4.7766 4.7766 4.9270 4.9270 5.2733 5.2733 5.5799 5.5799 5.7485 5.7485 6.2747 6.2747 6.4188 6.4188 10.0450 10.0450 10.2174 10.2174 10.5018 10.5018 12.1963 12.1963 12.4437 12.4437 12.7191 12.7191 k = 0.6830 0.0568-0.2320 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8235 -25.8235 -18.4883 -18.4883 -12.1479 -12.1479 -11.9686 -11.9686 -10.8397 -10.8397 -10.6046 -10.6046 -10.5474 -10.5474 -10.4877 -10.4877 -5.0787 -5.0787 -3.1157 -3.1157 -3.0953 -3.0953 0.2338 0.2338 0.4400 0.4400 1.3894 1.3894 1.6559 1.6559 2.0258 2.0258 2.0900 2.0900 2.5998 2.5998 2.8155 2.8155 4.0786 4.0786 4.2152 4.2152 4.6921 4.6921 4.7781 4.7781 4.9487 4.9487 5.2875 5.2875 5.5920 5.5920 5.7801 5.7801 6.2861 6.2861 6.4528 6.4528 10.0267 10.0267 10.2113 10.2113 10.4873 10.4873 12.2077 12.2077 12.4327 12.4327 12.7488 12.7488 k = 0.6750 0.0640-0.2156 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8234 -25.8234 -18.4890 -18.4890 -12.1655 -12.1655 -11.9624 -11.9624 -10.8153 -10.8153 -10.6066 -10.6066 -10.5480 -10.5480 -10.4883 -10.4883 -5.0801 -5.0801 -3.1149 -3.1149 -3.0989 -3.0989 0.2004 0.2004 0.4442 0.4442 1.3928 1.3928 1.6391 1.6391 2.0117 2.0117 2.0921 2.0921 2.5855 2.5855 2.7938 2.7938 4.0797 4.0797 4.2311 4.2311 4.6804 4.6804 4.7831 4.7831 4.9732 4.9732 5.3023 5.3023 5.6081 5.6081 5.8127 5.8127 6.2979 6.2979 6.4876 6.4876 10.0076 10.0076 10.2051 10.2051 10.4713 10.4713 12.2104 12.2104 12.4331 12.4331 12.7793 12.7793 k = 0.6671 0.0712-0.1992 ( 9708 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8233 -25.8233 -18.4898 -18.4898 -12.1831 -12.1831 -11.9558 -11.9558 -10.7907 -10.7907 -10.6085 -10.6085 -10.5492 -10.5492 -10.4887 -10.4887 -5.0815 -5.0815 -3.1160 -3.1160 -3.1008 -3.1008 0.1667 0.1667 0.4494 0.4494 1.3942 1.3942 1.6218 1.6218 1.9985 1.9985 2.0953 2.0953 2.5710 2.5710 2.7732 2.7732 4.0726 4.0726 4.2555 4.2555 4.6584 4.6584 4.7901 4.7901 5.0007 5.0007 5.3176 5.3176 5.6288 5.6288 5.8450 5.8450 6.3103 6.3103 6.5229 6.5229 9.9877 9.9877 10.1989 10.1989 10.4537 10.4537 12.2029 12.2029 12.4468 12.4468 12.8106 12.8106 k = 0.6591 0.0784-0.1828 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8232 -25.8232 -18.4906 -18.4906 -12.2006 -12.2006 -11.9488 -11.9488 -10.7662 -10.7662 -10.6102 -10.6102 -10.5512 -10.5512 -10.4886 -10.4886 -5.0830 -5.0830 -3.1194 -3.1194 -3.1007 -3.1007 0.1329 0.1329 0.4555 0.4555 1.3939 1.3939 1.6041 1.6041 1.9869 1.9869 2.0989 2.0989 2.5561 2.5561 2.7543 2.7543 4.0604 4.0604 4.2853 4.2853 4.6286 4.6286 4.7969 4.7969 5.0313 5.0313 5.3332 5.3332 5.6540 5.6540 5.8765 5.8765 6.3236 6.3236 6.5584 6.5584 9.9671 9.9671 10.1925 10.1925 10.4347 10.4347 12.1867 12.1867 12.4721 12.4721 12.8425 12.8425 k = 0.6511 0.0856-0.1664 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8232 -25.8232 -18.4914 -18.4914 -12.2178 -12.2178 -11.9417 -11.9417 -10.7419 -10.7419 -10.6119 -10.6119 -10.5539 -10.5539 -10.4880 -10.4880 -5.0846 -5.0846 -3.1241 -3.1241 -3.0992 -3.0992 0.0992 0.0992 0.4625 0.4625 1.3921 1.3921 1.5862 1.5862 1.9769 1.9769 2.1026 2.1026 2.5406 2.5406 2.7376 2.7376 4.0452 4.0452 4.3182 4.3182 4.5928 4.5928 4.8025 4.8025 5.0645 5.0645 5.3492 5.3492 5.6830 5.6830 5.9066 5.9066 6.3377 6.3377 6.5938 6.5938 9.9458 9.9458 10.1861 10.1861 10.4146 10.4146 12.1649 12.1649 12.5062 12.5062 12.8748 12.8748 k = 0.6432 0.0928-0.1500 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8231 -25.8231 -18.4922 -18.4922 -12.2347 -12.2347 -11.9343 -11.9343 -10.7181 -10.7181 -10.6133 -10.6133 -10.5573 -10.5573 -10.4870 -10.4870 -5.0862 -5.0862 -3.1295 -3.1295 -3.0972 -3.0972 0.0657 0.0657 0.4703 0.4703 1.3890 1.3890 1.5680 1.5680 1.9688 1.9688 2.1057 2.1057 2.5246 2.5246 2.7239 2.7239 4.0282 4.0282 4.3526 4.3526 4.5521 4.5521 4.8065 4.8065 5.1000 5.1000 5.3655 5.3655 5.7150 5.7150 5.9352 5.9352 6.3528 6.3528 6.6291 6.6291 9.9240 9.9240 10.1794 10.1794 10.3934 10.3934 12.1399 12.1399 12.5465 12.5465 12.9075 12.9075 k = 0.6352 0.1000-0.1336 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8230 -25.8230 -18.4930 -18.4930 -12.2511 -12.2511 -11.9268 -11.9268 -10.6950 -10.6950 -10.6145 -10.6145 -10.5613 -10.5613 -10.4855 -10.4855 -5.0879 -5.0879 -3.1353 -3.1353 -3.0950 -3.0950 0.0328 0.0328 0.4789 0.4789 1.3848 1.3848 1.5497 1.5497 1.9626 1.9626 2.1081 2.1081 2.5079 2.5079 2.7136 2.7136 4.0102 4.0102 4.3874 4.3874 4.5080 4.5080 4.8090 4.8090 5.1372 5.1372 5.3821 5.3821 5.7491 5.7491 5.9622 5.9622 6.3689 6.3689 6.6638 6.6638 9.9018 9.9018 10.1727 10.1727 10.3713 10.3713 12.1134 12.1134 12.5912 12.5912 12.9405 12.9405 k = 0.6273 0.1071-0.1172 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8229 -25.8229 -18.4938 -18.4938 -12.2670 -12.2670 -11.9191 -11.9191 -10.6730 -10.6730 -10.6152 -10.6152 -10.5658 -10.5658 -10.4837 -10.4837 -5.0896 -5.0896 -3.1411 -3.1411 -3.0926 -3.0926 0.0005 0.0005 0.4882 0.4882 1.3798 1.3798 1.5312 1.5312 1.9583 1.9583 2.1092 2.1092 2.4904 2.4904 2.7075 2.7075 3.9917 3.9917 4.4191 4.4191 4.4640 4.4640 4.8100 4.8100 5.1756 5.1756 5.3989 5.3989 5.7845 5.7845 5.9872 5.9872 6.3859 6.3859 6.6979 6.6979 9.8793 9.8793 10.1659 10.1659 10.3486 10.3486 12.0863 12.0863 12.6392 12.6392 12.9736 12.9736 k = 0.6193 0.1143-0.1008 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8229 -25.8229 -18.4946 -18.4946 -12.2823 -12.2823 -11.9115 -11.9115 -10.6530 -10.6530 -10.6147 -10.6147 -10.5703 -10.5703 -10.4817 -10.4817 -5.0913 -5.0913 -3.1470 -3.1470 -3.0903 -3.0903 -0.0309 -0.0309 0.4981 0.4981 1.3741 1.3741 1.5127 1.5127 1.9559 1.9559 2.1089 2.1089 2.4722 2.4722 2.7056 2.7056 3.9730 3.9730 4.4036 4.4036 4.4647 4.4647 4.8098 4.8098 5.2145 5.2145 5.4158 5.4158 5.8206 5.8206 6.0105 6.0105 6.4039 6.4039 6.7311 6.7311 9.8566 9.8566 10.1590 10.1590 10.3255 10.3255 12.0594 12.0594 12.6898 12.6898 13.0067 13.0067 k = 0.6114 0.1215-0.0844 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8228 -25.8228 -18.4954 -18.4954 -12.2969 -12.2969 -11.9039 -11.9039 -10.6377 -10.6377 -10.6110 -10.6110 -10.5745 -10.5745 -10.4794 -10.4794 -5.0931 -5.0931 -3.1528 -3.1528 -3.0880 -3.0880 -0.0613 -0.0613 0.5086 0.5086 1.3680 1.3680 1.4943 1.4943 1.9552 1.9552 2.1070 2.1070 2.4534 2.4534 2.7083 2.7083 3.9545 3.9545 4.3540 4.3540 4.4972 4.4972 4.8085 4.8085 5.2533 5.2533 5.4326 5.4326 5.8566 5.8566 6.0318 6.0318 6.4226 6.4226 6.7632 6.7632 9.8340 9.8340 10.1521 10.1521 10.3022 10.3022 12.0330 12.0330 12.7421 12.7421 13.0396 13.0396 k = 0.6034 0.1287-0.0680 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8227 -25.8227 -18.4961 -18.4961 -12.3107 -12.3107 -11.8964 -11.8964 -10.6304 -10.6304 -10.6025 -10.6025 -10.5766 -10.5766 -10.4771 -10.4771 -5.0948 -5.0948 -3.1585 -3.1585 -3.0857 -3.0857 -0.0904 -0.0904 0.5194 0.5194 1.3616 1.3616 1.4760 1.4760 1.9561 1.9561 2.1036 2.1036 2.4341 2.4341 2.7154 2.7154 3.9362 3.9362 4.3016 4.3016 4.5304 4.5304 4.8065 4.8065 5.2916 5.2916 5.4492 5.4492 5.8921 5.8921 6.0512 6.0512 6.4421 6.4421 6.7940 6.7940 9.8116 9.8116 10.1453 10.1453 10.2790 10.2790 12.0075 12.0075 12.7957 12.7957 13.0720 13.0720 k = 0.5955 0.1359-0.0516 ( 9734 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8227 -25.8227 -18.4968 -18.4968 -12.3238 -12.3238 -11.8890 -11.8890 -10.6285 -10.6285 -10.5971 -10.5971 -10.5711 -10.5711 -10.4747 -10.4747 -5.0965 -5.0965 -3.1640 -3.1640 -3.0835 -3.0835 -0.1181 -0.1181 0.5306 0.5306 1.3551 1.3551 1.4582 1.4582 1.9587 1.9587 2.0987 2.0987 2.4145 2.4145 2.7267 2.7267 3.9186 3.9186 4.2483 4.2483 4.5628 4.5628 4.8038 4.8038 5.3288 5.3288 5.4655 5.4655 5.9266 5.9266 6.0688 6.0688 6.4620 6.4620 6.8232 6.8232 9.7896 9.7896 10.1386 10.1386 10.2560 10.2560 11.9832 11.9832 12.8500 12.8500 13.1038 13.1038 k = 0.5875 0.1431-0.0352 ( 9748 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8226 -25.8226 -18.4975 -18.4975 -12.3360 -12.3360 -11.8819 -11.8819 -10.6284 -10.6284 -10.5990 -10.5990 -10.5576 -10.5576 -10.4723 -10.4723 -5.0981 -5.0981 -3.1693 -3.1693 -3.0814 -3.0814 -0.1442 -0.1442 0.5420 0.5420 1.3484 1.3484 1.4408 1.4408 1.9627 1.9627 2.0927 2.0927 2.3946 2.3946 2.7418 2.7418 3.9016 3.9016 4.1949 4.1949 4.5937 4.5937 4.8006 4.8006 5.3644 5.3644 5.4812 5.4812 5.9596 5.9596 6.0847 6.0847 6.4822 6.4822 6.8508 6.8508 9.7683 9.7683 10.1321 10.1321 10.2337 10.2337 11.9601 11.9601 12.9043 12.9043 13.1346 13.1346 k = 0.5796 0.1503-0.0188 ( 9748 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8225 -25.8225 -18.4981 -18.4981 -12.3472 -12.3472 -11.8752 -11.8752 -10.6289 -10.6289 -10.6033 -10.6033 -10.5424 -10.5424 -10.4699 -10.4699 -5.0997 -5.0997 -3.1743 -3.1743 -3.0795 -3.0795 -0.1685 -0.1685 0.5533 0.5533 1.3418 1.3418 1.4241 1.4241 1.9679 1.9679 2.0858 2.0858 2.3748 2.3748 2.7601 2.7601 3.8856 3.8856 4.1422 4.1422 4.6228 4.6228 4.7972 4.7972 5.3980 5.3980 5.4962 5.4962 5.9908 5.9908 6.0990 6.0990 6.5023 6.5023 6.8765 6.8765 9.7477 9.7477 10.1259 10.1259 10.2121 10.2121 11.9386 11.9386 12.9581 12.9581 13.1640 13.1640 k = 0.5716 0.1574-0.0024 ( 9742 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8225 -25.8225 -18.4987 -18.4987 -12.3576 -12.3576 -11.8688 -11.8688 -10.6295 -10.6295 -10.6080 -10.6080 -10.5275 -10.5275 -10.4677 -10.4677 -5.1011 -5.1011 -3.1789 -3.1789 -3.0777 -3.0777 -0.1910 -0.1910 0.5646 0.5646 1.3353 1.3353 1.4084 1.4084 1.9744 1.9744 2.0785 2.0785 2.3551 2.3551 2.7809 2.7809 3.8705 3.8705 4.0906 4.0906 4.6499 4.6499 4.7937 4.7937 5.4292 5.4292 5.5104 5.5104 6.0198 6.0198 6.1117 6.1117 6.5220 6.5220 6.9002 6.9002 9.7282 9.7282 10.1200 10.1200 10.1916 10.1916 11.9187 11.9187 13.0108 13.0108 13.1916 13.1916 k = 0.5636 0.1646 0.0140 ( 9730 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8224 -25.8224 -18.4992 -18.4992 -12.3669 -12.3669 -11.8628 -11.8628 -10.6301 -10.6301 -10.6127 -10.6127 -10.5136 -10.5136 -10.4655 -10.4655 -5.1025 -5.1025 -3.1833 -3.1833 -3.0760 -3.0760 -0.2114 -0.2114 0.5755 0.5755 1.3288 1.3288 1.3939 1.3939 1.9817 1.9817 2.0710 2.0710 2.3357 2.3357 2.8037 2.8037 3.8566 3.8566 4.0409 4.0409 4.6748 4.6748 4.7902 4.7902 5.4576 5.4576 5.5237 5.5237 6.0463 6.0463 6.1231 6.1231 6.5410 6.5410 6.9217 6.9217 9.7100 9.7100 10.1145 10.1145 10.1725 10.1725 11.9006 11.9006 13.0616 13.0616 13.2169 13.2169 k = 0.5557 0.1718 0.0304 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8224 -25.8224 -18.4997 -18.4997 -12.3752 -12.3752 -11.8574 -11.8574 -10.6308 -10.6308 -10.6171 -10.6171 -10.5012 -10.5012 -10.4635 -10.4635 -5.1038 -5.1038 -3.1872 -3.1872 -3.0745 -3.0745 -0.2297 -0.2297 0.5859 0.5859 1.3224 1.3224 1.3808 1.3808 1.9899 1.9899 2.0636 2.0636 2.3170 2.3170 2.8274 2.8274 3.8440 3.8440 3.9938 3.9938 4.6972 4.6972 4.7868 4.7868 5.4830 5.4830 5.5360 5.5360 6.0699 6.0699 6.1332 6.1332 6.5590 6.5590 6.9410 6.9410 9.6932 9.6932 10.1095 10.1095 10.1549 10.1549 11.8844 11.8844 13.1097 13.1097 13.2392 13.2392 k = 0.5477 0.1790 0.0468 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5001 -18.5001 -12.3825 -12.3825 -11.8526 -11.8526 -10.6314 -10.6314 -10.6212 -10.6212 -10.4902 -10.4902 -10.4615 -10.4615 -5.1049 -5.1049 -3.1906 -3.1906 -3.0732 -3.0732 -0.2458 -0.2458 0.5956 0.5956 1.3162 1.3162 1.3695 1.3695 1.9985 1.9985 2.0567 2.0567 2.2991 2.2991 2.8513 2.8513 3.8325 3.8325 3.9502 3.9502 4.7170 4.7170 4.7836 4.7836 5.5050 5.5050 5.5473 5.5473 6.0904 6.0904 6.1423 6.1423 6.5755 6.5755 6.9579 6.9579 9.6782 9.6782 10.1050 10.1050 10.1392 10.1392 11.8701 11.8701 13.1544 13.1544 13.2579 13.2579 k = 0.5398 0.1862 0.0632 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5005 -18.5005 -12.3887 -12.3887 -11.8484 -11.8484 -10.6319 -10.6319 -10.6247 -10.6247 -10.4809 -10.4809 -10.4597 -10.4597 -5.1059 -5.1059 -3.1936 -3.1936 -3.0721 -3.0721 -0.2595 -0.2595 0.6043 0.6043 1.3101 1.3101 1.3601 1.3601 2.0072 2.0072 2.0504 2.0504 2.2825 2.2825 2.8744 2.8744 3.8222 3.8222 3.9110 3.9110 4.7340 4.7340 4.7809 4.7809 5.5234 5.5234 5.5576 5.5576 6.1073 6.1073 6.1506 6.1506 6.5902 6.5902 6.9723 6.9723 9.6651 9.6651 10.1010 10.1010 10.1256 10.1256 11.8579 11.8579 13.1946 13.1946 13.2725 13.2725 k = 0.5318 0.1934 0.0796 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5008 -18.5008 -12.3938 -12.3938 -11.8449 -11.8449 -10.6324 -10.6324 -10.6277 -10.6277 -10.4735 -10.4735 -10.4580 -10.4580 -5.1067 -5.1067 -3.1961 -3.1961 -3.0712 -3.0712 -0.2709 -0.2709 0.6117 0.6117 1.3044 1.3044 1.3526 1.3526 2.0157 2.0157 2.0451 2.0451 2.2675 2.2675 2.8956 2.8956 3.8129 3.8129 3.8776 3.8776 4.7480 4.7480 4.7785 4.7785 5.5379 5.5379 5.5668 5.5668 6.1206 6.1206 6.1580 6.1580 6.6028 6.6028 6.9842 6.9842 9.6541 9.6541 10.0975 10.0975 10.1142 10.1142 11.8478 11.8478 13.2294 13.2294 13.2829 13.2830 k = 0.5239 0.2006 0.0960 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5010 -18.5010 -12.3977 -12.3977 -11.8421 -11.8421 -10.6328 -10.6328 -10.6301 -10.6301 -10.4681 -10.4681 -10.4562 -10.4562 -5.1074 -5.1074 -3.1981 -3.1981 -3.0705 -3.0705 -0.2798 -0.2798 0.6178 0.6178 1.2995 1.2995 1.3471 1.3471 2.0233 2.0233 2.0408 2.0408 2.2548 2.2548 2.9137 2.9137 3.8040 3.8040 3.8516 3.8516 4.7590 4.7590 4.7767 4.7767 5.5486 5.5486 5.5746 5.5746 6.1303 6.1303 6.1646 6.1646 6.6130 6.6130 6.9935 6.9935 9.6453 9.6453 10.0946 10.0946 10.1055 10.1055 11.8399 11.8399 13.2577 13.2577 13.2898 13.2898 k = 0.5159 0.2078 0.1124 ( 9736 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5012 -18.5012 -12.4006 -12.4006 -11.8401 -11.8401 -10.6332 -10.6332 -10.6316 -10.6316 -10.4647 -10.4647 -10.4544 -10.4544 -5.1078 -5.1078 -3.1995 -3.1995 -3.0699 -3.0699 -0.2862 -0.2862 0.6223 0.6223 1.2957 1.2957 1.3432 1.3432 2.0295 2.0295 2.0376 2.0376 2.2450 2.2450 2.9277 2.9277 3.7956 3.7956 3.8341 3.8341 4.7667 4.7667 4.7756 4.7756 5.5558 5.5558 5.5808 5.5808 6.1367 6.1367 6.1698 6.1698 6.6204 6.6204 7.0002 7.0002 9.6390 9.6390 10.0920 10.0920 10.0995 10.0995 11.8342 11.8342 13.2786 13.2786 13.2940 13.2940 k = 0.5080 0.2149 0.1288 ( 9738 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5013 -18.5013 -12.4023 -12.4023 -11.8389 -11.8389 -10.6336 -10.6336 -10.6324 -10.6324 -10.4629 -10.4629 -10.4531 -10.4531 -5.1081 -5.1081 -3.2003 -3.2003 -3.0696 -3.0696 -0.2900 -0.2900 0.6251 0.6251 1.2932 1.2932 1.3410 1.3410 2.0335 2.0335 2.0357 2.0357 2.2388 2.2388 2.9365 2.9365 3.7888 3.7888 3.8248 3.8248 4.7706 4.7706 4.7756 4.7756 5.5600 5.5600 5.5847 5.5847 6.1403 6.1403 6.1732 6.1732 6.6249 6.6249 7.0042 7.0042 9.6351 9.6351 10.0900 10.0900 10.0964 10.0964 11.8308 11.8308 13.2909 13.2909 13.2967 13.2967 k = 0.5000 0.2221 0.1452 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5013 -18.5013 -12.4029 -12.4029 -11.8385 -11.8385 -10.6339 -10.6339 -10.6326 -10.6326 -10.4623 -10.4623 -10.4526 -10.4526 -5.1082 -5.1082 -3.2006 -3.2006 -3.0695 -3.0695 -0.2913 -0.2913 0.6260 0.6260 1.2924 1.2924 1.3403 1.3403 2.0347 2.0347 2.0354 2.0354 2.2366 2.2366 2.9395 2.9395 3.7862 3.7862 3.8220 3.8220 4.7715 4.7715 4.7760 4.7760 5.5613 5.5613 5.5861 5.5861 6.1414 6.1414 6.1744 6.1744 6.6265 6.6265 7.0055 7.0055 9.6338 9.6338 10.0891 10.0891 10.0955 10.0955 11.8297 11.8297 13.2941 13.2941 13.2985 13.2985 k = 0.5000 0.2221 0.1452 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5013 -18.5013 -12.4029 -12.4029 -11.8385 -11.8385 -10.6339 -10.6339 -10.6326 -10.6326 -10.4623 -10.4623 -10.4526 -10.4526 -5.1082 -5.1082 -3.2006 -3.2006 -3.0695 -3.0695 -0.2913 -0.2913 0.6260 0.6260 1.2924 1.2924 1.3403 1.3403 2.0347 2.0347 2.0354 2.0354 2.2366 2.2366 2.9395 2.9395 3.7862 3.7862 3.8220 3.8220 4.7715 4.7715 4.7760 4.7760 5.5613 5.5613 5.5861 5.5861 6.1414 6.1414 6.1744 6.1744 6.6265 6.6265 7.0055 7.0055 9.6338 9.6338 10.0891 10.0891 10.0955 10.0955 11.8297 11.8297 13.2941 13.2941 13.2985 13.2985 k = 0.4828 0.2145 0.1402 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5014 -18.5014 -12.4028 -12.4028 -11.8385 -11.8385 -10.6341 -10.6341 -10.6328 -10.6328 -10.4621 -10.4621 -10.4524 -10.4524 -5.1082 -5.1082 -3.2006 -3.2006 -3.0696 -3.0696 -0.2909 -0.2909 0.6259 0.6259 1.2917 1.2917 1.3393 1.3393 2.0355 2.0355 2.0365 2.0365 2.2318 2.2318 2.9449 2.9449 3.7848 3.7848 3.8205 3.8205 4.7730 4.7730 4.7775 4.7775 5.5623 5.5623 5.5871 5.5871 6.1404 6.1404 6.1734 6.1734 6.6265 6.6265 7.0055 7.0055 9.6337 9.6337 10.0889 10.0889 10.0953 10.0953 11.8323 11.8323 13.2933 13.2933 13.2978 13.2978 k = 0.4655 0.2068 0.1352 ( 9723 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5014 -18.5014 -12.4026 -12.4026 -11.8385 -11.8385 -10.6347 -10.6347 -10.6335 -10.6335 -10.4614 -10.4614 -10.4517 -10.4517 -5.1083 -5.1083 -3.2004 -3.2004 -3.0701 -3.0701 -0.2898 -0.2898 0.6254 0.6254 1.2895 1.2895 1.3362 1.3362 2.0381 2.0381 2.0399 2.0399 2.2177 2.2177 2.9604 2.9604 3.7808 3.7808 3.8161 3.8161 4.7773 4.7773 4.7820 4.7820 5.5651 5.5651 5.5903 5.5903 6.1374 6.1374 6.1703 6.1703 6.6266 6.6266 7.0055 7.0055 9.6334 9.6334 10.0881 10.0881 10.0946 10.0946 11.8403 11.8403 13.2908 13.2908 13.2956 13.2956 k = 0.4483 0.1991 0.1302 ( 9729 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5015 -18.5015 -12.4023 -12.4023 -11.8385 -11.8385 -10.6358 -10.6358 -10.6345 -10.6345 -10.4603 -10.4603 -10.4506 -10.4506 -5.1084 -5.1084 -3.2001 -3.2001 -3.0707 -3.0707 -0.2880 -0.2880 0.6247 0.6247 1.2859 1.2859 1.3313 1.3313 2.0423 2.0423 2.0456 2.0456 2.1956 2.1956 2.9848 2.9848 3.7741 3.7741 3.8088 3.8088 4.7844 4.7844 4.7893 4.7893 5.5698 5.5698 5.5954 5.5954 6.1324 6.1324 6.1651 6.1651 6.6269 6.6269 7.0055 7.0055 9.6327 9.6327 10.0868 10.0868 10.0934 10.0934 11.8535 11.8535 13.2868 13.2868 13.2921 13.2921 k = 0.4310 0.1915 0.1252 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5016 -18.5016 -12.4019 -12.4019 -11.8385 -11.8385 -10.6372 -10.6372 -10.6360 -10.6360 -10.4588 -10.4588 -10.4490 -10.4490 -5.1086 -5.1086 -3.1998 -3.1998 -3.0717 -3.0717 -0.2855 -0.2855 0.6236 0.6236 1.2810 1.2810 1.3246 1.3246 2.0480 2.0480 2.0532 2.0532 2.1670 2.1670 3.0167 3.0167 3.7651 3.7651 3.7989 3.7989 4.7941 4.7941 4.7993 4.7993 5.5762 5.5762 5.6025 5.6025 6.1254 6.1254 6.1579 6.1579 6.6271 6.6271 7.0055 7.0055 9.6319 9.6319 10.0851 10.0851 10.0918 10.0918 11.8718 11.8718 13.2813 13.2813 13.2873 13.2873 k = 0.4138 0.1838 0.1202 ( 9756 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5017 -18.5017 -12.4014 -12.4014 -11.8385 -11.8385 -10.6390 -10.6390 -10.6378 -10.6378 -10.4570 -10.4570 -10.4471 -10.4471 -5.1088 -5.1088 -3.1993 -3.1993 -3.0728 -3.0728 -0.2823 -0.2823 0.6223 0.6223 1.2749 1.2749 1.3162 1.3162 2.0551 2.0551 2.0628 2.0628 2.1337 2.1337 3.0543 3.0543 3.7538 3.7538 3.7866 3.7866 4.8063 4.8063 4.8118 4.8118 5.5844 5.5844 5.6116 5.6116 6.1164 6.1164 6.1487 6.1487 6.6275 6.6275 7.0055 7.0055 9.6309 9.6309 10.0829 10.0829 10.0897 10.0897 11.8951 11.8951 13.2745 13.2745 13.2813 13.2813 k = 0.3966 0.1762 0.1151 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5018 -18.5018 -12.4007 -12.4007 -11.8385 -11.8385 -10.6412 -10.6412 -10.6400 -10.6400 -10.4548 -10.4548 -10.4449 -10.4449 -5.1091 -5.1091 -3.1987 -3.1987 -3.0742 -3.0742 -0.2784 -0.2784 0.6206 0.6206 1.2678 1.2678 1.3065 1.3065 2.0630 2.0630 2.0740 2.0740 2.0974 2.0974 3.0962 3.0962 3.7406 3.7406 3.7721 3.7721 4.8208 4.8208 4.8267 4.8267 5.5942 5.5942 5.6224 5.6224 6.1056 6.1056 6.1376 6.1376 6.6279 6.6279 7.0055 7.0055 9.6298 9.6298 10.0802 10.0802 10.0872 10.0872 11.9230 11.9230 13.2665 13.2665 13.2742 13.2742 k = 0.3793 0.1685 0.1101 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5020 -18.5020 -12.4000 -12.4000 -11.8385 -11.8385 -10.6435 -10.6435 -10.6424 -10.6424 -10.4523 -10.4523 -10.4424 -10.4424 -5.1094 -5.1094 -3.1981 -3.1981 -3.0759 -3.0759 -0.2739 -0.2739 0.6187 0.6187 1.2597 1.2597 1.2956 1.2956 2.0551 2.0551 2.0758 2.0758 2.0867 2.0867 3.1412 3.1412 3.7257 3.7257 3.7559 3.7559 4.8373 4.8373 4.8436 4.8436 5.6055 5.6055 5.6348 5.6348 6.0928 6.0928 6.1245 6.1245 6.6284 6.6284 7.0055 7.0055 9.6286 9.6286 10.0771 10.0771 10.0844 10.0844 11.9554 11.9554 13.2577 13.2577 13.2663 13.2663 k = 0.3621 0.1609 0.1051 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5022 -18.5022 -12.3992 -12.3992 -11.8385 -11.8385 -10.6461 -10.6461 -10.6450 -10.6450 -10.4496 -10.4496 -10.4396 -10.4396 -5.1097 -5.1097 -3.1974 -3.1974 -3.0777 -3.0777 -0.2688 -0.2688 0.6165 0.6165 1.2508 1.2508 1.2837 1.2837 2.0159 2.0159 2.0851 2.0851 2.1005 2.1005 3.1884 3.1884 3.7094 3.7094 3.7381 3.7381 4.8558 4.8558 4.8625 4.8625 5.6181 5.6181 5.6487 5.6487 6.0783 6.0783 6.1095 6.1095 6.6290 6.6290 7.0055 7.0055 9.6272 9.6272 10.0736 10.0736 10.0811 10.0811 11.9920 11.9920 13.2480 13.2481 13.2576 13.2576 k = 0.3448 0.1532 0.1001 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5023 -18.5023 -12.3982 -12.3982 -11.8384 -11.8384 -10.6489 -10.6489 -10.6478 -10.6478 -10.4467 -10.4467 -10.4367 -10.4367 -5.1101 -5.1101 -3.1966 -3.1966 -3.0796 -3.0796 -0.2632 -0.2632 0.6141 0.6141 1.2413 1.2413 1.2710 1.2710 1.9748 1.9748 2.0965 2.0965 2.1154 2.1154 3.2370 3.2370 3.6920 3.6920 3.7191 3.7191 4.8759 4.8759 4.8830 4.8830 5.6320 5.6320 5.6639 5.6639 6.0619 6.0619 6.0928 6.0928 6.6295 6.6295 7.0055 7.0055 9.6259 9.6259 10.0698 10.0698 10.0776 10.0776 12.0323 12.0323 13.2379 13.2379 13.2479 13.2479 k = 0.3276 0.1455 0.0951 ( 9711 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5026 -18.5026 -12.3973 -12.3973 -11.8384 -11.8384 -10.6518 -10.6518 -10.6508 -10.6508 -10.4437 -10.4437 -10.4336 -10.4336 -5.1105 -5.1105 -3.1957 -3.1957 -3.0818 -3.0818 -0.2570 -0.2570 0.6113 0.6113 1.2313 1.2313 1.2578 1.2578 1.9335 1.9335 2.1087 2.1087 2.1310 2.1310 3.2863 3.2863 3.6738 3.6738 3.6992 3.6992 4.8976 4.8976 4.9050 4.9050 5.6468 5.6468 5.6802 5.6802 6.0439 6.0439 6.0743 6.0743 6.6301 6.6301 7.0055 7.0055 9.6245 9.6245 10.0656 10.0656 10.0737 10.0737 12.0760 12.0760 13.2167 13.2167 13.2280 13.2362 k = 0.3103 0.1379 0.0901 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5028 -18.5028 -12.3962 -12.3962 -11.8384 -11.8384 -10.6547 -10.6547 -10.6538 -10.6538 -10.4406 -10.4406 -10.4305 -10.4305 -5.1110 -5.1110 -3.1948 -3.1948 -3.0840 -3.0840 -0.2504 -0.2504 0.6084 0.6084 1.2210 1.2210 1.2443 1.2443 1.8925 1.8925 2.1214 2.1214 2.1471 2.1471 3.3358 3.3358 3.6550 3.6550 3.6787 3.6787 4.9206 4.9206 4.9284 4.9284 5.6626 5.6626 5.6975 5.6975 6.0242 6.0242 6.0541 6.0541 6.6307 6.6307 7.0055 7.0055 9.6232 9.6232 10.0612 10.0612 10.0697 10.0697 12.1226 12.1226 13.1560 13.1560 13.2167 13.2265 k = 0.2931 0.1302 0.0851 ( 9734 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8803 -25.8803 -25.8222 -25.8222 -18.5030 -18.5030 -12.3952 -12.3952 -11.8384 -11.8384 -10.6577 -10.6577 -10.6568 -10.6568 -10.4375 -10.4375 -10.4272 -10.4272 -5.1114 -5.1114 -3.1938 -3.1938 -3.0863 -3.0863 -0.2434 -0.2434 0.6052 0.6052 1.2105 1.2105 1.2306 1.2306 1.8522 1.8522 2.1345 2.1345 2.1637 2.1637 3.3851 3.3851 3.6359 3.6359 3.6578 3.6578 4.9448 4.9448 4.9530 4.9530 5.6789 5.6789 5.7154 5.7154 6.0030 6.0030 6.0324 6.0324 6.6313 6.6313 7.0055 7.0055 9.6220 9.6220 10.0565 10.0565 10.0654 10.0654 12.1715 12.1715 13.0887 13.0887 13.2057 13.2142 k = 0.2759 0.1226 0.0801 ( 9743 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8803 -25.8803 -25.8222 -25.8222 -18.5033 -18.5033 -12.3940 -12.3940 -11.8384 -11.8384 -10.6607 -10.6607 -10.6599 -10.6599 -10.4343 -10.4343 -10.4240 -10.4240 -5.1119 -5.1119 -3.1929 -3.1929 -3.0887 -3.0887 -0.2361 -0.2361 0.6018 0.6018 1.1999 1.1999 1.2169 1.2169 1.8130 1.8130 2.1479 2.1479 2.1804 2.1804 3.4336 3.4336 3.6167 3.6167 3.6368 3.6368 4.9702 4.9702 4.9786 4.9786 5.6958 5.6958 5.7337 5.7337 5.9804 5.9804 6.0092 6.0092 6.6319 6.6319 7.0055 7.0055 9.6208 9.6208 10.0517 10.0517 10.0609 10.0609 12.2219 12.2219 13.0175 13.0175 13.1951 13.2038 k = 0.2586 0.1149 0.0751 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8803 -25.8803 -25.8222 -25.8222 -18.5035 -18.5035 -12.3929 -12.3929 -11.8384 -11.8384 -10.6637 -10.6637 -10.6630 -10.6630 -10.4312 -10.4312 -10.4208 -10.4208 -5.1124 -5.1124 -3.1919 -3.1919 -3.0912 -3.0912 -0.2286 -0.2286 0.5983 0.5983 1.1894 1.1894 1.2034 1.2034 1.7750 1.7750 2.1612 2.1612 2.1970 2.1970 3.4809 3.4809 3.5979 3.5979 3.6159 3.6159 4.9965 4.9965 5.0053 5.0053 5.7128 5.7128 5.7522 5.7522 5.9563 5.9563 5.9847 5.9847 6.6325 6.6325 7.0055 7.0055 9.6196 9.6196 10.0468 10.0468 10.0564 10.0564 12.2727 12.2727 12.9455 12.9455 13.1842 13.1861 k = 0.2414 0.1072 0.0701 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8803 -25.8803 -25.8222 -25.8222 -18.5038 -18.5038 -12.3918 -12.3918 -11.8384 -11.8384 -10.6667 -10.6667 -10.6659 -10.6659 -10.4281 -10.4281 -10.4177 -10.4177 -5.1129 -5.1129 -3.1908 -3.1908 -3.0936 -3.0936 -0.2208 -0.2208 0.5946 0.5946 1.1790 1.1790 1.1901 1.1901 1.7386 1.7386 2.1745 2.1745 2.2136 2.2136 3.5259 3.5259 3.5803 3.5803 3.5952 3.5952 5.0238 5.0238 5.0330 5.0330 5.7299 5.7299 5.7705 5.7705 5.9310 5.9310 5.9590 5.9590 6.6331 6.6331 7.0055 7.0055 9.6186 9.6186 10.0418 10.0418 10.0518 10.0518 12.3222 12.3222 12.8760 12.8760 13.1744 13.1789 k = 0.2241 0.0996 0.0651 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8803 -25.8803 -25.8222 -25.8222 -18.5040 -18.5040 -12.3906 -12.3906 -11.8383 -11.8383 -10.6695 -10.6695 -10.6688 -10.6688 -10.4251 -10.4251 -10.4146 -10.4146 -5.1133 -5.1133 -3.1898 -3.1898 -3.0960 -3.0960 -0.2130 -0.2130 0.5909 0.5909 1.1689 1.1689 1.1773 1.1773 1.7039 1.7039 2.1876 2.1876 2.2297 2.2297 3.5529 3.5529 3.5751 3.5751 3.5797 3.5797 5.0519 5.0519 5.0614 5.0614 5.7466 5.7466 5.7883 5.7883 5.9047 5.9047 5.9325 5.9325 6.6337 6.6337 7.0055 7.0055 9.6177 9.6177 10.0368 10.0368 10.0472 10.0472 12.3673 12.3673 12.8135 12.8135 13.1636 13.1646 k = 0.2069 0.0919 0.0601 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8803 -25.8803 -25.8222 -25.8222 -18.5042 -18.5042 -12.3895 -12.3895 -11.8383 -11.8383 -10.6722 -10.6722 -10.6716 -10.6716 -10.4223 -10.4223 -10.4117 -10.4117 -5.1138 -5.1138 -3.1888 -3.1888 -3.0984 -3.0984 -0.2051 -0.2051 0.5871 0.5871 1.1592 1.1592 1.1650 1.1650 1.6711 1.6711 2.2003 2.2003 2.2454 2.2454 3.5398 3.5398 3.5557 3.5557 3.6179 3.6179 5.0808 5.0808 5.0907 5.0907 5.7627 5.7627 5.8048 5.8048 5.8776 5.8776 5.9058 5.9058 6.6342 6.6342 7.0055 7.0055 9.6168 9.6168 10.0319 10.0319 10.0426 10.0426 12.4022 12.4022 12.7648 12.7648 13.1541 13.1581 k = 0.1897 0.0843 0.0551 ( 9764 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5045 -18.5045 -12.3884 -12.3884 -11.8383 -11.8383 -10.6748 -10.6748 -10.6742 -10.6742 -10.4196 -10.4196 -10.4089 -10.4089 -5.1143 -5.1143 -3.1879 -3.1879 -3.1006 -3.1006 -0.1974 -0.1974 0.5832 0.5832 1.1500 1.1500 1.1534 1.1534 1.6403 1.6403 2.2125 2.2125 2.2605 2.2605 3.5235 3.5235 3.5371 3.5371 3.6578 3.6578 5.1104 5.1104 5.1207 5.1207 5.7772 5.7772 5.8176 5.8176 5.8504 5.8504 5.8810 5.8810 6.6347 6.6347 7.0055 7.0055 9.6160 9.6160 10.0271 10.0271 10.0382 10.0382 12.4180 12.4180 12.7395 12.7395 13.1452 13.1458 k = 0.1724 0.0766 0.0501 ( 9758 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5047 -18.5047 -12.3874 -12.3874 -11.8383 -11.8383 -10.6772 -10.6772 -10.6767 -10.6767 -10.4170 -10.4170 -10.4063 -10.4063 -5.1147 -5.1147 -3.1870 -3.1870 -3.1028 -3.1028 -0.1899 -0.1899 0.5795 0.5795 1.1413 1.1413 1.1424 1.1424 1.6118 1.6118 2.2242 2.2242 2.2749 2.2749 3.5077 3.5077 3.5194 3.5194 3.6957 3.6957 5.1406 5.1406 5.1514 5.1514 5.7867 5.7867 5.8182 5.8182 5.8267 5.8267 5.8667 5.8667 6.6351 6.6351 7.0054 7.0054 9.6153 9.6153 10.0224 10.0224 10.0339 10.0339 12.4085 12.4085 12.7447 12.7447 13.1367 13.1394 k = 0.1552 0.0689 0.0451 ( 9758 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5049 -18.5049 -12.3864 -12.3864 -11.8383 -11.8383 -10.6795 -10.6795 -10.6790 -10.6790 -10.4146 -10.4146 -10.4038 -10.4038 -5.1151 -5.1151 -3.1861 -3.1861 -3.1049 -3.1049 -0.1826 -0.1826 0.5758 0.5758 1.1323 1.1323 1.1333 1.1333 1.5856 1.5856 2.2351 2.2351 2.2883 2.2883 3.4929 3.4929 3.5030 3.5030 3.7310 3.7310 5.1714 5.1714 5.1828 5.1828 5.7765 5.7765 5.7985 5.7985 5.8210 5.8210 5.8709 5.8709 6.6356 6.6356 7.0054 7.0054 9.6147 9.6147 10.0180 10.0180 10.0298 10.0298 12.3788 12.3788 12.7755 12.7755 13.1303 13.1348 k = 0.1379 0.0613 0.0401 ( 9764 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5051 -18.5051 -12.3855 -12.3855 -11.8383 -11.8383 -10.6815 -10.6815 -10.6811 -10.6811 -10.4125 -10.4125 -10.4016 -10.4016 -5.1155 -5.1155 -3.1853 -3.1853 -3.1068 -3.1068 -0.1758 -0.1758 0.5723 0.5723 1.1230 1.1230 1.1259 1.1259 1.5618 1.5618 2.2452 2.2452 2.3007 2.3007 3.4792 3.4792 3.4879 3.4879 3.7634 3.7634 5.2027 5.2027 5.2146 5.2146 5.7499 5.7499 5.7700 5.7700 5.8300 5.8300 5.8821 5.8821 6.6359 6.6359 7.0053 7.0053 9.6141 9.6141 10.0139 10.0139 10.0261 10.0261 12.3394 12.3394 12.8219 12.8219 13.1222 13.1240 k = 0.1207 0.0536 0.0350 ( 9776 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5053 -18.5053 -12.3846 -12.3846 -11.8383 -11.8383 -10.6834 -10.6834 -10.6830 -10.6830 -10.4105 -10.4105 -10.3996 -10.3996 -5.1159 -5.1159 -3.1845 -3.1845 -3.1085 -3.1085 -0.1694 -0.1694 0.5690 0.5690 1.1147 1.1147 1.1192 1.1192 1.5406 1.5406 2.2543 2.2543 2.3120 2.3120 3.4668 3.4668 3.4741 3.4741 3.7925 3.7925 5.2344 5.2344 5.2470 5.2470 5.7195 5.7195 5.7387 5.7387 5.8409 5.8409 5.8940 5.8940 6.6362 6.6362 7.0053 7.0053 9.6136 9.6136 10.0102 10.0102 10.0226 10.0226 12.2980 12.2980 12.8766 12.8766 13.1175 13.1199 k = 0.1034 0.0460 0.0300 ( 9776 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5054 -18.5054 -12.3839 -12.3839 -11.8383 -11.8383 -10.6850 -10.6850 -10.6846 -10.6846 -10.4088 -10.4088 -10.3979 -10.3979 -5.1162 -5.1162 -3.1839 -3.1839 -3.1100 -3.1100 -0.1637 -0.1637 0.5660 0.5660 1.1074 1.1074 1.1133 1.1133 1.5220 1.5220 2.2625 2.2625 2.3220 2.3220 3.4558 3.4558 3.4620 3.4620 3.8183 3.8183 5.2664 5.2664 5.2797 5.2797 5.6879 5.6879 5.7063 5.7063 5.8513 5.8513 5.9052 5.9052 6.6365 6.6365 7.0052 7.0052 9.6132 9.6132 10.0068 10.0068 10.0195 10.0195 12.2586 12.2586 12.9358 12.9358 13.1102 13.1136 k = 0.0862 0.0383 0.0250 ( 9779 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5056 -18.5056 -12.3832 -12.3832 -11.8383 -11.8383 -10.6864 -10.6864 -10.6860 -10.6860 -10.4073 -10.4073 -10.3964 -10.3964 -5.1165 -5.1165 -3.1833 -3.1833 -3.1113 -3.1113 -0.1587 -0.1587 0.5634 0.5634 1.1011 1.1011 1.1083 1.1083 1.5061 1.5061 2.2695 2.2695 2.3307 2.3307 3.4464 3.4464 3.4515 3.4515 3.8405 3.8405 5.2986 5.2986 5.3126 5.3126 5.6559 5.6559 5.6734 5.6734 5.8605 5.8605 5.9151 5.9151 6.6367 6.6367 7.0052 7.0052 9.6128 9.6128 10.0039 10.0039 10.0168 10.0168 12.2233 12.2233 12.9974 12.9974 13.1050 13.1050 k = 0.0690 0.0306 0.0200 ( 9773 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5057 -18.5057 -12.3827 -12.3827 -11.8383 -11.8383 -10.6876 -10.6876 -10.6872 -10.6872 -10.4061 -10.4061 -10.3951 -10.3951 -5.1167 -5.1167 -3.1828 -3.1828 -3.1125 -3.1125 -0.1544 -0.1544 0.5611 0.5611 1.0960 1.0960 1.1041 1.1041 1.4930 1.4930 2.2754 2.2754 2.3380 2.3380 3.4385 3.4385 3.4427 3.4427 3.8589 3.8589 5.3306 5.3306 5.3455 5.3455 5.6239 5.6239 5.6403 5.6403 5.8683 5.8683 5.9235 5.9235 6.6369 6.6369 7.0051 7.0051 9.6125 9.6125 10.0014 10.0014 10.0145 10.0145 12.1933 12.1933 13.0603 13.0603 13.1011 13.1011 k = 0.0517 0.0230 0.0150 ( 9773 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5058 -18.5058 -12.3823 -12.3823 -11.8383 -11.8383 -10.6885 -10.6885 -10.6881 -10.6881 -10.4052 -10.4052 -10.3941 -10.3941 -5.1169 -5.1169 -3.1824 -3.1824 -3.1133 -3.1133 -0.1510 -0.1510 0.5593 0.5593 1.0919 1.0919 1.1009 1.1009 1.4828 1.4828 2.2800 2.2800 2.3437 2.3437 3.4323 3.4323 3.4359 3.4359 3.8733 3.8733 5.3618 5.3618 5.3780 5.3780 5.5925 5.5925 5.6077 5.6077 5.8744 5.8744 5.9301 5.9301 6.6371 6.6371 7.0051 7.0051 9.6122 9.6122 9.9994 9.9994 10.0127 10.0127 12.1695 12.1695 13.0980 13.0980 13.1175 13.1175 k = 0.0345 0.0153 0.0100 ( 9764 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3820 -12.3820 -11.8383 -11.8383 -10.6891 -10.6891 -10.6887 -10.6887 -10.4045 -10.4045 -10.3934 -10.3934 -5.1170 -5.1170 -3.1822 -3.1822 -3.1140 -3.1140 -0.1485 -0.1485 0.5579 0.5579 1.0890 1.0890 1.0985 1.0985 1.4755 1.4755 2.2834 2.2834 2.3478 2.3478 3.4279 3.4279 3.4309 3.4309 3.8838 3.8838 5.3912 5.3912 5.4089 5.4089 5.5630 5.5630 5.5766 5.5766 5.8789 5.8789 5.9349 5.9349 6.6372 6.6372 7.0050 7.0050 9.6120 9.6120 9.9980 9.9980 10.0114 10.0114 12.1521 12.1521 13.0958 13.0958 13.1155 13.1155 k = 0.0172 0.0077 0.0050 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3818 -12.3818 -11.8383 -11.8383 -10.6895 -10.6895 -10.6891 -10.6891 -10.4041 -10.4041 -10.3930 -10.3930 -5.1171 -5.1171 -3.1820 -3.1820 -3.1143 -3.1143 -0.1470 -0.1470 0.5571 0.5571 1.0872 1.0872 1.0971 1.0971 1.4711 1.4711 2.2854 2.2854 2.3503 2.3503 3.4252 3.4252 3.4279 3.4279 3.8900 3.8900 5.4154 5.4154 5.4352 5.4352 5.5387 5.5387 5.5502 5.5502 5.8816 5.8816 5.9379 5.9379 6.6372 6.6372 7.0050 7.0050 9.6119 9.6119 9.9972 9.9972 10.0106 10.0106 12.1416 12.1416 13.0945 13.0945 13.1142 13.1142 k = 0.0000 0.0000 0.0000 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3817 -12.3817 -11.8383 -11.8383 -10.6896 -10.6896 -10.6893 -10.6893 -10.4039 -10.4039 -10.3929 -10.3929 -5.1172 -5.1172 -3.1819 -3.1819 -3.1145 -3.1145 -0.1465 -0.1465 0.5569 0.5569 1.0866 1.0866 1.0966 1.0966 1.4696 1.4696 2.2861 2.2861 2.3512 2.3512 3.4243 3.4243 3.4269 3.4269 3.8921 3.8921 5.4260 5.4260 5.4472 5.4472 5.5281 5.5281 5.5380 5.5380 5.8825 5.8825 5.9388 5.9388 6.6373 6.6373 7.0050 7.0050 9.6119 9.6119 9.9969 9.9969 10.0104 10.0104 12.1381 12.1381 13.0940 13.0940 13.1138 13.1138 k = 0.0000 0.0000 0.0000 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3817 -12.3817 -11.8383 -11.8383 -10.6896 -10.6896 -10.6893 -10.6893 -10.4039 -10.4039 -10.3929 -10.3929 -5.1172 -5.1172 -3.1819 -3.1819 -3.1145 -3.1145 -0.1465 -0.1465 0.5569 0.5569 1.0866 1.0866 1.0966 1.0966 1.4696 1.4696 2.2861 2.2861 2.3512 2.3512 3.4243 3.4243 3.4269 3.4269 3.8921 3.8921 5.4260 5.4260 5.4472 5.4472 5.5281 5.5281 5.5380 5.5380 5.8825 5.8825 5.9388 5.9388 6.6373 6.6373 7.0050 7.0050 9.6119 9.6119 9.9969 9.9969 10.0104 10.0104 12.1381 12.1381 13.0940 13.0940 13.1138 13.1138 k = 0.0079-0.0072-0.0163 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5059 -18.5059 -12.3813 -12.3813 -11.8385 -11.8385 -10.6895 -10.6895 -10.6891 -10.6891 -10.4044 -10.4044 -10.3933 -10.3933 -5.1171 -5.1171 -3.1818 -3.1818 -3.1146 -3.1146 -0.1451 -0.1451 0.5559 0.5559 1.0879 1.0879 1.0979 1.0979 1.4709 1.4709 2.2854 2.2854 2.3504 2.3504 3.4218 3.4218 3.4270 3.4270 3.8972 3.8972 5.4241 5.4241 5.4452 5.4452 5.5285 5.5285 5.5382 5.5382 5.8809 5.8809 5.9371 5.9371 6.6354 6.6354 7.0041 7.0041 9.6130 9.6130 9.9979 9.9979 10.0114 10.0114 12.1407 12.1407 13.0768 13.0768 13.1074 13.1074 k = 0.0159-0.0143-0.0327 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5057 -18.5057 -12.3801 -12.3801 -11.8393 -11.8393 -10.6894 -10.6894 -10.6884 -10.6884 -10.4060 -10.4060 -10.3945 -10.3945 -5.1169 -5.1169 -3.1813 -3.1813 -3.1150 -3.1150 -0.1411 -0.1411 0.5530 0.5530 1.0917 1.0917 1.1020 1.1020 1.4750 1.4750 2.2833 2.2833 2.3480 2.3480 3.4121 3.4121 3.4298 3.4298 3.9118 3.9118 5.4180 5.4180 5.4398 5.4398 5.5295 5.5295 5.5387 5.5387 5.8758 5.8758 5.9322 5.9322 6.6299 6.6299 7.0012 7.0012 9.6164 9.6164 10.0006 10.0006 10.0146 10.0146 12.1482 12.1482 13.0272 13.0272 13.1060 13.1060 k = 0.0238-0.0215-0.0490 ( 9759 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5055 -18.5055 -12.3780 -12.3780 -11.8407 -11.8407 -10.6894 -10.6894 -10.6869 -10.6869 -10.4090 -10.4090 -10.3960 -10.3960 -5.1167 -5.1167 -3.1805 -3.1805 -3.1157 -3.1157 -0.1343 -0.1343 0.5483 0.5483 1.0975 1.0975 1.1090 1.1090 1.4818 1.4818 2.2795 2.2795 2.3445 2.3445 3.3970 3.3970 3.4348 3.4348 3.9348 3.9348 5.4066 5.4066 5.4326 5.4326 5.5304 5.5304 5.5395 5.5395 5.8667 5.8667 5.9247 5.9247 6.6208 6.6208 6.9965 6.9965 9.6220 9.6220 10.0046 10.0046 10.0203 10.0203 12.1607 12.1607 12.9669 12.9669 13.1069 13.1069 k = 0.0317-0.0287-0.0654 ( 9759 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8222 -25.8222 -18.5053 -18.5053 -12.3751 -12.3751 -11.8425 -11.8425 -10.6894 -10.6894 -10.6849 -10.6849 -10.4138 -10.4138 -10.3975 -10.3975 -5.1163 -5.1163 -3.1795 -3.1795 -3.1166 -3.1166 -0.1248 -0.1248 0.5420 0.5420 1.1051 1.1051 1.1192 1.1192 1.4912 1.4912 2.2737 2.2737 2.3401 2.3401 3.3779 3.3779 3.4418 3.4418 3.9647 3.9647 5.3896 5.3896 5.4247 5.4247 5.5307 5.5307 5.5406 5.5406 5.8531 5.8531 5.9154 5.9154 6.6085 6.6085 6.9899 6.9899 9.6296 9.6296 10.0096 10.0096 10.0288 10.0288 12.1780 12.1780 12.9034 12.9034 13.1086 13.1086 k = 0.0396-0.0358-0.0817 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8223 -25.8223 -18.5049 -18.5049 -12.3714 -12.3714 -11.8449 -11.8449 -10.6893 -10.6893 -10.6823 -10.6823 -10.4204 -10.4204 -10.3990 -10.3990 -5.1159 -5.1159 -3.1781 -3.1781 -3.1177 -3.1177 -0.1128 -0.1128 0.5343 0.5343 1.1143 1.1143 1.1324 1.1324 1.5032 1.5032 2.2657 2.2657 2.3356 2.3356 3.3562 3.3562 3.4507 3.4507 4.0001 4.0001 5.3675 5.3675 5.4160 5.4160 5.5301 5.5301 5.5418 5.5418 5.8343 5.8343 5.9050 5.9050 6.5931 6.5931 6.9814 6.9814 9.6393 9.6393 10.0152 10.0152 10.0400 10.0400 12.1998 12.1998 12.8391 12.8391 13.1108 13.1108 k = 0.0476-0.0430-0.0981 ( 9763 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8223 -25.8223 -18.5045 -18.5045 -12.3668 -12.3668 -11.8477 -11.8477 -10.6893 -10.6893 -10.6792 -10.6792 -10.4289 -10.4289 -10.4004 -10.4004 -5.1153 -5.1153 -3.1764 -3.1764 -3.1191 -3.1191 -0.0983 -0.0983 0.5253 0.5253 1.1252 1.1252 1.1484 1.1484 1.5177 1.5177 2.2550 2.2550 2.3312 2.3312 3.3331 3.3331 3.4615 3.4615 4.0397 4.0397 5.3405 5.3405 5.4065 5.4065 5.5285 5.5285 5.5427 5.5427 5.8103 5.8103 5.8942 5.8942 6.5750 6.5750 6.9711 6.9711 9.6509 9.6509 10.0217 10.0217 10.0536 10.0536 12.2259 12.2259 12.7748 12.7748 13.1135 13.1135 k = 0.0555-0.0501-0.1144 ( 9759 PWs) bands (ev): -49.7716 -49.7716 -26.5039 -26.5039 -25.8802 -25.8802 -25.8224 -25.8224 -18.5040 -18.5040 -12.3615 -12.3615 -11.8509 -11.8509 -10.6892 -10.6892 -10.6756 -10.6756 -10.4390 -10.4390 -10.4018 -10.4018 -5.1146 -5.1146 -3.1745 -3.1745 -3.1206 -3.1206 -0.0815 -0.0815 0.5153 0.5153 1.1378 1.1378 1.1667 1.1667 1.5347 1.5347 2.2418 2.2418 2.3273 2.3273 3.3093 3.3093 3.4739 3.4739 4.0825 4.0825 5.3091 5.3091 5.3962 5.3962 5.5259 5.5259 5.5432 5.5432 5.7813 5.7813 5.8830 5.8830 6.5545 6.5545 6.9589 6.9589 9.6642 9.6642 10.0289 10.0289 10.0693 10.0693 12.2559 12.2559 12.7112 12.7112 13.1164 13.1164 k = 0.0634-0.0573-0.1308 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8224 -25.8224 -18.5034 -18.5034 -12.3554 -12.3554 -11.8546 -11.8546 -10.6891 -10.6891 -10.6715 -10.6715 -10.4506 -10.4506 -10.4033 -10.4033 -5.1139 -5.1139 -3.1723 -3.1723 -3.1223 -3.1223 -0.0624 -0.0624 0.5046 0.5046 1.1522 1.1522 1.1872 1.1872 1.5540 1.5540 2.2262 2.2262 2.3240 2.3240 3.2854 3.2854 3.4880 3.4880 4.1277 4.1277 5.2733 5.2733 5.3850 5.3850 5.5224 5.5224 5.5429 5.5429 5.7480 5.7480 5.8714 5.8714 6.5320 6.5320 6.9451 6.9451 9.6790 9.6790 10.0370 10.0370 10.0868 10.0868 12.2894 12.2894 12.6486 12.6486 13.1195 13.1195 k = 0.0714-0.0645-0.1471 ( 9761 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8224 -25.8224 -18.5028 -18.5028 -12.3486 -12.3486 -11.8587 -11.8587 -10.6889 -10.6889 -10.6670 -10.6670 -10.4637 -10.4637 -10.4050 -10.4050 -5.1131 -5.1131 -3.1699 -3.1699 -3.1241 -3.1241 -0.0412 -0.0412 0.4933 0.4933 1.1683 1.1683 1.2096 1.2096 1.5755 1.5755 2.2086 2.2086 2.3213 2.3213 3.2618 3.2618 3.5035 3.5035 4.1747 4.1747 5.2334 5.2334 5.3729 5.3729 5.5179 5.5179 5.5419 5.5419 5.7110 5.7110 5.8593 5.8593 6.5077 6.5077 6.9294 6.9294 9.6953 9.6953 10.0458 10.0458 10.1056 10.1056 12.3259 12.3259 12.5873 12.5873 13.1227 13.1227 k = 0.0793-0.0716-0.1635 ( 9753 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8225 -25.8225 -18.5021 -18.5021 -12.3410 -12.3410 -11.8631 -11.8631 -10.6887 -10.6887 -10.6620 -10.6620 -10.4782 -10.4782 -10.4068 -10.4068 -5.1121 -5.1121 -3.1673 -3.1673 -3.1260 -3.1260 -0.0181 -0.0181 0.4816 0.4816 1.1861 1.1861 1.2335 1.2335 1.5989 1.5989 2.1895 2.1895 2.3191 2.3191 3.2389 3.2389 3.5205 3.5205 4.2228 4.2228 5.1893 5.1893 5.3599 5.3599 5.5125 5.5125 5.5400 5.5400 5.6711 5.6711 5.8469 5.8469 6.4820 6.4820 6.9121 6.9121 9.7129 9.7129 10.0554 10.0554 10.1256 10.1256 12.3649 12.3649 12.5275 12.5275 13.1257 13.1257 k = 0.0872-0.0788-0.1798 ( 9757 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8226 -25.8226 -18.5013 -18.5013 -12.3327 -12.3327 -11.8678 -11.8678 -10.6883 -10.6883 -10.6567 -10.6567 -10.4939 -10.4939 -10.4088 -10.4088 -5.1111 -5.1111 -3.1645 -3.1645 -3.1279 -3.1279 0.0068 0.0068 0.4697 0.4697 1.2053 1.2053 1.2588 1.2588 1.6241 1.6241 2.1694 2.1694 2.3174 2.3174 3.2168 3.2168 3.5388 3.5388 4.2714 4.2714 5.1412 5.1412 5.3460 5.3460 5.5062 5.5062 5.5371 5.5371 5.6291 5.6291 5.8341 5.8341 6.4552 6.4552 6.8932 6.8932 9.7316 9.7316 10.0657 10.0657 10.1465 10.1465 12.4058 12.4058 12.4694 12.4694 13.1285 13.1285 k = 0.0951-0.0860-0.1962 ( 9749 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8802 -25.8802 -25.8226 -25.8226 -18.5005 -18.5005 -12.3237 -12.3237 -11.8728 -11.8728 -10.6879 -10.6879 -10.6511 -10.6511 -10.5109 -10.5109 -10.4109 -10.4109 -5.1101 -5.1101 -3.1616 -3.1616 -3.1297 -3.1297 0.0333 0.0333 0.4579 0.4579 1.2260 1.2260 1.2853 1.2853 1.6507 1.6507 2.1491 2.1491 2.3161 2.3161 3.1957 3.1957 3.5583 3.5583 4.3202 4.3202 5.0893 5.0893 5.3309 5.3309 5.4988 5.4988 5.5331 5.5331 5.5861 5.5861 5.8211 5.8211 6.4274 6.4274 6.8727 6.8727 9.7512 9.7512 10.0767 10.0767 10.1678 10.1678 12.4131 12.4131 12.4480 12.4480 13.1308 13.1308 k = 0.1031-0.0931-0.2125 ( 9743 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8802 -25.8802 -25.8227 -25.8227 -18.4997 -18.4997 -12.3141 -12.3141 -11.8780 -11.8780 -10.6874 -10.6874 -10.6452 -10.6452 -10.5289 -10.5289 -10.4133 -10.4133 -5.1089 -5.1089 -3.1587 -3.1587 -3.1313 -3.1313 0.0612 0.0612 0.4461 0.4461 1.2478 1.2478 1.3128 1.3128 1.6783 1.6783 2.1292 2.1292 2.3152 2.3152 3.1757 3.1757 3.5790 3.5790 4.3683 4.3683 5.0338 5.0338 5.3142 5.3142 5.4902 5.4902 5.5272 5.5272 5.5440 5.5440 5.8079 5.8079 6.3989 6.3989 6.8506 6.8506 9.7717 9.7717 10.0883 10.0883 10.1894 10.1894 12.3591 12.3591 12.4907 12.4907 13.1324 13.1324 k = 0.1110-0.1003-0.2289 ( 9747 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8802 -25.8802 -25.8228 -25.8228 -18.4988 -18.4988 -12.3038 -12.3038 -11.8834 -11.8834 -10.6868 -10.6868 -10.6390 -10.6390 -10.5480 -10.5480 -10.4159 -10.4159 -5.1078 -5.1078 -3.1561 -3.1561 -3.1326 -3.1326 0.0903 0.0903 0.4347 0.4347 1.2705 1.2705 1.3409 1.3409 1.7063 1.7063 2.1109 2.1109 2.3147 2.3147 3.1568 3.1568 3.6006 3.6006 4.4154 4.4154 4.9751 4.9751 5.2954 5.2954 5.4786 5.4786 5.5028 5.5028 5.5230 5.5230 5.7947 5.7947 6.3699 6.3699 6.8270 6.8270 9.7928 9.7928 10.1004 10.1004 10.2111 10.2111 12.3073 12.3073 12.5333 12.5333 13.1330 13.1330 k = 0.1189-0.1074-0.2452 ( 9745 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8803 -25.8803 -25.8228 -25.8228 -18.4979 -18.4979 -12.2929 -12.2929 -11.8890 -11.8890 -10.6861 -10.6861 -10.6327 -10.6327 -10.5678 -10.5678 -10.4187 -10.4187 -5.1065 -5.1065 -3.1538 -3.1538 -3.1332 -3.1332 0.1204 0.1204 0.4236 0.4236 1.2937 1.2937 1.3696 1.3696 1.7339 1.7339 2.0952 2.0952 2.3146 2.3146 3.1391 3.1391 3.6231 3.6231 4.4606 4.4606 4.9137 4.9137 5.2734 5.2734 5.4535 5.4535 5.4796 5.4796 5.5151 5.5151 5.7815 5.7815 6.3405 6.3405 6.8021 6.8021 9.8144 9.8144 10.1129 10.1129 10.2326 10.2326 12.2579 12.2579 12.5751 12.5751 13.1325 13.1325 k = 0.1269-0.1146-0.2616 ( 9751 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8803 -25.8803 -25.8229 -25.8229 -18.4970 -18.4970 -12.2815 -12.2815 -11.8946 -11.8946 -10.6855 -10.6855 -10.6263 -10.6263 -10.5883 -10.5883 -10.4216 -10.4216 -5.1052 -5.1052 -3.1524 -3.1524 -3.1327 -3.1327 0.1514 0.1514 0.4132 0.4132 1.3167 1.3167 1.3986 1.3986 1.7602 1.7602 2.0838 2.0838 2.3149 2.3149 3.1226 3.1226 3.6465 3.6465 4.5031 4.5031 4.8500 4.8500 5.2470 5.2470 5.4211 5.4211 5.4678 5.4678 5.5064 5.5064 5.7684 5.7684 6.3108 6.3108 6.7758 6.7758 9.8364 9.8364 10.1259 10.1259 10.2537 10.2537 12.2112 12.2112 12.6156 12.6156 13.1305 13.1305 k = 0.1348-0.1218-0.2779 ( 9745 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8230 -25.8230 -18.4960 -18.4960 -12.2696 -12.2696 -11.9004 -11.9004 -10.6850 -10.6850 -10.6204 -10.6204 -10.6085 -10.6085 -10.4248 -10.4248 -5.1039 -5.1039 -3.1520 -3.1520 -3.1311 -3.1311 0.1830 0.1830 0.4033 0.4033 1.3390 1.3390 1.4276 1.4276 1.7839 1.7839 2.0784 2.0784 2.3156 2.3156 3.1074 3.1074 3.6705 3.6705 4.5417 4.5417 4.7853 4.7853 5.2152 5.2152 5.3931 5.3931 5.4576 5.4576 5.4966 5.4966 5.7556 5.7556 6.2811 6.2811 6.7482 6.7482 9.8587 9.8587 10.1391 10.1391 10.2743 10.2743 12.1673 12.1673 12.6541 12.6541 13.1267 13.1267 k = 0.1427-0.1289-0.2943 ( 9735 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8231 -25.8231 -18.4951 -18.4951 -12.2571 -12.2571 -11.9061 -11.9061 -10.6852 -10.6852 -10.6309 -10.6309 -10.6119 -10.6119 -10.4282 -10.4282 -5.1025 -5.1025 -3.1524 -3.1524 -3.1284 -3.1284 0.2149 0.2149 0.3943 0.3943 1.3594 1.3594 1.4564 1.4564 1.8043 1.8043 2.0808 2.0808 2.3168 2.3168 3.0934 3.0934 3.6949 3.6949 4.5739 4.5739 4.7216 4.7216 5.1781 5.1781 5.3715 5.3715 5.4479 5.4479 5.4857 5.4857 5.7430 5.7430 6.2515 6.2515 6.7195 6.7195 9.8811 9.8811 10.1526 10.1526 10.2942 10.2942 12.1263 12.1263 12.6902 12.6902 13.1209 13.1209 k = 0.1507-0.1361-0.3106 ( 9735 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8231 -25.8231 -18.4941 -18.4941 -12.2443 -12.2443 -11.9118 -11.9118 -10.6878 -10.6878 -10.6492 -10.6492 -10.6055 -10.6055 -10.4318 -10.4318 -5.1011 -5.1011 -3.1534 -3.1534 -3.1250 -3.1250 0.2472 0.2472 0.3861 0.3861 1.3769 1.3769 1.4847 1.4847 1.8215 1.8215 2.0918 2.0918 2.3185 2.3185 3.0807 3.0807 3.7198 3.7198 4.5894 4.5894 4.6694 4.6694 5.1367 5.1367 5.3557 5.3557 5.4388 5.4388 5.4740 5.4740 5.7307 5.7307 6.2220 6.2220 6.6898 6.6898 9.9036 9.9036 10.1663 10.1663 10.3133 10.3133 12.0884 12.0884 12.7236 12.7236 13.1128 13.1128 k = 0.1586-0.1433-0.3270 ( 9725 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8803 -25.8803 -25.8232 -25.8232 -18.4931 -18.4931 -12.2310 -12.2310 -11.9175 -11.9175 -10.6971 -10.6971 -10.6614 -10.6614 -10.5988 -10.5988 -10.4356 -10.4356 -5.0997 -5.0997 -3.1546 -3.1546 -3.1212 -3.1212 0.2794 0.2794 0.3790 0.3790 1.3902 1.3902 1.5123 1.5123 1.8369 1.8369 2.1110 2.1110 2.3208 2.3208 3.0693 3.0693 3.7447 3.7447 4.5573 4.5573 4.6595 4.6595 5.0925 5.0925 5.3445 5.3445 5.4305 5.4305 5.4620 5.4620 5.7186 5.7186 6.1929 6.1929 6.6591 6.6591 9.9259 9.9259 10.1801 10.1801 10.3315 10.3315 12.0537 12.0537 12.7540 12.7540 13.1021 13.1021 k = 0.1665-0.1504-0.3433 ( 9729 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8233 -25.8233 -18.4922 -18.4922 -12.2175 -12.2175 -11.9232 -11.9232 -10.7147 -10.7147 -10.6653 -10.6653 -10.5920 -10.5920 -10.4396 -10.4396 -5.0983 -5.0983 -3.1559 -3.1559 -3.1170 -3.1170 0.3114 0.3114 0.3732 0.3732 1.3979 1.3979 1.5390 1.5390 1.8528 1.8528 2.1371 2.1371 2.3237 2.3237 3.0590 3.0590 3.7695 3.7695 4.4977 4.4977 4.6718 4.6718 5.0468 5.0468 5.3362 5.3362 5.4228 5.4228 5.4510 5.4510 5.7069 5.7069 6.1642 6.1642 6.6277 6.6277 9.9482 9.9482 10.1940 10.1940 10.3487 10.3487 12.0224 12.0224 12.7812 12.7812 13.0886 13.0886 k = 0.1744-0.1576-0.3596 ( 9729 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8234 -25.8234 -18.4912 -18.4912 -12.2037 -12.2037 -11.9287 -11.9287 -10.7363 -10.7363 -10.6652 -10.6652 -10.5853 -10.5853 -10.4437 -10.4437 -5.0969 -5.0969 -3.1573 -3.1573 -3.1127 -3.1127 0.3419 0.3419 0.3698 0.3698 1.3992 1.3992 1.5647 1.5647 1.8715 1.8715 2.1678 2.1678 2.3274 2.3274 3.0501 3.0501 3.7938 3.7938 4.4348 4.4348 4.6829 4.6829 5.0007 5.0007 5.3289 5.3289 5.4135 5.4135 5.4445 5.4445 5.6954 5.6954 6.1361 6.1361 6.5957 6.5957 9.9701 9.9701 10.2080 10.2080 10.3648 10.3648 11.9944 11.9944 12.8051 12.8051 13.0723 13.0723 k = 0.1824-0.1647-0.3760 ( 9735 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8234 -25.8234 -18.4903 -18.4903 -12.1896 -12.1896 -11.9340 -11.9340 -10.7595 -10.7595 -10.6635 -10.6635 -10.5787 -10.5787 -10.4481 -10.4481 -5.0954 -5.0954 -3.1585 -3.1585 -3.1083 -3.1083 0.3589 0.3589 0.3807 0.3807 1.3937 1.3937 1.5893 1.5893 1.8945 1.8945 2.2011 2.2011 2.3324 2.3324 3.0423 3.0423 3.8170 3.8170 4.3737 4.3737 4.6886 4.6886 4.9551 4.9551 5.3209 5.3209 5.4003 5.4003 5.4460 5.4460 5.6842 5.6842 6.1087 6.1087 6.5633 6.5633 9.9917 9.9917 10.2219 10.2219 10.3798 10.3798 11.9700 11.9700 12.8257 12.8257 13.0531 13.0531 k = 0.1903-0.1719-0.3923 ( 9727 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8803 -25.8803 -25.8235 -25.8235 -18.4894 -18.4894 -12.1754 -12.1754 -11.9392 -11.9392 -10.7832 -10.7832 -10.6609 -10.6609 -10.5723 -10.5723 -10.4526 -10.4526 -5.0940 -5.0940 -3.1597 -3.1597 -3.1038 -3.1038 0.3589 0.3589 0.4096 0.4096 1.3818 1.3818 1.6128 1.6128 1.9221 1.9221 2.2344 2.2344 2.3396 2.3396 3.0358 3.0358 3.8383 3.8383 4.3166 4.3166 4.6879 4.6879 4.9109 4.9109 5.3112 5.3112 5.3839 5.3839 5.4552 5.4552 5.6733 5.6733 6.0822 6.0822 6.5308 6.5308 10.0129 10.0129 10.2359 10.2359 10.3935 10.3935 11.9492 11.9492 12.8428 12.8428 13.0311 13.0311 k = 0.1982-0.1791-0.4087 ( 9727 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8803 -25.8803 -25.8236 -25.8236 -18.4885 -18.4885 -12.1612 -12.1612 -11.9442 -11.9442 -10.8070 -10.8070 -10.6579 -10.6579 -10.5659 -10.5659 -10.4572 -10.4572 -5.0926 -5.0926 -3.1607 -3.1607 -3.0994 -3.0994 0.3581 0.3581 0.4398 0.4398 1.3643 1.3643 1.6351 1.6351 1.9540 1.9540 2.2646 2.2646 2.3510 2.3510 3.0304 3.0304 3.8567 3.8567 4.2657 4.2657 4.6806 4.6806 4.8690 4.8690 5.2995 5.2995 5.3655 5.3655 5.4701 5.4701 5.6626 5.6626 6.0567 6.0567 6.4982 6.4982 10.0336 10.0336 10.2497 10.2497 10.4060 10.4060 11.9321 11.9321 12.8561 12.8561 13.0070 13.0070 k = 0.2062-0.1862-0.4250 ( 9723 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8803 -25.8803 -25.8236 -25.8236 -18.4877 -18.4877 -12.1469 -12.1469 -11.9490 -11.9490 -10.8308 -10.8308 -10.6544 -10.6544 -10.5598 -10.5598 -10.4620 -10.4620 -5.0912 -5.0912 -3.1615 -3.1615 -3.0951 -3.0951 0.3585 0.3585 0.4696 0.4696 1.3424 1.3424 1.6561 1.6561 1.9893 1.9893 2.2877 2.2877 2.3695 2.3695 3.0261 3.0261 3.8705 3.8705 4.2234 4.2234 4.6667 4.6667 4.8305 4.8305 5.2858 5.2858 5.3457 5.3457 5.4892 5.4892 5.6522 5.6522 6.0325 6.0325 6.4659 6.4659 10.0536 10.0536 10.2635 10.2635 10.4172 10.4172 11.9186 11.9186 12.8644 12.8644 12.9819 12.9819 k = 0.2141-0.1934-0.4414 ( 9725 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8237 -25.8237 -18.4869 -18.4869 -12.1327 -12.1327 -11.9536 -11.9536 -10.8542 -10.8542 -10.6507 -10.6507 -10.5540 -10.5540 -10.4670 -10.4670 -5.0898 -5.0898 -3.1622 -3.1622 -3.0909 -3.0909 0.3601 0.3601 0.4987 0.4987 1.3169 1.3169 1.6759 1.6759 2.0267 2.0267 2.3023 2.3023 2.3958 2.3958 3.0228 3.0228 3.8782 3.8782 4.1920 4.1920 4.6465 4.6465 4.7962 4.7962 5.2702 5.2702 5.3251 5.3251 5.5105 5.5105 5.6425 5.6425 6.0096 6.0096 6.4342 6.4342 10.0730 10.0730 10.2772 10.2772 10.4270 10.4270 11.9089 11.9089 12.8650 12.8650 12.9589 12.9589 k = 0.2220-0.2006-0.4577 ( 9725 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8238 -25.8238 -18.4861 -18.4861 -12.1187 -12.1187 -11.9579 -11.9579 -10.8772 -10.8772 -10.6466 -10.6466 -10.5483 -10.5483 -10.4720 -10.4720 -5.0885 -5.0885 -3.1627 -3.1627 -3.0868 -3.0868 0.3633 0.3633 0.5267 0.5267 1.2890 1.2890 1.6943 1.6943 2.0651 2.0651 2.3106 2.3106 2.4268 2.4268 3.0204 3.0204 3.8785 3.8785 4.1734 4.1734 4.6208 4.6208 4.7664 4.7664 5.2527 5.2527 5.3041 5.3041 5.5321 5.5321 5.6343 5.6343 5.9882 5.9882 6.4033 6.4033 10.0916 10.0916 10.2908 10.2908 10.4354 10.4354 11.9029 11.9029 12.8536 12.8536 12.9428 12.9428 k = 0.2299-0.2077-0.4741 ( 9731 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8238 -25.8238 -18.4854 -18.4854 -12.1050 -12.1050 -11.9620 -11.9620 -10.8997 -10.8997 -10.6423 -10.6423 -10.5429 -10.5429 -10.4771 -10.4771 -5.0872 -5.0872 -3.1630 -3.1630 -3.0828 -3.0828 0.3679 0.3679 0.5535 0.5535 1.2593 1.2593 1.7114 1.7114 2.1033 2.1033 2.3154 2.3154 2.4593 2.4593 3.0188 3.0188 3.8722 3.8722 4.1673 4.1673 4.5913 4.5913 4.7408 4.7408 5.2332 5.2332 5.2830 5.2830 5.5504 5.5504 5.6298 5.6298 5.9686 5.9686 6.3734 6.3734 10.1094 10.1094 10.3043 10.3043 10.4425 10.4425 11.9008 11.9008 12.8284 12.8284 12.9356 12.9356 k = 0.2379-0.2149-0.4904 ( 9737 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4847 -18.4847 -12.0915 -12.0915 -11.9658 -11.9658 -10.9213 -10.9213 -10.6378 -10.6378 -10.5379 -10.5379 -10.4823 -10.4823 -5.0859 -5.0859 -3.1632 -3.1632 -3.0791 -3.0791 0.3741 0.3741 0.5788 0.5788 1.2287 1.2287 1.7272 1.7272 2.1399 2.1399 2.3181 2.3181 2.4919 2.4919 3.0176 3.0176 3.8620 3.8620 4.1714 4.1714 4.5597 4.5597 4.7187 4.7187 5.2115 5.2115 5.2621 5.2621 5.5602 5.5602 5.6338 5.6338 5.9509 5.9509 6.3449 6.3449 10.1263 10.1263 10.3178 10.3178 10.4480 10.4480 11.9024 11.9024 12.7936 12.7936 12.9336 12.9336 k = 0.2458-0.2220-0.5068 ( 9735 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4841 -18.4841 -12.0786 -12.0786 -11.9693 -11.9693 -10.9421 -10.9421 -10.6331 -10.6331 -10.5331 -10.5331 -10.4875 -10.4875 -5.0847 -5.0847 -3.1631 -3.1631 -3.0755 -3.0755 0.3819 0.3819 0.6023 0.6023 1.1978 1.1978 1.7417 1.7417 2.1734 2.1734 2.3193 2.3193 2.5240 2.5240 3.0167 3.0167 3.8512 3.8512 4.1822 4.1822 4.5281 4.5281 4.6995 4.6995 5.1877 5.1877 5.2417 5.2417 5.5586 5.5586 5.6481 5.6481 5.9352 5.9352 6.3179 6.3179 10.1422 10.1422 10.3311 10.3311 10.4521 10.4521 11.9077 11.9077 12.7532 12.7532 12.9331 12.9331 k = 0.2537-0.2292-0.5231 ( 9732 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4835 -18.4835 -12.0661 -12.0661 -11.9725 -11.9725 -10.9618 -10.9618 -10.6283 -10.6283 -10.5287 -10.5287 -10.4928 -10.4928 -5.0835 -5.0835 -3.1629 -3.1629 -3.0722 -3.0722 0.3913 0.3913 0.6234 0.6234 1.1674 1.1674 1.7549 1.7549 2.2025 2.2025 2.3193 2.3193 2.5560 2.5560 3.0158 3.0158 3.8423 3.8423 4.1966 4.1966 4.4982 4.4982 4.6828 4.6828 5.1622 5.1622 5.2214 5.2214 5.5497 5.5497 5.6687 5.6687 5.9217 5.9217 6.2926 6.2926 10.1570 10.1570 10.3443 10.3443 10.4547 10.4547 11.9169 11.9169 12.7092 12.7092 12.9326 12.9326 k = 0.2617-0.2364-0.5395 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4830 -18.4830 -12.0543 -12.0543 -11.9754 -11.9754 -10.9804 -10.9804 -10.6233 -10.6233 -10.5246 -10.5246 -10.4980 -10.4980 -5.0823 -5.0823 -3.1625 -3.1625 -3.0691 -3.0691 0.4023 0.4023 0.6418 0.6418 1.1381 1.1381 1.7668 1.7668 2.2258 2.2258 2.3185 2.3185 2.5883 2.5883 3.0143 3.0143 3.8369 3.8369 4.2119 4.2119 4.4718 4.4718 4.6687 4.6687 5.1354 5.1354 5.2011 5.2011 5.5371 5.5371 5.6914 5.6914 5.9104 5.9104 6.2692 6.2692 10.1706 10.1706 10.3574 10.3574 10.4559 10.4559 11.9298 11.9298 12.6628 12.6628 12.9314 12.9314 k = 0.2696-0.2435-0.5558 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4826 -18.4826 -12.0432 -12.0432 -11.9781 -11.9781 -10.9977 -10.9977 -10.6183 -10.6183 -10.5210 -10.5210 -10.5032 -10.5032 -5.0812 -5.0812 -3.1620 -3.1620 -3.0663 -3.0663 0.4149 0.4149 0.6565 0.6565 1.1109 1.1109 1.7775 1.7775 2.2421 2.2421 2.3175 2.3175 2.6215 2.6215 3.0120 3.0120 3.8354 3.8354 4.2256 4.2256 4.4509 4.4509 4.6573 4.6573 5.1078 5.1078 5.1805 5.1805 5.5228 5.5228 5.7144 5.7144 5.9014 5.9014 6.2478 6.2478 10.1831 10.1831 10.3702 10.3702 10.4555 10.4555 11.9465 11.9465 12.6146 12.6146 12.9293 12.9293 k = 0.2775-0.2507-0.5722 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4822 -18.4822 -12.0330 -12.0330 -11.9804 -11.9804 -11.0136 -11.0136 -10.6132 -10.6132 -10.5178 -10.5178 -10.5082 -10.5082 -5.0801 -5.0801 -3.1613 -3.1613 -3.0637 -3.0637 0.4293 0.4293 0.6667 0.6667 1.0868 1.0868 1.7871 1.7871 2.2505 2.2505 2.3168 2.3168 2.6560 2.6560 3.0085 3.0085 3.8373 3.8373 4.2355 4.2355 4.4373 4.4373 4.6489 4.6489 5.0800 5.0800 5.1594 5.1594 5.5078 5.5078 5.7366 5.7366 5.8948 5.8948 6.2285 6.2285 10.1943 10.1943 10.3827 10.3827 10.4537 10.4537 11.9669 11.9669 12.5650 12.5650 12.9261 12.9261 k = 0.2854-0.2579-0.5885 ( 9730 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4818 -18.4818 -12.0237 -12.0237 -11.9825 -11.9825 -11.0279 -11.0279 -10.6082 -10.6082 -10.5164 -10.5164 -10.5117 -10.5117 -5.0791 -5.0791 -3.1604 -3.1604 -3.0614 -3.0614 0.4452 0.4452 0.6714 0.6714 1.0669 1.0669 1.7956 1.7956 2.2514 2.2514 2.3167 2.3167 2.6915 2.6915 3.0036 3.0036 3.8417 3.8417 4.2400 4.2400 4.4322 4.4322 4.6438 4.6438 5.0526 5.0526 5.1376 5.1376 5.4928 5.4928 5.7577 5.7577 5.8904 5.8904 6.2112 6.2112 10.2041 10.2041 10.3946 10.3946 10.4507 10.4507 11.9910 11.9910 12.5146 12.5146 12.9219 12.9219 k = 0.2934-0.2650-0.6049 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4816 -18.4816 -12.0154 -12.0154 -11.9843 -11.9843 -11.0407 -11.0407 -10.6032 -10.6032 -10.5196 -10.5196 -10.5109 -10.5109 -5.0781 -5.0781 -3.1594 -3.1594 -3.0594 -3.0594 0.4627 0.4627 0.6699 0.6699 1.0519 1.0519 1.8030 1.8030 2.2462 2.2462 2.3168 2.3168 2.7276 2.7276 2.9969 2.9969 3.8474 3.8474 4.2396 4.2396 4.4350 4.4350 4.6424 4.6424 5.0263 5.0263 5.1152 5.1152 5.4784 5.4784 5.7771 5.7771 5.8884 5.8884 6.1962 6.1962 10.2126 10.2126 10.4053 10.4053 10.4471 10.4471 12.0188 12.0188 12.4635 12.4635 12.9168 12.9168 k = 0.3013-0.2722-0.6212 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4813 -18.4813 -12.0081 -12.0081 -11.9858 -11.9858 -11.0517 -11.0517 -10.5984 -10.5984 -10.5242 -10.5242 -10.5089 -10.5089 -5.0772 -5.0772 -3.1582 -3.1582 -3.0577 -3.0577 0.4819 0.4819 0.6616 0.6616 1.0423 1.0423 1.8094 1.8094 2.2367 2.2367 2.3163 2.3163 2.7637 2.7637 2.9886 2.9886 3.8529 3.8529 4.2360 4.2360 4.4430 4.4430 4.6451 4.6451 5.0019 5.0019 5.0921 5.0921 5.4650 5.4650 5.7947 5.7947 5.8888 5.8888 6.1833 6.1833 10.2196 10.2196 10.4130 10.4130 10.4446 10.4446 12.0502 12.0502 12.4121 12.4121 12.9107 12.9107 k = 0.3092-0.2793-0.6376 ( 9708 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4811 -18.4811 -12.0020 -12.0020 -11.9870 -11.9870 -11.0610 -11.0610 -10.5937 -10.5937 -10.5289 -10.5289 -10.5071 -10.5071 -5.0763 -5.0763 -3.1569 -3.1569 -3.0562 -3.0562 0.5027 0.5027 0.6467 0.6467 1.0381 1.0381 1.8148 1.8148 2.2247 2.2247 2.3150 2.3150 2.7989 2.7989 2.9786 2.9786 3.8571 3.8571 4.2314 4.2314 4.4532 4.4532 4.6518 4.6518 4.9806 4.9806 5.0688 5.0688 5.4529 5.4529 5.8101 5.8101 5.8916 5.8916 6.1727 6.1727 10.2251 10.2251 10.4144 10.4144 10.4464 10.4464 12.0851 12.0851 12.3608 12.3608 12.9037 12.9037 k = 0.3172-0.2865-0.6539 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4810 -18.4810 -11.9970 -11.9970 -11.9880 -11.9880 -11.0684 -11.0684 -10.5893 -10.5893 -10.5333 -10.5333 -10.5056 -10.5056 -5.0755 -5.0755 -3.1555 -3.1555 -3.0550 -3.0550 0.5250 0.5250 0.6259 0.6259 1.0385 1.0385 1.8192 1.8192 2.2116 2.2116 2.3126 2.3126 2.8322 2.8322 2.9674 2.9674 3.8592 3.8592 4.2272 4.2272 4.4629 4.4629 4.6617 4.6617 4.9638 4.9638 5.0458 5.0458 5.4425 5.4425 5.8229 5.8229 5.8970 5.8970 6.1646 6.1646 10.2291 10.2291 10.4088 10.4088 10.4533 10.4533 12.1235 12.1235 12.3097 12.3097 12.8960 12.8960 k = 0.3251-0.2937-0.6703 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9931 -11.9931 -11.9887 -11.9887 -11.0741 -11.0741 -10.5851 -10.5851 -10.5375 -10.5375 -10.5044 -10.5044 -5.0747 -5.0747 -3.1540 -3.1540 -3.0540 -3.0540 0.5488 0.5488 0.6003 0.6003 1.0424 1.0424 1.8226 1.8226 2.1983 2.1983 2.3093 2.3093 2.8624 2.8624 2.9554 2.9554 3.8592 3.8592 4.2238 4.2238 4.4705 4.4705 4.6731 4.6731 4.9535 4.9535 5.0236 5.0236 5.4339 5.4339 5.8330 5.8330 5.9048 5.9048 6.1590 6.1590 10.2315 10.2315 10.3994 10.3994 10.4622 10.4622 12.1651 12.1651 12.2593 12.2593 12.8876 12.8876 k = 0.3330-0.3008-0.6866 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9905 -11.9905 -11.9892 -11.9892 -11.0780 -11.0780 -10.5815 -10.5815 -10.5413 -10.5413 -10.5035 -10.5035 -5.0739 -5.0739 -3.1524 -3.1524 -3.0532 -3.0532 0.5704 0.5704 0.5748 0.5748 1.0487 1.0487 1.8250 1.8250 2.1858 2.1858 2.3051 2.3051 2.8873 2.8873 2.9446 2.9446 3.8571 3.8571 4.2209 4.2209 4.4751 4.4751 4.6834 4.6834 4.9513 4.9513 5.0038 5.0038 5.4269 5.4269 5.8400 5.8400 5.9151 5.9151 6.1562 6.1562 10.2322 10.2322 10.3878 10.3878 10.4714 10.4714 12.2038 12.2038 12.2155 12.2155 12.8786 12.8786 k = 0.3409-0.3080-0.7029 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9898 -11.9898 -11.9886 -11.9886 -11.0801 -11.0801 -10.5784 -10.5784 -10.5446 -10.5446 -10.5030 -10.5030 -5.0732 -5.0732 -3.1507 -3.1507 -3.0527 -3.0527 0.5391 0.5391 0.6009 0.6009 1.0565 1.0565 1.8263 1.8263 2.1747 2.1747 2.3000 2.3000 2.9005 2.9005 2.9411 2.9411 3.8538 3.8538 4.2179 4.2179 4.4764 4.4764 4.6901 4.6901 4.9557 4.9557 4.9903 4.9903 5.4216 5.4216 5.8439 5.8439 5.9280 5.9280 6.1562 6.1562 10.2311 10.2311 10.3749 10.3749 10.4803 10.4803 12.1596 12.1596 12.2587 12.2587 12.8692 12.8692 k = 0.3489-0.3152-0.7193 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4809 -18.4809 -11.9899 -11.9899 -11.9881 -11.9881 -11.0806 -11.0806 -10.5761 -10.5761 -10.5472 -10.5472 -10.5028 -10.5028 -5.0726 -5.0726 -3.1490 -3.1490 -3.0524 -3.0524 0.5054 0.5054 0.6291 0.6291 1.0648 1.0648 1.8264 1.8264 2.1657 2.1657 2.2941 2.2941 2.8958 2.8958 2.9508 2.9508 3.8496 3.8496 4.2142 4.2142 4.4745 4.4745 4.6918 4.6918 4.9538 4.9538 4.9967 4.9967 5.4178 5.4178 5.8446 5.8446 5.9435 5.9435 6.1589 6.1589 10.2281 10.2281 10.3612 10.3612 10.4886 10.4886 12.1119 12.1119 12.3093 12.3093 12.8594 12.8594 k = 0.3568-0.3223-0.7356 ( 9700 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4810 -18.4810 -11.9899 -11.9899 -11.9885 -11.9885 -11.0796 -11.0796 -10.5747 -10.5747 -10.5489 -10.5489 -10.5029 -10.5029 -5.0720 -5.0720 -3.1472 -3.1472 -3.0522 -3.0522 0.4707 0.4707 0.6585 0.6585 1.0732 1.0732 1.8252 1.8252 2.1592 2.1592 2.2876 2.2876 2.8832 2.8832 2.9638 2.9638 3.8452 3.8452 4.2090 4.2090 4.4695 4.4695 4.6892 4.6892 4.9441 4.9441 5.0237 5.0237 5.4152 5.4152 5.8422 5.8422 5.9617 5.9617 6.1641 6.1641 10.2229 10.2229 10.3471 10.3471 10.4962 10.4962 12.0654 12.0654 12.3626 12.3626 12.8493 12.8493 k = 0.6432-0.1002-0.5905 ( 9700 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8242 -25.8242 -18.4810 -18.4810 -11.9899 -11.9899 -11.9885 -11.9885 -11.0796 -11.0796 -10.5747 -10.5747 -10.5489 -10.5489 -10.5030 -10.5030 -5.0720 -5.0720 -3.1472 -3.1472 -3.0522 -3.0522 0.4707 0.4707 0.6587 0.6587 1.0731 1.0731 1.8253 1.8253 2.1593 2.1593 2.2875 2.2875 2.8833 2.8833 2.9639 2.9639 3.8452 3.8452 4.2092 4.2092 4.4694 4.4694 4.6890 4.6890 4.9444 4.9444 5.0237 5.0237 5.4151 5.4151 5.8421 5.8421 5.9616 5.9616 6.1644 6.1644 10.2229 10.2229 10.3472 10.3472 10.4962 10.4962 12.0653 12.0653 12.3627 12.3627 12.8494 12.8494 k = 0.6352-0.0823-0.5905 ( 9704 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4811 -18.4811 -11.9903 -11.9903 -11.9891 -11.9891 -11.0772 -11.0772 -10.5744 -10.5744 -10.5496 -10.5496 -10.5033 -10.5033 -5.0714 -5.0714 -3.1454 -3.1454 -3.0522 -3.0522 0.4354 0.4354 0.6895 0.6895 1.0811 1.0811 1.8226 1.8226 2.1553 2.1553 2.2805 2.2805 2.8690 2.8690 2.9741 2.9741 3.8410 3.8410 4.2022 4.2022 4.4618 4.4618 4.6835 4.6835 4.9356 4.9356 5.0605 5.0605 5.4134 5.4134 5.8369 5.8369 5.9826 5.9826 6.1719 6.1719 10.2153 10.2153 10.3333 10.3333 10.5030 10.5030 12.0201 12.0201 12.4184 12.4184 12.8393 12.8393 k = 0.6273-0.0644-0.5905 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4812 -18.4812 -11.9922 -11.9922 -11.9890 -11.9890 -11.0735 -11.0735 -10.5751 -10.5751 -10.5495 -10.5495 -10.5039 -10.5039 -5.0708 -5.0708 -3.1436 -3.1436 -3.0524 -3.0524 0.4001 0.4001 0.7215 0.7215 1.0884 1.0884 1.8183 1.8183 2.1540 2.1540 2.2735 2.2735 2.8546 2.8546 2.9801 2.9801 3.8370 3.8370 4.1933 4.1933 4.4522 4.4522 4.6764 4.6764 4.9300 4.9300 5.1024 5.1024 5.4122 5.4122 5.8294 5.8294 6.0062 6.0062 6.1812 6.1812 10.2050 10.2050 10.3200 10.3200 10.5089 10.5089 11.9765 11.9765 12.4759 12.4759 12.8293 12.8293 k = 0.6193-0.0465-0.5905 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4813 -18.4813 -11.9948 -11.9948 -11.9886 -11.9886 -11.0687 -11.0687 -10.5765 -10.5765 -10.5489 -10.5489 -10.5047 -10.5047 -5.0703 -5.0703 -3.1417 -3.1417 -3.0526 -3.0526 0.3652 0.3652 0.7546 0.7546 1.0948 1.0948 1.8121 1.8121 2.1551 2.1551 2.2669 2.2669 2.8410 2.8410 2.9815 2.9815 3.8332 3.8332 4.1823 4.1823 4.4414 4.4414 4.6687 4.6687 4.9279 4.9279 5.1470 5.1470 5.4111 5.4111 5.8201 5.8201 6.0323 6.0323 6.1919 6.1919 10.1921 10.1921 10.3078 10.3078 10.5141 10.5141 11.9348 11.9348 12.5347 12.5347 12.8199 12.8199 k = 0.6114-0.0286-0.5905 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4815 -18.4815 -11.9980 -11.9980 -11.9881 -11.9881 -11.0629 -11.0629 -10.5783 -10.5783 -10.5479 -10.5479 -10.5057 -10.5057 -5.0699 -5.0699 -3.1399 -3.1399 -3.0530 -3.0530 0.3310 0.3310 0.7887 0.7887 1.1003 1.1003 1.8039 1.8039 2.1577 2.1577 2.2619 2.2619 2.8284 2.8284 2.9783 2.9783 3.8295 3.8295 4.1694 4.1694 4.4304 4.4304 4.6610 4.6610 4.9295 4.9295 5.1925 5.1925 5.4097 5.4097 5.8096 5.8096 6.0606 6.0606 6.2035 6.2035 10.1767 10.1767 10.2968 10.2968 10.5184 10.5184 11.8950 11.8950 12.5938 12.5938 12.8115 12.8115 k = 0.6034-0.0107-0.5905 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4817 -18.4817 -12.0016 -12.0016 -11.9875 -11.9875 -11.0564 -11.0564 -10.5803 -10.5803 -10.5470 -10.5470 -10.5068 -10.5068 -5.0694 -5.0694 -3.1381 -3.1381 -3.0534 -3.0534 0.2979 0.2979 0.8237 0.8237 1.1048 1.1048 1.7934 1.7934 2.1605 2.1605 2.2597 2.2597 2.8171 2.8171 2.9708 2.9708 3.8254 3.8254 4.1547 4.1547 4.4201 4.4201 4.6534 4.6534 4.9345 4.9345 5.2375 5.2375 5.4076 5.4076 5.7984 5.7984 6.0907 6.0907 6.2158 6.2158 10.1591 10.1591 10.2870 10.2870 10.5219 10.5219 11.8573 11.8573 12.6514 12.6514 12.8056 12.8056 k = 0.5955 0.0072-0.5905 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5046 -26.5046 -25.8804 -25.8804 -25.8241 -25.8241 -18.4819 -18.4819 -12.0055 -12.0055 -11.9868 -11.9868 -11.0494 -11.0494 -10.5822 -10.5822 -10.5462 -10.5462 -10.5080 -10.5080 -5.0690 -5.0690 -3.1364 -3.1364 -3.0539 -3.0539 0.2661 0.2661 0.8595 0.8595 1.1085 1.1085 1.7804 1.7804 2.1620 2.1620 2.2624 2.2624 2.8072 2.8072 2.9594 2.9594 3.8207 3.8207 4.1386 4.1386 4.4114 4.4114 4.6460 4.6460 4.9426 4.9426 5.2809 5.2809 5.4046 5.4046 5.7873 5.7873 6.1221 6.1221 6.2285 6.2285 10.1399 10.1399 10.2782 10.2782 10.5246 10.5246 11.8219 11.8219 12.7027 12.7027 12.8067 12.8067 k = 0.5875 0.0252-0.5905 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8241 -25.8241 -18.4820 -18.4820 -12.0096 -12.0096 -11.9861 -11.9861 -11.0419 -11.0419 -10.5841 -10.5841 -10.5457 -10.5457 -10.5092 -10.5092 -5.0687 -5.0687 -3.1348 -3.1348 -3.0544 -3.0544 0.2360 0.2360 0.8958 0.8958 1.1113 1.1113 1.7650 1.7650 2.1607 2.1607 2.2710 2.2710 2.7986 2.7986 2.9445 2.9445 3.8153 3.8153 4.1212 4.1212 4.4047 4.4047 4.6389 4.6389 4.9535 4.9535 5.3216 5.3216 5.4006 5.4006 5.7765 5.7765 6.1539 6.1539 6.2416 6.2416 10.1197 10.1197 10.2703 10.2703 10.5267 10.5267 11.7889 11.7889 12.7348 12.7348 12.8273 12.8273 k = 0.5796 0.0431-0.5905 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4822 -18.4822 -12.0136 -12.0136 -11.9854 -11.9854 -11.0344 -11.0344 -10.5858 -10.5858 -10.5454 -10.5454 -10.5105 -10.5105 -5.0684 -5.0684 -3.1332 -3.1332 -3.0549 -3.0549 0.2077 0.2077 0.9325 0.9325 1.1136 1.1136 1.7471 1.7471 2.1569 2.1569 2.2858 2.2858 2.7911 2.7911 2.9266 2.9266 3.8091 3.8091 4.1030 4.1030 4.4006 4.4006 4.6319 4.6319 4.9668 4.9668 5.3567 5.3567 5.3976 5.3976 5.7667 5.7667 6.1852 6.1852 6.2551 6.2551 10.0991 10.0991 10.2631 10.2631 10.5282 10.5282 11.7583 11.7583 12.7428 12.7428 12.8715 12.8715 k = 0.5716 0.0610-0.5905 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4824 -18.4824 -12.0176 -12.0176 -11.9847 -11.9847 -11.0268 -11.0268 -10.5873 -10.5873 -10.5453 -10.5453 -10.5117 -10.5117 -5.0681 -5.0681 -3.1317 -3.1317 -3.0554 -3.0554 0.1814 0.1814 0.9692 0.9692 1.1156 1.1156 1.7266 1.7266 2.1512 2.1512 2.3058 2.3058 2.7843 2.7843 2.9063 2.9063 3.8021 3.8021 4.0845 4.0845 4.3990 4.3990 4.6250 4.6250 4.9824 4.9824 5.3720 5.3720 5.4092 5.4092 5.7581 5.7581 6.2145 6.2145 6.2698 6.2698 10.0785 10.0785 10.2565 10.2565 10.5291 10.5291 11.7304 11.7304 12.7405 12.7405 12.9250 12.9250 k = 0.5636 0.0789-0.5905 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4826 -18.4826 -12.0215 -12.0215 -11.9840 -11.9840 -11.0195 -11.0195 -10.5887 -10.5887 -10.5455 -10.5455 -10.5129 -10.5129 -5.0678 -5.0678 -3.1304 -3.1304 -3.0558 -3.0558 0.1574 0.1574 1.0054 1.0054 1.1176 1.1176 1.7039 1.7039 2.1448 2.1448 2.3299 2.3299 2.7776 2.7776 2.8847 2.8847 3.7945 3.7945 4.0661 4.0661 4.3998 4.3998 4.6182 4.6182 4.9997 4.9997 5.3655 5.3655 5.4368 5.4368 5.7510 5.7510 6.2395 6.2395 6.2869 6.2869 10.0585 10.0585 10.2505 10.2505 10.5297 10.5297 11.7051 11.7051 12.7354 12.7354 12.9797 12.9797 k = 0.5557 0.0968-0.5905 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4827 -18.4827 -12.0251 -12.0251 -11.9834 -11.9834 -11.0125 -11.0125 -10.5899 -10.5899 -10.5458 -10.5458 -10.5139 -10.5139 -5.0676 -5.0676 -3.1292 -3.1292 -3.0563 -3.0563 0.1358 0.1358 1.0398 1.0398 1.1208 1.1208 1.6793 1.6793 2.1383 2.1383 2.3573 2.3573 2.7698 2.7698 2.8630 2.8630 3.7868 3.7868 4.0484 4.0484 4.4026 4.4026 4.6115 4.6115 5.0186 5.0186 5.3531 5.3531 5.4644 5.4644 5.7455 5.7455 6.2584 6.2584 6.3076 6.3076 10.0397 10.0397 10.2451 10.2451 10.5299 10.5299 11.6826 11.6826 12.7297 12.7297 13.0324 13.0324 k = 0.5477 0.1147-0.5905 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4829 -18.4829 -12.0283 -12.0283 -11.9828 -11.9828 -11.0060 -11.0060 -10.5909 -10.5909 -10.5463 -10.5463 -10.5149 -10.5149 -5.0674 -5.0674 -3.1281 -3.1281 -3.0567 -3.0567 0.1168 0.1168 1.0698 1.0698 1.1275 1.1275 1.6532 1.6532 2.1322 2.1322 2.3871 2.3871 2.7588 2.7588 2.8433 2.8433 3.7792 3.7792 4.0319 4.0319 4.4067 4.4067 4.6051 4.6051 5.0386 5.0386 5.3380 5.3380 5.4890 5.4890 5.7414 5.7414 6.2718 6.2718 6.3304 6.3304 10.0223 10.0223 10.2403 10.2403 10.5299 10.5299 11.6629 11.6629 12.7241 12.7241 13.0816 13.0816 k = 0.5398 0.1326-0.5905 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4830 -18.4830 -12.0312 -12.0312 -11.9823 -11.9823 -11.0003 -11.0003 -10.5918 -10.5918 -10.5469 -10.5469 -10.5158 -10.5158 -5.0672 -5.0672 -3.1272 -3.1272 -3.0570 -3.0570 0.1004 0.1004 1.0897 1.0897 1.1429 1.1429 1.6264 1.6264 2.1269 2.1269 2.4190 2.4190 2.7423 2.7423 2.8279 2.8279 3.7721 3.7721 4.0170 4.0170 4.4118 4.4118 4.5990 4.5990 5.0594 5.0594 5.3210 5.3210 5.5098 5.5098 5.7386 5.7386 6.2816 6.2816 6.3526 6.3526 10.0069 10.0069 10.2361 10.2361 10.5297 10.5297 11.6462 11.6462 12.7191 12.7191 13.1260 13.1260 k = 0.5318 0.1505-0.5905 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4831 -18.4831 -12.0336 -12.0336 -11.9818 -11.9818 -10.9954 -10.9954 -10.5924 -10.5924 -10.5475 -10.5475 -10.5165 -10.5165 -5.0670 -5.0670 -3.1264 -3.1264 -3.0573 -3.0573 0.0869 0.0869 1.0985 1.0985 1.1673 1.1673 1.5998 1.5998 2.1224 2.1224 2.4523 2.4523 2.7195 2.7195 2.8180 2.8180 3.7657 3.7657 4.0042 4.0042 4.4171 4.4171 4.5934 4.5934 5.0804 5.0804 5.3028 5.3028 5.5268 5.5268 5.7370 5.7370 6.2890 6.2890 6.3724 6.3724 9.9937 9.9937 10.2326 10.2326 10.5295 10.5295 11.6324 11.6324 12.7147 12.7147 13.1643 13.1643 k = 0.5239 0.1684-0.5905 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8240 -25.8240 -18.4832 -18.4832 -12.0356 -12.0356 -11.9815 -11.9815 -10.9915 -10.9915 -10.5929 -10.5929 -10.5480 -10.5480 -10.5170 -10.5170 -5.0669 -5.0669 -3.1258 -3.1258 -3.0576 -3.0576 0.0763 0.0763 1.1018 1.1018 1.1936 1.1936 1.5751 1.5751 2.1189 2.1189 2.4867 2.4867 2.6916 2.6916 2.8123 2.8123 3.7605 3.7605 3.9939 3.9939 4.4220 4.4220 4.5886 4.5886 5.1008 5.1008 5.2844 5.2844 5.5400 5.5400 5.7362 5.7362 6.2944 6.2944 6.3887 6.3887 9.9831 9.9831 10.2298 10.2298 10.5292 10.5292 11.6217 11.6217 12.7113 12.7113 13.1955 13.1955 k = 0.5159 0.1863-0.5905 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0370 -12.0370 -11.9812 -11.9812 -10.9886 -10.9886 -10.5933 -10.5933 -10.5485 -10.5485 -10.5174 -10.5174 -5.0669 -5.0669 -3.1254 -3.1254 -3.0577 -3.0577 0.0687 0.0687 1.1032 1.1032 1.2165 1.2165 1.5541 1.5541 2.1164 2.1164 2.5218 2.5218 2.6604 2.6604 2.8092 2.8092 3.7566 3.7566 3.9863 3.9863 4.4260 4.4260 4.5849 4.5849 5.1193 5.1193 5.2673 5.2673 5.5492 5.5492 5.7358 5.7358 6.2983 6.2983 6.4008 6.4008 9.9754 9.9754 10.2278 10.2278 10.5290 10.5290 11.6140 11.6140 12.7088 12.7088 13.2185 13.2185 k = 0.5080 0.2042-0.5905 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0378 -12.0378 -11.9811 -11.9811 -10.9868 -10.9868 -10.5935 -10.5935 -10.5487 -10.5487 -10.5177 -10.5177 -5.0668 -5.0668 -3.1251 -3.1251 -3.0578 -3.0578 0.0641 0.0641 1.1038 1.1038 1.2323 1.2323 1.5397 1.5397 2.1149 2.1149 2.5572 2.5572 2.6270 2.6270 2.8077 2.8077 3.7542 3.7542 3.9817 3.9817 4.4287 4.4287 4.5825 4.5825 5.1333 5.1333 5.2541 5.2541 5.5548 5.5548 5.7358 5.7358 6.3005 6.3005 6.4082 6.4082 9.9707 9.9707 10.2266 10.2266 10.5288 10.5288 11.6093 11.6093 12.7072 12.7072 13.2327 13.2327 k = 0.5000 0.2221-0.5905 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0381 -12.0381 -11.9810 -11.9810 -10.9862 -10.9862 -10.5936 -10.5936 -10.5488 -10.5488 -10.5177 -10.5177 -5.0668 -5.0668 -3.1250 -3.1250 -3.0579 -3.0579 0.0626 0.0626 1.1039 1.1039 1.2380 1.2380 1.5344 1.5344 2.1144 2.1144 2.5909 2.5909 2.5939 2.5939 2.8073 2.8073 3.7534 3.7534 3.9801 3.9801 4.4296 4.4296 4.5817 4.5817 5.1388 5.1388 5.2488 5.2488 5.5566 5.5566 5.7358 5.7358 6.3013 6.3013 6.4108 6.4108 9.9691 9.9691 10.2261 10.2261 10.5288 10.5288 11.6078 11.6078 12.7067 12.7067 13.2375 13.2375 k = 0.5000 0.2221-0.5905 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0381 -12.0381 -11.9810 -11.9810 -10.9862 -10.9862 -10.5936 -10.5936 -10.5488 -10.5488 -10.5177 -10.5177 -5.0668 -5.0668 -3.1250 -3.1250 -3.0579 -3.0579 0.0626 0.0626 1.1039 1.1039 1.2380 1.2380 1.5344 1.5344 2.1144 2.1144 2.5909 2.5909 2.5939 2.5939 2.8073 2.8073 3.7534 3.7534 3.9801 3.9801 4.4296 4.4296 4.5817 4.5817 5.1388 5.1388 5.2488 5.2488 5.5566 5.5566 5.7358 5.7358 6.3013 6.3013 6.4108 6.4108 9.9691 9.9691 10.2261 10.2261 10.5288 10.5288 11.6078 11.6078 12.7067 12.7067 13.2375 13.2375 k = 0.5130 0.2279-0.5773 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0383 -12.0383 -11.9809 -11.9809 -10.9862 -10.9862 -10.5939 -10.5939 -10.5486 -10.5486 -10.5175 -10.5175 -5.0668 -5.0668 -3.1250 -3.1250 -3.0580 -3.0580 0.0629 0.0629 1.1003 1.1003 1.2410 1.2410 1.5344 1.5344 2.1139 2.1139 2.5891 2.5891 2.5952 2.5952 2.8070 2.8070 3.7542 3.7542 3.9820 3.9820 4.4305 4.4305 4.5822 4.5822 5.1381 5.1381 5.2470 5.2470 5.5578 5.5578 5.7350 5.7350 6.3012 6.3012 6.4102 6.4102 9.9691 9.9691 10.2270 10.2270 10.5289 10.5289 11.6090 11.6090 12.7059 12.7059 13.2374 13.2374 k = 0.5260 0.2337-0.5641 ( 9717 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4833 -18.4833 -12.0390 -12.0390 -11.9808 -11.9808 -10.9859 -10.9859 -10.5947 -10.5947 -10.5477 -10.5477 -10.5169 -10.5169 -5.0670 -5.0670 -3.1251 -3.1251 -3.0582 -3.0582 0.0639 0.0639 1.0903 1.0903 1.2491 1.2491 1.5341 1.5341 2.1124 2.1124 2.5858 2.5858 2.5970 2.5970 2.8061 2.8061 3.7566 3.7566 3.9876 3.9876 4.4333 4.4333 4.5836 4.5836 5.1361 5.1361 5.2415 5.2415 5.5612 5.5612 5.7328 5.7328 6.3011 6.3011 6.4086 6.4086 9.9691 9.9691 10.2295 10.2295 10.5294 10.5294 11.6126 11.6126 12.7034 12.7034 13.2370 13.2370 k = 0.5391 0.2395-0.5509 ( 9709 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4834 -18.4834 -12.0401 -12.0401 -11.9805 -11.9805 -10.9854 -10.9854 -10.5961 -10.5961 -10.5464 -10.5464 -10.5158 -10.5158 -5.0672 -5.0672 -3.1253 -3.1253 -3.0587 -3.0587 0.0655 0.0655 1.0757 1.0757 1.2606 1.2606 1.5337 1.5337 2.1100 2.1100 2.5817 2.5817 2.5987 2.5987 2.8047 2.8047 3.7605 3.7605 3.9967 3.9967 4.4379 4.4379 4.5859 4.5859 5.1326 5.1326 5.2328 5.2328 5.5665 5.5665 5.7293 5.7293 6.3008 6.3008 6.4061 6.4061 9.9692 9.9692 10.2337 10.2337 10.5302 10.5302 11.6185 11.6185 12.6993 12.6993 13.2365 13.2365 k = 0.5521 0.2453-0.5377 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4834 -18.4834 -12.0417 -12.0417 -11.9802 -11.9802 -10.9847 -10.9847 -10.5979 -10.5979 -10.5447 -10.5447 -10.5144 -10.5144 -5.0675 -5.0675 -3.1256 -3.1256 -3.0593 -3.0593 0.0678 0.0678 1.0578 1.0578 1.2741 1.2741 1.5331 1.5331 2.1066 2.1066 2.5770 2.5770 2.6002 2.6002 2.8028 2.8028 3.7660 3.7660 4.0093 4.0093 4.4442 4.4442 4.5890 4.5890 5.1277 5.1277 5.2214 5.2214 5.5732 5.5732 5.7246 5.7246 6.3006 6.3006 6.4025 6.4025 9.9692 9.9692 10.2393 10.2393 10.5313 10.5313 11.6269 11.6269 12.6939 12.6939 13.2357 13.2357 k = 0.5651 0.2510-0.5245 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.0436 -12.0436 -11.9798 -11.9798 -10.9837 -10.9837 -10.6001 -10.6001 -10.5426 -10.5426 -10.5127 -10.5127 -5.0679 -5.0679 -3.1259 -3.1259 -3.0601 -3.0601 0.0708 0.0708 1.0379 1.0379 1.2885 1.2885 1.5324 1.5324 2.1023 2.1023 2.5715 2.5715 2.6016 2.6016 2.8005 2.8005 3.7731 3.7731 4.0250 4.0250 4.4522 4.4522 4.5928 4.5928 5.1214 5.1214 5.2078 5.2078 5.5807 5.5807 5.7192 5.7192 6.3003 6.3003 6.3980 6.3980 9.9692 9.9692 10.2463 10.2463 10.5327 10.5327 11.6375 11.6375 12.6872 12.6872 13.2347 13.2347 k = 0.5781 0.2568-0.5113 ( 9715 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.0458 -12.0458 -11.9794 -11.9794 -10.9824 -10.9824 -10.6025 -10.6025 -10.5403 -10.5403 -10.5106 -10.5106 -5.0684 -5.0684 -3.1263 -3.1263 -3.0610 -3.0610 0.0743 0.0743 1.0165 1.0165 1.3032 1.3032 1.5315 1.5315 2.0970 2.0970 2.5654 2.5654 2.6031 2.6031 2.7978 2.7978 3.7819 3.7819 4.0436 4.0436 4.4618 4.4618 4.5970 4.5970 5.1136 5.1136 5.1927 5.1927 5.5883 5.5883 5.7135 5.7135 6.3002 6.3002 6.3928 6.3928 9.9691 9.9691 10.2545 10.2545 10.5342 10.5342 11.6505 11.6505 12.6795 12.6795 13.2335 13.2335 k = 0.5911 0.2626-0.4981 ( 9717 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4836 -18.4836 -12.0485 -12.0485 -11.9790 -11.9790 -10.9807 -10.9807 -10.6051 -10.6051 -10.5378 -10.5378 -10.5083 -10.5083 -5.0690 -5.0690 -3.1268 -3.1268 -3.0620 -3.0620 0.0784 0.0784 0.9940 0.9940 1.3179 1.3179 1.5303 1.5303 2.0909 2.0909 2.5586 2.5586 2.6046 2.6046 2.7947 2.7947 3.7923 3.7923 4.0647 4.0647 4.4727 4.4727 4.6016 4.6016 5.1044 5.1044 5.1767 5.1767 5.5954 5.5954 5.7080 5.7080 6.3002 6.3002 6.3868 6.3868 9.9688 9.9688 10.2637 10.2637 10.5360 10.5360 11.6656 11.6656 12.6711 12.6711 13.2321 13.2321 k = 0.6041 0.2684-0.4849 ( 9709 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4837 -18.4837 -12.0514 -12.0514 -11.9786 -11.9786 -10.9786 -10.9786 -10.6079 -10.6079 -10.5351 -10.5351 -10.5059 -10.5059 -5.0697 -5.0697 -3.1274 -3.1274 -3.0632 -3.0632 0.0831 0.0831 0.9707 0.9707 1.3322 1.3322 1.5290 1.5290 2.0841 2.0841 2.5512 2.5512 2.6062 2.6062 2.7914 2.7914 3.8043 3.8043 4.0880 4.0880 4.4848 4.4848 4.6061 4.6061 5.0939 5.0939 5.1603 5.1603 5.6012 5.6012 5.7033 5.7033 6.3004 6.3004 6.3802 6.3802 9.9685 9.9685 10.2736 10.2736 10.5379 10.5379 11.6830 11.6830 12.6623 12.6623 13.2305 13.2305 k = 0.6172 0.2742-0.4717 ( 9707 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4838 -18.4838 -12.0547 -12.0547 -11.9782 -11.9782 -10.9760 -10.9760 -10.6109 -10.6109 -10.5324 -10.5324 -10.5033 -10.5033 -5.0704 -5.0704 -3.1281 -3.1281 -3.0645 -3.0645 0.0883 0.0883 0.9468 0.9468 1.3462 1.3462 1.5275 1.5275 2.0765 2.0765 2.5434 2.5434 2.6079 2.6079 2.7878 2.7878 3.8181 3.8181 4.1129 4.1129 4.4981 4.4981 4.6103 4.6103 5.0822 5.0822 5.1439 5.1439 5.6049 5.6049 5.7003 5.7003 6.3010 6.3010 6.3731 6.3731 9.9679 9.9679 10.2840 10.2840 10.5398 10.5398 11.7024 11.7024 12.6534 12.6534 13.2289 13.2289 k = 0.6302 0.2800-0.4585 ( 9701 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4839 -18.4839 -12.0583 -12.0583 -11.9778 -11.9778 -10.9729 -10.9729 -10.6139 -10.6139 -10.5297 -10.5297 -10.5006 -10.5006 -5.0712 -5.0712 -3.1289 -3.1289 -3.0659 -3.0659 0.0939 0.0939 0.9224 0.9224 1.3596 1.3596 1.5257 1.5257 2.0684 2.0684 2.5351 2.5351 2.6096 2.6096 2.7840 2.7840 3.8336 3.8336 4.1390 4.1390 4.5123 4.5123 4.6139 4.6139 5.0698 5.0698 5.1279 5.1279 5.6063 5.6063 5.6995 5.6995 6.3020 6.3020 6.3656 6.3656 9.9671 9.9671 10.2945 10.2945 10.5418 10.5418 11.7238 11.7238 12.6446 12.6446 13.2271 13.2271 k = 0.6432 0.2857-0.4453 ( 9696 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4840 -18.4840 -12.0622 -12.0622 -11.9774 -11.9774 -10.9692 -10.9692 -10.6170 -10.6170 -10.5269 -10.5269 -10.4979 -10.4979 -5.0721 -5.0721 -3.1298 -3.1298 -3.0673 -3.0673 0.1000 0.1000 0.8978 0.8978 1.3724 1.3724 1.5237 1.5237 2.0598 2.0598 2.5265 2.5265 2.6112 2.6112 2.7799 2.7799 3.8509 3.8509 4.1659 4.1659 4.5272 4.5272 4.6163 4.6163 5.0570 5.0570 5.1128 5.1128 5.6052 5.6052 5.7007 5.7007 6.3036 6.3036 6.3579 6.3579 9.9662 9.9662 10.3050 10.3050 10.5437 10.5437 11.7469 11.7469 12.6363 12.6363 13.2252 13.2252 k = 0.6432 0.2857-0.4453 ( 9696 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4840 -18.4840 -12.0622 -12.0622 -11.9774 -11.9774 -10.9692 -10.9692 -10.6170 -10.6170 -10.5269 -10.5269 -10.4979 -10.4979 -5.0721 -5.0721 -3.1298 -3.1298 -3.0673 -3.0673 0.1000 0.1000 0.8978 0.8978 1.3724 1.3724 1.5237 1.5237 2.0598 2.0598 2.5265 2.5265 2.6112 2.6112 2.7799 2.7799 3.8509 3.8509 4.1659 4.1659 4.5272 4.5272 4.6163 4.6163 5.0570 5.0570 5.1128 5.1128 5.6052 5.6052 5.7007 5.7007 6.3036 6.3036 6.3579 6.3579 9.9662 9.9662 10.3050 10.3050 10.5437 10.5437 11.7469 11.7469 12.6363 12.6363 13.2252 13.2252 k = 0.6387 0.2838-0.4268 ( 9705 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8238 -25.8238 -18.4844 -18.4844 -12.0652 -12.0652 -11.9817 -11.9817 -10.9583 -10.9583 -10.6153 -10.6153 -10.5279 -10.5279 -10.4981 -10.4981 -5.0724 -5.0724 -3.1281 -3.1281 -3.0694 -3.0694 0.1028 0.1028 0.8594 0.8594 1.3980 1.3980 1.5179 1.5179 2.0403 2.0403 2.5109 2.5109 2.6144 2.6144 2.7687 2.7687 3.8745 3.8745 4.1915 4.1915 4.5478 4.5478 4.6013 4.6013 5.0569 5.0569 5.1146 5.1146 5.5999 5.5999 5.7147 5.7147 6.3134 6.3134 6.3556 6.3556 9.9662 9.9662 10.3045 10.3045 10.5400 10.5400 11.7729 11.7729 12.6092 12.6092 13.2217 13.2217 k = 0.6342 0.2818-0.4084 ( 9707 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8238 -25.8238 -18.4847 -18.4847 -12.0705 -12.0705 -11.9845 -11.9845 -10.9454 -10.9454 -10.6138 -10.6138 -10.5286 -10.5286 -10.4985 -10.4985 -5.0729 -5.0729 -3.1264 -3.1264 -3.0720 -3.0720 0.1056 0.1056 0.8209 0.8209 1.4213 1.4213 1.5123 1.5123 2.0200 2.0200 2.4934 2.4934 2.6185 2.6185 2.7540 2.7540 3.9020 3.9020 4.2152 4.2152 4.5692 4.5692 4.5883 4.5883 5.0578 5.0578 5.1179 5.1179 5.5931 5.5931 5.7316 5.7316 6.3222 6.3222 6.3573 6.3573 9.9659 9.9659 10.3027 10.3027 10.5350 10.5350 11.8017 11.8017 12.5812 12.5812 13.2183 13.2183 k = 0.6298 0.2798-0.3899 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8237 -25.8237 -18.4852 -18.4852 -12.0784 -12.0784 -11.9857 -11.9857 -10.9306 -10.9306 -10.6127 -10.6127 -10.5291 -10.5291 -10.4991 -10.4991 -5.0735 -5.0735 -3.1246 -3.1246 -3.0750 -3.0750 0.1082 0.1082 0.7827 0.7827 1.4413 1.4413 1.5076 1.5076 1.9996 1.9996 2.4743 2.4743 2.6231 2.6231 2.7366 2.7366 3.9326 3.9326 4.2344 4.2344 4.5763 4.5763 4.5942 4.5942 5.0598 5.0598 5.1221 5.1221 5.5862 5.5862 5.7505 5.7505 6.3276 6.3276 6.3653 6.3653 9.9652 9.9652 10.2995 10.2995 10.5288 10.5288 11.8334 11.8334 12.5524 12.5524 13.2152 13.2152 k = 0.6253 0.2778-0.3715 ( 9707 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8237 -25.8237 -18.4857 -18.4857 -12.0886 -12.0886 -11.9851 -11.9851 -10.9142 -10.9142 -10.6119 -10.6119 -10.5295 -10.5295 -10.4999 -10.4999 -5.0742 -5.0742 -3.1227 -3.1227 -3.0783 -3.0783 0.1103 0.1103 0.7450 0.7450 1.4564 1.4564 1.5054 1.5054 1.9799 1.9799 2.4537 2.4537 2.6279 2.6279 2.7172 2.7172 3.9658 3.9658 4.2466 4.2466 4.5727 4.5727 4.6166 4.6166 5.0625 5.0625 5.1272 5.1272 5.5806 5.5806 5.7707 5.7707 6.3298 6.3298 6.3796 6.3796 9.9639 9.9639 10.2949 10.2949 10.5213 10.5213 11.8678 11.8678 12.5231 12.5231 13.2124 13.2124 k = 0.6208 0.2758-0.3530 ( 9707 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8236 -25.8236 -18.4863 -18.4863 -12.1008 -12.1008 -11.9830 -11.9830 -10.8963 -10.8963 -10.6114 -10.6114 -10.5299 -10.5299 -10.5008 -10.5008 -5.0750 -5.0750 -3.1207 -3.1207 -3.0820 -3.0820 0.1117 0.1117 0.7082 0.7082 1.4637 1.4637 1.5086 1.5086 1.9614 1.9614 2.4319 2.4319 2.6327 2.6327 2.6964 2.6964 4.0011 4.0011 4.2501 4.2501 4.5752 4.5752 4.6392 4.6392 5.0659 5.0659 5.1332 5.1332 5.5774 5.5774 5.7917 5.7917 6.3310 6.3310 6.3980 6.3980 9.9618 9.9618 10.2889 10.2889 10.5124 10.5124 11.9046 11.9046 12.4937 12.4937 13.2100 13.2100 k = 0.6163 0.2738-0.3346 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8236 -25.8236 -18.4869 -18.4869 -12.1145 -12.1145 -11.9797 -11.9797 -10.8772 -10.8772 -10.6112 -10.6112 -10.5303 -10.5303 -10.5016 -10.5016 -5.0760 -5.0760 -3.1188 -3.1188 -3.0859 -3.0859 0.1119 0.1119 0.6730 0.6730 1.4630 1.4630 1.5171 1.5171 1.9445 1.9445 2.4094 2.4094 2.6370 2.6370 2.6749 2.6749 4.0379 4.0379 4.2446 4.2446 4.5832 4.5832 4.6611 4.6611 5.0699 5.0699 5.1404 5.1404 5.5777 5.5777 5.8133 5.8133 6.3323 6.3323 6.4194 6.4194 9.9589 9.9589 10.2817 10.2817 10.5021 10.5021 11.9434 11.9434 12.4648 12.4648 13.2080 13.2080 k = 0.6119 0.2718-0.3161 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8235 -25.8235 -18.4875 -18.4875 -12.1293 -12.1293 -11.9755 -11.9755 -10.8571 -10.8571 -10.6113 -10.6113 -10.5311 -10.5311 -10.5021 -10.5021 -5.0770 -5.0770 -3.1169 -3.1169 -3.0901 -3.0901 0.1105 0.1105 0.6399 0.6399 1.4581 1.4581 1.5270 1.5270 1.9297 1.9297 2.3862 2.3862 2.6397 2.6397 2.6543 2.6543 4.0758 4.0758 4.2316 4.2316 4.5936 4.5936 4.6823 4.6823 5.0748 5.0748 5.1492 5.1492 5.5823 5.5823 5.8350 5.8350 6.3344 6.3344 6.4432 6.4432 9.9548 9.9548 10.2733 10.2733 10.4905 10.4905 11.9836 11.9836 12.4369 12.4369 13.2064 13.2064 k = 0.6074 0.2698-0.2977 ( 9730 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8235 -25.8235 -18.4882 -18.4882 -12.1449 -12.1449 -11.9705 -11.9705 -10.8361 -10.8361 -10.6117 -10.6117 -10.5323 -10.5323 -10.5022 -10.5022 -5.0782 -5.0782 -3.1153 -3.1153 -3.0942 -3.0942 0.1070 0.1070 0.6094 0.6094 1.4513 1.4513 1.5357 1.5357 1.9173 1.9173 2.3628 2.3628 2.6282 2.6282 2.6474 2.6474 4.1142 4.1142 4.2133 4.2133 4.6026 4.6026 4.7027 4.7027 5.0814 5.0814 5.1601 5.1601 5.5916 5.5916 5.8567 5.8567 6.3374 6.3374 6.4690 6.4690 9.9496 9.9496 10.2640 10.2640 10.4776 10.4776 12.0240 12.0240 12.4113 12.4113 13.2054 13.2054 k = 0.6029 0.2678-0.2792 ( 9738 PWs) bands (ev): -49.7716 -49.7716 -26.5044 -26.5044 -25.8804 -25.8804 -25.8234 -25.8234 -18.4889 -18.4889 -12.1610 -12.1610 -11.9648 -11.9648 -10.8145 -10.8145 -10.6122 -10.6122 -10.5343 -10.5343 -10.5018 -10.5018 -5.0794 -5.0794 -3.1143 -3.1143 -3.0980 -3.0980 0.1009 0.1009 0.5823 0.5823 1.4436 1.4436 1.5421 1.5421 1.9077 1.9077 2.3394 2.3394 2.6074 2.6074 2.6497 2.6497 4.1517 4.1517 4.1927 4.1927 4.6064 4.6064 4.7224 4.7224 5.0903 5.0903 5.1736 5.1736 5.6057 5.6057 5.8783 5.8783 6.3415 6.3415 6.4966 6.4966 9.9430 9.9430 10.2539 10.2539 10.4633 10.4633 12.0629 12.0629 12.3898 12.3898 13.2050 13.2050 k = 0.5984 0.2659-0.2608 ( 9740 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8233 -25.8233 -18.4896 -18.4896 -12.1775 -12.1775 -11.9587 -11.9587 -10.7924 -10.7924 -10.6130 -10.6130 -10.5369 -10.5369 -10.5007 -10.5007 -5.0808 -5.0808 -3.1148 -3.1148 -3.1004 -3.1004 0.0918 0.0918 0.5591 0.5591 1.4355 1.4355 1.5456 1.5456 1.9009 1.9009 2.3161 2.3161 2.5864 2.5864 2.6523 2.6523 4.1611 4.1611 4.1981 4.1981 4.6027 4.6027 4.7412 4.7412 5.1023 5.1023 5.1899 5.1899 5.6244 5.6244 5.8994 5.8994 6.3468 6.3468 6.5256 6.5256 9.9350 9.9350 10.2431 10.2431 10.4478 10.4478 12.0969 12.0969 12.3758 12.3758 13.2052 13.2052 k = 0.5940 0.2639-0.2423 ( 9741 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8233 -25.8233 -18.4903 -18.4903 -12.1940 -12.1940 -11.9522 -11.9522 -10.7700 -10.7700 -10.6139 -10.6139 -10.5403 -10.5403 -10.4992 -10.4992 -5.0822 -5.0822 -3.1174 -3.1174 -3.1009 -3.1009 0.0794 0.0794 0.5403 0.5403 1.4272 1.4272 1.5461 1.5461 1.8970 1.8970 2.2932 2.2932 2.5660 2.5660 2.6548 2.6548 4.1374 4.1374 4.2353 4.2353 4.5907 4.5907 4.7583 4.7583 5.1177 5.1177 5.2095 5.2095 5.6472 5.6472 5.9202 5.9202 6.3533 6.3533 6.5558 6.5558 9.9255 9.9255 10.2320 10.2320 10.4310 10.4310 12.1211 12.1211 12.3741 12.3741 13.2060 13.2060 k = 0.5895 0.2619-0.2238 ( 9728 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8232 -25.8232 -18.4911 -18.4911 -12.2105 -12.2105 -11.9454 -11.9454 -10.7476 -10.7476 -10.6148 -10.6148 -10.5443 -10.5443 -10.4971 -10.4971 -5.0837 -5.0837 -3.1216 -3.1216 -3.0999 -3.0999 0.0637 0.0637 0.5261 0.5261 1.4187 1.4187 1.5435 1.5435 1.8959 1.8959 2.2708 2.2708 2.5464 2.5464 2.6574 2.6574 4.1113 4.1113 4.2739 4.2739 4.5708 4.5708 4.7731 4.7731 5.1366 5.1366 5.2320 5.2320 5.6736 5.6736 5.9405 5.9405 6.3613 6.3613 6.5869 6.5869 9.9144 9.9144 10.2207 10.2207 10.4132 10.4132 12.1310 12.1310 12.3891 12.3891 13.2075 13.2075 k = 0.5850 0.2599-0.2054 ( 9727 PWs) bands (ev): -49.7716 -49.7716 -26.5043 -26.5043 -25.8804 -25.8804 -25.8231 -25.8231 -18.4919 -18.4919 -12.2268 -12.2268 -11.9383 -11.9383 -10.7253 -10.7253 -10.6158 -10.6158 -10.5487 -10.5487 -10.4947 -10.4947 -5.0853 -5.0853 -3.1267 -3.1267 -3.0981 -3.0981 0.0449 0.0449 0.5165 0.5165 1.4103 1.4103 1.5380 1.5380 1.8971 1.8971 2.2491 2.2491 2.5276 2.5276 2.6604 2.6604 4.0849 4.0849 4.3119 4.3119 4.5442 4.5442 4.7850 4.7850 5.1586 5.1586 5.2572 5.2572 5.7028 5.7028 5.9602 5.9602 6.3705 6.3705 6.6186 6.6186 9.9017 9.9017 10.2094 10.2094 10.3943 10.3943 12.1266 12.1266 12.4208 12.4208 13.2096 13.2096 k = 0.5805 0.2579-0.1869 ( 9713 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8230 -25.8230 -18.4926 -18.4926 -12.2429 -12.2429 -11.9310 -11.9310 -10.7033 -10.7033 -10.6168 -10.6168 -10.5535 -10.5535 -10.4921 -10.4921 -5.0869 -5.0869 -3.1321 -3.1321 -3.0961 -3.0961 0.0234 0.0234 0.5110 0.5110 1.4018 1.4018 1.5300 1.5300 1.9004 1.9004 2.2282 2.2282 2.5094 2.5094 2.6642 2.6642 4.0587 4.0587 4.3484 4.3484 4.5126 4.5126 4.7940 4.7940 5.1833 5.1833 5.2842 5.2842 5.7342 5.7342 5.9793 5.9793 6.3812 6.3812 6.6505 6.6505 9.8875 9.8875 10.1982 10.1982 10.3745 10.3745 12.1123 12.1123 12.4647 12.4647 13.2123 13.2123 k = 0.5761 0.2559-0.1685 ( 9711 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8230 -25.8230 -18.4934 -18.4934 -12.2585 -12.2585 -11.9236 -11.9236 -10.6819 -10.6819 -10.6176 -10.6176 -10.5585 -10.5585 -10.4893 -10.4893 -5.0886 -5.0886 -3.1378 -3.1378 -3.0939 -3.0939 -0.0003 -0.0003 0.5093 0.5093 1.3935 1.3935 1.5197 1.5197 1.9054 1.9054 2.2081 2.2081 2.4917 2.4917 2.6692 2.6692 4.0332 4.0332 4.3802 4.3802 4.4799 4.4799 4.8001 4.8001 5.2102 5.2102 5.3125 5.3125 5.7673 5.7673 5.9979 5.9979 6.3933 6.3933 6.6825 6.6825 9.8719 9.8719 10.1874 10.1874 10.3539 10.3539 12.0924 12.0924 12.5163 12.5163 13.2157 13.2157 k = 0.5716 0.2539-0.1500 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8229 -25.8229 -18.4942 -18.4942 -12.2736 -12.2736 -11.9161 -11.9161 -10.6617 -10.6617 -10.6179 -10.6179 -10.5636 -10.5636 -10.4864 -10.4864 -5.0903 -5.0903 -3.1435 -3.1435 -3.0916 -3.0916 -0.0254 -0.0254 0.5107 0.5107 1.3853 1.3853 1.5077 1.5077 1.9116 1.9116 2.1890 2.1890 2.4743 2.4743 2.6758 2.6758 4.0085 4.0085 4.3924 4.3924 4.4622 4.4622 4.8038 4.8038 5.2388 5.2388 5.3410 5.3410 5.8013 5.8013 6.0157 6.0157 6.4067 6.4067 6.7142 6.7142 9.8550 9.8550 10.1770 10.1770 10.3328 10.3328 12.0697 12.0697 12.5728 12.5728 13.2197 13.2197 k = 0.5671 0.2519-0.1316 ( 9721 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8228 -25.8228 -18.4949 -18.4949 -12.2882 -12.2882 -11.9086 -11.9086 -10.6438 -10.6438 -10.6170 -10.6170 -10.5684 -10.5684 -10.4835 -10.4835 -5.0920 -5.0920 -3.1492 -3.1492 -3.0893 -3.0893 -0.0513 -0.0513 0.5148 0.5148 1.3773 1.3773 1.4943 1.4943 1.9187 1.9187 2.1708 2.1708 2.4570 2.4570 2.6844 2.6844 3.9849 3.9849 4.3654 4.3654 4.4795 4.4795 4.8055 4.8055 5.2684 5.2684 5.3691 5.3691 5.8357 5.8357 6.0328 6.0328 6.4214 6.4214 6.7452 6.7452 9.8370 9.8370 10.1671 10.1671 10.3113 10.3113 12.0458 12.0458 12.6321 12.6321 13.2243 13.2243 k = 0.5626 0.2500-0.1131 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5042 -26.5042 -25.8804 -25.8804 -25.8228 -25.8228 -18.4957 -18.4957 -12.3021 -12.3021 -11.9012 -11.9012 -10.6319 -10.6319 -10.6119 -10.6119 -10.5721 -10.5721 -10.4806 -10.4806 -5.0937 -5.0937 -3.1548 -3.1548 -3.0871 -3.0871 -0.0774 -0.0774 0.5209 0.5209 1.3695 1.3695 1.4798 1.4798 1.9264 1.9264 2.1537 2.1537 2.4396 2.4396 2.6953 2.6953 3.9623 3.9623 4.3223 4.3223 4.5095 4.5095 4.8055 4.8055 5.2987 5.2987 5.3962 5.3962 5.8701 5.8701 6.0490 6.0490 6.4373 6.4373 6.7754 6.7754 9.8183 9.8183 10.1578 10.1578 10.2896 10.2896 12.0217 12.0217 12.6932 12.6932 13.2293 13.2294 k = 0.5582 0.2480-0.0947 ( 9728 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8227 -25.8227 -18.4964 -18.4964 -12.3153 -12.3153 -11.8939 -11.8939 -10.6283 -10.6283 -10.6028 -10.6028 -10.5724 -10.5724 -10.4777 -10.4777 -5.0953 -5.0953 -3.1603 -3.1603 -3.0849 -3.0849 -0.1032 -0.1032 0.5286 0.5286 1.3620 1.3620 1.4647 1.4647 1.9346 1.9346 2.1376 2.1376 2.4219 2.4219 2.7087 2.7087 3.9411 3.9411 4.2748 4.2748 4.5411 4.5411 4.8043 4.8043 5.3290 5.3290 5.4219 5.4219 5.9039 5.9039 6.0644 6.0644 6.4543 6.4543 6.8045 6.8045 9.7990 9.7990 10.1491 10.1491 10.2679 10.2679 11.9980 11.9980 12.7550 12.7550 13.2349 13.2349 k = 0.5537 0.2460-0.0762 ( 9742 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8226 -25.8226 -18.4970 -18.4970 -12.3277 -12.3277 -11.8868 -11.8868 -10.6278 -10.6278 -10.5989 -10.5989 -10.5652 -10.5652 -10.4750 -10.4750 -5.0970 -5.0970 -3.1656 -3.1656 -3.0828 -3.0828 -0.1284 -0.1284 0.5375 0.5375 1.3546 1.3546 1.4493 1.4493 1.9432 1.9432 2.1227 2.1227 2.4040 2.4040 2.7245 2.7245 3.9211 3.9211 4.2255 4.2255 4.5721 4.5721 4.8021 4.8021 5.3590 5.3590 5.4458 5.4458 5.9368 5.9368 6.0788 6.0788 6.4721 6.4721 6.8322 6.8322 9.7796 9.7796 10.1409 10.1409 10.2465 10.2465 11.9752 11.9752 12.8170 12.8170 13.2408 13.2408 k = 0.5492 0.2440-0.0578 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8226 -25.8226 -18.4977 -18.4977 -12.3393 -12.3393 -11.8800 -11.8800 -10.6282 -10.6282 -10.6008 -10.6008 -10.5522 -10.5522 -10.4723 -10.4723 -5.0985 -5.0985 -3.1707 -3.1707 -3.0809 -3.0809 -0.1524 -0.1524 0.5473 0.5473 1.3476 1.3476 1.4338 1.4338 1.9520 1.9520 2.1089 2.1089 2.3858 2.3858 2.7427 2.7427 3.9025 3.9025 4.1755 4.1755 4.6017 4.6017 4.7994 4.7994 5.3882 5.3882 5.4677 5.4677 5.9684 5.9684 6.0921 6.0921 6.4904 6.4904 6.8584 6.8584 9.7603 9.7603 10.1333 10.1333 10.2256 10.2256 11.9535 11.9535 12.8783 12.8783 13.2470 13.2470 k = 0.5447 0.2420-0.0393 ( 9738 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8225 -25.8225 -18.4983 -18.4983 -12.3500 -12.3500 -11.8735 -11.8735 -10.6288 -10.6288 -10.6048 -10.6048 -10.5378 -10.5378 -10.4698 -10.4698 -5.1000 -5.1000 -3.1755 -3.1755 -3.0790 -3.0790 -0.1751 -0.1751 0.5575 0.5575 1.3408 1.3408 1.4187 1.4187 1.9610 1.9610 2.0962 2.0962 2.3675 2.3675 2.7629 2.7629 3.8854 3.8854 4.1258 4.1258 4.6297 4.6297 4.7962 4.7962 5.4163 5.4163 5.4876 5.4876 5.9982 5.9982 6.1044 6.1044 6.5090 6.5090 6.8829 6.8829 9.7413 9.7413 10.1264 10.1264 10.2053 10.2053 11.9331 11.9331 12.9384 12.9384 13.2534 13.2534 k = 0.5403 0.2400-0.0209 ( 9736 PWs) bands (ev): -49.7716 -49.7716 -26.5041 -26.5041 -25.8804 -25.8804 -25.8225 -25.8225 -18.4988 -18.4988 -12.3598 -12.3598 -11.8674 -11.8674 -10.6295 -10.6295 -10.6093 -10.6093 -10.5238 -10.5238 -10.4674 -10.4674 -5.1015 -5.1015 -3.1800 -3.1800 -3.0773 -3.0773 -0.1962 -0.1962 0.5678 0.5678 1.3341 1.3341 1.4042 1.4042 1.9703 1.9703 2.0847 2.0847 2.3491 2.3491 2.7848 2.7848 3.8697 3.8697 4.0769 4.0769 4.6557 4.6557 4.7929 4.7929 5.4428 5.4428 5.5055 5.5055 6.0259 6.0259 6.1157 6.1157 6.5274 6.5274 6.9054 6.9054 9.7232 9.7232 10.1200 10.1200 10.1861 10.1861 11.9143 11.9143 12.9966 12.9966 13.2598 13.2598 k = 0.5358 0.2380-0.0024 ( 9726 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8224 -25.8224 -18.4993 -18.4993 -12.3687 -12.3687 -11.8617 -11.8617 -10.6302 -10.6302 -10.6137 -10.6137 -10.5108 -10.5108 -10.4652 -10.4652 -5.1028 -5.1028 -3.1841 -3.1841 -3.0757 -3.0757 -0.2155 -0.2155 0.5780 0.5780 1.3277 1.3277 1.3907 1.3907 1.9797 1.9797 2.0743 2.0743 2.3310 2.3310 2.8078 2.8078 3.8555 3.8555 4.0297 4.0297 4.6794 4.6794 4.7895 4.7895 5.4674 5.4674 5.5213 5.5213 6.0512 6.0512 6.1260 6.1260 6.5453 6.5453 6.9259 6.9259 9.7061 9.7061 10.1142 10.1142 10.1681 10.1681 11.8971 11.8971 13.0521 13.0521 13.2662 13.2662 k = 0.5313 0.2360 0.0160 ( 9722 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8224 -25.8224 -18.4998 -18.4998 -12.3766 -12.3766 -11.8565 -11.8565 -10.6308 -10.6308 -10.6179 -10.6179 -10.4990 -10.4990 -10.4632 -10.4632 -5.1040 -5.1040 -3.1878 -3.1878 -3.0743 -3.0743 -0.2329 -0.2329 0.5879 0.5879 1.3214 1.3214 1.3785 1.3785 1.9892 1.9892 2.0652 2.0652 2.3132 2.3132 2.8314 2.8314 3.8427 3.8427 3.9849 3.9849 4.7008 4.7008 4.7863 4.7863 5.4897 5.4897 5.5353 5.5353 6.0737 6.0737 6.1353 6.1353 6.5623 6.5623 6.9442 6.9442 9.6902 9.6902 10.1091 10.1091 10.1516 10.1516 11.8816 11.8816 13.1040 13.1040 13.2723 13.2723 k = 0.5268 0.2341 0.0345 ( 9720 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5002 -18.5002 -12.3835 -12.3835 -11.8519 -11.8519 -10.6314 -10.6314 -10.6218 -10.6218 -10.4887 -10.4887 -10.4613 -10.4613 -5.1051 -5.1051 -3.1911 -3.1911 -3.0730 -3.0730 -0.2481 -0.2481 0.5970 0.5970 1.3153 1.3153 1.3679 1.3679 1.9986 1.9986 2.0572 2.0572 2.2962 2.2962 2.8548 2.8548 3.8313 3.8313 3.9434 3.9434 4.7197 4.7197 4.7833 4.7833 5.5094 5.5094 5.5476 5.5476 6.0931 6.0931 6.1438 6.1438 6.5780 6.5780 6.9603 6.9603 9.6760 9.6760 10.1046 10.1046 10.1367 10.1367 11.8681 11.8681 13.1516 13.1516 13.2781 13.2781 k = 0.5224 0.2321 0.0529 ( 9717 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5005 -18.5005 -12.3894 -12.3894 -11.8479 -11.8479 -10.6319 -10.6319 -10.6252 -10.6252 -10.4799 -10.4799 -10.4595 -10.4595 -5.1060 -5.1060 -3.1940 -3.1940 -3.0720 -3.0720 -0.2611 -0.2611 0.6053 0.6053 1.3094 1.3094 1.3590 1.3590 2.0077 2.0077 2.0504 2.0504 2.2804 2.2804 2.8772 2.8772 3.8212 3.8212 3.9062 3.9062 4.7359 4.7359 4.7806 4.7806 5.5260 5.5260 5.5582 5.5582 6.1092 6.1092 6.1516 6.1516 6.5920 6.5920 6.9740 6.9740 9.6635 9.6635 10.1006 10.1006 10.1239 10.1239 11.8565 11.8565 13.1939 13.1939 13.2833 13.2833 k = 0.5179 0.2301 0.0714 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5008 -18.5008 -12.3942 -12.3942 -11.8446 -11.8446 -10.6324 -10.6324 -10.6280 -10.6280 -10.4729 -10.4729 -10.4578 -10.4578 -5.1068 -5.1068 -3.1963 -3.1963 -3.0711 -3.0711 -0.2719 -0.2719 0.6124 0.6124 1.3039 1.3039 1.3520 1.3520 2.0162 2.0162 2.0449 2.0449 2.2661 2.2661 2.8976 2.8976 3.8120 3.8120 3.8745 3.8745 4.7493 4.7493 4.7783 4.7783 5.5393 5.5393 5.5675 5.5675 6.1218 6.1218 6.1588 6.1588 6.6040 6.6040 6.9853 6.9853 9.6531 9.6531 10.0972 10.0972 10.1131 10.1131 11.8469 11.8469 13.2299 13.2299 13.2878 13.2878 k = 0.5134 0.2281 0.0898 ( 9724 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8223 -25.8223 -18.5011 -18.5011 -12.3980 -12.3980 -11.8420 -11.8420 -10.6328 -10.6328 -10.6302 -10.6302 -10.4678 -10.4678 -10.4560 -10.4560 -5.1074 -5.1074 -3.1982 -3.1982 -3.0704 -3.0704 -0.2804 -0.2804 0.6182 0.6182 1.2992 1.2992 1.3467 1.3467 2.0237 2.0237 2.0406 2.0406 2.2540 2.2540 2.9149 2.9149 3.8034 3.8034 3.8499 3.8499 4.7597 4.7597 4.7766 4.7766 5.5493 5.5493 5.5752 5.5752 6.1309 6.1309 6.1651 6.1651 6.6136 6.6136 6.9941 6.9941 9.6448 9.6448 10.0944 10.0944 10.1049 10.1049 11.8394 11.8394 13.2586 13.2586 13.2915 13.2916 k = 0.5089 0.2261 0.1083 ( 9734 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5012 -18.5012 -12.4007 -12.4007 -11.8401 -11.8401 -10.6332 -10.6332 -10.6317 -10.6317 -10.4645 -10.4645 -10.4543 -10.4543 -5.1078 -5.1078 -3.1995 -3.1995 -3.0699 -3.0699 -0.2864 -0.2864 0.6225 0.6225 1.2955 1.2955 1.3431 1.3431 2.0297 2.0297 2.0375 2.0375 2.2446 2.2446 2.9283 2.9283 3.7952 3.7952 3.8334 3.8334 4.7669 4.7669 4.7756 4.7756 5.5561 5.5561 5.5811 5.5811 6.1369 6.1369 6.1701 6.1701 6.6207 6.6207 7.0005 7.0005 9.6387 9.6387 10.0919 10.0919 10.0993 10.0993 11.8340 11.8340 13.2792 13.2792 13.2944 13.2944 k = 0.5045 0.2241 0.1267 ( 9738 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5013 -18.5013 -12.4023 -12.4023 -11.8389 -11.8389 -10.6337 -10.6337 -10.6324 -10.6324 -10.4628 -10.4628 -10.4531 -10.4531 -5.1081 -5.1081 -3.2003 -3.2003 -3.0696 -3.0696 -0.2901 -0.2901 0.6251 0.6251 1.2932 1.2932 1.3410 1.3410 2.0336 2.0336 2.0357 2.0357 2.2387 2.2387 2.9367 2.9367 3.7887 3.7887 3.8247 3.8247 4.7707 4.7707 4.7756 4.7756 5.5600 5.5600 5.5848 5.5848 6.1403 6.1403 6.1733 6.1733 6.6250 6.6250 7.0043 7.0043 9.6351 9.6351 10.0899 10.0899 10.0964 10.0964 11.8308 11.8308 13.2911 13.2911 13.2968 13.2968 k = 0.5000 0.2221 0.1452 ( 9744 PWs) bands (ev): -49.7716 -49.7716 -26.5040 -26.5040 -25.8804 -25.8804 -25.8222 -25.8222 -18.5013 -18.5013 -12.4029 -12.4029 -11.8385 -11.8385 -10.6339 -10.6339 -10.6326 -10.6326 -10.4623 -10.4623 -10.4526 -10.4526 -5.1082 -5.1082 -3.2006 -3.2006 -3.0695 -3.0695 -0.2913 -0.2913 0.6260 0.6260 1.2924 1.2924 1.3403 1.3403 2.0347 2.0347 2.0354 2.0354 2.2366 2.2366 2.9395 2.9395 3.7862 3.7862 3.8220 3.8220 4.7715 4.7715 4.7760 4.7760 5.5613 5.5613 5.5861 5.5861 6.1414 6.1414 6.1744 6.1744 6.6265 6.6265 7.0055 7.0055 9.6338 9.6338 10.0891 10.0891 10.0955 10.0955 11.8297 11.8297 13.2941 13.2941 13.2985 13.2985 k = 0.5000-0.4517-0.2952 ( 9698 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1231 -12.1231 -11.9080 -11.9080 -10.9909 -10.9909 -10.6810 -10.6810 -10.4906 -10.4906 -10.4483 -10.4483 -5.0898 -5.0898 -3.1801 -3.1801 -3.0716 -3.0716 0.1885 0.1885 1.0230 1.0230 1.1339 1.1339 1.5944 1.5944 2.1109 2.1109 2.4840 2.4840 2.6774 2.6774 2.7265 2.7265 4.0642 4.0642 4.3437 4.3437 4.5867 4.5867 4.7029 4.7029 4.7569 4.7569 5.1365 5.1365 5.4458 5.4458 5.5825 5.5825 6.2096 6.2096 6.3251 6.3251 9.9469 9.9469 10.4468 10.4468 10.6026 10.6026 11.8697 11.8697 12.8289 12.8289 13.2253 13.2253 k = 0.5143-0.4406-0.2880 ( 9696 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1228 -12.1228 -11.9082 -11.9082 -10.9909 -10.9909 -10.6808 -10.6808 -10.4907 -10.4907 -10.4485 -10.4485 -5.0898 -5.0898 -3.1799 -3.1799 -3.0716 -3.0716 0.1881 0.1881 1.0211 1.0211 1.1363 1.1363 1.5940 1.5940 2.1108 2.1108 2.4843 2.4843 2.6769 2.6769 2.7269 2.7269 4.0624 4.0624 4.3429 4.3429 4.5894 4.5894 4.7030 4.7030 4.7557 4.7557 5.1352 5.1352 5.4475 5.4475 5.5829 5.5829 6.2099 6.2099 6.3252 6.3252 9.9470 9.9470 10.4464 10.4464 10.6024 10.6024 11.8691 11.8691 12.8289 12.8289 13.2266 13.2266 k = 0.5286-0.4295-0.2807 ( 9695 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1222 -12.1222 -11.9089 -11.9089 -10.9908 -10.9908 -10.6802 -10.6802 -10.4909 -10.4909 -10.4490 -10.4490 -5.0895 -5.0895 -3.1793 -3.1793 -3.0715 -3.0715 0.1871 0.1871 1.0158 1.0158 1.1431 1.1431 1.5929 1.5929 2.1106 2.1106 2.4853 2.4853 2.6755 2.6755 2.7280 2.7280 4.0572 4.0572 4.3406 4.3406 4.5971 4.5971 4.7034 4.7034 4.7525 4.7525 5.1314 5.1314 5.4524 5.4524 5.5841 5.5841 6.2108 6.2108 6.3254 6.3254 9.9472 9.9472 10.4451 10.4451 10.6018 10.6018 11.8676 11.8676 12.8289 12.8289 13.2307 13.2308 k = 0.5430-0.4184-0.2735 ( 9695 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1212 -12.1212 -11.9100 -11.9100 -10.9907 -10.9907 -10.6793 -10.6793 -10.4913 -10.4913 -10.4499 -10.4499 -5.0892 -5.0892 -3.1783 -3.1783 -3.0715 -3.0715 0.1854 0.1854 1.0082 1.0082 1.1532 1.1532 1.5911 1.5911 2.1102 2.1102 2.4870 2.4870 2.6731 2.6731 2.7297 2.7297 4.0489 4.0489 4.3369 4.3369 4.6089 4.6089 4.7040 4.7040 4.7476 4.7476 5.1253 5.1253 5.4603 5.4603 5.5860 5.5860 6.2123 6.2123 6.3257 6.3257 9.9475 9.9475 10.4430 10.4430 10.6008 10.6008 11.8650 11.8650 12.8288 12.8288 13.2371 13.2373 k = 0.5573-0.4073-0.2662 ( 9695 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1197 -12.1197 -11.9115 -11.9115 -10.9906 -10.9906 -10.6780 -10.6780 -10.4918 -10.4918 -10.4511 -10.4511 -5.0887 -5.0887 -3.1769 -3.1769 -3.0714 -3.0714 0.1830 0.1830 0.9993 0.9993 1.1655 1.1655 1.5887 1.5887 2.1096 2.1096 2.4893 2.4893 2.6700 2.6700 2.7321 2.7321 4.0381 4.0381 4.3319 4.3319 4.6232 4.6232 4.7051 4.7051 4.7421 4.7421 5.1175 5.1175 5.4707 5.4707 5.5886 5.5886 6.2143 6.2143 6.3261 6.3261 9.9479 9.9479 10.4400 10.4400 10.5994 10.5994 11.8615 11.8615 12.8281 12.8281 13.2452 13.2458 k = 0.5716-0.3961-0.2589 ( 9696 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1179 -12.1179 -11.9134 -11.9134 -10.9903 -10.9903 -10.6763 -10.6763 -10.4925 -10.4925 -10.4526 -10.4526 -5.0880 -5.0880 -3.1751 -3.1751 -3.0712 -3.0712 0.1801 0.1801 0.9898 0.9898 1.1794 1.1794 1.5856 1.5856 2.1088 2.1088 2.4920 2.4920 2.6661 2.6661 2.7349 2.7349 4.0255 4.0255 4.3256 4.3256 4.6370 4.6370 4.7078 4.7078 4.7371 4.7371 5.1083 5.1083 5.4832 5.4832 5.5916 5.5916 6.2169 6.2169 6.3267 6.3267 9.9485 9.9485 10.4363 10.4363 10.5976 10.5976 11.8572 11.8572 12.8267 12.8267 13.2518 13.2548 k = 0.5859-0.3850-0.2517 ( 9704 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1157 -12.1157 -11.9158 -11.9158 -10.9900 -10.9900 -10.6743 -10.6743 -10.4933 -10.4933 -10.4545 -10.4545 -5.0872 -5.0872 -3.1729 -3.1729 -3.0711 -3.0711 0.1765 0.1765 0.9802 0.9802 1.1941 1.1941 1.5821 1.5821 2.1078 2.1078 2.4953 2.4953 2.6618 2.6618 2.7382 2.7382 4.0116 4.0116 4.3182 4.3182 4.6455 4.6455 4.7138 4.7138 4.7353 4.7353 5.0982 5.0982 5.4972 5.4972 5.5951 5.5951 6.2200 6.2200 6.3274 6.3274 9.9492 9.9492 10.4317 10.4317 10.5955 10.5955 11.8521 11.8521 12.8240 12.8240 13.2528 13.2545 k = 0.6002-0.3739-0.2444 ( 9700 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1131 -12.1131 -11.9185 -11.9185 -10.9897 -10.9897 -10.6719 -10.6719 -10.4943 -10.4943 -10.4567 -10.4567 -5.0864 -5.0864 -3.1704 -3.1704 -3.0709 -3.0709 0.1724 0.1724 0.9709 0.9709 1.2093 1.2093 1.5780 1.5780 2.1065 2.1065 2.4989 2.4989 2.6570 2.6570 2.7419 2.7419 3.9970 3.9970 4.3098 4.3098 4.6454 4.6454 4.7195 4.7195 4.7430 4.7430 5.0879 5.0879 5.5122 5.5122 5.5988 5.5988 6.2237 6.2237 6.3281 6.3281 9.9500 9.9500 10.4263 10.4263 10.5931 10.5931 11.8462 11.8462 12.8198 12.8198 13.2520 13.2523 k = 0.6146-0.3628-0.2372 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1102 -12.1102 -11.9216 -11.9216 -10.9892 -10.9892 -10.6692 -10.6692 -10.4955 -10.4955 -10.4592 -10.4592 -5.0854 -5.0854 -3.1677 -3.1677 -3.0707 -3.0707 0.1678 0.1678 0.9619 0.9619 1.2247 1.2247 1.5736 1.5736 2.1049 2.1049 2.5027 2.5027 2.6518 2.6518 2.7460 2.7460 3.9822 3.9822 4.3005 4.3005 4.6383 4.6383 4.7202 4.7202 4.7630 4.7630 5.0779 5.0779 5.5278 5.5278 5.6027 5.6027 6.2279 6.2279 6.3291 6.3291 9.9509 9.9509 10.4202 10.4202 10.5903 10.5903 11.8398 11.8398 12.8137 12.8137 13.2503 13.2503 k = 0.6289-0.3517-0.2299 ( 9714 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1069 -12.1069 -11.9252 -11.9252 -10.9886 -10.9886 -10.6662 -10.6662 -10.4968 -10.4968 -10.4619 -10.4619 -5.0843 -5.0843 -3.1647 -3.1647 -3.0704 -3.0704 0.1628 0.1628 0.9535 0.9535 1.2402 1.2402 1.5690 1.5690 2.1030 2.1030 2.5066 2.5066 2.6466 2.6466 2.7503 2.7503 3.9673 3.9673 4.2903 4.2903 4.6272 4.6272 4.7188 4.7188 4.7888 4.7888 5.0687 5.0687 5.5435 5.5435 5.6068 5.6068 6.2326 6.2326 6.3301 6.3301 9.9519 9.9519 10.4134 10.4134 10.5873 10.5873 11.8329 11.8329 12.8055 12.8055 13.2481 13.2481 k = 0.6432-0.3406-0.2226 ( 9715 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4835 -18.4835 -12.1034 -12.1034 -11.9290 -11.9290 -10.9879 -10.9879 -10.6628 -10.6628 -10.4984 -10.4984 -10.4648 -10.4648 -5.0832 -5.0832 -3.1615 -3.1615 -3.0702 -3.0702 0.1574 0.1574 0.9456 0.9456 1.2555 1.2555 1.5641 1.5641 2.1008 2.1008 2.5105 2.5105 2.6412 2.6412 2.7548 2.7548 3.9527 3.9527 4.2794 4.2794 4.6143 4.6143 4.7163 4.7163 4.8170 4.8170 5.0608 5.0608 5.5586 5.5586 5.6112 5.6112 6.2378 6.2378 6.3312 6.3312 9.9530 9.9530 10.4058 10.4058 10.5841 10.5841 11.8256 11.8256 12.7951 12.7951 13.2456 13.2456 k = 0.6575-0.3295-0.2154 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4836 -18.4836 -12.0996 -12.0996 -11.9332 -11.9332 -10.9870 -10.9870 -10.6592 -10.6592 -10.5001 -10.5001 -10.4680 -10.4680 -5.0820 -5.0820 -3.1582 -3.1582 -3.0699 -3.0699 0.1518 0.1518 0.9384 0.9384 1.2704 1.2704 1.5591 1.5591 2.0982 2.0982 2.5143 2.5143 2.6360 2.6360 2.7594 2.7594 3.9385 3.9385 4.2679 4.2679 4.6009 4.6009 4.7126 4.7126 4.8461 4.8461 5.0546 5.0546 5.5726 5.5726 5.6163 5.6163 6.2434 6.2434 6.3325 6.3325 9.9541 9.9541 10.3977 10.3977 10.5807 10.5807 11.8180 11.8180 12.7826 12.7826 13.2431 13.2431 k = 0.6718-0.3184-0.2081 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4836 -18.4836 -12.0955 -12.0955 -11.9376 -11.9376 -10.9859 -10.9859 -10.6552 -10.6552 -10.5021 -10.5021 -10.4713 -10.4713 -5.0808 -5.0808 -3.1548 -3.1548 -3.0696 -3.0696 0.1459 0.1459 0.9318 0.9318 1.2849 1.2849 1.5542 1.5542 2.0952 2.0952 2.5179 2.5179 2.6310 2.6310 2.7640 2.7640 3.9249 3.9249 4.2561 4.2561 4.5877 4.5877 4.7074 4.7074 4.8753 4.8753 5.0507 5.0507 5.5845 5.5845 5.6227 5.6227 6.2494 6.2494 6.3340 6.3340 9.9553 9.9553 10.3889 10.3889 10.5770 10.5770 11.8102 11.8102 12.7680 12.7680 13.2405 13.2405 k = 0.6862-0.3073-0.2009 ( 9716 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4836 -18.4836 -12.0913 -12.0913 -11.9424 -11.9424 -10.9847 -10.9847 -10.6510 -10.6510 -10.5043 -10.5043 -10.4747 -10.4747 -5.0796 -5.0796 -3.1513 -3.1513 -3.0693 -3.0693 0.1399 0.1399 0.9258 0.9258 1.2987 1.2987 1.5493 1.5493 2.0919 2.0919 2.5211 2.5211 2.6264 2.6264 2.7685 2.7685 3.9119 3.9119 4.2439 4.2439 4.5752 4.5752 4.7005 4.7005 4.9041 4.9041 5.0491 5.0491 5.5933 5.5933 5.6310 5.6310 6.2557 6.2557 6.3356 6.3356 9.9566 9.9566 10.3796 10.3796 10.5732 10.5732 11.8022 11.8022 12.7519 12.7519 13.2378 13.2378 k = 0.7005-0.2962-0.1936 ( 9706 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4837 -18.4837 -12.0869 -12.0869 -11.9473 -11.9473 -10.9832 -10.9832 -10.6466 -10.6466 -10.5067 -10.5067 -10.4782 -10.4782 -5.0783 -5.0783 -3.1478 -3.1478 -3.0690 -3.0690 0.1338 0.1338 0.9204 0.9204 1.3119 1.3119 1.5446 1.5446 2.0882 2.0882 2.5237 2.5237 2.6222 2.6222 2.7726 2.7726 3.8997 3.8997 4.2317 4.2317 4.5638 4.5638 4.6919 4.6919 4.9319 4.9319 5.0503 5.0503 5.5991 5.5991 5.6413 5.6413 6.2624 6.2624 6.3374 6.3374 9.9580 9.9580 10.3698 10.3698 10.5693 10.5693 11.7941 11.7941 12.7346 12.7346 13.2353 13.2353 k = 0.7148-0.2851-0.1863 ( 9718 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4837 -18.4837 -12.0825 -12.0825 -11.9524 -11.9524 -10.9815 -10.9815 -10.6420 -10.6420 -10.5094 -10.5094 -10.4817 -10.4817 -5.0771 -5.0771 -3.1444 -3.1444 -3.0687 -3.0687 0.1277 0.1277 0.9156 0.9156 1.3242 1.3242 1.5401 1.5401 2.0842 2.0842 2.5259 2.5259 2.6187 2.6187 2.7763 2.7763 3.8883 3.8883 4.2197 4.2197 4.5537 4.5537 4.6818 4.6818 4.9583 4.9583 5.0542 5.0542 5.6027 5.6027 5.6524 5.6524 6.2694 6.2694 6.3395 6.3395 9.9593 9.9593 10.3596 10.3596 10.5653 10.5653 11.7859 11.7859 12.7167 12.7167 13.2329 13.2329 k = 0.7291-0.2740-0.1791 ( 9710 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4838 -18.4838 -12.0780 -12.0780 -11.9576 -11.9576 -10.9795 -10.9795 -10.6372 -10.6372 -10.5124 -10.5124 -10.4851 -10.4851 -5.0760 -5.0760 -3.1411 -3.1411 -3.0683 -3.0683 0.1217 0.1217 0.9113 0.9113 1.3357 1.3357 1.5360 1.5360 2.0799 2.0799 2.5274 2.5274 2.6158 2.6158 2.7793 2.7793 3.8780 3.8780 4.2079 4.2079 4.5451 4.5451 4.6703 4.6703 4.9829 4.9829 5.0609 5.0609 5.6047 5.6047 5.6636 5.6636 6.2765 6.2765 6.3419 6.3419 9.9607 9.9607 10.3490 10.3490 10.5611 10.5611 11.7778 11.7778 12.6987 12.6987 13.2308 13.2308 k = 0.7434-0.2629-0.1718 ( 9712 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4838 -18.4838 -12.0736 -12.0736 -11.9629 -11.9629 -10.9773 -10.9773 -10.6323 -10.6323 -10.5157 -10.5157 -10.4885 -10.4885 -5.0749 -5.0749 -3.1379 -3.1379 -3.0680 -3.0680 0.1158 0.1158 0.9074 0.9074 1.3463 1.3463 1.5322 1.5322 2.0752 2.0752 2.5282 2.5282 2.6135 2.6135 2.7814 2.7814 3.8688 3.8688 4.1966 4.1966 4.5381 4.5381 4.6577 4.6577 5.0052 5.0052 5.0703 5.0703 5.6057 5.6057 5.6743 5.6743 6.2837 6.2837 6.3448 6.3448 9.9621 9.9621 10.3382 10.3382 10.5569 10.5569 11.7698 11.7698 12.6811 12.6811 13.2288 13.2288 k = 0.7577-0.2518-0.1646 ( 9705 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4839 -18.4839 -12.0695 -12.0695 -11.9680 -11.9680 -10.9748 -10.9748 -10.6272 -10.6272 -10.5193 -10.5193 -10.4918 -10.4918 -5.0739 -5.0739 -3.1350 -3.1350 -3.0678 -3.0678 0.1102 0.1102 0.9040 0.9040 1.3559 1.3559 1.5288 1.5288 2.0704 2.0704 2.5283 2.5283 2.6120 2.6120 2.7824 2.7824 3.8611 3.8611 4.1858 4.1858 4.5329 4.5329 4.6443 4.6443 5.0250 5.0250 5.0824 5.0824 5.6060 5.6060 5.6842 5.6842 6.2907 6.2907 6.3482 6.3482 9.9635 9.9635 10.3272 10.3272 10.5526 10.5526 11.7620 11.7620 12.6646 12.6646 13.2272 13.2272 k = 0.7721-0.2407-0.1573 ( 9701 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4839 -18.4839 -12.0656 -12.0656 -11.9729 -11.9729 -10.9720 -10.9720 -10.6222 -10.6222 -10.5230 -10.5230 -10.4950 -10.4950 -5.0729 -5.0729 -3.1323 -3.1323 -3.0675 -3.0675 0.1049 0.1049 0.9008 0.9008 1.3646 1.3646 1.5259 1.5259 2.0654 2.0654 2.5277 2.5277 2.6112 2.6112 2.7820 2.7820 3.8551 3.8551 4.1755 4.1755 4.5293 4.5293 4.6304 4.6304 5.0422 5.0422 5.0968 5.0968 5.6058 5.6058 5.6931 5.6931 6.2973 6.2973 6.3525 6.3525 9.9648 9.9648 10.3161 10.3161 10.5482 10.5482 11.7544 11.7544 12.6495 12.6495 13.2259 13.2259 k = 0.7864-0.2296-0.1500 ( 9696 PWs) bands (ev): -49.7716 -49.7716 -26.5045 -26.5045 -25.8804 -25.8804 -25.8239 -25.8239 -18.4840 -18.4840 -12.0623 -12.0623 -11.9774 -11.9774 -10.9688 -10.9688 -10.6172 -10.6172 -10.5268 -10.5268 -10.4980 -10.4980 -5.0721 -5.0721 -3.1298 -3.1298 -3.0673 -3.0673 0.0999 0.0999 0.8979 0.8979 1.3724 1.3724 1.5235 1.5235 2.0601 2.0601 2.5263 2.5263 2.6112 2.6112 2.7800 2.7800 3.8510 3.8510 4.1659 4.1659 4.5273 4.5273 4.6163 4.6163 5.0569 5.0569 5.1128 5.1128 5.6052 5.6052 5.7009 5.7009 6.3033 6.3033 6.3577 6.3577 9.9661 9.9661 10.3050 10.3050 10.5437 10.5437 11.7470 11.7470 12.6363 12.6363 13.2251 13.2251 Writing output data file BaTixBO3x2.save init_run : 0.36s CPU 0.51s WALL ( 1 calls) electrons : 742.46s CPU 748.79s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.02s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 742.46s CPU 748.78s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.07s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.15s WALL ( 265 calls) cegterg : 715.64s CPU 721.17s WALL ( 801 calls) Called by sum_band: Called by *egterg: h_psi : 442.96s CPU 446.51s WALL ( 14725 calls) s_psi : 18.09s CPU 17.75s WALL ( 14725 calls) g_psi : 1.21s CPU 1.23s WALL ( 13659 calls) cdiaghg : 178.28s CPU 180.33s WALL ( 13924 calls) cegterg:over : 35.96s CPU 35.94s WALL ( 13659 calls) cegterg:upda : 33.73s CPU 33.91s WALL ( 13659 calls) cegterg:last : 17.06s CPU 17.05s WALL ( 1889 calls) cdiaghg:chol : 10.24s CPU 10.41s WALL ( 13924 calls) cdiaghg:inve : 7.35s CPU 7.53s WALL ( 13924 calls) cdiaghg:para : 12.94s CPU 12.94s WALL ( 27848 calls) Called by h_psi: h_psi:vloc : 398.84s CPU 402.16s WALL ( 14725 calls) h_psi:vnl : 42.80s CPU 43.07s WALL ( 14725 calls) add_vuspsi : 21.17s CPU 21.11s WALL ( 14725 calls) General routines calbec : 21.58s CPU 21.92s WALL ( 14725 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 376.13s CPU 379.54s WALL ( 1700872 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.32s CPU 0.50s WALL ( 530 calls) Parallel routines fft_scatter : 104.74s CPU 105.45s WALL ( 1700895 calls) PWSCF : 12m53.80s CPU 13m22.83s WALL This run was terminated on: 14: 5: 4 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=