Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:59:17 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 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: ./BaxMnGex2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S 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 87 87 24 1983 1983 298 Max 88 88 25 1985 1985 299 Sum 3153 3153 889 71423 71423 10731 bravais-lattice index = 14 lattice parameter (alat) = 11.9794 a.u. unit-cell volume = 740.9335 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.979354 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.751392 celldm(5)= -0.751392 celldm(6)= 0.502783 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.502783 0.864413 0.000000 ) a(3) = ( -0.751392 -0.432206 0.498607 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.581647 1.002795 ) b(2) = ( 0.000000 1.156855 1.002795 ) b(3) = ( 0.000000 0.000000 2.005589 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mn read from file: /users/gautes/Pseudo/Mn.rel-pbe-oncvpsp.UPF MD5 check sum: d838f0974ec4eb0180564ac5264e0bcc Pseudo is Norm-conserving, Zval = 15.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1464 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 PseudoPot. # 3 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 atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Mn 15.00 54.93800 Mn( 1.00) Ba 10.00 137.32700 Ba( 1.00) 4 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 326 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 2) = ( 0.0000000 0.0000000 0.0200559), wk = 0.0030675 k( 3) = ( 0.0000000 0.0000000 0.0401118), wk = 0.0030675 k( 4) = ( 0.0000000 0.0000000 0.0601677), wk = 0.0030675 k( 5) = ( 0.0000000 0.0000000 0.0802236), wk = 0.0030675 k( 6) = ( 0.0000000 0.0000000 0.1002795), wk = 0.0030675 k( 7) = ( 0.0000000 0.0000000 0.1203354), wk = 0.0030675 k( 8) = ( 0.0000000 0.0000000 0.1403913), wk = 0.0030675 k( 9) = ( 0.0000000 0.0000000 0.1604472), wk = 0.0030675 k( 10) = ( 0.0000000 0.0000000 0.1805030), wk = 0.0030675 k( 11) = ( 0.0000000 0.0000000 0.2005589), wk = 0.0030675 k( 12) = ( 0.0000000 0.0000000 0.2206148), wk = 0.0030675 k( 13) = ( 0.0000000 0.0000000 0.2406707), wk = 0.0030675 k( 14) = ( 0.0000000 0.0000000 0.2607266), wk = 0.0030675 k( 15) = ( 0.0000000 0.0000000 0.2807825), wk = 0.0030675 k( 16) = ( 0.0000000 0.0000000 0.3008384), wk = 0.0030675 k( 17) = ( 0.0000000 0.0000000 0.3208943), wk = 0.0030675 k( 18) = ( 0.0000000 0.0000000 0.3409502), wk = 0.0030675 k( 19) = ( 0.0000000 0.0000000 0.3610061), wk = 0.0030675 k( 20) = ( 0.0000000 0.0000000 0.3810620), wk = 0.0030675 k( 21) = ( 0.0000000 0.0000000 0.4011179), wk = 0.0030675 k( 22) = ( 0.0000000 0.0000000 0.4211738), wk = 0.0030675 k( 23) = ( 0.0000000 0.0000000 0.4412297), wk = 0.0030675 k( 24) = ( 0.0000000 0.0000000 0.4612856), wk = 0.0030675 k( 25) = ( 0.0000000 0.0000000 0.4813415), wk = 0.0030675 k( 26) = ( 0.0000000 0.0000000 0.5013974), wk = 0.0030675 k( 27) = ( 0.0000000 0.0000000 0.5214532), wk = 0.0030675 k( 28) = ( 0.0000000 0.0000000 0.5415091), wk = 0.0030675 k( 29) = ( 0.0000000 0.0000000 0.5615650), wk = 0.0030675 k( 30) = ( 0.0000000 0.0000000 0.5816209), wk = 0.0030675 k( 31) = ( 0.0000000 0.0000000 0.6016768), wk = 0.0030675 k( 32) = ( 0.0000000 0.0000000 0.6217327), wk = 0.0030675 k( 33) = ( 0.0000000 0.0000000 0.6417886), wk = 0.0030675 k( 34) = ( 0.0000000 0.0000000 0.6618445), wk = 0.0030675 k( 35) = ( 0.0000000 0.0000000 0.6819004), wk = 0.0030675 k( 36) = ( 0.0000000 0.0000000 0.7019563), wk = 0.0030675 k( 37) = ( 0.0000000 0.0000000 0.7220122), wk = 0.0030675 k( 38) = ( 0.0000000 0.0000000 0.7420681), wk = 0.0030675 k( 39) = ( 0.0000000 0.0000000 0.7621240), wk = 0.0030675 k( 40) = ( 0.0000000 0.0000000 0.7821799), wk = 0.0030675 k( 41) = ( 0.0000000 0.0000000 0.8022358), wk = 0.0030675 k( 42) = ( 0.0000000 0.0000000 0.8222917), wk = 0.0030675 k( 43) = ( 0.0000000 0.0000000 0.8423476), wk = 0.0030675 k( 44) = ( 0.0000000 0.0000000 0.8624034), wk = 0.0030675 k( 45) = ( 0.0000000 0.0000000 0.8824593), wk = 0.0030675 k( 46) = ( 0.0000000 0.0000000 0.9025152), wk = 0.0030675 k( 47) = ( 0.0000000 0.0000000 0.9225711), wk = 0.0030675 k( 48) = ( 0.0000000 0.0000000 0.9426270), wk = 0.0030675 k( 49) = ( 0.0000000 0.0000000 0.9626829), wk = 0.0030675 k( 50) = ( 0.0000000 0.0000000 0.9827388), wk = 0.0030675 k( 51) = ( 0.0000000 0.0000000 1.0027947), wk = 0.0030675 k( 52) = ( 0.0000000 0.0000000 1.0027947), wk = 0.0030675 k( 53) = ( -0.0091907 0.0159780 1.0027947), wk = 0.0030675 k( 54) = ( -0.0183813 0.0319560 1.0027947), wk = 0.0030675 k( 55) = ( -0.0275720 0.0479340 1.0027947), wk = 0.0030675 k( 56) = ( -0.0367627 0.0639120 1.0027947), wk = 0.0030675 k( 57) = ( -0.0459533 0.0798900 1.0027947), wk = 0.0030675 k( 58) = ( -0.0551440 0.0958680 1.0027947), wk = 0.0030675 k( 59) = ( -0.0643347 0.1118460 1.0027947), wk = 0.0030675 k( 60) = ( -0.0735254 0.1278240 1.0027947), wk = 0.0030675 k( 61) = ( -0.0827160 0.1438020 1.0027947), wk = 0.0030675 k( 62) = ( -0.0827160 0.1438020 1.0027947), wk = 0.0030675 k( 63) = ( -0.0896708 0.1558928 0.9888464), wk = 0.0030675 k( 64) = ( -0.0966255 0.1679836 0.9748980), wk = 0.0030675 k( 65) = ( -0.1035802 0.1800744 0.9609497), wk = 0.0030675 k( 66) = ( -0.1105350 0.1921652 0.9470014), wk = 0.0030675 k( 67) = ( -0.1174897 0.2042561 0.9330530), wk = 0.0030675 k( 68) = ( -0.1244444 0.2163469 0.9191047), wk = 0.0030675 k( 69) = ( -0.1313992 0.2284377 0.9051563), wk = 0.0030675 k( 70) = ( -0.1383539 0.2405285 0.8912080), wk = 0.0030675 k( 71) = ( -0.1453086 0.2526193 0.8772596), wk = 0.0030675 k( 72) = ( -0.1522634 0.2647101 0.8633113), wk = 0.0030675 k( 73) = ( -0.1592181 0.2768010 0.8493630), wk = 0.0030675 k( 74) = ( -0.1661728 0.2888918 0.8354147), wk = 0.0030675 k( 75) = ( -0.1731275 0.3009826 0.8214663), wk = 0.0030675 k( 76) = ( -0.1800823 0.3130734 0.8075180), wk = 0.0030675 k( 77) = ( -0.1870370 0.3251642 0.7935696), wk = 0.0030675 k( 78) = ( -0.1939917 0.3372550 0.7796213), wk = 0.0030675 k( 79) = ( -0.2009465 0.3493459 0.7656729), wk = 0.0030675 k( 80) = ( -0.2079012 0.3614367 0.7517246), wk = 0.0030675 k( 81) = ( -0.2148559 0.3735275 0.7377763), wk = 0.0030675 k( 82) = ( -0.2218107 0.3856183 0.7238279), wk = 0.0030675 k( 83) = ( -0.2287654 0.3977091 0.7098796), wk = 0.0030675 k( 84) = ( -0.2357201 0.4097999 0.6959313), wk = 0.0030675 k( 85) = ( -0.2426749 0.4218907 0.6819829), wk = 0.0030675 k( 86) = ( -0.2496296 0.4339816 0.6680346), wk = 0.0030675 k( 87) = ( -0.2565844 0.4460724 0.6540862), wk = 0.0030675 k( 88) = ( -0.2635391 0.4581632 0.6401379), wk = 0.0030675 k( 89) = ( -0.2704938 0.4702540 0.6261896), wk = 0.0030675 k( 90) = ( -0.2774486 0.4823448 0.6122412), wk = 0.0030675 k( 91) = ( -0.2844033 0.4944356 0.5982929), wk = 0.0030675 k( 92) = ( -0.2913580 0.5065265 0.5843445), wk = 0.0030675 k( 93) = ( -0.2913580 0.5065265 0.5843445), wk = 0.0030675 k( 94) = ( -0.2842517 0.4941722 0.5700922), wk = 0.0030675 k( 95) = ( -0.2771454 0.4818179 0.5558399), wk = 0.0030675 k( 96) = ( -0.2700391 0.4694635 0.5415876), wk = 0.0030675 k( 97) = ( -0.2629328 0.4571092 0.5273353), wk = 0.0030675 k( 98) = ( -0.2558265 0.4447549 0.5130830), wk = 0.0030675 k( 99) = ( -0.2487203 0.4324006 0.4988307), wk = 0.0030675 k( 100) = ( -0.2416140 0.4200463 0.4845784), wk = 0.0030675 k( 101) = ( -0.2345077 0.4076920 0.4703261), wk = 0.0030675 k( 102) = ( -0.2274014 0.3953377 0.4560738), wk = 0.0030675 k( 103) = ( -0.2202951 0.3829834 0.4418215), wk = 0.0030675 k( 104) = ( -0.2131888 0.3706291 0.4275692), wk = 0.0030675 k( 105) = ( -0.2060825 0.3582748 0.4133169), wk = 0.0030675 k( 106) = ( -0.1989762 0.3459205 0.3990646), wk = 0.0030675 k( 107) = ( -0.1918699 0.3335662 0.3848123), wk = 0.0030675 k( 108) = ( -0.1847636 0.3212119 0.3705600), wk = 0.0030675 k( 109) = ( -0.1776573 0.3088576 0.3563077), wk = 0.0030675 k( 110) = ( -0.1705510 0.2965033 0.3420553), wk = 0.0030675 k( 111) = ( -0.1634447 0.2841490 0.3278030), wk = 0.0030675 k( 112) = ( -0.1563384 0.2717947 0.3135507), wk = 0.0030675 k( 113) = ( -0.1492322 0.2594404 0.2992984), wk = 0.0030675 k( 114) = ( -0.1421259 0.2470861 0.2850461), wk = 0.0030675 k( 115) = ( -0.1350196 0.2347318 0.2707938), wk = 0.0030675 k( 116) = ( -0.1279133 0.2223775 0.2565415), wk = 0.0030675 k( 117) = ( -0.1208070 0.2100232 0.2422892), wk = 0.0030675 k( 118) = ( -0.1137007 0.1976689 0.2280369), wk = 0.0030675 k( 119) = ( -0.1065944 0.1853146 0.2137846), wk = 0.0030675 k( 120) = ( -0.0994881 0.1729603 0.1995323), wk = 0.0030675 k( 121) = ( -0.0923818 0.1606060 0.1852800), wk = 0.0030675 k( 122) = ( -0.0852755 0.1482517 0.1710277), wk = 0.0030675 k( 123) = ( -0.0781692 0.1358973 0.1567754), wk = 0.0030675 k( 124) = ( -0.0710629 0.1235430 0.1425231), wk = 0.0030675 k( 125) = ( -0.0639566 0.1111887 0.1282708), wk = 0.0030675 k( 126) = ( -0.0568503 0.0988344 0.1140184), wk = 0.0030675 k( 127) = ( -0.0497440 0.0864801 0.0997661), wk = 0.0030675 k( 128) = ( -0.0426378 0.0741258 0.0855138), wk = 0.0030675 k( 129) = ( -0.0355315 0.0617715 0.0712615), wk = 0.0030675 k( 130) = ( -0.0284252 0.0494172 0.0570092), wk = 0.0030675 k( 131) = ( -0.0213189 0.0370629 0.0427569), wk = 0.0030675 k( 132) = ( -0.0142126 0.0247086 0.0285046), wk = 0.0030675 k( 133) = ( -0.0071063 0.0123543 0.0142523), wk = 0.0030675 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 136) = ( 0.0172414 0.0099174 -0.0000000), wk = 0.0030675 k( 137) = ( 0.0344828 0.0198348 -0.0000000), wk = 0.0030675 k( 138) = ( 0.0517241 0.0297521 0.0000000), wk = 0.0030675 k( 139) = ( 0.0689655 0.0396695 -0.0000000), wk = 0.0030675 k( 140) = ( 0.0862069 0.0495869 0.0000000), wk = 0.0030675 k( 141) = ( 0.1034483 0.0595043 0.0000000), wk = 0.0030675 k( 142) = ( 0.1206897 0.0694216 0.0000000), wk = 0.0030675 k( 143) = ( 0.1379310 0.0793390 0.0000000), wk = 0.0030675 k( 144) = ( 0.1551724 0.0892564 0.0000000), wk = 0.0030675 k( 145) = ( 0.1724138 0.0991738 0.0000000), wk = 0.0030675 k( 146) = ( 0.1896552 0.1090911 0.0000000), wk = 0.0030675 k( 147) = ( 0.2068966 0.1190085 0.0000000), wk = 0.0030675 k( 148) = ( 0.2241379 0.1289259 0.0000000), wk = 0.0030675 k( 149) = ( 0.2413793 0.1388433 0.0000000), wk = 0.0030675 k( 150) = ( 0.2586207 0.1487607 0.0000000), wk = 0.0030675 k( 151) = ( 0.2758621 0.1586780 0.0000000), wk = 0.0030675 k( 152) = ( 0.2931034 0.1685954 0.0000000), wk = 0.0030675 k( 153) = ( 0.3103448 0.1785128 0.0000000), wk = 0.0030675 k( 154) = ( 0.3275862 0.1884302 0.0000000), wk = 0.0030675 k( 155) = ( 0.3448276 0.1983475 0.0000000), wk = 0.0030675 k( 156) = ( 0.3620690 0.2082649 0.0000000), wk = 0.0030675 k( 157) = ( 0.3793103 0.2181823 0.0000000), wk = 0.0030675 k( 158) = ( 0.3965517 0.2280997 0.0000000), wk = 0.0030675 k( 159) = ( 0.4137931 0.2380171 0.0000000), wk = 0.0030675 k( 160) = ( 0.4310345 0.2479344 0.0000000), wk = 0.0030675 k( 161) = ( 0.4482759 0.2578518 0.0000000), wk = 0.0030675 k( 162) = ( 0.4655172 0.2677692 0.0000000), wk = 0.0030675 k( 163) = ( 0.4827586 0.2776866 0.0000000), wk = 0.0030675 k( 164) = ( 0.5000000 0.2876039 0.0000000), wk = 0.0030675 k( 165) = ( 0.5000000 0.2876039 0.0000000), wk = 0.0030675 k( 166) = ( 0.4930453 0.2996948 0.0139483), wk = 0.0030675 k( 167) = ( 0.4860905 0.3117856 0.0278967), wk = 0.0030675 k( 168) = ( 0.4791358 0.3238764 0.0418450), wk = 0.0030675 k( 169) = ( 0.4721811 0.3359672 0.0557934), wk = 0.0030675 k( 170) = ( 0.4652263 0.3480580 0.0697417), wk = 0.0030675 k( 171) = ( 0.4582716 0.3601488 0.0836900), wk = 0.0030675 k( 172) = ( 0.4513169 0.3722397 0.0976384), wk = 0.0030675 k( 173) = ( 0.4443621 0.3843305 0.1115867), wk = 0.0030675 k( 174) = ( 0.4374074 0.3964213 0.1255351), wk = 0.0030675 k( 175) = ( 0.4304527 0.4085121 0.1394834), wk = 0.0030675 k( 176) = ( 0.4234979 0.4206029 0.1534317), wk = 0.0030675 k( 177) = ( 0.4165432 0.4326937 0.1673801), wk = 0.0030675 k( 178) = ( 0.4095885 0.4447846 0.1813284), wk = 0.0030675 k( 179) = ( 0.4026337 0.4568754 0.1952767), wk = 0.0030675 k( 180) = ( 0.3956790 0.4689662 0.2092251), wk = 0.0030675 k( 181) = ( 0.3887243 0.4810570 0.2231734), wk = 0.0030675 k( 182) = ( 0.3817695 0.4931478 0.2371218), wk = 0.0030675 k( 183) = ( 0.3748148 0.5052386 0.2510701), wk = 0.0030675 k( 184) = ( 0.3678601 0.5173294 0.2650184), wk = 0.0030675 k( 185) = ( 0.3609053 0.5294203 0.2789668), wk = 0.0030675 k( 186) = ( 0.3539506 0.5415111 0.2929151), wk = 0.0030675 k( 187) = ( 0.3469959 0.5536019 0.3068634), wk = 0.0030675 k( 188) = ( 0.3400411 0.5656927 0.3208118), wk = 0.0030675 k( 189) = ( 0.3330864 0.5777835 0.3347601), wk = 0.0030675 k( 190) = ( 0.3261317 0.5898743 0.3487085), wk = 0.0030675 k( 191) = ( 0.3191769 0.6019652 0.3626568), wk = 0.0030675 k( 192) = ( 0.3122222 0.6140560 0.3766051), wk = 0.0030675 k( 193) = ( 0.3052675 0.6261468 0.3905535), wk = 0.0030675 k( 194) = ( 0.2983128 0.6382376 0.4045018), wk = 0.0030675 k( 195) = ( 0.2913580 0.6503284 0.4184502), wk = 0.0030675 k( 196) = ( 0.2913580 0.6503284 0.4184502), wk = 0.0030675 k( 197) = ( 0.2731481 0.6458346 0.4236344), wk = 0.0030675 k( 198) = ( 0.2549383 0.6413408 0.4288186), wk = 0.0030675 k( 199) = ( 0.2367284 0.6368470 0.4340027), wk = 0.0030675 k( 200) = ( 0.2185185 0.6323532 0.4391870), wk = 0.0030675 k( 201) = ( 0.2003086 0.6278594 0.4443712), wk = 0.0030675 k( 202) = ( 0.1820988 0.6233656 0.4495554), wk = 0.0030675 k( 203) = ( 0.1638889 0.6188718 0.4547396), wk = 0.0030675 k( 204) = ( 0.1456790 0.6143779 0.4599237), wk = 0.0030675 k( 205) = ( 0.1274691 0.6098841 0.4651080), wk = 0.0030675 k( 206) = ( 0.1092593 0.6053903 0.4702921), wk = 0.0030675 k( 207) = ( 0.0910494 0.6008965 0.4754764), wk = 0.0030675 k( 208) = ( 0.0728395 0.5964027 0.4806606), wk = 0.0030675 k( 209) = ( 0.0546296 0.5919089 0.4858447), wk = 0.0030675 k( 210) = ( 0.0364198 0.5874151 0.4910290), wk = 0.0030675 k( 211) = ( 0.0182099 0.5829213 0.4962131), wk = 0.0030675 k( 212) = ( 0.0000000 0.5784274 0.5013974), wk = 0.0030675 k( 213) = ( 0.0000000 0.5784274 0.5013974), wk = 0.0030675 k( 214) = ( 0.0069444 0.5663545 0.5153250), wk = 0.0030675 k( 215) = ( 0.0138889 0.5542816 0.5292528), wk = 0.0030675 k( 216) = ( 0.0208333 0.5422087 0.5431805), wk = 0.0030675 k( 217) = ( 0.0277778 0.5301357 0.5571082), wk = 0.0030675 k( 218) = ( 0.0347222 0.5180628 0.5710359), wk = 0.0030675 k( 219) = ( 0.0416667 0.5059899 0.5849636), wk = 0.0030675 k( 220) = ( 0.0486111 0.4939169 0.5988913), wk = 0.0030675 k( 221) = ( 0.0555556 0.4818440 0.6128190), wk = 0.0030675 k( 222) = ( 0.0625000 0.4697711 0.6267467), wk = 0.0030675 k( 223) = ( 0.0694444 0.4576982 0.6406744), wk = 0.0030675 k( 224) = ( 0.0763889 0.4456252 0.6546021), wk = 0.0030675 k( 225) = ( 0.0833333 0.4335523 0.6685298), wk = 0.0030675 k( 226) = ( 0.0902778 0.4214794 0.6824575), wk = 0.0030675 k( 227) = ( 0.0972222 0.4094064 0.6963852), wk = 0.0030675 k( 228) = ( 0.1041667 0.3973335 0.7103129), wk = 0.0030675 k( 229) = ( 0.1111111 0.3852606 0.7242406), wk = 0.0030675 k( 230) = ( 0.1180556 0.3731876 0.7381683), wk = 0.0030675 k( 231) = ( 0.1250000 0.3611147 0.7520960), wk = 0.0030675 k( 232) = ( 0.1319444 0.3490418 0.7660237), wk = 0.0030675 k( 233) = ( 0.1388889 0.3369688 0.7799514), wk = 0.0030675 k( 234) = ( 0.1458333 0.3248959 0.7938791), wk = 0.0030675 k( 235) = ( 0.1527778 0.3128230 0.8078069), wk = 0.0030675 k( 236) = ( 0.1597222 0.3007501 0.8217345), wk = 0.0030675 k( 237) = ( 0.1666667 0.2886771 0.8356623), wk = 0.0030675 k( 238) = ( 0.1736111 0.2766042 0.8495900), wk = 0.0030675 k( 239) = ( 0.1805556 0.2645313 0.8635177), wk = 0.0030675 k( 240) = ( 0.1875000 0.2524583 0.8774454), wk = 0.0030675 k( 241) = ( 0.1944444 0.2403854 0.8913731), wk = 0.0030675 k( 242) = ( 0.2013889 0.2283125 0.9053008), wk = 0.0030675 k( 243) = ( 0.2083333 0.2162396 0.9192285), wk = 0.0030675 k( 244) = ( 0.2152778 0.2041666 0.9331562), wk = 0.0030675 k( 245) = ( 0.2222222 0.1920937 0.9470839), wk = 0.0030675 k( 246) = ( 0.2291667 0.1800208 0.9610116), wk = 0.0030675 k( 247) = ( 0.2361111 0.1679478 0.9749393), wk = 0.0030675 k( 248) = ( 0.2430556 0.1558749 0.9888670), wk = 0.0030675 k( 249) = ( 0.2500000 0.1438020 1.0027947), wk = 0.0030675 k( 250) = ( 0.2500000 0.1438020 1.0027947), wk = 0.0030675 k( 251) = ( 0.2647059 0.1522609 0.9930362), wk = 0.0030675 k( 252) = ( 0.2794118 0.1607198 0.9832777), wk = 0.0030675 k( 253) = ( 0.2941177 0.1691788 0.9735192), wk = 0.0030675 k( 254) = ( 0.3088235 0.1776377 0.9637607), wk = 0.0030675 k( 255) = ( 0.3235294 0.1860967 0.9540022), wk = 0.0030675 k( 256) = ( 0.3382353 0.1945556 0.9442437), wk = 0.0030675 k( 257) = ( 0.3529412 0.2030145 0.9344853), wk = 0.0030675 k( 258) = ( 0.3676471 0.2114735 0.9247268), wk = 0.0030675 k( 259) = ( 0.3823529 0.2199324 0.9149683), wk = 0.0030675 k( 260) = ( 0.3970588 0.2283914 0.9052098), wk = 0.0030675 k( 261) = ( 0.4117647 0.2368503 0.8954513), wk = 0.0030675 k( 262) = ( 0.4264706 0.2453092 0.8856928), wk = 0.0030675 k( 263) = ( 0.4411765 0.2537682 0.8759343), wk = 0.0030675 k( 264) = ( 0.4558823 0.2622271 0.8661758), wk = 0.0030675 k( 265) = ( 0.4705882 0.2706861 0.8564173), wk = 0.0030675 k( 266) = ( 0.4852941 0.2791450 0.8466588), wk = 0.0030675 k( 267) = ( 0.5000000 0.2876039 0.8369003), wk = 0.0030675 k( 268) = ( 0.5000000 0.2876039 0.8369003), wk = 0.0030675 k( 269) = ( 0.5000000 0.2876039 0.8169741), wk = 0.0030675 k( 270) = ( 0.5000000 0.2876039 0.7970479), wk = 0.0030675 k( 271) = ( 0.5000000 0.2876039 0.7771217), wk = 0.0030675 k( 272) = ( 0.5000000 0.2876039 0.7571955), wk = 0.0030675 k( 273) = ( 0.5000000 0.2876039 0.7372693), wk = 0.0030675 k( 274) = ( 0.5000000 0.2876039 0.7173431), wk = 0.0030675 k( 275) = ( 0.5000000 0.2876039 0.6974169), wk = 0.0030675 k( 276) = ( 0.5000000 0.2876039 0.6774907), wk = 0.0030675 k( 277) = ( 0.5000000 0.2876039 0.6575645), wk = 0.0030675 k( 278) = ( 0.5000000 0.2876039 0.6376383), wk = 0.0030675 k( 279) = ( 0.5000000 0.2876039 0.6177121), wk = 0.0030675 k( 280) = ( 0.5000000 0.2876039 0.5977859), wk = 0.0030675 k( 281) = ( 0.5000000 0.2876039 0.5778597), wk = 0.0030675 k( 282) = ( 0.5000000 0.2876039 0.5579336), wk = 0.0030675 k( 283) = ( 0.5000000 0.2876039 0.5380073), wk = 0.0030675 k( 284) = ( 0.5000000 0.2876039 0.5180811), wk = 0.0030675 k( 285) = ( 0.5000000 0.2876039 0.4981550), wk = 0.0030675 k( 286) = ( 0.5000000 0.2876039 0.4782287), wk = 0.0030675 k( 287) = ( 0.5000000 0.2876039 0.4583026), wk = 0.0030675 k( 288) = ( 0.5000000 0.2876039 0.4383764), wk = 0.0030675 k( 289) = ( 0.5000000 0.2876039 0.4184502), wk = 0.0030675 k( 290) = ( 0.5000000 0.2876039 0.3985240), wk = 0.0030675 k( 291) = ( 0.5000000 0.2876039 0.3785978), wk = 0.0030675 k( 292) = ( 0.5000000 0.2876039 0.3586716), wk = 0.0030675 k( 293) = ( 0.5000000 0.2876039 0.3387454), wk = 0.0030675 k( 294) = ( 0.5000000 0.2876039 0.3188192), wk = 0.0030675 k( 295) = ( 0.5000000 0.2876039 0.2988930), wk = 0.0030675 k( 296) = ( 0.5000000 0.2876039 0.2789668), wk = 0.0030675 k( 297) = ( 0.5000000 0.2876039 0.2590406), wk = 0.0030675 k( 298) = ( 0.5000000 0.2876039 0.2391144), wk = 0.0030675 k( 299) = ( 0.5000000 0.2876039 0.2191882), wk = 0.0030675 k( 300) = ( 0.5000000 0.2876039 0.1992620), wk = 0.0030675 k( 301) = ( 0.5000000 0.2876039 0.1793358), wk = 0.0030675 k( 302) = ( 0.5000000 0.2876039 0.1594096), wk = 0.0030675 k( 303) = ( 0.5000000 0.2876039 0.1394834), wk = 0.0030675 k( 304) = ( 0.5000000 0.2876039 0.1195572), wk = 0.0030675 k( 305) = ( 0.5000000 0.2876039 0.0996310), wk = 0.0030675 k( 306) = ( 0.5000000 0.2876039 0.0797048), wk = 0.0030675 k( 307) = ( 0.5000000 0.2876039 0.0597786), wk = 0.0030675 k( 308) = ( 0.5000000 0.2876039 0.0398524), wk = 0.0030675 k( 309) = ( 0.5000000 0.2876039 0.0199262), wk = 0.0030675 k( 310) = ( 0.5000000 0.2876039 0.0000000), wk = 0.0030675 k( 311) = ( 0.0000000 0.0000000 1.0027947), wk = 0.0030675 k( 312) = ( 0.0166667 0.0095868 1.0027947), wk = 0.0030675 k( 313) = ( 0.0333333 0.0191736 1.0027947), wk = 0.0030675 k( 314) = ( 0.0500000 0.0287604 1.0027947), wk = 0.0030675 k( 315) = ( 0.0666667 0.0383472 1.0027947), wk = 0.0030675 k( 316) = ( 0.0833333 0.0479340 1.0027947), wk = 0.0030675 k( 317) = ( 0.1000000 0.0575208 1.0027947), wk = 0.0030675 k( 318) = ( 0.1166667 0.0671076 1.0027947), wk = 0.0030675 k( 319) = ( 0.1333333 0.0766944 1.0027947), wk = 0.0030675 k( 320) = ( 0.1500000 0.0862812 1.0027947), wk = 0.0030675 k( 321) = ( 0.1666667 0.0958680 1.0027947), wk = 0.0030675 k( 322) = ( 0.1833333 0.1054548 1.0027947), wk = 0.0030675 k( 323) = ( 0.2000000 0.1150416 1.0027947), wk = 0.0030675 k( 324) = ( 0.2166667 0.1246284 1.0027947), wk = 0.0030675 k( 325) = ( 0.2333333 0.1342152 1.0027947), wk = 0.0030675 k( 326) = ( 0.2500000 0.1438020 1.0027947), wk = 0.0030675 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 2) = ( 0.0000000 0.0000000 0.0100000), wk = 0.0030675 k( 3) = ( 0.0000000 0.0000000 0.0200000), wk = 0.0030675 k( 4) = ( 0.0000000 0.0000000 0.0300000), wk = 0.0030675 k( 5) = ( 0.0000000 0.0000000 0.0400000), wk = 0.0030675 k( 6) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0030675 k( 7) = ( 0.0000000 0.0000000 0.0600000), wk = 0.0030675 k( 8) = ( 0.0000000 0.0000000 0.0700000), wk = 0.0030675 k( 9) = ( 0.0000000 0.0000000 0.0800000), wk = 0.0030675 k( 10) = ( 0.0000000 0.0000000 0.0900000), wk = 0.0030675 k( 11) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0030675 k( 12) = ( 0.0000000 0.0000000 0.1100000), wk = 0.0030675 k( 13) = ( 0.0000000 0.0000000 0.1200000), wk = 0.0030675 k( 14) = ( 0.0000000 0.0000000 0.1300000), wk = 0.0030675 k( 15) = ( 0.0000000 0.0000000 0.1400000), wk = 0.0030675 k( 16) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0030675 k( 17) = ( 0.0000000 0.0000000 0.1600000), wk = 0.0030675 k( 18) = ( 0.0000000 0.0000000 0.1700000), wk = 0.0030675 k( 19) = ( 0.0000000 0.0000000 0.1800000), wk = 0.0030675 k( 20) = ( 0.0000000 0.0000000 0.1900000), wk = 0.0030675 k( 21) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0030675 k( 22) = ( 0.0000000 0.0000000 0.2100000), wk = 0.0030675 k( 23) = ( 0.0000000 0.0000000 0.2200000), wk = 0.0030675 k( 24) = ( 0.0000000 0.0000000 0.2300000), wk = 0.0030675 k( 25) = ( 0.0000000 0.0000000 0.2400000), wk = 0.0030675 k( 26) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0030675 k( 27) = ( 0.0000000 0.0000000 0.2600000), wk = 0.0030675 k( 28) = ( 0.0000000 0.0000000 0.2700000), wk = 0.0030675 k( 29) = ( 0.0000000 0.0000000 0.2800000), wk = 0.0030675 k( 30) = ( 0.0000000 0.0000000 0.2900000), wk = 0.0030675 k( 31) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0030675 k( 32) = ( 0.0000000 0.0000000 0.3100000), wk = 0.0030675 k( 33) = ( 0.0000000 0.0000000 0.3200000), wk = 0.0030675 k( 34) = ( 0.0000000 0.0000000 0.3300000), wk = 0.0030675 k( 35) = ( 0.0000000 0.0000000 0.3400000), wk = 0.0030675 k( 36) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0030675 k( 37) = ( 0.0000000 0.0000000 0.3600000), wk = 0.0030675 k( 38) = ( 0.0000000 0.0000000 0.3700000), wk = 0.0030675 k( 39) = ( 0.0000000 0.0000000 0.3800000), wk = 0.0030675 k( 40) = ( 0.0000000 0.0000000 0.3900000), wk = 0.0030675 k( 41) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0030675 k( 42) = ( 0.0000000 0.0000000 0.4100000), wk = 0.0030675 k( 43) = ( 0.0000000 0.0000000 0.4200000), wk = 0.0030675 k( 44) = ( 0.0000000 0.0000000 0.4300000), wk = 0.0030675 k( 45) = ( 0.0000000 0.0000000 0.4400000), wk = 0.0030675 k( 46) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0030675 k( 47) = ( 0.0000000 0.0000000 0.4600000), wk = 0.0030675 k( 48) = ( 0.0000000 0.0000000 0.4700000), wk = 0.0030675 k( 49) = ( 0.0000000 0.0000000 0.4800000), wk = 0.0030675 k( 50) = ( 0.0000000 0.0000000 0.4900000), wk = 0.0030675 k( 51) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030675 k( 52) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030675 k( 53) = ( -0.0091907 0.0091907 0.5000000), wk = 0.0030675 k( 54) = ( -0.0183813 0.0183813 0.5000000), wk = 0.0030675 k( 55) = ( -0.0275720 0.0275720 0.5000000), wk = 0.0030675 k( 56) = ( -0.0367627 0.0367627 0.5000000), wk = 0.0030675 k( 57) = ( -0.0459533 0.0459533 0.5000000), wk = 0.0030675 k( 58) = ( -0.0551440 0.0551440 0.5000000), wk = 0.0030675 k( 59) = ( -0.0643347 0.0643347 0.5000000), wk = 0.0030675 k( 60) = ( -0.0735254 0.0735254 0.5000000), wk = 0.0030675 k( 61) = ( -0.0827160 0.0827160 0.5000000), wk = 0.0030675 k( 62) = ( -0.0827160 0.0827160 0.5000000), wk = 0.0030675 k( 63) = ( -0.0896708 0.0896708 0.4930453), wk = 0.0030675 k( 64) = ( -0.0966255 0.0966255 0.4860905), wk = 0.0030675 k( 65) = ( -0.1035802 0.1035802 0.4791358), wk = 0.0030675 k( 66) = ( -0.1105350 0.1105350 0.4721811), wk = 0.0030675 k( 67) = ( -0.1174897 0.1174897 0.4652263), wk = 0.0030675 k( 68) = ( -0.1244444 0.1244444 0.4582716), wk = 0.0030675 k( 69) = ( -0.1313992 0.1313992 0.4513169), wk = 0.0030675 k( 70) = ( -0.1383539 0.1383539 0.4443621), wk = 0.0030675 k( 71) = ( -0.1453086 0.1453086 0.4374074), wk = 0.0030675 k( 72) = ( -0.1522634 0.1522634 0.4304527), wk = 0.0030675 k( 73) = ( -0.1592181 0.1592181 0.4234979), wk = 0.0030675 k( 74) = ( -0.1661728 0.1661728 0.4165432), wk = 0.0030675 k( 75) = ( -0.1731275 0.1731275 0.4095885), wk = 0.0030675 k( 76) = ( -0.1800823 0.1800823 0.4026337), wk = 0.0030675 k( 77) = ( -0.1870370 0.1870370 0.3956790), wk = 0.0030675 k( 78) = ( -0.1939917 0.1939918 0.3887243), wk = 0.0030675 k( 79) = ( -0.2009465 0.2009465 0.3817695), wk = 0.0030675 k( 80) = ( -0.2079012 0.2079012 0.3748148), wk = 0.0030675 k( 81) = ( -0.2148559 0.2148560 0.3678601), wk = 0.0030675 k( 82) = ( -0.2218107 0.2218107 0.3609053), wk = 0.0030675 k( 83) = ( -0.2287654 0.2287654 0.3539506), wk = 0.0030675 k( 84) = ( -0.2357201 0.2357202 0.3469959), wk = 0.0030675 k( 85) = ( -0.2426749 0.2426749 0.3400411), wk = 0.0030675 k( 86) = ( -0.2496296 0.2496296 0.3330864), wk = 0.0030675 k( 87) = ( -0.2565844 0.2565844 0.3261317), wk = 0.0030675 k( 88) = ( -0.2635391 0.2635391 0.3191769), wk = 0.0030675 k( 89) = ( -0.2704938 0.2704938 0.3122222), wk = 0.0030675 k( 90) = ( -0.2774486 0.2774486 0.3052675), wk = 0.0030675 k( 91) = ( -0.2844033 0.2844033 0.2983128), wk = 0.0030675 k( 92) = ( -0.2913580 0.2913580 0.2913580), wk = 0.0030675 k( 93) = ( -0.2913580 0.2913580 0.2913580), wk = 0.0030675 k( 94) = ( -0.2842517 0.2842517 0.2842517), wk = 0.0030675 k( 95) = ( -0.2771454 0.2771454 0.2771454), wk = 0.0030675 k( 96) = ( -0.2700391 0.2700391 0.2700391), wk = 0.0030675 k( 97) = ( -0.2629328 0.2629328 0.2629328), wk = 0.0030675 k( 98) = ( -0.2558265 0.2558265 0.2558266), wk = 0.0030675 k( 99) = ( -0.2487203 0.2487203 0.2487203), wk = 0.0030675 k( 100) = ( -0.2416140 0.2416140 0.2416140), wk = 0.0030675 k( 101) = ( -0.2345077 0.2345077 0.2345077), wk = 0.0030675 k( 102) = ( -0.2274014 0.2274014 0.2274014), wk = 0.0030675 k( 103) = ( -0.2202951 0.2202951 0.2202951), wk = 0.0030675 k( 104) = ( -0.2131888 0.2131888 0.2131888), wk = 0.0030675 k( 105) = ( -0.2060825 0.2060825 0.2060825), wk = 0.0030675 k( 106) = ( -0.1989762 0.1989762 0.1989762), wk = 0.0030675 k( 107) = ( -0.1918699 0.1918699 0.1918699), wk = 0.0030675 k( 108) = ( -0.1847636 0.1847636 0.1847636), wk = 0.0030675 k( 109) = ( -0.1776573 0.1776573 0.1776573), wk = 0.0030675 k( 110) = ( -0.1705510 0.1705510 0.1705510), wk = 0.0030675 k( 111) = ( -0.1634447 0.1634447 0.1634447), wk = 0.0030675 k( 112) = ( -0.1563384 0.1563384 0.1563384), wk = 0.0030675 k( 113) = ( -0.1492322 0.1492322 0.1492321), wk = 0.0030675 k( 114) = ( -0.1421259 0.1421259 0.1421259), wk = 0.0030675 k( 115) = ( -0.1350196 0.1350196 0.1350196), wk = 0.0030675 k( 116) = ( -0.1279133 0.1279133 0.1279133), wk = 0.0030675 k( 117) = ( -0.1208070 0.1208070 0.1208070), wk = 0.0030675 k( 118) = ( -0.1137007 0.1137007 0.1137007), wk = 0.0030675 k( 119) = ( -0.1065944 0.1065944 0.1065944), wk = 0.0030675 k( 120) = ( -0.0994881 0.0994881 0.0994881), wk = 0.0030675 k( 121) = ( -0.0923818 0.0923818 0.0923818), wk = 0.0030675 k( 122) = ( -0.0852755 0.0852755 0.0852755), wk = 0.0030675 k( 123) = ( -0.0781692 0.0781692 0.0781692), wk = 0.0030675 k( 124) = ( -0.0710629 0.0710629 0.0710629), wk = 0.0030675 k( 125) = ( -0.0639566 0.0639566 0.0639566), wk = 0.0030675 k( 126) = ( -0.0568503 0.0568503 0.0568503), wk = 0.0030675 k( 127) = ( -0.0497440 0.0497440 0.0497440), wk = 0.0030675 k( 128) = ( -0.0426378 0.0426378 0.0426378), wk = 0.0030675 k( 129) = ( -0.0355315 0.0355315 0.0355315), wk = 0.0030675 k( 130) = ( -0.0284252 0.0284252 0.0284252), wk = 0.0030675 k( 131) = ( -0.0213189 0.0213189 0.0213189), wk = 0.0030675 k( 132) = ( -0.0142126 0.0142126 0.0142126), wk = 0.0030675 k( 133) = ( -0.0071063 0.0071063 0.0071063), wk = 0.0030675 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030675 k( 136) = ( 0.0172414 0.0172414 -0.0172414), wk = 0.0030675 k( 137) = ( 0.0344828 0.0344828 -0.0344828), wk = 0.0030675 k( 138) = ( 0.0517241 0.0517241 -0.0517241), wk = 0.0030675 k( 139) = ( 0.0689655 0.0689655 -0.0689655), wk = 0.0030675 k( 140) = ( 0.0862069 0.0862069 -0.0862069), wk = 0.0030675 k( 141) = ( 0.1034483 0.1034483 -0.1034483), wk = 0.0030675 k( 142) = ( 0.1206897 0.1206897 -0.1206897), wk = 0.0030675 k( 143) = ( 0.1379310 0.1379310 -0.1379310), wk = 0.0030675 k( 144) = ( 0.1551724 0.1551724 -0.1551724), wk = 0.0030675 k( 145) = ( 0.1724138 0.1724138 -0.1724138), wk = 0.0030675 k( 146) = ( 0.1896552 0.1896552 -0.1896552), wk = 0.0030675 k( 147) = ( 0.2068966 0.2068966 -0.2068966), wk = 0.0030675 k( 148) = ( 0.2241379 0.2241379 -0.2241379), wk = 0.0030675 k( 149) = ( 0.2413793 0.2413793 -0.2413793), wk = 0.0030675 k( 150) = ( 0.2586207 0.2586207 -0.2586207), wk = 0.0030675 k( 151) = ( 0.2758621 0.2758621 -0.2758621), wk = 0.0030675 k( 152) = ( 0.2931034 0.2931034 -0.2931034), wk = 0.0030675 k( 153) = ( 0.3103448 0.3103448 -0.3103448), wk = 0.0030675 k( 154) = ( 0.3275862 0.3275862 -0.3275862), wk = 0.0030675 k( 155) = ( 0.3448276 0.3448276 -0.3448276), wk = 0.0030675 k( 156) = ( 0.3620690 0.3620690 -0.3620690), wk = 0.0030675 k( 157) = ( 0.3793103 0.3793103 -0.3793103), wk = 0.0030675 k( 158) = ( 0.3965517 0.3965517 -0.3965517), wk = 0.0030675 k( 159) = ( 0.4137931 0.4137931 -0.4137931), wk = 0.0030675 k( 160) = ( 0.4310345 0.4310345 -0.4310345), wk = 0.0030675 k( 161) = ( 0.4482759 0.4482759 -0.4482759), wk = 0.0030675 k( 162) = ( 0.4655172 0.4655172 -0.4655172), wk = 0.0030675 k( 163) = ( 0.4827586 0.4827586 -0.4827586), wk = 0.0030675 k( 164) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030675 k( 165) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030675 k( 166) = ( 0.4930453 0.5069547 -0.4930453), wk = 0.0030675 k( 167) = ( 0.4860905 0.5139095 -0.4860905), wk = 0.0030675 k( 168) = ( 0.4791358 0.5208642 -0.4791358), wk = 0.0030675 k( 169) = ( 0.4721811 0.5278189 -0.4721811), wk = 0.0030675 k( 170) = ( 0.4652263 0.5347737 -0.4652263), wk = 0.0030675 k( 171) = ( 0.4582716 0.5417284 -0.4582716), wk = 0.0030675 k( 172) = ( 0.4513169 0.5486831 -0.4513169), wk = 0.0030675 k( 173) = ( 0.4443621 0.5556379 -0.4443621), wk = 0.0030675 k( 174) = ( 0.4374074 0.5625926 -0.4374074), wk = 0.0030675 k( 175) = ( 0.4304527 0.5695473 -0.4304527), wk = 0.0030675 k( 176) = ( 0.4234979 0.5765021 -0.4234979), wk = 0.0030675 k( 177) = ( 0.4165432 0.5834568 -0.4165432), wk = 0.0030675 k( 178) = ( 0.4095885 0.5904115 -0.4095885), wk = 0.0030675 k( 179) = ( 0.4026337 0.5973663 -0.4026337), wk = 0.0030675 k( 180) = ( 0.3956790 0.6043210 -0.3956790), wk = 0.0030675 k( 181) = ( 0.3887243 0.6112757 -0.3887243), wk = 0.0030675 k( 182) = ( 0.3817695 0.6182305 -0.3817695), wk = 0.0030675 k( 183) = ( 0.3748148 0.6251852 -0.3748148), wk = 0.0030675 k( 184) = ( 0.3678601 0.6321399 -0.3678601), wk = 0.0030675 k( 185) = ( 0.3609053 0.6390947 -0.3609053), wk = 0.0030675 k( 186) = ( 0.3539506 0.6460494 -0.3539506), wk = 0.0030675 k( 187) = ( 0.3469959 0.6530041 -0.3469959), wk = 0.0030675 k( 188) = ( 0.3400411 0.6599589 -0.3400411), wk = 0.0030675 k( 189) = ( 0.3330864 0.6669136 -0.3330864), wk = 0.0030675 k( 190) = ( 0.3261317 0.6738683 -0.3261317), wk = 0.0030675 k( 191) = ( 0.3191769 0.6808231 -0.3191769), wk = 0.0030675 k( 192) = ( 0.3122222 0.6877778 -0.3122222), wk = 0.0030675 k( 193) = ( 0.3052675 0.6947325 -0.3052675), wk = 0.0030675 k( 194) = ( 0.2983128 0.7016872 -0.2983128), wk = 0.0030675 k( 195) = ( 0.2913580 0.7086420 -0.2913580), wk = 0.0030675 k( 196) = ( 0.2913580 0.7086420 -0.2913580), wk = 0.0030675 k( 197) = ( 0.2731481 0.6956019 -0.2731481), wk = 0.0030675 k( 198) = ( 0.2549383 0.6825617 -0.2549383), wk = 0.0030675 k( 199) = ( 0.2367284 0.6695216 -0.2367284), wk = 0.0030675 k( 200) = ( 0.2185185 0.6564815 -0.2185185), wk = 0.0030675 k( 201) = ( 0.2003086 0.6434414 -0.2003086), wk = 0.0030675 k( 202) = ( 0.1820988 0.6304012 -0.1820988), wk = 0.0030675 k( 203) = ( 0.1638889 0.6173611 -0.1638889), wk = 0.0030675 k( 204) = ( 0.1456790 0.6043210 -0.1456790), wk = 0.0030675 k( 205) = ( 0.1274691 0.5912809 -0.1274691), wk = 0.0030675 k( 206) = ( 0.1092593 0.5782407 -0.1092593), wk = 0.0030675 k( 207) = ( 0.0910494 0.5652006 -0.0910494), wk = 0.0030675 k( 208) = ( 0.0728395 0.5521605 -0.0728395), wk = 0.0030675 k( 209) = ( 0.0546296 0.5391204 -0.0546296), wk = 0.0030675 k( 210) = ( 0.0364198 0.5260803 -0.0364197), wk = 0.0030675 k( 211) = ( 0.0182099 0.5130401 -0.0182099), wk = 0.0030675 k( 212) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030675 k( 213) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0030675 k( 214) = ( 0.0069444 0.4930556 0.0069444), wk = 0.0030675 k( 215) = ( 0.0138889 0.4861111 0.0138889), wk = 0.0030675 k( 216) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0030675 k( 217) = ( 0.0277778 0.4722222 0.0277778), wk = 0.0030675 k( 218) = ( 0.0347222 0.4652778 0.0347222), wk = 0.0030675 k( 219) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0030675 k( 220) = ( 0.0486111 0.4513889 0.0486111), wk = 0.0030675 k( 221) = ( 0.0555556 0.4444444 0.0555556), wk = 0.0030675 k( 222) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0030675 k( 223) = ( 0.0694444 0.4305556 0.0694444), wk = 0.0030675 k( 224) = ( 0.0763889 0.4236111 0.0763889), wk = 0.0030675 k( 225) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0030675 k( 226) = ( 0.0902778 0.4097222 0.0902778), wk = 0.0030675 k( 227) = ( 0.0972222 0.4027778 0.0972222), wk = 0.0030675 k( 228) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0030675 k( 229) = ( 0.1111111 0.3888889 0.1111111), wk = 0.0030675 k( 230) = ( 0.1180556 0.3819444 0.1180556), wk = 0.0030675 k( 231) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0030675 k( 232) = ( 0.1319444 0.3680556 0.1319444), wk = 0.0030675 k( 233) = ( 0.1388889 0.3611111 0.1388889), wk = 0.0030675 k( 234) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0030675 k( 235) = ( 0.1527778 0.3472222 0.1527778), wk = 0.0030675 k( 236) = ( 0.1597222 0.3402778 0.1597222), wk = 0.0030675 k( 237) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0030675 k( 238) = ( 0.1736111 0.3263889 0.1736111), wk = 0.0030675 k( 239) = ( 0.1805556 0.3194444 0.1805556), wk = 0.0030675 k( 240) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0030675 k( 241) = ( 0.1944444 0.3055556 0.1944444), wk = 0.0030675 k( 242) = ( 0.2013889 0.2986111 0.2013889), wk = 0.0030675 k( 243) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0030675 k( 244) = ( 0.2152778 0.2847222 0.2152778), wk = 0.0030675 k( 245) = ( 0.2222222 0.2777778 0.2222222), wk = 0.0030675 k( 246) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0030675 k( 247) = ( 0.2361111 0.2638889 0.2361111), wk = 0.0030675 k( 248) = ( 0.2430556 0.2569444 0.2430556), wk = 0.0030675 k( 249) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030675 k( 250) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030675 k( 251) = ( 0.2647059 0.2647059 0.2304285), wk = 0.0030675 k( 252) = ( 0.2794118 0.2794118 0.2108569), wk = 0.0030675 k( 253) = ( 0.2941177 0.2941177 0.1912854), wk = 0.0030675 k( 254) = ( 0.3088235 0.3088235 0.1717139), wk = 0.0030675 k( 255) = ( 0.3235294 0.3235294 0.1521423), wk = 0.0030675 k( 256) = ( 0.3382353 0.3382353 0.1325708), wk = 0.0030675 k( 257) = ( 0.3529412 0.3529412 0.1129993), wk = 0.0030675 k( 258) = ( 0.3676471 0.3676471 0.0934277), wk = 0.0030675 k( 259) = ( 0.3823529 0.3823529 0.0738562), wk = 0.0030675 k( 260) = ( 0.3970588 0.3970588 0.0542847), wk = 0.0030675 k( 261) = ( 0.4117647 0.4117647 0.0347132), wk = 0.0030675 k( 262) = ( 0.4264706 0.4264706 0.0151416), wk = 0.0030675 k( 263) = ( 0.4411765 0.4411765 -0.0044299), wk = 0.0030675 k( 264) = ( 0.4558823 0.4558823 -0.0240014), wk = 0.0030675 k( 265) = ( 0.4705882 0.4705882 -0.0435730), wk = 0.0030675 k( 266) = ( 0.4852941 0.4852941 -0.0631445), wk = 0.0030675 k( 267) = ( 0.5000000 0.5000000 -0.0827160), wk = 0.0030675 k( 268) = ( 0.5000000 0.5000000 -0.0827160), wk = 0.0030675 k( 269) = ( 0.5000000 0.5000000 -0.0926514), wk = 0.0030675 k( 270) = ( 0.5000000 0.5000000 -0.1025867), wk = 0.0030675 k( 271) = ( 0.5000000 0.5000000 -0.1125220), wk = 0.0030675 k( 272) = ( 0.5000000 0.5000000 -0.1224574), wk = 0.0030675 k( 273) = ( 0.5000000 0.5000000 -0.1323927), wk = 0.0030675 k( 274) = ( 0.5000000 0.5000000 -0.1423280), wk = 0.0030675 k( 275) = ( 0.5000000 0.5000000 -0.1522634), wk = 0.0030675 k( 276) = ( 0.5000000 0.5000000 -0.1621987), wk = 0.0030675 k( 277) = ( 0.5000000 0.5000000 -0.1721340), wk = 0.0030675 k( 278) = ( 0.5000000 0.5000000 -0.1820693), wk = 0.0030675 k( 279) = ( 0.5000000 0.5000000 -0.1920047), wk = 0.0030675 k( 280) = ( 0.5000000 0.5000000 -0.2019400), wk = 0.0030675 k( 281) = ( 0.5000000 0.5000000 -0.2118754), wk = 0.0030675 k( 282) = ( 0.5000000 0.5000000 -0.2218107), wk = 0.0030675 k( 283) = ( 0.5000000 0.5000000 -0.2317460), wk = 0.0030675 k( 284) = ( 0.5000000 0.5000000 -0.2416813), wk = 0.0030675 k( 285) = ( 0.5000000 0.5000000 -0.2516167), wk = 0.0030675 k( 286) = ( 0.5000000 0.5000000 -0.2615520), wk = 0.0030675 k( 287) = ( 0.5000000 0.5000000 -0.2714874), wk = 0.0030675 k( 288) = ( 0.5000000 0.5000000 -0.2814227), wk = 0.0030675 k( 289) = ( 0.5000000 0.5000000 -0.2913580), wk = 0.0030675 k( 290) = ( 0.5000000 0.5000000 -0.3012934), wk = 0.0030675 k( 291) = ( 0.5000000 0.5000000 -0.3112287), wk = 0.0030675 k( 292) = ( 0.5000000 0.5000000 -0.3211640), wk = 0.0030675 k( 293) = ( 0.5000000 0.5000000 -0.3310993), wk = 0.0030675 k( 294) = ( 0.5000000 0.5000000 -0.3410347), wk = 0.0030675 k( 295) = ( 0.5000000 0.5000000 -0.3509700), wk = 0.0030675 k( 296) = ( 0.5000000 0.5000000 -0.3609053), wk = 0.0030675 k( 297) = ( 0.5000000 0.5000000 -0.3708407), wk = 0.0030675 k( 298) = ( 0.5000000 0.5000000 -0.3807760), wk = 0.0030675 k( 299) = ( 0.5000000 0.5000000 -0.3907113), wk = 0.0030675 k( 300) = ( 0.5000000 0.5000000 -0.4006467), wk = 0.0030675 k( 301) = ( 0.5000000 0.5000000 -0.4105820), wk = 0.0030675 k( 302) = ( 0.5000000 0.5000000 -0.4205173), wk = 0.0030675 k( 303) = ( 0.5000000 0.5000000 -0.4304527), wk = 0.0030675 k( 304) = ( 0.5000000 0.5000000 -0.4403880), wk = 0.0030675 k( 305) = ( 0.5000000 0.5000000 -0.4503233), wk = 0.0030675 k( 306) = ( 0.5000000 0.5000000 -0.4602587), wk = 0.0030675 k( 307) = ( 0.5000000 0.5000000 -0.4701940), wk = 0.0030675 k( 308) = ( 0.5000000 0.5000000 -0.4801293), wk = 0.0030675 k( 309) = ( 0.5000000 0.5000000 -0.4900647), wk = 0.0030675 k( 310) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030675 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030675 k( 312) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0030675 k( 313) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0030675 k( 314) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0030675 k( 315) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0030675 k( 316) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0030675 k( 317) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0030675 k( 318) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0030675 k( 319) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0030675 k( 320) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0030675 k( 321) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0030675 k( 322) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0030675 k( 323) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0030675 k( 324) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0030675 k( 325) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0030675 k( 326) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030675 Dense grid: 71423 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.45 Mb ( 512, 58) NL pseudopotentials 0.51 Mb ( 256, 131) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 1984) G-vector shells 0.01 Mb ( 881) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.81 Mb ( 512, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.23 Mb ( 131, 2, 58) The potential is recalculated from file : ./BaxMnGex2.save/charge-density.dat Starting wfc are 66 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.2 secs Computing kpt #: 2 total cpu time spent up to now is 4.2 secs Computing kpt #: 3 total cpu time spent up to now is 5.3 secs Computing kpt #: 4 total cpu time spent up to now is 6.3 secs Computing kpt #: 5 total cpu time spent up to now is 7.3 secs Computing kpt #: 6 total cpu time spent up to now is 8.3 secs Computing kpt #: 7 total cpu time spent up to now is 9.2 secs Computing kpt #: 8 total cpu time spent up to now is 10.2 secs Computing kpt #: 9 total cpu time spent up to now is 11.1 secs Computing kpt #: 10 total cpu time spent up to now is 12.1 secs Computing kpt #: 11 total cpu time spent up to now is 13.0 secs Computing kpt #: 12 total cpu time spent up to now is 13.9 secs Computing kpt #: 13 total cpu time spent up to now is 14.9 secs Computing kpt #: 14 total cpu time spent up to now is 15.8 secs Computing kpt #: 15 total cpu time spent up to now is 16.7 secs Computing kpt #: 16 total cpu time spent up to now is 17.7 secs Computing kpt #: 17 total cpu time spent up to now is 18.6 secs Computing kpt #: 18 total cpu time spent up to now is 19.5 secs Computing kpt #: 19 total cpu time spent up to now is 20.4 secs Computing kpt #: 20 total cpu time spent up to now is 21.3 secs Computing kpt #: 21 total cpu time spent up to now is 22.3 secs Computing kpt #: 22 total cpu time spent up to now is 23.2 secs Computing kpt #: 23 total cpu time spent up to now is 24.0 secs Computing kpt #: 24 total cpu time spent up to now is 24.9 secs Computing kpt #: 25 total cpu time spent up to now is 25.8 secs Computing kpt #: 26 total cpu time spent up to now is 26.7 secs Computing kpt #: 27 total cpu time spent up to now is 27.6 secs Computing kpt #: 28 total cpu time spent up to now is 28.5 secs Computing kpt #: 29 total cpu time spent up to now is 29.4 secs Computing kpt #: 30 total cpu time spent up to now is 30.3 secs Computing kpt #: 31 total cpu time spent up to now is 31.2 secs Computing kpt #: 32 total cpu time spent up to now is 32.0 secs Computing kpt #: 33 total cpu time spent up to now is 32.9 secs Computing kpt #: 34 total cpu time spent up to now is 33.8 secs Computing kpt #: 35 total cpu time spent up to now is 34.7 secs Computing kpt #: 36 total cpu time spent up to now is 35.6 secs Computing kpt #: 37 total cpu time spent up to now is 36.5 secs Computing kpt #: 38 total cpu time spent up to now is 37.4 secs Computing kpt #: 39 total cpu time spent up to now is 38.3 secs Computing kpt #: 40 total cpu time spent up to now is 39.1 secs Computing kpt #: 41 total cpu time spent up to now is 40.0 secs Computing kpt #: 42 total cpu time spent up to now is 40.9 secs Computing kpt #: 43 total cpu time spent up to now is 41.8 secs Computing kpt #: 44 total cpu time spent up to now is 42.7 secs Computing kpt #: 45 total cpu time spent up to now is 43.7 secs Computing kpt #: 46 total cpu time spent up to now is 44.6 secs Computing kpt #: 47 total cpu time spent up to now is 45.5 secs Computing kpt #: 48 total cpu time spent up to now is 46.4 secs Computing kpt #: 49 total cpu time spent up to now is 47.2 secs Computing kpt #: 50 total cpu time spent up to now is 48.1 secs Computing kpt #: 51 total cpu time spent up to now is 49.0 secs Computing kpt #: 52 total cpu time spent up to now is 49.9 secs Computing kpt #: 53 total cpu time spent up to now is 50.8 secs Computing kpt #: 54 total cpu time spent up to now is 51.7 secs Computing kpt #: 55 total cpu time spent up to now is 52.6 secs Computing kpt #: 56 total cpu time spent up to now is 53.5 secs Computing kpt #: 57 total cpu time spent up to now is 54.4 secs Computing kpt #: 58 total cpu time spent up to now is 55.3 secs Computing kpt #: 59 total cpu time spent up to now is 56.2 secs Computing kpt #: 60 total cpu time spent up to now is 57.1 secs Computing kpt #: 61 total cpu time spent up to now is 58.1 secs Computing kpt #: 62 total cpu time spent up to now is 59.0 secs Computing kpt #: 63 total cpu time spent up to now is 59.9 secs Computing kpt #: 64 total cpu time spent up to now is 60.8 secs Computing kpt #: 65 total cpu time spent up to now is 61.8 secs Computing kpt #: 66 total cpu time spent up to now is 62.7 secs Computing kpt #: 67 total cpu time spent up to now is 63.7 secs Computing kpt #: 68 total cpu time spent up to now is 66.6 secs Computing kpt #: 69 total cpu time spent up to now is 67.5 secs Computing kpt #: 70 total cpu time spent up to now is 68.5 secs Computing kpt #: 71 total cpu time spent up to now is 69.4 secs Computing kpt #: 72 total cpu time spent up to now is 70.4 secs Computing kpt #: 73 total cpu time spent up to now is 71.3 secs Computing kpt #: 74 total cpu time spent up to now is 72.3 secs Computing kpt #: 75 total cpu time spent up to now is 73.2 secs Computing kpt #: 76 total cpu time spent up to now is 74.1 secs Computing kpt #: 77 total cpu time spent up to now is 75.1 secs Computing kpt #: 78 total cpu time spent up to now is 76.1 secs Computing kpt #: 79 total cpu time spent up to now is 77.0 secs Computing kpt #: 80 total cpu time spent up to now is 78.0 secs Computing kpt #: 81 total cpu time spent up to now is 78.9 secs Computing kpt #: 82 total cpu time spent up to now is 79.9 secs Computing kpt #: 83 total cpu time spent up to now is 80.9 secs Computing kpt #: 84 total cpu time spent up to now is 81.8 secs Computing kpt #: 85 total cpu time spent up to now is 82.8 secs Computing kpt #: 86 total cpu time spent up to now is 83.7 secs Computing kpt #: 87 total cpu time spent up to now is 84.7 secs Computing kpt #: 88 total cpu time spent up to now is 85.6 secs Computing kpt #: 89 total cpu time spent up to now is 86.6 secs Computing kpt #: 90 total cpu time spent up to now is 87.5 secs Computing kpt #: 91 total cpu time spent up to now is 88.5 secs Computing kpt #: 92 total cpu time spent up to now is 89.4 secs Computing kpt #: 93 total cpu time spent up to now is 90.4 secs Computing kpt #: 94 total cpu time spent up to now is 91.3 secs Computing kpt #: 95 total cpu time spent up to now is 92.2 secs Computing kpt #: 96 total cpu time spent up to now is 93.1 secs Computing kpt #: 97 total cpu time spent up to now is 94.1 secs Computing kpt #: 98 total cpu time spent up to now is 95.0 secs Computing kpt #: 99 total cpu time spent up to now is 95.9 secs Computing kpt #: 100 total cpu time spent up to now is 96.8 secs Computing kpt #: 101 total cpu time spent up to now is 97.7 secs Computing kpt #: 102 total cpu time spent up to now is 98.6 secs Computing kpt #: 103 total cpu time spent up to now is 99.5 secs Computing kpt #: 104 total cpu time spent up to now is 100.4 secs Computing kpt #: 105 total cpu time spent up to now is 101.3 secs Computing kpt #: 106 total cpu time spent up to now is 102.3 secs Computing kpt #: 107 total cpu time spent up to now is 103.2 secs Computing kpt #: 108 total cpu time spent up to now is 104.1 secs Computing kpt #: 109 total cpu time spent up to now is 105.0 secs Computing kpt #: 110 total cpu time spent up to now is 105.9 secs Computing kpt #: 111 total cpu time spent up to now is 106.8 secs Computing kpt #: 112 total cpu time spent up to now is 107.7 secs Computing kpt #: 113 total cpu time spent up to now is 108.6 secs Computing kpt #: 114 total cpu time spent up to now is 109.5 secs Computing kpt #: 115 total cpu time spent up to now is 110.4 secs Computing kpt #: 116 total cpu time spent up to now is 111.4 secs Computing kpt #: 117 total cpu time spent up to now is 112.3 secs Computing kpt #: 118 total cpu time spent up to now is 113.3 secs Computing kpt #: 119 total cpu time spent up to now is 114.2 secs Computing kpt #: 120 total cpu time spent up to now is 115.2 secs Computing kpt #: 121 total cpu time spent up to now is 116.1 secs Computing kpt #: 122 total cpu time spent up to now is 117.1 secs Computing kpt #: 123 total cpu time spent up to now is 118.1 secs Computing kpt #: 124 total cpu time spent up to now is 119.0 secs Computing kpt #: 125 total cpu time spent up to now is 120.0 secs Computing kpt #: 126 total cpu time spent up to now is 121.0 secs Computing kpt #: 127 total cpu time spent up to now is 122.0 secs Computing kpt #: 128 total cpu time spent up to now is 123.0 secs Computing kpt #: 129 total cpu time spent up to now is 124.1 secs Computing kpt #: 130 total cpu time spent up to now is 125.1 secs Computing kpt #: 131 total cpu time spent up to now is 126.1 secs Computing kpt #: 132 total cpu time spent up to now is 127.2 secs Computing kpt #: 133 total cpu time spent up to now is 128.2 secs Computing kpt #: 134 total cpu time spent up to now is 129.1 secs Computing kpt #: 135 total cpu time spent up to now is 130.1 secs Computing kpt #: 136 total cpu time spent up to now is 131.0 secs Computing kpt #: 137 total cpu time spent up to now is 132.0 secs Computing kpt #: 138 total cpu time spent up to now is 133.0 secs Computing kpt #: 139 total cpu time spent up to now is 134.0 secs Computing kpt #: 140 total cpu time spent up to now is 135.0 secs Computing kpt #: 141 total cpu time spent up to now is 136.0 secs Computing kpt #: 142 total cpu time spent up to now is 136.9 secs Computing kpt #: 143 total cpu time spent up to now is 137.8 secs Computing kpt #: 144 total cpu time spent up to now is 139.0 secs Computing kpt #: 145 total cpu time spent up to now is 140.3 secs Computing kpt #: 146 total cpu time spent up to now is 141.2 secs Computing kpt #: 147 total cpu time spent up to now is 142.1 secs Computing kpt #: 148 total cpu time spent up to now is 143.0 secs Computing kpt #: 149 total cpu time spent up to now is 143.9 secs Computing kpt #: 150 total cpu time spent up to now is 144.9 secs Computing kpt #: 151 total cpu time spent up to now is 145.8 secs Computing kpt #: 152 total cpu time spent up to now is 146.8 secs Computing kpt #: 153 total cpu time spent up to now is 147.8 secs Computing kpt #: 154 total cpu time spent up to now is 148.8 secs Computing kpt #: 155 total cpu time spent up to now is 149.8 secs Computing kpt #: 156 total cpu time spent up to now is 150.9 secs Computing kpt #: 157 total cpu time spent up to now is 151.9 secs Computing kpt #: 158 total cpu time spent up to now is 152.9 secs Computing kpt #: 159 total cpu time spent up to now is 153.8 secs Computing kpt #: 160 total cpu time spent up to now is 154.8 secs Computing kpt #: 161 total cpu time spent up to now is 155.8 secs Computing kpt #: 162 total cpu time spent up to now is 156.7 secs Computing kpt #: 163 total cpu time spent up to now is 157.7 secs Computing kpt #: 164 total cpu time spent up to now is 158.6 secs Computing kpt #: 165 total cpu time spent up to now is 159.5 secs Computing kpt #: 166 total cpu time spent up to now is 160.5 secs Computing kpt #: 167 total cpu time spent up to now is 161.4 secs Computing kpt #: 168 total cpu time spent up to now is 162.4 secs Computing kpt #: 169 total cpu time spent up to now is 163.3 secs Computing kpt #: 170 total cpu time spent up to now is 164.3 secs Computing kpt #: 171 total cpu time spent up to now is 165.3 secs Computing kpt #: 172 total cpu time spent up to now is 166.2 secs Computing kpt #: 173 total cpu time spent up to now is 167.2 secs Computing kpt #: 174 total cpu time spent up to now is 168.1 secs Computing kpt #: 175 total cpu time spent up to now is 169.1 secs Computing kpt #: 176 total cpu time spent up to now is 170.1 secs Computing kpt #: 177 total cpu time spent up to now is 171.1 secs Computing kpt #: 178 total cpu time spent up to now is 172.0 secs Computing kpt #: 179 total cpu time spent up to now is 173.0 secs Computing kpt #: 180 total cpu time spent up to now is 174.0 secs Computing kpt #: 181 total cpu time spent up to now is 175.0 secs Computing kpt #: 182 total cpu time spent up to now is 175.9 secs Computing kpt #: 183 total cpu time spent up to now is 176.9 secs Computing kpt #: 184 total cpu time spent up to now is 177.9 secs Computing kpt #: 185 total cpu time spent up to now is 178.9 secs Computing kpt #: 186 total cpu time spent up to now is 179.8 secs Computing kpt #: 187 total cpu time spent up to now is 180.8 secs Computing kpt #: 188 total cpu time spent up to now is 181.7 secs Computing kpt #: 189 total cpu time spent up to now is 182.7 secs Computing kpt #: 190 total cpu time spent up to now is 183.7 secs Computing kpt #: 191 total cpu time spent up to now is 184.7 secs Computing kpt #: 192 total cpu time spent up to now is 185.7 secs Computing kpt #: 193 total cpu time spent up to now is 186.7 secs Computing kpt #: 194 total cpu time spent up to now is 187.6 secs Computing kpt #: 195 total cpu time spent up to now is 188.6 secs Computing kpt #: 196 total cpu time spent up to now is 189.5 secs Computing kpt #: 197 total cpu time spent up to now is 190.5 secs Computing kpt #: 198 total cpu time spent up to now is 191.4 secs Computing kpt #: 199 total cpu time spent up to now is 192.4 secs Computing kpt #: 200 total cpu time spent up to now is 193.3 secs Computing kpt #: 201 total cpu time spent up to now is 194.3 secs Computing kpt #: 202 total cpu time spent up to now is 195.3 secs Computing kpt #: 203 total cpu time spent up to now is 196.4 secs Computing kpt #: 204 total cpu time spent up to now is 197.4 secs Computing kpt #: 205 total cpu time spent up to now is 198.4 secs Computing kpt #: 206 total cpu time spent up to now is 199.4 secs Computing kpt #: 207 total cpu time spent up to now is 200.5 secs Computing kpt #: 208 total cpu time spent up to now is 201.5 secs Computing kpt #: 209 total cpu time spent up to now is 202.6 secs Computing kpt #: 210 total cpu time spent up to now is 203.6 secs Computing kpt #: 211 total cpu time spent up to now is 204.6 secs Computing kpt #: 212 total cpu time spent up to now is 205.6 secs Computing kpt #: 213 total cpu time spent up to now is 206.6 secs Computing kpt #: 214 total cpu time spent up to now is 207.6 secs Computing kpt #: 215 total cpu time spent up to now is 208.6 secs Computing kpt #: 216 total cpu time spent up to now is 209.6 secs Computing kpt #: 217 total cpu time spent up to now is 210.6 secs Computing kpt #: 218 total cpu time spent up to now is 211.7 secs Computing kpt #: 219 total cpu time spent up to now is 212.7 secs Computing kpt #: 220 total cpu time spent up to now is 213.7 secs Computing kpt #: 221 total cpu time spent up to now is 214.7 secs Computing kpt #: 222 total cpu time spent up to now is 215.7 secs Computing kpt #: 223 total cpu time spent up to now is 216.7 secs Computing kpt #: 224 total cpu time spent up to now is 217.7 secs Computing kpt #: 225 total cpu time spent up to now is 218.7 secs Computing kpt #: 226 total cpu time spent up to now is 219.7 secs Computing kpt #: 227 total cpu time spent up to now is 220.7 secs Computing kpt #: 228 total cpu time spent up to now is 221.6 secs Computing kpt #: 229 total cpu time spent up to now is 222.6 secs Computing kpt #: 230 total cpu time spent up to now is 223.6 secs Computing kpt #: 231 total cpu time spent up to now is 224.6 secs Computing kpt #: 232 total cpu time spent up to now is 225.5 secs Computing kpt #: 233 total cpu time spent up to now is 226.5 secs Computing kpt #: 234 total cpu time spent up to now is 227.5 secs Computing kpt #: 235 total cpu time spent up to now is 228.4 secs Computing kpt #: 236 total cpu time spent up to now is 229.4 secs Computing kpt #: 237 total cpu time spent up to now is 230.4 secs Computing kpt #: 238 total cpu time spent up to now is 231.3 secs Computing kpt #: 239 total cpu time spent up to now is 232.3 secs Computing kpt #: 240 total cpu time spent up to now is 233.3 secs Computing kpt #: 241 total cpu time spent up to now is 234.2 secs Computing kpt #: 242 total cpu time spent up to now is 235.2 secs Computing kpt #: 243 total cpu time spent up to now is 236.1 secs Computing kpt #: 244 total cpu time spent up to now is 237.1 secs Computing kpt #: 245 total cpu time spent up to now is 238.0 secs Computing kpt #: 246 total cpu time spent up to now is 239.0 secs Computing kpt #: 247 total cpu time spent up to now is 240.0 secs Computing kpt #: 248 total cpu time spent up to now is 240.9 secs Computing kpt #: 249 total cpu time spent up to now is 241.8 secs Computing kpt #: 250 total cpu time spent up to now is 242.7 secs Computing kpt #: 251 total cpu time spent up to now is 243.6 secs Computing kpt #: 252 total cpu time spent up to now is 244.5 secs Computing kpt #: 253 total cpu time spent up to now is 245.4 secs Computing kpt #: 254 total cpu time spent up to now is 246.3 secs Computing kpt #: 255 total cpu time spent up to now is 247.3 secs Computing kpt #: 256 total cpu time spent up to now is 248.2 secs Computing kpt #: 257 total cpu time spent up to now is 249.1 secs Computing kpt #: 258 total cpu time spent up to now is 250.1 secs Computing kpt #: 259 total cpu time spent up to now is 251.0 secs Computing kpt #: 260 total cpu time spent up to now is 251.9 secs Computing kpt #: 261 total cpu time spent up to now is 252.9 secs Computing kpt #: 262 total cpu time spent up to now is 253.8 secs Computing kpt #: 263 total cpu time spent up to now is 254.7 secs Computing kpt #: 264 total cpu time spent up to now is 255.7 secs Computing kpt #: 265 total cpu time spent up to now is 256.6 secs Computing kpt #: 266 total cpu time spent up to now is 257.5 secs Computing kpt #: 267 total cpu time spent up to now is 258.4 secs Computing kpt #: 268 total cpu time spent up to now is 259.3 secs Computing kpt #: 269 total cpu time spent up to now is 260.3 secs Computing kpt #: 270 total cpu time spent up to now is 261.2 secs Computing kpt #: 271 total cpu time spent up to now is 262.1 secs Computing kpt #: 272 total cpu time spent up to now is 263.1 secs Computing kpt #: 273 total cpu time spent up to now is 264.0 secs Computing kpt #: 274 total cpu time spent up to now is 264.9 secs Computing kpt #: 275 total cpu time spent up to now is 265.9 secs Computing kpt #: 276 total cpu time spent up to now is 266.8 secs Computing kpt #: 277 total cpu time spent up to now is 267.8 secs Computing kpt #: 278 total cpu time spent up to now is 268.8 secs Computing kpt #: 279 total cpu time spent up to now is 269.7 secs Computing kpt #: 280 total cpu time spent up to now is 270.7 secs Computing kpt #: 281 total cpu time spent up to now is 271.6 secs Computing kpt #: 282 total cpu time spent up to now is 272.5 secs Computing kpt #: 283 total cpu time spent up to now is 273.5 secs Computing kpt #: 284 total cpu time spent up to now is 274.4 secs Computing kpt #: 285 total cpu time spent up to now is 275.4 secs Computing kpt #: 286 total cpu time spent up to now is 276.3 secs Computing kpt #: 287 total cpu time spent up to now is 277.3 secs Computing kpt #: 288 total cpu time spent up to now is 278.2 secs Computing kpt #: 289 total cpu time spent up to now is 279.2 secs Computing kpt #: 290 total cpu time spent up to now is 280.1 secs Computing kpt #: 291 total cpu time spent up to now is 281.1 secs Computing kpt #: 292 total cpu time spent up to now is 282.0 secs Computing kpt #: 293 total cpu time spent up to now is 282.9 secs Computing kpt #: 294 total cpu time spent up to now is 283.9 secs Computing kpt #: 295 total cpu time spent up to now is 284.9 secs Computing kpt #: 296 total cpu time spent up to now is 285.9 secs Computing kpt #: 297 total cpu time spent up to now is 286.9 secs Computing kpt #: 298 total cpu time spent up to now is 287.9 secs Computing kpt #: 299 total cpu time spent up to now is 288.9 secs Computing kpt #: 300 total cpu time spent up to now is 289.9 secs Computing kpt #: 301 total cpu time spent up to now is 290.8 secs Computing kpt #: 302 total cpu time spent up to now is 291.8 secs Computing kpt #: 303 total cpu time spent up to now is 292.8 secs Computing kpt #: 304 total cpu time spent up to now is 293.7 secs Computing kpt #: 305 total cpu time spent up to now is 294.7 secs Computing kpt #: 306 total cpu time spent up to now is 295.6 secs Computing kpt #: 307 total cpu time spent up to now is 296.6 secs Computing kpt #: 308 total cpu time spent up to now is 297.5 secs Computing kpt #: 309 total cpu time spent up to now is 298.4 secs Computing kpt #: 310 total cpu time spent up to now is 299.3 secs Computing kpt #: 311 total cpu time spent up to now is 300.2 secs Computing kpt #: 312 total cpu time spent up to now is 301.1 secs Computing kpt #: 313 total cpu time spent up to now is 302.0 secs Computing kpt #: 314 total cpu time spent up to now is 302.9 secs Computing kpt #: 315 total cpu time spent up to now is 303.8 secs Computing kpt #: 316 total cpu time spent up to now is 304.7 secs Computing kpt #: 317 total cpu time spent up to now is 305.6 secs Computing kpt #: 318 total cpu time spent up to now is 306.5 secs Computing kpt #: 319 total cpu time spent up to now is 307.4 secs Computing kpt #: 320 total cpu time spent up to now is 308.3 secs Computing kpt #: 321 total cpu time spent up to now is 309.3 secs Computing kpt #: 322 total cpu time spent up to now is 310.2 secs Computing kpt #: 323 total cpu time spent up to now is 311.1 secs Computing kpt #: 324 total cpu time spent up to now is 312.0 secs Computing kpt #: 325 total cpu time spent up to now is 312.9 secs Computing kpt #: 326 total cpu time spent up to now is 313.7 secs ethr = 2.08E-08, avg # of iterations = 14.0 total cpu time spent up to now is 313.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8797 PWs) bands (ev): -68.8426 -68.8426 -68.8314 -68.8314 -38.6253 -38.6253 -38.6072 -38.6072 -37.4697 -37.4697 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3292 -4.3292 -2.3847 -2.3847 -2.3168 -2.3168 -0.0772 -0.0772 2.6845 2.6845 5.3977 5.3977 7.6622 7.6622 7.7496 7.7496 8.1830 8.1830 8.3587 8.3587 8.4253 8.4253 8.4425 8.4425 9.3189 9.3189 9.3559 9.3559 9.6554 9.6554 9.6783 9.6783 9.7766 9.7766 10.2453 10.2453 10.2854 10.2854 11.7196 11.7196 k = 0.0000 0.0000 0.0201 ( 8815 PWs) bands (ev): -68.8428 -68.8428 -68.8332 -68.8332 -38.6253 -38.6253 -38.6073 -38.6073 -37.4698 -37.4698 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3294 -4.3294 -2.3848 -2.3848 -2.3175 -2.3175 -0.0751 -0.0751 2.6839 2.6839 5.3991 5.3991 7.6559 7.6559 7.7428 7.7428 8.1859 8.1859 8.3549 8.3549 8.4149 8.4149 8.4520 8.4520 9.3183 9.3183 9.3554 9.3554 9.6552 9.6552 9.6775 9.6775 9.7708 9.7708 10.2444 10.2444 10.2830 10.2830 11.7112 11.7112 k = 0.0000 0.0000 0.0401 ( 8831 PWs) bands (ev): -68.8428 -68.8428 -68.8349 -68.8349 -38.6253 -38.6253 -38.6073 -38.6073 -37.4698 -37.4698 -37.4394 -37.4394 -37.3605 -37.3605 -37.3564 -37.3564 -17.6405 -17.6405 -4.3300 -4.3300 -2.3853 -2.3853 -2.3198 -2.3198 -0.0688 -0.0688 2.6820 2.6820 5.4033 5.4033 7.6488 7.6488 7.7363 7.7363 8.1897 8.1897 8.3438 8.3438 8.3966 8.3966 8.4688 8.4688 9.3141 9.3141 9.3566 9.3566 9.6534 9.6534 9.6755 9.6755 9.7681 9.7681 10.2420 10.2420 10.2743 10.2743 11.6945 11.6945 k = 0.0000 0.0000 0.0602 ( 8845 PWs) bands (ev): -68.8425 -68.8425 -68.8367 -68.8367 -38.6253 -38.6253 -38.6073 -38.6073 -37.4698 -37.4698 -37.4394 -37.4394 -37.3606 -37.3606 -37.3564 -37.3564 -17.6403 -17.6403 -4.3310 -4.3310 -2.3861 -2.3861 -2.3236 -2.3236 -0.0584 -0.0584 2.6788 2.6788 5.4102 5.4102 7.6355 7.6355 7.7283 7.7283 8.1957 8.1957 8.3263 8.3263 8.3738 8.3738 8.4876 8.4876 9.3086 9.3086 9.3590 9.3590 9.6504 9.6504 9.6725 9.6725 9.7661 9.7661 10.2384 10.2384 10.2804 10.2804 11.6553 11.6553 k = 0.0000 0.0000 0.0802 ( 8847 PWs) bands (ev): -68.8423 -68.8423 -68.8372 -68.8372 -38.6252 -38.6252 -38.6074 -38.6074 -37.4697 -37.4697 -37.4396 -37.4396 -37.3606 -37.3606 -37.3564 -37.3564 -17.6400 -17.6400 -4.3324 -4.3324 -2.3873 -2.3873 -2.3287 -2.3287 -0.0441 -0.0441 2.6751 2.6751 5.4198 5.4198 7.6165 7.6165 7.7226 7.7226 8.2032 8.2032 8.3031 8.3031 8.3526 8.3526 8.5128 8.5128 9.3058 9.3058 9.3608 9.3608 9.6474 9.6474 9.6690 9.6690 9.7609 9.7609 10.2336 10.2336 10.2893 10.2893 11.5988 11.5988 k = 0.0000 0.0000 0.1003 ( 8851 PWs) bands (ev): -68.8422 -68.8422 -68.8377 -68.8377 -38.6252 -38.6252 -38.6075 -38.6075 -37.4696 -37.4696 -37.4397 -37.4397 -37.3605 -37.3605 -37.3564 -37.3564 -17.6397 -17.6397 -4.3341 -4.3341 -2.3890 -2.3890 -2.3348 -2.3348 -0.0260 -0.0260 2.6705 2.6705 5.4319 5.4319 7.5894 7.5894 7.7189 7.7189 8.2118 8.2118 8.2699 8.2699 8.3351 8.3351 8.5407 8.5407 9.3033 9.3033 9.3620 9.3620 9.6417 9.6417 9.6653 9.6653 9.7527 9.7527 10.2280 10.2280 10.2997 10.2997 11.5294 11.5294 k = 0.0000 0.0000 0.1203 ( 8863 PWs) bands (ev): -68.8430 -68.8430 -68.8382 -68.8382 -38.6251 -38.6251 -38.6076 -38.6076 -37.4694 -37.4694 -37.4399 -37.4399 -37.3605 -37.3605 -37.3565 -37.3565 -17.6393 -17.6393 -4.3362 -4.3362 -2.3913 -2.3913 -2.3419 -2.3419 -0.0043 -0.0043 2.6651 2.6651 5.4462 5.4462 7.5560 7.5560 7.7176 7.7176 8.2166 8.2166 8.2315 8.2315 8.3222 8.3222 8.5700 8.5700 9.2995 9.2995 9.3622 9.3622 9.6306 9.6306 9.6571 9.6571 9.7392 9.7392 10.2216 10.2216 10.3097 10.3097 11.4542 11.4542 k = 0.0000 0.0000 0.1404 ( 8899 PWs) bands (ev): -68.8452 -68.8452 -68.8400 -68.8400 -38.6250 -38.6250 -38.6077 -38.6077 -37.4693 -37.4693 -37.4402 -37.4402 -37.3606 -37.3606 -37.3566 -37.3566 -17.6389 -17.6389 -4.3387 -4.3387 -2.3945 -2.3945 -2.3493 -2.3493 0.0208 0.0208 2.6588 2.6588 5.4629 5.4629 7.5123 7.5123 7.7145 7.7145 8.1716 8.1716 8.2269 8.2269 8.3109 8.3109 8.5992 8.5992 9.2964 9.2964 9.3600 9.3600 9.6188 9.6188 9.6444 9.6444 9.7208 9.7208 10.2142 10.2142 10.3191 10.3191 11.3708 11.3708 k = 0.0000 0.0000 0.1604 ( 8911 PWs) bands (ev): -68.8460 -68.8460 -68.8405 -68.8405 -38.6249 -38.6249 -38.6079 -38.6079 -37.4691 -37.4691 -37.4404 -37.4404 -37.3605 -37.3605 -37.3566 -37.3566 -17.6383 -17.6383 -4.3415 -4.3415 -2.3989 -2.3989 -2.3567 -2.3567 0.0489 0.0489 2.6516 2.6516 5.4814 5.4814 7.4685 7.4685 7.7154 7.7154 8.1139 8.1139 8.2390 8.2390 8.3021 8.3021 8.6296 8.6296 9.2942 9.2942 9.3586 9.3586 9.6071 9.6071 9.6349 9.6349 9.7038 9.7038 10.2069 10.2069 10.3354 10.3354 11.2920 11.2920 k = 0.0000 0.0000 0.1805 ( 8911 PWs) bands (ev): -68.8456 -68.8456 -68.8410 -68.8410 -38.6247 -38.6247 -38.6080 -38.6080 -37.4689 -37.4689 -37.4406 -37.4406 -37.3605 -37.3605 -37.3566 -37.3566 -17.6377 -17.6377 -4.3445 -4.3445 -2.4049 -2.4049 -2.3635 -2.3635 0.0800 0.0800 2.6438 2.6438 5.5019 5.5019 7.4214 7.4214 7.7186 7.7186 8.0510 8.0510 8.2546 8.2546 8.2959 8.2959 8.6613 8.6613 9.2927 9.2927 9.3584 9.3584 9.5973 9.5973 9.6286 9.6286 9.6888 9.6888 10.1999 10.1999 10.3518 10.3518 11.2152 11.2152 k = 0.0000 0.0000 0.2006 ( 8907 PWs) bands (ev): -68.8455 -68.8455 -68.8406 -68.8406 -38.6246 -38.6246 -38.6082 -38.6082 -37.4686 -37.4686 -37.4409 -37.4409 -37.3604 -37.3604 -37.3567 -37.3567 -17.6371 -17.6371 -4.3479 -4.3479 -2.4127 -2.4127 -2.3693 -2.3693 0.1134 0.1134 2.6357 2.6357 5.5239 5.5239 7.3730 7.3730 7.7229 7.7229 7.9836 7.9836 8.2676 8.2676 8.2935 8.2935 8.6939 8.6939 9.2926 9.2926 9.3585 9.3585 9.5855 9.5855 9.6211 9.6211 9.6751 9.6751 10.1934 10.1934 10.3682 10.3682 11.1429 11.1429 k = 0.0000 0.0000 0.2206 ( 8911 PWs) bands (ev): -68.8455 -68.8455 -68.8411 -68.8411 -38.6244 -38.6244 -38.6084 -38.6084 -37.4684 -37.4684 -37.4412 -37.4412 -37.3604 -37.3604 -37.3567 -37.3567 -17.6364 -17.6364 -4.3516 -4.3516 -2.4223 -2.4223 -2.3740 -2.3740 0.1491 0.1491 2.6272 2.6272 5.5468 5.5468 7.3211 7.3211 7.7273 7.7273 7.9126 7.9126 8.2804 8.2804 8.2932 8.2932 8.7263 8.7263 9.2896 9.2896 9.3563 9.3563 9.5714 9.5714 9.6130 9.6130 9.6608 9.6608 10.1870 10.1870 10.3838 10.3838 11.0721 11.0721 k = 0.0000 0.0000 0.2407 ( 8913 PWs) bands (ev): -68.8457 -68.8457 -68.8411 -68.8411 -38.6242 -38.6242 -38.6086 -38.6086 -37.4681 -37.4681 -37.4416 -37.4416 -37.3604 -37.3604 -37.3568 -37.3568 -17.6356 -17.6356 -4.3554 -4.3554 -2.4332 -2.4332 -2.3777 -2.3777 0.1865 0.1865 2.6183 2.6183 5.5704 5.5704 7.2684 7.2684 7.7330 7.7330 7.8388 7.8388 8.2899 8.2899 8.2969 8.2969 8.7583 8.7583 9.2884 9.2884 9.3534 9.3534 9.5581 9.5581 9.6043 9.6043 9.6465 9.6465 10.1811 10.1811 10.3990 10.3990 11.0053 11.0053 k = 0.0000 0.0000 0.2607 ( 8915 PWs) bands (ev): -68.8463 -68.8463 -68.8407 -68.8407 -38.6240 -38.6240 -38.6088 -38.6088 -37.4677 -37.4677 -37.4419 -37.4419 -37.3603 -37.3603 -37.3568 -37.3568 -17.6348 -17.6348 -4.3595 -4.3595 -2.4451 -2.4451 -2.3808 -2.3808 0.2255 0.2255 2.6091 2.6091 5.5939 5.5939 7.2173 7.2173 7.7407 7.7407 7.7633 7.7633 8.2951 8.2951 8.3080 8.3080 8.7891 8.7891 9.2858 9.2858 9.3487 9.3487 9.5433 9.5433 9.5913 9.5913 9.6303 9.6303 10.1755 10.1755 10.4156 10.4156 10.9447 10.9447 k = 0.0000 0.0000 0.2808 ( 8935 PWs) bands (ev): -68.8475 -68.8475 -68.8417 -68.8417 -38.6238 -38.6238 -38.6090 -38.6090 -37.4674 -37.4674 -37.4423 -37.4423 -37.3603 -37.3603 -37.3569 -37.3569 -17.6339 -17.6339 -4.3637 -4.3637 -2.4576 -2.4576 -2.3835 -2.3835 0.2656 0.2656 2.5998 2.5998 5.6167 5.6167 7.1678 7.1678 7.6856 7.6856 7.7482 7.7482 8.2976 8.2976 8.3187 8.3187 8.8167 8.8167 9.2802 9.2802 9.3414 9.3414 9.5251 9.5251 9.5742 9.5742 9.6130 9.6130 10.1702 10.1702 10.4225 10.4225 10.8892 10.8892 k = 0.0000 0.0000 0.3008 ( 8941 PWs) bands (ev): -68.8477 -68.8477 -68.8421 -68.8421 -38.6236 -38.6236 -38.6092 -38.6092 -37.4671 -37.4671 -37.4427 -37.4427 -37.3602 -37.3602 -37.3570 -37.3570 -17.6330 -17.6330 -4.3682 -4.3682 -2.4703 -2.4703 -2.3859 -2.3859 0.3064 0.3064 2.5904 2.5904 5.6380 5.6380 7.1203 7.1203 7.6073 7.6073 7.7559 7.7559 8.3028 8.3028 8.3336 8.3336 8.8444 8.8444 9.2744 9.2744 9.3320 9.3320 9.5105 9.5105 9.5605 9.5605 9.6028 9.6028 10.1652 10.1652 10.4344 10.4344 10.8372 10.8372 k = 0.0000 0.0000 0.3209 ( 8937 PWs) bands (ev): -68.8472 -68.8472 -68.8422 -68.8422 -38.6234 -38.6234 -38.6095 -38.6095 -37.4667 -37.4667 -37.4431 -37.4431 -37.3602 -37.3602 -37.3570 -37.3570 -17.6321 -17.6321 -4.3727 -4.3727 -2.4832 -2.4832 -2.3881 -2.3881 0.3478 0.3478 2.5812 2.5812 5.6579 5.6579 7.0783 7.0783 7.5286 7.5286 7.7646 7.7646 8.3091 8.3091 8.3509 8.3509 8.8698 8.8698 9.2696 9.2696 9.3246 9.3246 9.4987 9.4987 9.5463 9.5463 9.5932 9.5932 10.1609 10.1609 10.4456 10.4456 10.7933 10.7933 k = 0.0000 0.0000 0.3410 ( 8933 PWs) bands (ev): -68.8468 -68.8468 -68.8422 -68.8422 -38.6232 -38.6232 -38.6097 -38.6097 -37.4663 -37.4663 -37.4436 -37.4436 -37.3601 -37.3601 -37.3571 -37.3571 -17.6311 -17.6311 -4.3773 -4.3773 -2.4960 -2.4960 -2.3901 -2.3901 0.3892 0.3892 2.5722 2.5722 5.6752 5.6752 7.0420 7.0420 7.4495 7.4495 7.7727 7.7727 8.3183 8.3183 8.3661 8.3661 8.8936 8.8936 9.2631 9.2631 9.3155 9.3155 9.4872 9.4872 9.5329 9.5329 9.5855 9.5855 10.1563 10.1563 10.4541 10.4541 10.7558 10.7558 k = 0.0000 0.0000 0.3610 ( 8951 PWs) bands (ev): -68.8478 -68.8478 -68.8431 -68.8431 -38.6229 -38.6229 -38.6100 -38.6100 -37.4659 -37.4659 -37.4440 -37.4440 -37.3600 -37.3600 -37.3572 -37.3572 -17.6301 -17.6301 -4.3819 -4.3819 -2.5086 -2.5086 -2.3920 -2.3920 0.4303 0.4303 2.5632 2.5632 5.6890 5.6890 7.0118 7.0118 7.3706 7.3706 7.7824 7.7824 8.3231 8.3231 8.3768 8.3768 8.9129 8.9129 9.2512 9.2512 9.3006 9.3006 9.4728 9.4728 9.5152 9.5152 9.5740 9.5740 10.1514 10.1514 10.4609 10.4609 10.7227 10.7227 k = 0.0000 0.0000 0.3811 ( 8949 PWs) bands (ev): -68.8471 -68.8471 -68.8436 -68.8436 -38.6227 -38.6227 -38.6103 -38.6103 -37.4655 -37.4655 -37.4445 -37.4445 -37.3600 -37.3600 -37.3572 -37.3572 -17.6290 -17.6290 -4.3866 -4.3866 -2.5209 -2.5209 -2.3938 -2.3938 0.4708 0.4708 2.5547 2.5547 5.6993 5.6993 6.9897 6.9897 7.2922 7.2922 7.7913 7.7913 8.3322 8.3322 8.3952 8.3952 8.9312 8.9312 9.2407 9.2407 9.2876 9.2876 9.4606 9.4606 9.5018 9.5018 9.5665 9.5665 10.1461 10.1461 10.4674 10.4674 10.6973 10.6973 k = 0.0000 0.0000 0.4011 ( 8957 PWs) bands (ev): -68.8470 -68.8470 -68.8446 -68.8446 -38.6224 -38.6224 -38.6105 -38.6105 -37.4651 -37.4651 -37.4450 -37.4450 -37.3599 -37.3599 -37.3573 -37.3573 -17.6280 -17.6280 -4.3913 -4.3913 -2.5327 -2.5327 -2.3955 -2.3955 0.5104 0.5104 2.5465 2.5465 5.7055 5.7055 6.9745 6.9745 7.2146 7.2146 7.7998 7.7998 8.3387 8.3387 8.4084 8.4084 8.9459 8.9459 9.2290 9.2290 9.2734 9.2734 9.4487 9.4487 9.4909 9.4909 9.5567 9.5567 10.1399 10.1399 10.4730 10.4730 10.6744 10.6744 k = 0.0000 0.0000 0.4212 ( 8961 PWs) bands (ev): -68.8478 -68.8478 -68.8442 -68.8442 -38.6222 -38.6222 -38.6108 -38.6108 -37.4647 -37.4647 -37.4455 -37.4455 -37.3598 -37.3598 -37.3573 -37.3573 -17.6269 -17.6269 -4.3960 -4.3960 -2.5441 -2.5441 -2.3972 -2.3972 0.5486 0.5486 2.5390 2.5390 5.7076 5.7076 6.9674 6.9674 7.1382 7.1382 7.8115 7.8115 8.3483 8.3483 8.4199 8.4199 8.9587 8.9587 9.2148 9.2148 9.2594 9.2594 9.4330 9.4330 9.4804 9.4804 9.5461 9.5461 10.1348 10.1348 10.4817 10.4817 10.6557 10.6557 k = 0.0000 0.0000 0.4412 ( 8965 PWs) bands (ev): -68.8478 -68.8478 -68.8447 -68.8447 -38.6219 -38.6219 -38.6111 -38.6111 -37.4643 -37.4643 -37.4460 -37.4460 -37.3597 -37.3597 -37.3574 -37.3574 -17.6258 -17.6258 -4.4006 -4.4006 -2.5550 -2.5550 -2.3987 -2.3987 0.5853 0.5853 2.5319 2.5319 5.7063 5.7063 6.9685 6.9685 7.0635 7.0635 7.8232 7.8232 8.3564 8.3564 8.4338 8.4338 8.9691 8.9691 9.1982 9.1982 9.2404 9.2404 9.4181 9.4181 9.4753 9.4753 9.5365 9.5365 10.1291 10.1291 10.4855 10.4855 10.6423 10.6423 k = 0.0000 0.0000 0.4613 ( 8967 PWs) bands (ev): -68.8484 -68.8484 -68.8443 -68.8443 -38.6216 -38.6216 -38.6114 -38.6114 -37.4638 -37.4638 -37.4465 -37.4465 -37.3596 -37.3596 -37.3574 -37.3574 -17.6247 -17.6247 -4.4051 -4.4051 -2.5653 -2.5653 -2.4002 -2.4002 0.6201 0.6201 2.5255 2.5255 5.7019 5.7019 6.9689 6.9689 6.9987 6.9987 7.8370 7.8370 8.3653 8.3653 8.4448 8.4448 8.9773 8.9773 9.1810 9.1810 9.2218 9.2218 9.4029 9.4029 9.4722 9.4722 9.5237 9.5237 10.1243 10.1243 10.4918 10.4918 10.6318 10.6318 k = 0.0000 0.0000 0.4813 ( 8967 PWs) bands (ev): -68.8492 -68.8492 -68.8435 -68.8435 -38.6214 -38.6214 -38.6117 -38.6117 -37.4634 -37.4634 -37.4471 -37.4471 -37.3595 -37.3595 -37.3575 -37.3575 -17.6235 -17.6235 -4.4095 -4.4095 -2.5749 -2.5749 -2.4016 -2.4016 0.6527 0.6527 2.5198 2.5198 5.6954 5.6954 6.9126 6.9126 6.9995 6.9995 7.8503 7.8503 8.3767 8.3767 8.4548 8.4548 8.9844 8.9844 9.1630 9.1630 9.2033 9.2033 9.3882 9.3882 9.4680 9.4680 9.5102 9.5102 10.1185 10.1185 10.4994 10.4994 10.6238 10.6238 k = 0.0000 0.0000 0.5014 ( 8951 PWs) bands (ev): -68.8478 -68.8478 -68.8431 -68.8431 -38.6211 -38.6211 -38.6120 -38.6120 -37.4629 -37.4629 -37.4475 -37.4475 -37.3594 -37.3594 -37.3575 -37.3575 -17.6224 -17.6224 -4.4138 -4.4138 -2.5840 -2.5840 -2.4028 -2.4028 0.6829 0.6829 2.5147 2.5147 5.6878 5.6878 6.8432 6.8432 7.0213 7.0213 7.8646 7.8646 8.3852 8.3852 8.4680 8.4680 8.9899 8.9899 9.1456 9.1456 9.1875 9.1875 9.3831 9.3831 9.4682 9.4682 9.5001 9.5001 10.1144 10.1144 10.5060 10.5060 10.6223 10.6223 k = 0.0000 0.0000 0.5215 ( 8965 PWs) bands (ev): -68.8484 -68.8484 -68.8441 -68.8441 -38.6208 -38.6208 -38.6123 -38.6123 -37.4625 -37.4625 -37.4481 -37.4481 -37.3593 -37.3593 -37.3576 -37.3576 -17.6213 -17.6213 -4.4180 -4.4180 -2.5924 -2.5924 -2.4040 -2.4040 0.7104 0.7104 2.5102 2.5102 5.6802 5.6802 6.7746 6.7746 7.0485 7.0485 7.8777 7.8777 8.3903 8.3903 8.4751 8.4751 8.9936 8.9936 9.1248 9.1248 9.1609 9.1609 9.3712 9.3712 9.4611 9.4611 9.4906 9.4906 10.1070 10.1070 10.5058 10.5058 10.6191 10.6191 k = 0.0000 0.0000 0.5415 ( 8961 PWs) bands (ev): -68.8479 -68.8479 -68.8442 -68.8442 -38.6206 -38.6206 -38.6126 -38.6126 -37.4621 -37.4621 -37.4486 -37.4486 -37.3592 -37.3592 -37.3576 -37.3576 -17.6202 -17.6202 -4.4220 -4.4220 -2.6002 -2.6002 -2.4051 -2.4051 0.7351 0.7351 2.5065 2.5065 5.6739 5.6739 6.7080 6.7080 7.0808 7.0808 7.8917 7.8917 8.3960 8.3960 8.4843 8.4843 8.9970 8.9970 9.1048 9.1048 9.1398 9.1398 9.3615 9.3615 9.4506 9.4506 9.4882 9.4882 10.0995 10.0995 10.5091 10.5091 10.6229 10.6229 k = 0.0000 0.0000 0.5616 ( 8963 PWs) bands (ev): -68.8481 -68.8481 -68.8442 -68.8442 -38.6203 -38.6203 -38.6129 -38.6129 -37.4616 -37.4616 -37.4491 -37.4491 -37.3591 -37.3591 -37.3577 -37.3577 -17.6191 -17.6191 -4.4258 -4.4258 -2.6073 -2.6073 -2.4060 -2.4060 0.7568 0.7568 2.5035 2.5035 5.6694 5.6694 6.6435 6.6435 7.1151 7.1151 7.9057 7.9057 8.3991 8.3991 8.4913 8.4913 8.9994 8.9994 9.0844 9.0844 9.1185 9.1185 9.3529 9.3529 9.4353 9.4353 9.4897 9.4897 10.0912 10.0912 10.5120 10.5120 10.6233 10.6233 k = 0.0000 0.0000 0.5816 ( 8959 PWs) bands (ev): -68.8485 -68.8485 -68.8434 -68.8434 -38.6200 -38.6200 -38.6132 -38.6132 -37.4612 -37.4612 -37.4496 -37.4496 -37.3590 -37.3590 -37.3577 -37.3577 -17.6180 -17.6180 -4.4294 -4.4294 -2.6137 -2.6137 -2.4068 -2.4068 0.7755 0.7755 2.5013 2.5013 5.6678 5.6678 6.5811 6.5811 7.1514 7.1514 7.9208 7.9208 8.4019 8.4019 8.4977 8.4977 9.0016 9.0016 9.0657 9.0657 9.0985 9.0985 9.3467 9.3467 9.4188 9.4188 9.4912 9.4912 10.0838 10.0838 10.5152 10.5152 10.6241 10.6241 k = 0.0000 0.0000 0.6017 ( 8955 PWs) bands (ev): -68.8484 -68.8484 -68.8431 -68.8431 -38.6197 -38.6197 -38.6135 -38.6135 -37.4608 -37.4608 -37.4501 -37.4501 -37.3588 -37.3588 -37.3578 -37.3578 -17.6169 -17.6169 -4.4329 -4.4329 -2.6196 -2.6196 -2.4075 -2.4075 0.7912 0.7912 2.4996 2.4996 5.6696 5.6696 6.5212 6.5212 7.1880 7.1880 7.9370 7.9370 8.3990 8.3990 8.5009 8.5009 9.0009 9.0009 9.0491 9.0491 9.0763 9.0763 9.3449 9.3449 9.4023 9.4023 9.4966 9.4966 10.0778 10.0778 10.5206 10.5206 10.6242 10.6242 k = 0.0000 0.0000 0.6217 ( 8951 PWs) bands (ev): -68.8479 -68.8479 -68.8431 -68.8431 -38.6195 -38.6195 -38.6138 -38.6138 -37.4604 -37.4604 -37.4506 -37.4506 -37.3587 -37.3587 -37.3578 -37.3578 -17.6159 -17.6159 -4.4361 -4.4361 -2.6248 -2.6248 -2.4081 -2.4081 0.8038 0.8038 2.4987 2.4987 5.6756 5.6756 6.4637 6.4637 7.2246 7.2246 7.9511 7.9511 8.3957 8.3957 8.5072 8.5072 8.9973 8.9973 9.0375 9.0375 9.0561 9.0561 9.3406 9.3406 9.3884 9.3884 9.4984 9.4984 10.0676 10.0676 10.5224 10.5224 10.6259 10.6259 k = 0.0000 0.0000 0.6418 ( 8951 PWs) bands (ev): -68.8479 -68.8479 -68.8432 -68.8432 -38.6192 -38.6192 -38.6140 -38.6140 -37.4600 -37.4600 -37.4511 -37.4511 -37.3586 -37.3586 -37.3578 -37.3578 -17.6149 -17.6149 -4.4392 -4.4392 -2.6295 -2.6295 -2.4085 -2.4085 0.8134 0.8134 2.4985 2.4985 5.6860 5.6860 6.4087 6.4087 7.2598 7.2598 7.9639 7.9639 8.3910 8.3910 8.5089 8.5089 8.9868 8.9868 9.0313 9.0313 9.0365 9.0365 9.3333 9.3333 9.3783 9.3783 9.5038 9.5038 10.0543 10.0543 10.5241 10.5241 10.6253 10.6253 k = 0.0000 0.0000 0.6618 ( 8959 PWs) bands (ev): -68.8482 -68.8482 -68.8437 -68.8437 -38.6190 -38.6190 -38.6143 -38.6143 -37.4596 -37.4596 -37.4515 -37.4515 -37.3585 -37.3585 -37.3579 -37.3579 -17.6139 -17.6139 -4.4421 -4.4421 -2.6336 -2.6336 -2.4088 -2.4088 0.8202 0.8202 2.4987 2.4987 5.7008 5.7008 6.3562 6.3562 7.2931 7.2931 7.9762 7.9762 8.3815 8.3815 8.5089 8.5089 8.9716 8.9716 9.0160 9.0160 9.0307 9.0307 9.3239 9.3239 9.3679 9.3679 9.5087 9.5087 10.0395 10.0395 10.5239 10.5239 10.6246 10.6246 k = 0.0000 0.0000 0.6819 ( 8971 PWs) bands (ev): -68.8486 -68.8486 -68.8446 -68.8446 -38.6188 -38.6188 -38.6146 -38.6146 -37.4593 -37.4593 -37.4520 -37.4520 -37.3585 -37.3585 -37.3579 -37.3579 -17.6129 -17.6129 -4.4447 -4.4447 -2.6371 -2.6371 -2.4090 -2.4090 0.8243 0.8243 2.4994 2.4994 5.7204 5.7204 6.3066 6.3066 7.3230 7.3230 7.9882 7.9882 8.3685 8.3685 8.5072 8.5072 8.9542 8.9542 8.9943 8.9943 9.0300 9.0300 9.3148 9.3148 9.3629 9.3629 9.5110 9.5110 10.0236 10.0236 10.5258 10.5258 10.6200 10.6200 k = 0.0000 0.0000 0.7020 ( 8971 PWs) bands (ev): -68.8490 -68.8490 -68.8442 -68.8442 -38.6186 -38.6186 -38.6148 -38.6148 -37.4589 -37.4589 -37.4525 -37.4525 -37.3583 -37.3583 -37.3579 -37.3579 -17.6120 -17.6120 -4.4472 -4.4472 -2.6402 -2.6402 -2.4091 -2.4091 0.8259 0.8259 2.5007 2.5007 5.7446 5.7446 6.2597 6.2597 7.3494 7.3494 7.9997 7.9997 8.3573 8.3573 8.5061 8.5061 8.9378 8.9378 8.9765 8.9765 9.0312 9.0312 9.3087 9.3087 9.3626 9.3626 9.5158 9.5158 10.0072 10.0072 10.5268 10.5268 10.6129 10.6129 k = 0.0000 0.0000 0.7220 ( 8971 PWs) bands (ev): -68.8494 -68.8494 -68.8438 -68.8438 -38.6184 -38.6184 -38.6151 -38.6151 -37.4586 -37.4586 -37.4529 -37.4529 -37.3582 -37.3582 -37.3579 -37.3579 -17.6112 -17.6112 -4.4494 -4.4494 -2.6429 -2.6429 -2.4091 -2.4091 0.8254 0.8254 2.5024 2.5024 5.7733 5.7733 6.2155 6.2155 7.3716 7.3716 8.0111 8.0111 8.3438 8.3438 8.5022 8.5022 8.9205 8.9205 8.9597 8.9597 9.0314 9.0314 9.3053 9.3053 9.3671 9.3671 9.5205 9.5205 9.9911 9.9911 10.5282 10.5282 10.6046 10.6046 k = 0.0000 0.0000 0.7421 ( 8967 PWs) bands (ev): -68.8489 -68.8489 -68.8438 -68.8438 -38.6182 -38.6182 -38.6153 -38.6153 -37.4583 -37.4583 -37.4533 -37.4533 -37.3581 -37.3581 -37.3580 -37.3580 -17.6103 -17.6103 -4.4515 -4.4515 -2.6451 -2.6451 -2.4089 -2.4089 0.8230 0.8230 2.5045 2.5045 5.8065 5.8065 6.1742 6.1742 7.3892 7.3892 8.0218 8.0218 8.3287 8.3287 8.5002 8.5002 8.9049 8.9049 8.9437 8.9437 9.0303 9.0303 9.3045 9.3045 9.3738 9.3738 9.5254 9.5254 9.9733 9.9733 10.5290 10.5290 10.5991 10.5991 k = 0.0000 0.0000 0.7621 ( 8967 PWs) bands (ev): -68.8484 -68.8484 -68.8443 -68.8443 -38.6180 -38.6180 -38.6155 -38.6155 -37.4580 -37.4580 -37.4536 -37.4536 -37.3581 -37.3581 -37.3580 -37.3580 -17.6096 -17.6096 -4.4533 -4.4533 -2.6469 -2.6469 -2.4087 -2.4087 0.8190 0.8190 2.5068 2.5068 5.8432 5.8432 6.1359 6.1359 7.4010 7.4010 8.0320 8.0320 8.3124 8.3124 8.4984 8.4984 8.8910 8.8910 8.9258 8.9258 9.0280 9.0280 9.3065 9.3065 9.3820 9.3820 9.5325 9.5325 9.9539 9.9539 10.5263 10.5263 10.5877 10.5877 k = 0.0000 0.0000 0.7822 ( 8967 PWs) bands (ev): -68.8492 -68.8492 -68.8435 -68.8435 -38.6178 -38.6178 -38.6157 -38.6157 -37.4577 -37.4577 -37.4540 -37.4540 -37.3580 -37.3580 -37.3580 -37.3580 -17.6088 -17.6088 -4.4550 -4.4550 -2.6484 -2.6484 -2.4084 -2.4084 0.8137 0.8137 2.5093 2.5093 5.8830 5.8830 6.1006 6.1006 7.4067 7.4067 8.0411 8.0411 8.2958 8.2958 8.4956 8.4956 8.8769 8.8769 8.9137 8.9137 9.0240 9.0240 9.3117 9.3117 9.3946 9.3946 9.5332 9.5332 9.9351 9.9351 10.5282 10.5282 10.5701 10.5701 k = 0.0000 0.0000 0.8022 ( 8967 PWs) bands (ev): -68.8492 -68.8492 -68.8435 -68.8435 -38.6176 -38.6176 -38.6159 -38.6159 -37.4574 -37.4574 -37.4543 -37.4543 -37.3580 -37.3580 -37.3579 -37.3579 -17.6082 -17.6082 -4.4565 -4.4565 -2.6496 -2.6496 -2.4080 -2.4080 0.8075 0.8075 2.5119 2.5119 5.9254 5.9254 6.0684 6.0684 7.4069 7.4069 8.0495 8.0495 8.2788 8.2788 8.4924 8.4924 8.8641 8.8641 8.9005 8.9005 9.0193 9.0193 9.3190 9.3190 9.4073 9.4073 9.5375 9.5375 9.9143 9.9143 10.5283 10.5283 10.5565 10.5565 k = 0.0000 0.0000 0.8223 ( 8975 PWs) bands (ev): -68.8495 -68.8495 -68.8440 -68.8440 -38.6175 -38.6175 -38.6161 -38.6161 -37.4572 -37.4572 -37.4546 -37.4546 -37.3580 -37.3580 -37.3578 -37.3578 -17.6076 -17.6076 -4.4579 -4.4579 -2.6506 -2.6506 -2.4076 -2.4076 0.8006 0.8006 2.5144 2.5144 5.9689 5.9689 6.0398 6.0398 7.4015 7.4015 8.0570 8.0570 8.2603 8.2603 8.4888 8.4888 8.8514 8.8514 8.8880 8.8880 9.0114 9.0114 9.3246 9.3246 9.4213 9.4213 9.5412 9.5412 9.8925 9.8925 10.5272 10.5272 10.5430 10.5430 k = 0.0000 0.0000 0.8423 ( 8971 PWs) bands (ev): -68.8486 -68.8486 -68.8445 -68.8445 -38.6174 -38.6174 -38.6162 -38.6162 -37.4570 -37.4570 -37.4549 -37.4549 -37.3580 -37.3580 -37.3578 -37.3578 -17.6070 -17.6070 -4.4591 -4.4591 -2.6514 -2.6514 -2.4072 -2.4072 0.7936 0.7936 2.5171 2.5171 6.0015 6.0015 6.0273 6.0273 7.3914 7.3914 8.0652 8.0652 8.2447 8.2447 8.4867 8.4867 8.8408 8.8408 8.8708 8.8708 9.0069 9.0069 9.3361 9.3361 9.4377 9.4377 9.5452 9.5452 9.8719 9.8719 10.5269 10.5269 10.5355 10.5355 k = 0.0000 0.0000 0.8624 ( 8965 PWs) bands (ev): -68.8479 -68.8479 -68.8445 -68.8445 -38.6172 -38.6172 -38.6163 -38.6163 -37.4568 -37.4568 -37.4551 -37.4551 -37.3580 -37.3580 -37.3577 -37.3577 -17.6065 -17.6065 -4.4601 -4.4601 -2.6519 -2.6519 -2.4067 -2.4067 0.7865 0.7865 2.5196 2.5196 5.9856 5.9856 6.0670 6.0670 7.3771 7.3771 8.0705 8.0705 8.2299 8.2299 8.4853 8.4853 8.8316 8.8316 8.8612 8.8612 9.0024 9.0024 9.3476 9.3476 9.4529 9.4529 9.5469 9.5469 9.8483 9.8483 10.5267 10.5267 10.5336 10.5336 k = 0.0000 0.0000 0.8825 ( 8965 PWs) bands (ev): -68.8479 -68.8479 -68.8446 -68.8446 -38.6171 -38.6171 -38.6164 -38.6164 -37.4567 -37.4567 -37.4553 -37.4553 -37.3581 -37.3581 -37.3576 -37.3576 -17.6061 -17.6061 -4.4609 -4.4609 -2.6524 -2.6524 -2.4062 -2.4062 0.7798 0.7798 2.5219 2.5219 5.9662 5.9662 6.1112 6.1112 7.3588 7.3588 8.0751 8.0751 8.2148 8.2148 8.4837 8.4837 8.8230 8.8230 8.8512 8.8512 8.9986 8.9986 9.3556 9.3556 9.4728 9.4728 9.5508 9.5508 9.8260 9.8260 10.5189 10.5189 10.5314 10.5314 k = 0.0000 0.0000 0.9025 ( 8955 PWs) bands (ev): -68.8472 -68.8472 -68.8442 -68.8442 -38.6170 -38.6170 -38.6165 -38.6165 -37.4565 -37.4565 -37.4555 -37.4555 -37.3580 -37.3580 -37.3576 -37.3576 -17.6057 -17.6057 -4.4617 -4.4617 -2.6527 -2.6527 -2.4058 -2.4058 0.7736 0.7736 2.5241 2.5241 5.9488 5.9488 6.1541 6.1541 7.3388 7.3388 8.0797 8.0797 8.2034 8.2034 8.4840 8.4840 8.8168 8.8168 8.8449 8.8449 8.9969 8.9969 9.3676 9.3676 9.4933 9.4933 9.5538 9.5538 9.8050 9.8050 10.5126 10.5126 10.5283 10.5283 k = 0.0000 0.0000 0.9226 ( 8951 PWs) bands (ev): -68.8471 -68.8471 -68.8437 -68.8437 -38.6169 -38.6169 -38.6166 -38.6166 -37.4564 -37.4564 -37.4556 -37.4556 -37.3581 -37.3581 -37.3575 -37.3575 -17.6054 -17.6054 -4.4623 -4.4623 -2.6529 -2.6529 -2.4055 -2.4055 0.7683 0.7683 2.5258 2.5258 5.9349 5.9349 6.1925 6.1925 7.3183 7.3183 8.0834 8.0834 8.1928 8.1928 8.4834 8.4834 8.8106 8.8106 8.8417 8.8417 8.9907 8.9907 9.3762 9.3762 9.5129 9.5129 9.5593 9.5593 9.7841 9.7841 10.5053 10.5053 10.5296 10.5296 k = 0.0000 0.0000 0.9426 ( 8955 PWs) bands (ev): -68.8475 -68.8475 -68.8437 -68.8437 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4557 -37.4557 -37.3581 -37.3581 -37.3575 -37.3575 -17.6052 -17.6052 -4.4627 -4.4627 -2.6530 -2.6530 -2.4052 -2.4052 0.7639 0.7639 2.5272 2.5272 5.9240 5.9240 6.2250 6.2250 7.2995 7.2995 8.0862 8.0862 8.1841 8.1841 8.4816 8.4816 8.8031 8.8031 8.8363 8.8363 8.9864 8.9864 9.3827 9.3827 9.5319 9.5319 9.5608 9.5608 9.7650 9.7650 10.4969 10.4969 10.5309 10.5309 k = 0.0000 0.0000 0.9627 ( 8959 PWs) bands (ev): -68.8479 -68.8479 -68.8438 -68.8438 -38.6168 -38.6168 -38.6167 -38.6167 -37.4563 -37.4563 -37.4558 -37.4558 -37.3581 -37.3581 -37.3575 -37.3575 -17.6050 -17.6050 -4.4630 -4.4630 -2.6531 -2.6531 -2.4049 -2.4049 0.7606 0.7606 2.5282 2.5282 5.9162 5.9162 6.2500 6.2500 7.2842 7.2842 8.0876 8.0876 8.1779 8.1779 8.4814 8.4814 8.8000 8.8000 8.8330 8.8330 8.9826 8.9826 9.3880 9.3880 9.5460 9.5460 9.5598 9.5598 9.7474 9.7474 10.4920 10.4920 10.5309 10.5309 k = 0.0000 0.0000 0.9827 ( 8955 PWs) bands (ev): -68.8466 -68.8466 -68.8446 -68.8446 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4558 -37.4558 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4632 -4.4632 -2.6532 -2.6532 -2.4048 -2.4048 0.7586 0.7586 2.5289 2.5289 5.9115 5.9115 6.2670 6.2670 7.2742 7.2742 8.0920 8.0920 8.1734 8.1734 8.4801 8.4801 8.7970 8.7970 8.8307 8.8307 8.9823 8.9823 9.3894 9.3894 9.5511 9.5511 9.5604 9.5604 9.7425 9.7425 10.4970 10.4970 10.5293 10.5293 k = 0.0000 0.0000 1.0028 ( 8954 PWs) bands (ev): -68.8469 -68.8469 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4047 -2.4047 0.7580 0.7580 2.5292 2.5292 5.9101 5.9101 6.2719 6.2719 7.2707 7.2707 8.0912 8.0912 8.1728 8.1728 8.4786 8.4786 8.7950 8.7950 8.8337 8.8337 8.9850 8.9850 9.3922 9.3922 9.5553 9.5553 9.5608 9.5608 9.7361 9.7361 10.4907 10.4907 10.5324 10.5324 k = 0.0000 0.0000 1.0028 ( 8954 PWs) bands (ev): -68.8469 -68.8469 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4047 -2.4047 0.7580 0.7580 2.5292 2.5292 5.9101 5.9102 6.2719 6.2719 7.2707 7.2707 8.0912 8.0912 8.1728 8.1728 8.4786 8.4786 8.7950 8.7950 8.8337 8.8337 8.9850 8.9850 9.3922 9.3922 9.5553 9.5553 9.5608 9.5608 9.7361 9.7361 10.4907 10.4907 10.5324 10.5324 k =-0.0092 0.0160 1.0028 ( 8958 PWs) bands (ev): -68.8467 -68.8467 -68.8448 -68.8448 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4632 -4.4632 -2.6531 -2.6531 -2.4049 -2.4049 0.7590 0.7590 2.5272 2.5272 5.9128 5.9128 6.2730 6.2730 7.2703 7.2703 8.0905 8.0905 8.1716 8.1716 8.4806 8.4806 8.7967 8.7967 8.8295 8.8295 8.9816 8.9816 9.3863 9.3863 9.5548 9.5548 9.5670 9.5670 9.7392 9.7392 10.4922 10.4922 10.5256 10.5256 k =-0.0184 0.0320 1.0028 ( 8964 PWs) bands (ev): -68.8476 -68.8476 -68.8446 -68.8446 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6050 -17.6050 -4.4631 -4.4631 -2.6530 -2.6530 -2.4053 -2.4053 0.7621 0.7621 2.5216 2.5216 5.9230 5.9230 6.2756 6.2756 7.2693 7.2693 8.0830 8.0830 8.1700 8.1700 8.4840 8.4840 8.7948 8.7948 8.8279 8.8279 8.9782 8.9782 9.3751 9.3751 9.5541 9.5541 9.5794 9.5794 9.7372 9.7372 10.4913 10.4913 10.5250 10.5250 k =-0.0276 0.0479 1.0028 ( 8960 PWs) bands (ev): -68.8480 -68.8480 -68.8438 -68.8438 -38.6169 -38.6169 -38.6167 -38.6167 -37.4561 -37.4561 -37.4560 -37.4560 -37.3581 -37.3581 -37.3575 -37.3575 -17.6051 -17.6051 -4.4629 -4.4629 -2.6527 -2.6527 -2.4059 -2.4059 0.7673 0.7673 2.5122 2.5122 5.9399 5.9399 6.2803 6.2803 7.2675 7.2675 8.0712 8.0712 8.1684 8.1684 8.4885 8.4885 8.7953 8.7953 8.8247 8.8247 8.9726 8.9726 9.3628 9.3628 9.5574 9.5574 9.6054 9.6054 9.7354 9.7354 10.4892 10.4892 10.5269 10.5269 k =-0.0368 0.0639 1.0028 ( 8958 PWs) bands (ev): -68.8476 -68.8476 -68.8440 -68.8440 -38.6169 -38.6169 -38.6167 -38.6167 -37.4561 -37.4561 -37.4560 -37.4560 -37.3581 -37.3581 -37.3575 -37.3575 -17.6053 -17.6053 -4.4625 -4.4625 -2.6523 -2.6523 -2.4068 -2.4068 0.7744 0.7744 2.4996 2.4996 5.9627 5.9627 6.2875 6.2875 7.2649 7.2649 8.0556 8.0556 8.1647 8.1647 8.4914 8.4914 8.7987 8.7987 8.8188 8.8188 8.9706 8.9706 9.3467 9.3467 9.5569 9.5569 9.6360 9.6360 9.7352 9.7352 10.4891 10.4891 10.5249 10.5249 k =-0.0460 0.0799 1.0028 ( 8946 PWs) bands (ev): -68.8472 -68.8472 -68.8432 -68.8432 -38.6169 -38.6169 -38.6166 -38.6166 -37.4562 -37.4562 -37.4558 -37.4558 -37.3582 -37.3582 -37.3574 -37.3574 -17.6056 -17.6056 -4.4621 -4.4621 -2.6518 -2.6518 -2.4080 -2.4080 0.7834 0.7834 2.4835 2.4835 5.9911 5.9911 6.2966 6.2966 7.2617 7.2617 8.0372 8.0372 8.1604 8.1604 8.4996 8.4996 8.8036 8.8036 8.8149 8.8149 8.9637 8.9637 9.3317 9.3317 9.5633 9.5633 9.6698 9.6698 9.7390 9.7390 10.4887 10.4887 10.5219 10.5219 k =-0.0551 0.0959 1.0028 ( 8950 PWs) bands (ev): -68.8467 -68.8467 -68.8440 -68.8440 -38.6170 -38.6170 -38.6165 -38.6165 -37.4563 -37.4563 -37.4557 -37.4557 -37.3582 -37.3582 -37.3574 -37.3574 -17.6059 -17.6059 -4.4615 -4.4615 -2.6512 -2.6512 -2.4094 -2.4094 0.7941 0.7941 2.4644 2.4644 6.0252 6.0252 6.3078 6.3078 7.2576 7.2576 8.0146 8.0146 8.1536 8.1536 8.5037 8.5037 8.8045 8.8045 8.8112 8.8112 8.9553 8.9553 9.3138 9.3138 9.5601 9.5601 9.7054 9.7054 9.7446 9.7446 10.4880 10.4880 10.5181 10.5181 k =-0.0643 0.1118 1.0028 ( 8966 PWs) bands (ev): -68.8472 -68.8472 -68.8454 -68.8454 -38.6171 -38.6171 -38.6165 -38.6165 -37.4564 -37.4564 -37.4556 -37.4556 -37.3582 -37.3582 -37.3575 -37.3575 -17.6062 -17.6062 -4.4609 -4.4609 -2.6504 -2.6504 -2.4110 -2.4110 0.8065 0.8065 2.4426 2.4426 6.0638 6.0638 6.3206 6.3206 7.2527 7.2527 7.9886 7.9886 8.1457 8.1457 8.5071 8.5071 8.7954 8.7954 8.8101 8.8101 8.9453 8.9453 9.2961 9.2961 9.5579 9.5579 9.7343 9.7343 9.7579 9.7579 10.4830 10.4830 10.5119 10.5119 k =-0.0735 0.1278 1.0028 ( 8966 PWs) bands (ev): -68.8472 -68.8472 -68.8454 -68.8454 -38.6172 -38.6172 -38.6163 -38.6163 -37.4566 -37.4566 -37.4554 -37.4554 -37.3583 -37.3583 -37.3575 -37.3575 -17.6066 -17.6066 -4.4601 -4.4601 -2.6494 -2.6494 -2.4128 -2.4128 0.8203 0.8203 2.4183 2.4183 6.1088 6.1088 6.3356 6.3356 7.2469 7.2469 7.9589 7.9589 8.1380 8.1380 8.5147 8.5147 8.7836 8.7836 8.8130 8.8130 8.9346 8.9346 9.2837 9.2837 9.5566 9.5566 9.7499 9.7499 9.7911 9.7911 10.4819 10.4819 10.5136 10.5136 k =-0.0827 0.1438 1.0028 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6173 -38.6173 -38.6162 -38.6162 -37.4567 -37.4567 -37.4551 -37.4551 -37.3583 -37.3583 -37.3575 -37.3575 -17.6071 -17.6071 -4.4593 -4.4593 -2.6482 -2.6482 -2.4147 -2.4147 0.8355 0.8355 2.3919 2.3919 6.1578 6.1578 6.3526 6.3526 7.2403 7.2403 7.9270 7.9270 8.1306 8.1306 8.5222 8.5222 8.7719 8.7719 8.8166 8.8166 8.9239 8.9239 9.2769 9.2769 9.5542 9.5542 9.7634 9.7634 9.8382 9.8382 10.4816 10.4816 10.5152 10.5152 k =-0.0827 0.1438 1.0028 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6173 -38.6173 -38.6162 -38.6162 -37.4567 -37.4567 -37.4551 -37.4551 -37.3583 -37.3583 -37.3575 -37.3575 -17.6071 -17.6071 -4.4593 -4.4593 -2.6482 -2.6482 -2.4147 -2.4147 0.8355 0.8355 2.3919 2.3919 6.1578 6.1578 6.3526 6.3526 7.2403 7.2403 7.9270 7.9270 8.1306 8.1306 8.5222 8.5222 8.7719 8.7719 8.8166 8.8166 8.9239 8.9239 9.2769 9.2769 9.5542 9.5542 9.7634 9.7634 9.8382 9.8382 10.4816 10.4816 10.5152 10.5152 k =-0.0897 0.1559 0.9888 ( 8959 PWs) bands (ev): -68.8462 -68.8462 -68.8456 -68.8456 -38.6174 -38.6174 -38.6161 -38.6161 -37.4569 -37.4569 -37.4549 -37.4549 -37.3583 -37.3583 -37.3575 -37.3575 -17.6075 -17.6075 -4.4585 -4.4585 -2.6473 -2.6473 -2.4163 -2.4163 0.8481 0.8481 2.3706 2.3706 6.1979 6.1979 6.3640 6.3640 7.2365 7.2365 7.9000 7.9000 8.1240 8.1240 8.5291 8.5291 8.7617 8.7617 8.8223 8.8223 8.9146 8.9146 9.2695 9.2695 9.5511 9.5511 9.7723 9.7723 9.8709 9.8709 10.4825 10.4825 10.5173 10.5173 k =-0.0966 0.1680 0.9749 ( 8959 PWs) bands (ev): -68.8462 -68.8462 -68.8457 -68.8457 -38.6175 -38.6175 -38.6160 -38.6160 -37.4570 -37.4570 -37.4547 -37.4547 -37.3584 -37.3584 -37.3575 -37.3575 -17.6079 -17.6079 -4.4577 -4.4577 -2.6463 -2.6463 -2.4177 -2.4177 0.8619 0.8619 2.3484 2.3484 6.2409 6.2409 6.3703 6.3703 7.2364 7.2364 7.8718 7.8718 8.1184 8.1184 8.5376 8.5376 8.7515 8.7515 8.8267 8.8267 8.9045 8.9045 9.2639 9.2639 9.5469 9.5469 9.7860 9.7860 9.9060 9.9060 10.4833 10.4833 10.5198 10.5198 k =-0.1036 0.1801 0.9609 ( 8965 PWs) bands (ev): -68.8464 -68.8464 -68.8461 -68.8461 -38.6176 -38.6176 -38.6159 -38.6159 -37.4572 -37.4572 -37.4546 -37.4546 -37.3584 -37.3584 -37.3575 -37.3575 -17.6084 -17.6084 -4.4568 -4.4568 -2.6455 -2.6455 -2.4189 -2.4189 0.8768 0.8768 2.3254 2.3254 6.2852 6.2852 6.3722 6.3722 7.2397 7.2397 7.8421 7.8421 8.1131 8.1131 8.5466 8.5466 8.7401 8.7401 8.8337 8.8337 8.8941 8.8941 9.2582 9.2582 9.5414 9.5414 9.8019 9.8019 9.9393 9.9393 10.4824 10.4824 10.5204 10.5204 k =-0.1105 0.1922 0.9470 ( 8969 PWs) bands (ev): -68.8466 -68.8466 -68.8463 -68.8463 -38.6177 -38.6177 -38.6158 -38.6158 -37.4573 -37.4573 -37.4544 -37.4544 -37.3585 -37.3585 -37.3575 -37.3575 -17.6089 -17.6089 -4.4559 -4.4559 -2.6449 -2.6449 -2.4198 -2.4198 0.8927 0.8927 2.3017 2.3017 6.3281 6.3281 6.3742 6.3742 7.2462 7.2462 7.8114 7.8114 8.1082 8.1082 8.5561 8.5561 8.7274 8.7274 8.8407 8.8407 8.8836 8.8836 9.2529 9.2529 9.5351 9.5351 9.8195 9.8195 9.9719 9.9719 10.4870 10.4870 10.5264 10.5264 k =-0.1175 0.2043 0.9331 ( 8970 PWs) bands (ev): -68.8470 -68.8470 -68.8460 -68.8460 -38.6177 -38.6177 -38.6157 -38.6157 -37.4574 -37.4574 -37.4542 -37.4542 -37.3585 -37.3585 -37.3576 -37.3576 -17.6095 -17.6095 -4.4549 -4.4549 -2.6445 -2.6445 -2.4203 -2.4203 0.9095 0.9095 2.2777 2.2777 6.3461 6.3461 6.3994 6.3994 7.2557 7.2557 7.7799 7.7799 8.1039 8.1039 8.5658 8.5658 8.7145 8.7145 8.8506 8.8506 8.8762 8.8762 9.2480 9.2480 9.5234 9.5234 9.8380 9.8380 10.0049 10.0049 10.4965 10.4965 10.5366 10.5366 k =-0.1244 0.2163 0.9191 ( 8972 PWs) bands (ev): -68.8472 -68.8472 -68.8460 -68.8460 -38.6178 -38.6178 -38.6156 -38.6156 -37.4575 -37.4575 -37.4540 -37.4540 -37.3586 -37.3586 -37.3576 -37.3576 -17.6101 -17.6101 -4.4539 -4.4539 -2.6445 -2.6445 -2.4203 -2.4203 0.9271 0.9271 2.2535 2.2535 6.3384 6.3384 6.4478 6.4478 7.2672 7.2672 7.7478 7.7478 8.1002 8.1002 8.5765 8.5765 8.7009 8.7009 8.8585 8.8585 8.8682 8.8682 9.2448 9.2448 9.5164 9.5164 9.8564 9.8564 10.0350 10.0350 10.5085 10.5085 10.5496 10.5496 k =-0.1314 0.2284 0.9052 ( 8973 PWs) bands (ev): -68.8470 -68.8470 -68.8463 -68.8463 -38.6179 -38.6179 -38.6155 -38.6155 -37.4577 -37.4577 -37.4538 -37.4538 -37.3586 -37.3586 -37.3576 -37.3576 -17.6108 -17.6108 -4.4529 -4.4529 -2.6448 -2.6448 -2.4197 -2.4197 0.9453 0.9453 2.2292 2.2292 6.3234 6.3234 6.5019 6.5019 7.2803 7.2803 7.7150 7.7150 8.0974 8.0974 8.5897 8.5897 8.6868 8.6868 8.8592 8.8592 8.8680 8.8680 9.2442 9.2442 9.5075 9.5075 9.8728 9.8728 10.0639 10.0639 10.5239 10.5239 10.5673 10.5673 k =-0.1384 0.2405 0.8912 ( 8965 PWs) bands (ev): -68.8470 -68.8470 -68.8454 -68.8454 -38.6180 -38.6180 -38.6154 -38.6154 -37.4577 -37.4577 -37.4536 -37.4536 -37.3586 -37.3586 -37.3576 -37.3576 -17.6115 -17.6115 -4.4519 -4.4519 -2.6455 -2.6455 -2.4185 -2.4185 0.9640 0.9640 2.2050 2.2050 6.3050 6.3050 6.5585 6.5585 7.2948 7.2948 7.6835 7.6835 8.0948 8.0948 8.6027 8.6027 8.6732 8.6732 8.8530 8.8530 8.8792 8.8792 9.2429 9.2429 9.4982 9.4982 9.8923 9.8923 10.0919 10.0919 10.5461 10.5461 10.5929 10.5929 k =-0.1453 0.2526 0.8773 ( 8967 PWs) bands (ev): -68.8470 -68.8470 -68.8456 -68.8456 -38.6180 -38.6180 -38.6153 -38.6153 -37.4579 -37.4579 -37.4534 -37.4534 -37.3587 -37.3587 -37.3577 -37.3577 -17.6122 -17.6122 -4.4510 -4.4510 -2.6467 -2.6467 -2.4166 -2.4166 0.9831 0.9831 2.1810 2.1810 6.2831 6.2831 6.6163 6.6163 7.3096 7.3096 7.6524 7.6524 8.0921 8.0921 8.6149 8.6149 8.6583 8.6583 8.8447 8.8447 8.8904 8.8904 9.2425 9.2425 9.4900 9.4900 9.9096 9.9096 10.1157 10.1157 10.5660 10.5660 10.6220 10.6220 k =-0.1523 0.2647 0.8633 ( 8954 PWs) bands (ev): -68.8466 -68.8466 -68.8446 -68.8446 -38.6181 -38.6181 -38.6152 -38.6152 -37.4579 -37.4579 -37.4533 -37.4533 -37.3587 -37.3587 -37.3577 -37.3577 -17.6129 -17.6129 -4.4500 -4.4500 -2.6483 -2.6483 -2.4139 -2.4139 1.0023 1.0023 2.1574 2.1574 6.2594 6.2594 6.6750 6.6750 7.3249 7.3249 7.6229 7.6229 8.0904 8.0904 8.6218 8.6218 8.6532 8.6532 8.8395 8.8395 8.9043 8.9043 9.2440 9.2440 9.4831 9.4831 9.9283 9.9283 10.1376 10.1376 10.5910 10.5910 10.6608 10.6608 k =-0.1592 0.2768 0.8494 ( 8954 PWs) bands (ev): -68.8464 -68.8464 -68.8448 -68.8448 -38.6182 -38.6182 -38.6151 -38.6151 -37.4580 -37.4580 -37.4531 -37.4531 -37.3588 -37.3588 -37.3577 -37.3577 -17.6136 -17.6136 -4.4492 -4.4492 -2.6504 -2.6504 -2.4106 -2.4106 1.0217 1.0217 2.1342 2.1342 6.2338 6.2338 6.7344 6.7344 7.3384 7.3384 7.5946 7.5946 8.0875 8.0875 8.6152 8.6152 8.6589 8.6589 8.8327 8.8327 8.9160 8.9160 9.2447 9.2447 9.4736 9.4736 9.9442 9.9442 10.1562 10.1562 10.6145 10.6145 10.7056 10.7056 k =-0.1662 0.2889 0.8354 ( 8952 PWs) bands (ev): -68.8460 -68.8460 -68.8450 -68.8450 -38.6182 -38.6182 -38.6150 -38.6150 -37.4581 -37.4581 -37.4529 -37.4529 -37.3588 -37.3588 -37.3577 -37.3577 -17.6143 -17.6143 -4.4483 -4.4483 -2.6529 -2.6529 -2.4065 -2.4065 1.0410 1.0410 2.1116 2.1116 6.2067 6.2067 6.7940 6.7940 7.3508 7.3508 7.5685 7.5685 8.0845 8.0845 8.6026 8.6026 8.6725 8.6725 8.8227 8.8227 8.9296 8.9296 9.2461 9.2461 9.4668 9.4668 9.9605 9.9605 10.1737 10.1737 10.6366 10.6366 10.7575 10.7575 k =-0.1731 0.3010 0.8215 ( 8948 PWs) bands (ev): -68.8462 -68.8462 -68.8444 -68.8444 -38.6183 -38.6183 -38.6149 -38.6149 -37.4582 -37.4582 -37.4527 -37.4527 -37.3589 -37.3589 -37.3577 -37.3577 -17.6151 -17.6151 -4.4476 -4.4476 -2.6558 -2.6558 -2.4019 -2.4019 1.0601 1.0601 2.0897 2.0897 6.1791 6.1791 6.8528 6.8528 7.3619 7.3619 7.5451 7.5451 8.0810 8.0810 8.5879 8.5879 8.6892 8.6892 8.8164 8.8164 8.9445 8.9445 9.2455 9.2455 9.4564 9.4564 9.9777 9.9777 10.1905 10.1905 10.6625 10.6625 10.8139 10.8139 k =-0.1801 0.3131 0.8075 ( 8952 PWs) bands (ev): -68.8465 -68.8465 -68.8446 -68.8446 -38.6183 -38.6183 -38.6149 -38.6149 -37.4583 -37.4583 -37.4526 -37.4526 -37.3589 -37.3589 -37.3578 -37.3578 -17.6158 -17.6158 -4.4469 -4.4469 -2.6589 -2.6589 -2.3967 -2.3967 1.0788 1.0788 2.0686 2.0686 6.1508 6.1508 6.9111 6.9111 7.3701 7.3701 7.5240 7.5240 8.0767 8.0767 8.5741 8.5741 8.7048 8.7048 8.8089 8.8089 8.9574 8.9574 9.2458 9.2458 9.4444 9.4444 9.9909 9.9909 10.2045 10.2045 10.6871 10.6871 10.8766 10.8766 k =-0.1870 0.3252 0.7936 ( 8954 PWs) bands (ev): -68.8465 -68.8465 -68.8448 -68.8448 -38.6184 -38.6184 -38.6148 -38.6148 -37.4583 -37.4583 -37.4524 -37.4524 -37.3590 -37.3590 -37.3578 -37.3578 -17.6165 -17.6165 -4.4463 -4.4463 -2.6623 -2.6623 -2.3911 -2.3911 1.0971 1.0971 2.0484 2.0484 6.1222 6.1222 6.9693 6.9693 7.3749 7.3749 7.5068 7.5068 8.0718 8.0718 8.5610 8.5610 8.7241 8.7241 8.7995 8.7995 8.9716 8.9716 9.2466 9.2466 9.4319 9.4319 10.0054 10.0054 10.2189 10.2189 10.7063 10.7063 10.9449 10.9449 k =-0.1940 0.3373 0.7796 ( 8958 PWs) bands (ev): -68.8467 -68.8467 -68.8450 -68.8450 -38.6185 -38.6185 -38.6147 -38.6147 -37.4584 -37.4584 -37.4523 -37.4523 -37.3590 -37.3590 -37.3579 -37.3579 -17.6172 -17.6172 -4.4457 -4.4457 -2.6659 -2.6659 -2.3851 -2.3851 1.1147 1.1147 2.0292 2.0292 6.0938 6.0938 7.0259 7.0259 7.3764 7.3764 7.4937 7.4937 8.0655 8.0655 8.5486 8.5486 8.7435 8.7435 8.7890 8.7890 8.9856 8.9856 9.2465 9.2465 9.4192 9.4192 10.0208 10.0208 10.2325 10.2325 10.7253 10.7253 11.0174 11.0174 k =-0.2009 0.3493 0.7657 ( 8967 PWs) bands (ev): -68.8472 -68.8472 -68.8455 -68.8455 -38.6185 -38.6185 -38.6147 -38.6147 -37.4585 -37.4585 -37.4521 -37.4521 -37.3591 -37.3591 -37.3579 -37.3579 -17.6179 -17.6179 -4.4453 -4.4453 -2.6696 -2.6696 -2.3789 -2.3789 1.1317 1.1317 2.0110 2.0110 6.0658 6.0658 7.0814 7.0814 7.3749 7.3749 7.4841 7.4841 8.0579 8.0579 8.5378 8.5378 8.7634 8.7634 8.7768 8.7768 8.9982 8.9982 9.2460 9.2460 9.4026 9.4026 10.0364 10.0364 10.2452 10.2452 10.7390 10.7390 11.0952 11.0952 k =-0.2079 0.3614 0.7517 ( 8967 PWs) bands (ev): -68.8472 -68.8472 -68.8455 -68.8455 -38.6186 -38.6186 -38.6146 -38.6146 -37.4586 -37.4586 -37.4520 -37.4520 -37.3591 -37.3591 -37.3579 -37.3579 -17.6185 -17.6185 -4.4448 -4.4448 -2.6733 -2.6733 -2.3726 -2.3726 1.1479 1.1479 1.9940 1.9940 6.0386 6.0386 7.1355 7.1355 7.3720 7.3720 7.4788 7.4788 8.0491 8.0491 8.5282 8.5282 8.7650 8.7650 8.7861 8.7861 9.0106 9.0106 9.2446 9.2446 9.3898 9.3898 10.0565 10.0565 10.2571 10.2571 10.7521 10.7521 11.1782 11.1782 k =-0.2149 0.3735 0.7378 ( 8961 PWs) bands (ev): -68.8470 -68.8470 -68.8450 -68.8450 -38.6186 -38.6186 -38.6145 -38.6145 -37.4586 -37.4586 -37.4519 -37.4519 -37.3591 -37.3591 -37.3580 -37.3580 -17.6192 -17.6192 -4.4445 -4.4445 -2.6769 -2.6769 -2.3663 -2.3663 1.1631 1.1631 1.9781 1.9781 6.0123 6.0123 7.1875 7.1875 7.3666 7.3666 7.4760 7.4760 8.0423 8.0423 8.5209 8.5209 8.7538 8.7538 8.8095 8.8095 9.0236 9.0236 9.2468 9.2468 9.3758 9.3758 10.0776 10.0776 10.2697 10.2697 10.7587 10.7587 11.2672 11.2672 k =-0.2218 0.3856 0.7238 ( 8951 PWs) bands (ev): -68.8466 -68.8466 -68.8444 -68.8444 -38.6186 -38.6186 -38.6145 -38.6145 -37.4587 -37.4587 -37.4517 -37.4517 -37.3591 -37.3591 -37.3580 -37.3580 -17.6197 -17.6197 -4.4442 -4.4442 -2.6804 -2.6804 -2.3601 -2.3601 1.1774 1.1774 1.9635 1.9635 5.9874 5.9874 7.2386 7.2386 7.3617 7.3617 7.4745 7.4745 8.0326 8.0326 8.5182 8.5182 8.7434 8.7434 8.8319 8.8319 9.0357 9.0357 9.2482 9.2482 9.3604 9.3604 10.1018 10.1018 10.2847 10.2847 10.7597 10.7597 11.3607 11.3607 k =-0.2288 0.3977 0.7099 ( 8957 PWs) bands (ev): -68.8470 -68.8470 -68.8446 -68.8446 -38.6186 -38.6186 -38.6144 -38.6144 -37.4587 -37.4587 -37.4516 -37.4516 -37.3592 -37.3592 -37.3580 -37.3580 -17.6203 -17.6203 -4.4440 -4.4440 -2.6838 -2.6838 -2.3541 -2.3541 1.1905 1.1905 1.9502 1.9502 5.9638 5.9638 7.2850 7.2850 7.3574 7.3574 7.4730 7.4730 8.0215 8.0215 8.5151 8.5151 8.7290 8.7290 8.8521 8.8521 9.0447 9.0447 9.2491 9.2491 9.3412 9.3412 10.1273 10.1273 10.2966 10.2966 10.7528 10.7528 11.4564 11.4564 k =-0.2357 0.4098 0.6959 ( 8959 PWs) bands (ev): -68.8475 -68.8475 -68.8443 -68.8443 -38.6187 -38.6187 -38.6144 -38.6144 -37.4587 -37.4587 -37.4515 -37.4515 -37.3592 -37.3592 -37.3581 -37.3581 -17.6208 -17.6208 -4.4438 -4.4438 -2.6870 -2.6870 -2.3485 -2.3485 1.2024 1.2024 1.9381 1.9381 5.9420 5.9420 7.3249 7.3249 7.3590 7.3590 7.4717 7.4717 8.0100 8.0100 8.5120 8.5120 8.7168 8.7168 8.8726 8.8726 9.0530 9.0530 9.2500 9.2500 9.3224 9.3224 10.1557 10.1557 10.3084 10.3084 10.7403 10.7403 11.5567 11.5567 k =-0.2427 0.4219 0.6820 ( 8971 PWs) bands (ev): -68.8488 -68.8488 -68.8443 -68.8443 -38.6187 -38.6187 -38.6144 -38.6144 -37.4588 -37.4588 -37.4515 -37.4515 -37.3592 -37.3592 -37.3581 -37.3581 -17.6212 -17.6212 -4.4436 -4.4436 -2.6898 -2.6898 -2.3432 -2.3432 1.2131 1.2131 1.9273 1.9273 5.9222 5.9222 7.3405 7.3405 7.3821 7.3821 7.4693 7.4693 7.9962 7.9962 8.5106 8.5106 8.7011 8.7011 8.8924 8.8924 9.0610 9.0610 9.2479 9.2479 9.3007 9.3007 10.1853 10.1853 10.3183 10.3183 10.7209 10.7209 11.6589 11.6589 k =-0.2496 0.4340 0.6680 ( 8965 PWs) bands (ev): -68.8486 -68.8486 -68.8438 -68.8438 -38.6187 -38.6187 -38.6143 -38.6143 -37.4588 -37.4588 -37.4514 -37.4514 -37.3592 -37.3592 -37.3582 -37.3582 -17.6216 -17.6216 -4.4435 -4.4435 -2.6924 -2.6924 -2.3385 -2.3385 1.2225 1.2225 1.9180 1.9180 5.9046 5.9046 7.3421 7.3421 7.4171 7.4171 7.4688 7.4688 7.9827 7.9827 8.5123 8.5123 8.6892 8.6892 8.9135 8.9135 9.0707 9.0707 9.2507 9.2507 9.2826 9.2826 10.2190 10.2190 10.3290 10.3290 10.6988 10.6988 11.7647 11.7647 k =-0.2566 0.4461 0.6541 ( 8963 PWs) bands (ev): -68.8488 -68.8488 -68.8434 -68.8434 -38.6187 -38.6187 -38.6143 -38.6143 -37.4588 -37.4588 -37.4513 -37.4513 -37.3592 -37.3592 -37.3582 -37.3582 -17.6219 -17.6219 -4.4434 -4.4434 -2.6947 -2.6947 -2.3344 -2.3344 1.2305 1.2305 1.9101 1.9101 5.8893 5.8893 7.3416 7.3416 7.4469 7.4469 7.4714 7.4714 7.9708 7.9708 8.5151 8.5151 8.6775 8.6775 8.9328 8.9328 9.0804 9.0804 9.2502 9.2502 9.2624 9.2624 10.2549 10.2549 10.3392 10.3392 10.6692 10.6692 11.8735 11.8735 k =-0.2635 0.4582 0.6401 ( 8963 PWs) bands (ev): -68.8484 -68.8484 -68.8438 -68.8438 -38.6188 -38.6188 -38.6142 -38.6142 -37.4589 -37.4589 -37.4512 -37.4512 -37.3592 -37.3592 -37.3582 -37.3582 -17.6222 -17.6222 -4.4434 -4.4434 -2.6965 -2.6965 -2.3309 -2.3309 1.2372 1.2372 1.9036 1.9036 5.8766 5.8766 7.3408 7.3408 7.4575 7.4575 7.4893 7.4893 7.9583 7.9583 8.5191 8.5191 8.6677 8.6677 8.9511 8.9511 9.0895 9.0895 9.2393 9.2393 9.2523 9.2523 10.2897 10.2897 10.3478 10.3478 10.6356 10.6356 11.9824 11.9824 k =-0.2705 0.4703 0.6262 ( 8965 PWs) bands (ev): -68.8482 -68.8482 -68.8442 -68.8442 -38.6188 -38.6188 -38.6142 -38.6142 -37.4589 -37.4589 -37.4512 -37.4512 -37.3592 -37.3592 -37.3582 -37.3582 -17.6224 -17.6224 -4.4434 -4.4434 -2.6980 -2.6980 -2.3281 -2.3281 1.2423 1.2423 1.8985 1.8985 5.8666 5.8666 7.3398 7.3398 7.4580 7.4580 7.5120 7.5120 7.9470 7.9470 8.5239 8.5239 8.6563 8.6563 8.9644 8.9644 9.0986 9.0986 9.2207 9.2207 9.2541 9.2541 10.3221 10.3221 10.3602 10.3602 10.5987 10.5987 12.0891 12.0891 k =-0.2774 0.4823 0.6122 ( 8965 PWs) bands (ev): -68.8480 -68.8480 -68.8444 -68.8444 -38.6188 -38.6188 -38.6142 -38.6142 -37.4589 -37.4589 -37.4511 -37.4511 -37.3592 -37.3592 -37.3582 -37.3582 -17.6226 -17.6226 -4.4433 -4.4433 -2.6991 -2.6991 -2.3261 -2.3261 1.2461 1.2461 1.8949 1.8949 5.8593 5.8593 7.3395 7.3395 7.4571 7.4571 7.5301 7.5301 7.9389 7.9389 8.5278 8.5278 8.6498 8.6498 8.9753 8.9753 9.1095 9.1095 9.2017 9.2017 9.2542 9.2542 10.3410 10.3410 10.3860 10.3860 10.5587 10.5587 12.1889 12.1889 k =-0.2844 0.4944 0.5983 ( 8965 PWs) bands (ev): -68.8482 -68.8482 -68.8442 -68.8442 -38.6188 -38.6188 -38.6142 -38.6142 -37.4589 -37.4589 -37.4511 -37.4511 -37.3592 -37.3592 -37.3583 -37.3583 -17.6227 -17.6227 -4.4433 -4.4433 -2.6997 -2.6997 -2.3249 -2.3249 1.2483 1.2483 1.8927 1.8927 5.8549 5.8549 7.3407 7.3407 7.4563 7.4563 7.5415 7.5415 7.9329 7.9329 8.5298 8.5298 8.6435 8.6435 8.9824 8.9824 9.1201 9.1201 9.1863 9.1863 9.2542 9.2542 10.3477 10.3477 10.4224 10.4224 10.5209 10.5209 12.2680 12.2680 k =-0.2914 0.5065 0.5843 ( 8982 PWs) bands (ev): -68.8487 -68.8487 -68.8456 -68.8456 -38.6188 -38.6188 -38.6142 -38.6142 -37.4590 -37.4590 -37.4511 -37.4511 -37.3593 -37.3593 -37.3583 -37.3583 -17.6227 -17.6227 -4.4433 -4.4433 -2.7000 -2.7000 -2.3244 -2.3244 1.2490 1.2490 1.8919 1.8919 5.8534 5.8534 7.3392 7.3392 7.4555 7.4555 7.5451 7.5451 7.9281 7.9281 8.5287 8.5287 8.6379 8.6379 8.9840 8.9840 9.1221 9.1221 9.1763 9.1763 9.2536 9.2536 10.3490 10.3490 10.4457 10.4457 10.4927 10.4927 12.2999 12.2999 k =-0.2914 0.5065 0.5843 ( 8982 PWs) bands (ev): -68.8487 -68.8487 -68.8456 -68.8456 -38.6188 -38.6188 -38.6142 -38.6142 -37.4590 -37.4590 -37.4511 -37.4511 -37.3593 -37.3593 -37.3583 -37.3583 -17.6227 -17.6227 -4.4433 -4.4433 -2.7000 -2.7000 -2.3244 -2.3244 1.2490 1.2490 1.8919 1.8919 5.8534 5.8534 7.3392 7.3392 7.4555 7.4555 7.5451 7.5451 7.9281 7.9281 8.5287 8.5287 8.6379 8.6379 8.9840 8.9840 9.1221 9.1221 9.1763 9.1763 9.2536 9.2536 10.3490 10.3490 10.4457 10.4457 10.4927 10.4927 12.2999 12.2999 k =-0.2843 0.4942 0.5701 ( 8972 PWs) bands (ev): -68.8479 -68.8479 -68.8452 -68.8452 -38.6184 -38.6184 -38.6146 -38.6146 -37.4583 -37.4583 -37.4518 -37.4518 -37.3592 -37.3592 -37.3583 -37.3583 -17.6224 -17.6224 -4.4455 -4.4455 -2.7048 -2.7048 -2.3209 -2.3209 1.2486 1.2486 1.9162 1.9162 5.8273 5.8273 7.3228 7.3228 7.4368 7.4368 7.5523 7.5523 7.9443 7.9443 8.5242 8.5242 8.6682 8.6682 8.9835 8.9835 9.1139 9.1139 9.1486 9.1486 9.2459 9.2459 10.2972 10.2972 10.4169 10.4169 10.4900 10.4900 12.2202 12.2202 k =-0.2771 0.4818 0.5558 ( 8982 PWs) bands (ev): -68.8489 -68.8489 -68.8454 -68.8454 -38.6180 -38.6180 -38.6150 -38.6150 -37.4576 -37.4576 -37.4525 -37.4525 -37.3591 -37.3591 -37.3585 -37.3585 -17.6221 -17.6221 -4.4474 -4.4474 -2.7088 -2.7088 -2.3177 -2.3177 1.2442 1.2442 1.9411 1.9411 5.8062 5.8062 7.3020 7.3020 7.4198 7.4198 7.5592 7.5592 7.9580 7.9580 8.5180 8.5180 8.6954 8.6954 8.9775 8.9775 9.0956 9.0956 9.1313 9.1313 9.2343 9.2343 10.2453 10.2453 10.3859 10.3859 10.4896 10.4896 12.1370 12.1370 k =-0.2700 0.4695 0.5416 ( 8974 PWs) bands (ev): -68.8480 -68.8480 -68.8454 -68.8454 -38.6176 -38.6176 -38.6154 -38.6154 -37.4570 -37.4570 -37.4532 -37.4532 -37.3590 -37.3590 -37.3585 -37.3585 -17.6219 -17.6219 -4.4487 -4.4487 -2.7118 -2.7118 -2.3148 -2.3148 1.2358 1.2358 1.9667 1.9667 5.7902 5.7902 7.2783 7.2783 7.4050 7.4050 7.5658 7.5658 7.9751 7.9751 8.5138 8.5138 8.7289 8.7289 8.9788 8.9788 9.0695 9.0695 9.1242 9.1242 9.2284 9.2284 10.1952 10.1952 10.3584 10.3584 10.4920 10.4920 12.0577 12.0577 k =-0.2629 0.4571 0.5273 ( 8968 PWs) bands (ev): -68.8468 -68.8468 -68.8460 -68.8460 -38.6172 -38.6172 -38.6158 -38.6158 -37.4563 -37.4563 -37.4538 -37.4538 -37.3589 -37.3589 -37.3586 -37.3586 -17.6218 -17.6218 -4.4496 -4.4496 -2.7138 -2.7138 -2.3123 -2.3123 1.2235 1.2235 1.9931 1.9931 5.7794 5.7794 7.2508 7.2508 7.3921 7.3921 7.5721 7.5721 7.9913 7.9913 8.5117 8.5117 8.7607 8.7607 8.9802 8.9802 9.0436 9.0436 9.1159 9.1159 9.2285 9.2285 10.1472 10.1472 10.3330 10.3330 10.4959 10.4959 11.9770 11.9770 k =-0.2558 0.4448 0.5131 ( 8964 PWs) bands (ev): -68.8467 -68.8467 -68.8457 -68.8457 -38.6168 -38.6168 -38.6162 -38.6162 -37.4556 -37.4556 -37.4545 -37.4545 -37.3588 -37.3588 -37.3587 -37.3587 -17.6217 -17.6217 -4.4500 -4.4500 -2.7148 -2.7148 -2.3102 -2.3102 1.2072 1.2072 2.0200 2.0200 5.7735 5.7735 7.2211 7.2211 7.3811 7.3811 7.5778 7.5778 8.0077 8.0077 8.5083 8.5083 8.7932 8.7932 8.9756 8.9756 9.0224 9.0224 9.1175 9.1175 9.2253 9.2253 10.0997 10.0997 10.3100 10.3100 10.5009 10.5009 11.8966 11.8966 k =-0.2487 0.4324 0.4988 ( 8960 PWs) bands (ev): -68.8466 -68.8466 -68.8453 -68.8453 -38.6166 -38.6166 -38.6164 -38.6164 -37.4552 -37.4552 -37.4549 -37.4549 -37.3588 -37.3588 -37.3587 -37.3587 -17.6217 -17.6217 -4.4499 -4.4499 -2.7148 -2.7148 -2.3084 -2.3084 1.1870 1.1870 2.0474 2.0474 5.7722 5.7722 7.1889 7.1889 7.3718 7.3718 7.5830 7.5830 8.0242 8.0242 8.5071 8.5071 8.8260 8.8260 8.9591 8.9591 9.0161 9.0161 9.1227 9.1227 9.2203 9.2203 10.0530 10.0530 10.2890 10.2890 10.5071 10.5071 11.8170 11.8170 k =-0.2416 0.4200 0.4846 ( 8960 PWs) bands (ev): -68.8461 -68.8461 -68.8459 -68.8459 -38.6170 -38.6170 -38.6160 -38.6160 -37.4559 -37.4559 -37.4542 -37.4542 -37.3589 -37.3589 -37.3586 -37.3586 -17.6218 -17.6218 -4.4493 -4.4493 -2.7138 -2.7138 -2.3070 -2.3070 1.1632 1.1632 2.0753 2.0753 5.7752 5.7752 7.1542 7.1542 7.3645 7.3645 7.5875 7.5875 8.0407 8.0407 8.5063 8.5063 8.8593 8.8593 8.9325 8.9325 9.0191 9.0191 9.1296 9.1296 9.2204 9.2204 10.0054 10.0054 10.2682 10.2682 10.5153 10.5153 11.7402 11.7402 k =-0.2345 0.4077 0.4703 ( 8968 PWs) bands (ev): -68.8464 -68.8464 -68.8464 -68.8464 -38.6174 -38.6174 -38.6156 -38.6156 -37.4566 -37.4566 -37.4536 -37.4536 -37.3590 -37.3590 -37.3585 -37.3585 -17.6219 -17.6219 -4.4481 -4.4481 -2.7118 -2.7118 -2.3060 -2.3060 1.1357 1.1357 2.1035 2.1035 5.7818 5.7818 7.1181 7.1181 7.3584 7.3584 7.5922 7.5922 8.0555 8.0555 8.5068 8.5068 8.8866 8.8866 8.9036 8.9036 9.0237 9.0237 9.1398 9.1398 9.2218 9.2218 9.9623 9.9623 10.2475 10.2475 10.5236 10.5236 11.6620 11.6620 k =-0.2274 0.3953 0.4561 ( 8966 PWs) bands (ev): -68.8468 -68.8468 -68.8458 -68.8458 -38.6178 -38.6178 -38.6152 -38.6152 -37.4572 -37.4572 -37.4529 -37.4529 -37.3591 -37.3591 -37.3584 -37.3584 -17.6222 -17.6222 -4.4465 -4.4465 -2.7088 -2.7088 -2.3054 -2.3054 1.1050 1.1050 2.1320 2.1320 5.7915 5.7915 7.0824 7.0824 7.3546 7.3546 7.5972 7.5972 8.0709 8.0709 8.5091 8.5091 8.8671 8.8671 8.9237 8.9237 9.0311 9.0311 9.1541 9.1541 9.2255 9.2255 9.9260 9.9260 10.2304 10.2304 10.5345 10.5345 11.5856 11.5856 k =-0.2203 0.3830 0.4418 ( 8968 PWs) bands (ev): -68.8469 -68.8469 -68.8459 -68.8459 -38.6182 -38.6182 -38.6148 -38.6148 -37.4579 -37.4579 -37.4522 -37.4522 -37.3592 -37.3592 -37.3583 -37.3583 -17.6225 -17.6225 -4.4444 -4.4444 -2.7048 -2.7048 -2.3051 -2.3051 1.0711 1.0711 2.1605 2.1605 5.8036 5.8036 7.0471 7.0471 7.3528 7.3528 7.6015 7.6015 8.0871 8.0871 8.5118 8.5118 8.8367 8.8367 8.9560 8.9560 9.0421 9.0421 9.1709 9.1709 9.2284 9.2284 9.8828 9.8828 10.2137 10.2137 10.5480 10.5480 11.5114 11.5114 k =-0.2132 0.3706 0.4276 ( 8948 PWs) bands (ev): -68.8456 -68.8456 -68.8450 -68.8450 -38.6186 -38.6186 -38.6144 -38.6144 -37.4585 -37.4585 -37.4515 -37.4515 -37.3592 -37.3592 -37.3582 -37.3582 -17.6228 -17.6228 -4.4418 -4.4418 -2.6998 -2.6998 -2.3053 -2.3053 1.0344 1.0344 2.1893 2.1893 5.8172 5.8172 7.0139 7.0139 7.3540 7.3540 7.6071 7.6071 8.1052 8.1052 8.5180 8.5180 8.8083 8.8083 8.9907 8.9907 9.0588 9.0588 9.1907 9.1907 9.2379 9.2379 9.8475 9.8475 10.1994 10.1994 10.5662 10.5662 11.4444 11.4444 k =-0.2061 0.3583 0.4133 ( 8940 PWs) bands (ev): -68.8457 -68.8457 -68.8441 -68.8441 -38.6189 -38.6189 -38.6140 -38.6140 -37.4592 -37.4592 -37.4508 -37.4508 -37.3593 -37.3593 -37.3581 -37.3581 -17.6232 -17.6232 -4.4388 -4.4388 -2.6938 -2.6938 -2.3057 -2.3057 0.9951 0.9951 2.2180 2.2180 5.8312 5.8312 6.9841 6.9841 7.3562 7.3562 7.6129 7.6129 8.1203 8.1203 8.5239 8.5239 8.7783 8.7783 9.0199 9.0199 9.0764 9.0764 9.2105 9.2105 9.2486 9.2486 9.8115 9.8115 10.1884 10.1884 10.5850 10.5850 11.3750 11.3750 k =-0.1990 0.3459 0.3991 ( 8948 PWs) bands (ev): -68.8458 -68.8458 -68.8448 -68.8448 -38.6193 -38.6193 -38.6136 -38.6136 -37.4598 -37.4598 -37.4502 -37.4502 -37.3594 -37.3594 -37.3580 -37.3580 -17.6237 -17.6237 -4.4353 -4.4353 -2.6868 -2.6868 -2.3066 -2.3066 0.9535 0.9535 2.2464 2.2464 5.8443 5.8443 6.9574 6.9574 7.3604 7.3604 7.6187 7.6187 8.1340 8.1340 8.5270 8.5270 8.7505 8.7505 9.0448 9.0448 9.0926 9.0926 9.2288 9.2288 9.2575 9.2575 9.7759 9.7759 10.1754 10.1754 10.6063 10.6063 11.3033 11.3033 k =-0.1919 0.3336 0.3848 ( 8944 PWs) bands (ev): -68.8459 -68.8459 -68.8443 -68.8443 -38.6197 -38.6197 -38.6132 -38.6132 -37.4605 -37.4605 -37.4495 -37.4495 -37.3595 -37.3595 -37.3579 -37.3579 -17.6243 -17.6243 -4.4315 -4.4315 -2.6787 -2.6787 -2.3077 -2.3077 0.9098 0.9098 2.2747 2.2747 5.8557 5.8557 6.9364 6.9364 7.3652 7.3652 7.6266 7.6266 8.1496 8.1496 8.5344 8.5344 8.7193 8.7193 9.0706 9.0706 9.1173 9.1173 9.2471 9.2471 9.2694 9.2694 9.7450 9.7450 10.1647 10.1647 10.6282 10.6282 11.2361 11.2361 k =-0.1848 0.3212 0.3706 ( 8948 PWs) bands (ev): -68.8460 -68.8460 -68.8446 -68.8446 -38.6201 -38.6201 -38.6129 -38.6129 -37.4611 -37.4611 -37.4489 -37.4489 -37.3595 -37.3595 -37.3579 -37.3579 -17.6249 -17.6249 -4.4273 -4.4273 -2.6697 -2.6697 -2.3092 -2.3092 0.8644 0.8644 2.3025 2.3025 5.8639 5.8639 6.9215 6.9215 7.3717 7.3717 7.6356 7.6356 8.1638 8.1638 8.5401 8.5401 8.6900 8.6900 9.0907 9.0907 9.1423 9.1423 9.2642 9.2642 9.2835 9.2835 9.7149 9.7149 10.1544 10.1544 10.6527 10.6527 11.1697 11.1697 k =-0.1777 0.3089 0.3563 ( 8940 PWs) bands (ev): -68.8465 -68.8465 -68.8433 -68.8433 -38.6204 -38.6204 -38.6125 -38.6125 -37.4617 -37.4617 -37.4483 -37.4483 -37.3596 -37.3596 -37.3578 -37.3578 -17.6255 -17.6255 -4.4228 -4.4228 -2.6598 -2.6598 -2.3109 -2.3109 0.8175 0.8175 2.3300 2.3300 5.8681 5.8681 6.9143 6.9143 7.3796 7.3796 7.6469 7.6469 8.1789 8.1789 8.5484 8.5484 8.6590 8.6590 9.1121 9.1121 9.1712 9.1712 9.2827 9.2827 9.3033 9.3033 9.6888 9.6888 10.1455 10.1455 10.6800 10.6800 11.1082 11.1082 k =-0.1706 0.2965 0.3421 ( 8928 PWs) bands (ev): -68.8457 -68.8457 -68.8427 -68.8427 -38.6208 -38.6208 -38.6121 -38.6121 -37.4623 -37.4623 -37.4476 -37.4476 -37.3597 -37.3597 -37.3577 -37.3577 -17.6262 -17.6262 -4.4181 -4.4181 -2.6489 -2.6489 -2.3128 -2.3128 0.7695 0.7695 2.3569 2.3569 5.8674 5.8674 6.9154 6.9154 7.3892 7.3892 7.6611 7.6611 8.1942 8.1942 8.5569 8.5569 8.6318 8.6318 9.1323 9.1323 9.2026 9.2026 9.2967 9.2967 9.3257 9.3257 9.6655 9.6655 10.1400 10.1400 10.7097 10.7097 11.0467 11.0467 k =-0.1634 0.2841 0.3278 ( 8928 PWs) bands (ev): -68.8458 -68.8458 -68.8426 -68.8426 -38.6211 -38.6211 -38.6118 -38.6118 -37.4628 -37.4628 -37.4470 -37.4470 -37.3598 -37.3598 -37.3576 -37.3576 -17.6269 -17.6269 -4.4131 -4.4131 -2.6370 -2.6370 -2.3150 -2.3150 0.7206 0.7206 2.3829 2.3829 5.8614 5.8614 6.9243 6.9243 7.4004 7.4004 7.6764 7.6764 8.2084 8.2084 8.5604 8.5604 8.6054 8.6054 9.1504 9.1504 9.2320 9.2320 9.3065 9.3065 9.3497 9.3497 9.6417 9.6417 10.1334 10.1334 10.7427 10.7427 10.9887 10.9887 k =-0.1563 0.2718 0.3136 ( 8928 PWs) bands (ev): -68.8459 -68.8459 -68.8426 -68.8426 -38.6215 -38.6215 -38.6114 -38.6114 -37.4634 -37.4634 -37.4464 -37.4464 -37.3598 -37.3598 -37.3575 -37.3575 -17.6277 -17.6277 -4.4079 -4.4079 -2.6244 -2.6244 -2.3174 -2.3174 0.6710 0.6710 2.4081 2.4081 5.8500 5.8500 6.9413 6.9413 7.4124 7.4124 7.6935 7.6935 8.2219 8.2219 8.5608 8.5608 8.5811 8.5811 9.1687 9.1687 9.2610 9.2610 9.3186 9.3186 9.3724 9.3724 9.6233 9.6233 10.1281 10.1281 10.7776 10.7776 10.9309 10.9309 k =-0.1492 0.2594 0.2993 ( 8932 PWs) bands (ev): -68.8464 -68.8464 -68.8425 -68.8425 -38.6218 -38.6218 -38.6111 -38.6111 -37.4640 -37.4640 -37.4459 -37.4459 -37.3599 -37.3599 -37.3574 -37.3574 -17.6285 -17.6285 -4.4026 -4.4026 -2.6108 -2.6108 -2.3199 -2.3199 0.6210 0.6210 2.4325 2.4325 5.8336 5.8336 6.9656 6.9656 7.4250 7.4250 7.7132 7.7132 8.2351 8.2351 8.5455 8.5455 8.5713 8.5713 9.1861 9.1861 9.2890 9.2890 9.3283 9.3283 9.3952 9.3952 9.6062 9.6062 10.1239 10.1239 10.8141 10.8141 10.8765 10.8765 k =-0.1421 0.2471 0.2850 ( 8936 PWs) bands (ev): -68.8473 -68.8473 -68.8420 -68.8420 -38.6221 -38.6221 -38.6108 -38.6108 -37.4645 -37.4645 -37.4453 -37.4453 -37.3600 -37.3600 -37.3574 -37.3574 -17.6293 -17.6293 -4.3973 -4.3973 -2.5966 -2.5966 -2.3225 -2.3225 0.5709 0.5709 2.4559 2.4559 5.8130 5.8130 6.9962 6.9962 7.4390 7.4390 7.7359 7.7359 8.2483 8.2483 8.5176 8.5176 8.5722 8.5722 9.2017 9.2017 9.3167 9.3167 9.3364 9.3364 9.4157 9.4157 9.5943 9.5943 10.1208 10.1208 10.8245 10.8245 10.8564 10.8564 k =-0.1350 0.2347 0.2708 ( 8950 PWs) bands (ev): -68.8480 -68.8480 -68.8428 -68.8428 -38.6224 -38.6224 -38.6105 -38.6105 -37.4650 -37.4650 -37.4448 -37.4448 -37.3600 -37.3600 -37.3573 -37.3573 -17.6301 -17.6301 -4.3919 -4.3919 -2.5816 -2.5816 -2.3252 -2.3252 0.5210 0.5210 2.4782 2.4782 5.7889 5.7889 7.0326 7.0326 7.4531 7.4531 7.7602 7.7602 8.2601 8.2601 8.4893 8.4893 8.5703 8.5703 9.2175 9.2175 9.3378 9.3378 9.3450 9.3450 9.4340 9.4340 9.5861 9.5861 10.1194 10.1194 10.7716 10.7716 10.8973 10.8973 k =-0.1279 0.2224 0.2565 ( 8938 PWs) bands (ev): -68.8481 -68.8481 -68.8414 -68.8414 -38.6227 -38.6227 -38.6102 -38.6102 -37.4655 -37.4655 -37.4443 -37.4443 -37.3601 -37.3601 -37.3572 -37.3572 -17.6310 -17.6310 -4.3865 -4.3865 -2.5660 -2.5660 -2.3280 -2.3280 0.4714 0.4714 2.4997 2.4997 5.7621 5.7621 7.0748 7.0748 7.4691 7.4691 7.7873 7.7873 8.2732 8.2732 8.4645 8.4645 8.5718 8.5718 9.2350 9.2350 9.3449 9.3449 9.3725 9.3725 9.4572 9.4572 9.5855 9.5855 10.1205 10.1205 10.7279 10.7279 10.9427 10.9427 k =-0.1208 0.2100 0.2423 ( 8938 PWs) bands (ev): -68.8477 -68.8477 -68.8418 -68.8418 -38.6230 -38.6230 -38.6099 -38.6099 -37.4660 -37.4660 -37.4438 -37.4438 -37.3601 -37.3601 -37.3572 -37.3572 -17.6318 -17.6318 -4.3812 -4.3812 -2.5500 -2.5500 -2.3307 -2.3307 0.4226 0.4226 2.5200 2.5200 5.7333 5.7333 7.1192 7.1192 7.4847 7.4847 7.8165 7.8165 8.2843 8.2843 8.4400 8.4400 8.5711 8.5711 9.2488 9.2488 9.3469 9.3469 9.3975 9.3975 9.4846 9.4846 9.5887 9.5887 10.1223 10.1223 10.6777 10.6777 10.9889 10.9889 k =-0.1137 0.1977 0.2280 ( 8930 PWs) bands (ev): -68.8477 -68.8477 -68.8409 -68.8409 -38.6232 -38.6232 -38.6096 -38.6096 -37.4664 -37.4664 -37.4433 -37.4433 -37.3602 -37.3602 -37.3571 -37.3571 -17.6326 -17.6326 -4.3759 -4.3759 -2.5335 -2.5335 -2.3334 -2.3334 0.3745 0.3745 2.5391 2.5391 5.7035 5.7035 7.1663 7.1663 7.5025 7.5025 7.8481 7.8481 8.2961 8.2961 8.4161 8.4161 8.5702 8.5702 9.2616 9.2616 9.3492 9.3492 9.4244 9.4244 9.5050 9.5050 9.5956 9.5956 10.1262 10.1262 10.6362 10.6362 11.0401 11.0401 k =-0.1066 0.1853 0.2138 ( 8932 PWs) bands (ev): -68.8476 -68.8476 -68.8413 -68.8413 -38.6235 -38.6235 -38.6093 -38.6093 -37.4668 -37.4668 -37.4429 -37.4429 -37.3602 -37.3602 -37.3570 -37.3570 -17.6335 -17.6335 -4.3708 -4.3708 -2.5169 -2.5169 -2.3359 -2.3359 0.3277 0.3277 2.5571 2.5571 5.6735 5.6735 7.2141 7.2141 7.5183 7.5183 7.8817 7.8817 8.3064 8.3064 8.3877 8.3877 8.5678 8.5678 9.2719 9.2719 9.3505 9.3505 9.4494 9.4494 9.5290 9.5290 9.6067 9.6067 10.1309 10.1309 10.5903 10.5903 11.0903 11.0903 k =-0.0995 0.1730 0.1995 ( 8916 PWs) bands (ev): -68.8459 -68.8459 -68.8413 -68.8413 -38.6237 -38.6237 -38.6091 -38.6091 -37.4672 -37.4672 -37.4424 -37.4424 -37.3603 -37.3603 -37.3569 -37.3569 -17.6343 -17.6343 -4.3659 -4.3659 -2.5001 -2.5001 -2.3383 -2.3383 0.2822 0.2822 2.5739 2.5739 5.6432 5.6432 7.2639 7.2639 7.5361 7.5361 7.9174 7.9174 8.3170 8.3170 8.3692 8.3692 8.5661 8.5661 9.2809 9.2809 9.3515 9.3515 9.4763 9.4763 9.5535 9.5535 9.6206 9.6206 10.1394 10.1394 10.5493 10.5493 11.1436 11.1436 k =-0.0924 0.1606 0.1853 ( 8904 PWs) bands (ev): -68.8450 -68.8450 -68.8408 -68.8408 -38.6240 -38.6240 -38.6088 -38.6088 -37.4676 -37.4676 -37.4420 -37.4420 -37.3604 -37.3604 -37.3568 -37.3568 -17.6350 -17.6350 -4.3612 -4.3612 -2.4835 -2.4835 -2.3405 -2.3405 0.2383 0.2383 2.5895 2.5895 5.6134 5.6134 7.3123 7.3123 7.5542 7.5542 7.9546 7.9546 8.3247 8.3247 8.3522 8.3522 8.5644 8.5644 9.2874 9.2874 9.3538 9.3538 9.4994 9.4994 9.5770 9.5770 9.6353 9.6353 10.1471 10.1471 10.5102 10.5102 11.1986 11.1986 k =-0.0853 0.1483 0.1710 ( 8904 PWs) bands (ev): -68.8455 -68.8455 -68.8403 -68.8403 -38.6242 -38.6242 -38.6086 -38.6086 -37.4679 -37.4679 -37.4416 -37.4416 -37.3604 -37.3604 -37.3568 -37.3568 -17.6358 -17.6358 -4.3568 -4.3568 -2.4673 -2.4673 -2.3423 -2.3423 0.1962 0.1962 2.6038 2.6038 5.5845 5.5845 7.3596 7.3596 7.5724 7.5724 7.9926 7.9926 8.3197 8.3197 8.3424 8.3424 8.5594 8.5594 9.2911 9.2911 9.3555 9.3555 9.5193 9.5193 9.5954 9.5954 9.6480 9.6480 10.1559 10.1559 10.4732 10.4732 11.2552 11.2552 k =-0.0782 0.1359 0.1568 ( 8906 PWs) bands (ev): -68.8456 -68.8456 -68.8405 -68.8405 -38.6244 -38.6244 -38.6084 -38.6084 -37.4683 -37.4683 -37.4413 -37.4413 -37.3604 -37.3604 -37.3567 -37.3567 -17.6365 -17.6365 -4.3526 -4.3526 -2.4517 -2.4517 -2.3437 -2.3437 0.1563 0.1563 2.6167 2.6167 5.5568 5.5568 7.4044 7.4044 7.5904 7.5904 8.0312 8.0312 8.3041 8.3041 8.3472 8.3472 8.5527 8.5527 9.2927 9.2927 9.3569 9.3569 9.5376 9.5376 9.6103 9.6103 9.6610 9.6610 10.1656 10.1656 10.4384 10.4384 11.3121 11.3121 k =-0.0711 0.1235 0.1425 ( 8906 PWs) bands (ev): -68.8452 -68.8452 -68.8408 -68.8408 -38.6245 -38.6245 -38.6082 -38.6082 -37.4686 -37.4686 -37.4410 -37.4410 -37.3605 -37.3605 -37.3567 -37.3567 -17.6372 -17.6372 -4.3487 -4.3487 -2.4371 -2.4371 -2.3445 -2.3445 0.1187 0.1187 2.6284 2.6284 5.5308 5.5308 7.4468 7.4468 7.6084 7.6084 8.0702 8.0702 8.2866 8.2866 8.3540 8.3540 8.5446 8.5446 9.2934 9.2934 9.3583 9.3583 9.5567 9.5567 9.6237 9.6237 9.6772 9.6772 10.1762 10.1762 10.4042 10.4042 11.3690 11.3690 k =-0.0640 0.1112 0.1283 ( 8904 PWs) bands (ev): -68.8455 -68.8455 -68.8404 -68.8404 -38.6247 -38.6247 -38.6080 -38.6080 -37.4688 -37.4688 -37.4407 -37.4407 -37.3605 -37.3605 -37.3566 -37.3566 -17.6378 -17.6378 -4.3451 -4.3451 -2.4238 -2.4238 -2.3445 -2.3445 0.0837 0.0837 2.6390 2.6390 5.5068 5.5068 7.4868 7.4868 7.6264 7.6264 8.1092 8.1092 8.2670 8.2670 8.3608 8.3608 8.5372 8.5372 9.2953 9.2953 9.3603 9.3603 9.5745 9.5745 9.6338 9.6338 9.6906 9.6906 10.1871 10.1871 10.3744 10.3744 11.4258 11.4258 k =-0.0569 0.0988 0.1140 ( 8896 PWs) bands (ev): -68.8451 -68.8451 -68.8399 -68.8399 -38.6248 -38.6248 -38.6079 -38.6079 -37.4691 -37.4691 -37.4404 -37.4404 -37.3605 -37.3605 -37.3566 -37.3566 -17.6383 -17.6383 -4.3418 -4.3418 -2.4123 -2.4123 -2.3434 -2.3434 0.0516 0.0516 2.6485 2.6485 5.4850 5.4850 7.5224 7.5224 7.6442 7.6442 8.1482 8.1482 8.2500 8.2500 8.3676 8.3676 8.5289 8.5289 9.2979 9.2979 9.3621 9.3621 9.5925 9.5925 9.6435 9.6435 9.7049 9.7049 10.1976 10.1976 10.3520 10.3520 11.4807 11.4807 k =-0.0497 0.0865 0.0998 ( 8884 PWs) bands (ev): -68.8444 -68.8444 -68.8392 -68.8392 -38.6250 -38.6250 -38.6077 -38.6077 -37.4693 -37.4693 -37.4402 -37.4402 -37.3605 -37.3605 -37.3565 -37.3565 -17.6389 -17.6389 -4.3389 -4.3389 -2.4029 -2.4029 -2.3410 -2.3410 0.0226 0.0226 2.6568 2.6568 5.4651 5.4651 7.5543 7.5543 7.6628 7.6628 8.1865 8.1865 8.2399 8.2399 8.3740 8.3740 8.5208 8.5208 9.2986 9.2986 9.3626 9.3626 9.6088 9.6088 9.6496 9.6496 9.7177 9.7177 10.2076 10.2076 10.3330 10.3330 11.5340 11.5340 k =-0.0426 0.0741 0.0855 ( 8866 PWs) bands (ev): -68.8429 -68.8429 -68.8386 -68.8386 -38.6251 -38.6251 -38.6076 -38.6076 -37.4694 -37.4694 -37.4399 -37.4399 -37.3605 -37.3605 -37.3565 -37.3565 -17.6393 -17.6393 -4.3364 -4.3364 -2.3960 -2.3960 -2.3373 -2.3373 -0.0031 -0.0031 2.6640 2.6640 5.4473 5.4473 7.5827 7.5827 7.6805 7.6805 8.2214 8.2214 8.2317 8.2317 8.3793 8.3793 8.5110 8.5110 9.3019 9.3019 9.3624 9.3624 9.6223 9.6223 9.6607 9.6607 9.7394 9.7394 10.2174 10.2174 10.3119 10.3119 11.5822 11.5822 k =-0.0355 0.0618 0.0713 ( 8858 PWs) bands (ev): -68.8430 -68.8430 -68.8377 -68.8377 -38.6251 -38.6251 -38.6075 -38.6075 -37.4696 -37.4696 -37.4397 -37.4397 -37.3605 -37.3605 -37.3565 -37.3565 -17.6397 -17.6397 -4.3342 -4.3342 -2.3912 -2.3912 -2.3328 -2.3328 -0.0253 -0.0253 2.6702 2.6702 5.4323 5.4323 7.6061 7.6061 7.6970 7.6970 8.2158 8.2158 8.2594 8.2594 8.3844 8.3844 8.5027 8.5027 9.3046 9.3046 9.3609 9.3609 9.6335 9.6335 9.6649 9.6649 9.7493 9.7493 10.2256 10.2256 10.2942 10.2942 11.6240 11.6240 k =-0.0284 0.0494 0.0570 ( 8848 PWs) bands (ev): -68.8424 -68.8424 -68.8372 -68.8372 -38.6252 -38.6252 -38.6074 -38.6074 -37.4697 -37.4697 -37.4396 -37.4396 -37.3606 -37.3606 -37.3564 -37.3564 -17.6400 -17.6400 -4.3324 -4.3324 -2.3882 -2.3882 -2.3279 -2.3279 -0.0437 -0.0437 2.6752 2.6752 5.4200 5.4200 7.6238 7.6238 7.7117 7.7117 8.2069 8.2069 8.2914 8.2914 8.3898 8.3898 8.4908 8.4908 9.3079 9.3079 9.3606 9.3606 9.6440 9.6440 9.6700 9.6700 9.7587 9.7587 10.2324 10.2324 10.2807 10.2807 11.6578 11.6578 k =-0.0213 0.0371 0.0428 ( 8840 PWs) bands (ev): -68.8420 -68.8420 -68.8367 -68.8367 -38.6253 -38.6253 -38.6073 -38.6073 -37.4698 -37.4698 -37.4394 -37.4394 -37.3606 -37.3606 -37.3564 -37.3564 -17.6403 -17.6403 -4.3310 -4.3310 -2.3864 -2.3864 -2.3234 -2.3234 -0.0582 -0.0582 2.6790 2.6790 5.4104 5.4104 7.6377 7.6377 7.7245 7.7245 8.1978 8.1978 8.3194 8.3194 8.3953 8.3953 8.4773 8.4773 9.3108 9.3108 9.3600 9.3600 9.6506 9.6506 9.6748 9.6748 9.7678 9.7678 10.2380 10.2380 10.2712 10.2712 11.6829 11.6829 k =-0.0142 0.0247 0.0285 ( 8826 PWs) bands (ev): -68.8422 -68.8422 -68.8349 -68.8349 -38.6253 -38.6253 -38.6073 -38.6073 -37.4698 -37.4698 -37.4394 -37.4394 -37.3605 -37.3605 -37.3564 -37.3564 -17.6405 -17.6405 -4.3300 -4.3300 -2.3853 -2.3853 -2.3198 -2.3198 -0.0687 -0.0687 2.6817 2.6817 5.4033 5.4033 7.6488 7.6488 7.7359 7.7359 8.1915 8.1915 8.3411 8.3411 8.4029 8.4029 8.4626 8.4626 9.3158 9.3158 9.3581 9.3581 9.6538 9.6538 9.6763 9.6763 9.7718 9.7718 10.2420 10.2420 10.2772 10.2772 11.7012 11.7012 k =-0.0071 0.0124 0.0143 ( 8811 PWs) bands (ev): -68.8424 -68.8424 -68.8332 -68.8332 -38.6253 -38.6253 -38.6072 -38.6072 -37.4698 -37.4698 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3294 -4.3294 -2.3848 -2.3848 -2.3175 -2.3175 -0.0750 -0.0750 2.6839 2.6839 5.3991 5.3991 7.6558 7.6558 7.7429 7.7429 8.1876 8.1876 8.3548 8.3548 8.4158 8.4158 8.4522 8.4522 9.3183 9.3183 9.3564 9.3564 9.6556 9.6556 9.6781 9.6781 9.7733 9.7733 10.2444 10.2444 10.2814 10.2814 11.7115 11.7115 k = 0.0000 0.0000 0.0000 ( 8797 PWs) bands (ev): -68.8426 -68.8426 -68.8314 -68.8314 -38.6253 -38.6253 -38.6072 -38.6072 -37.4697 -37.4697 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3292 -4.3292 -2.3847 -2.3847 -2.3168 -2.3168 -0.0772 -0.0772 2.6845 2.6845 5.3977 5.3977 7.6622 7.6622 7.7496 7.7496 8.1830 8.1830 8.3587 8.3587 8.4253 8.4253 8.4425 8.4425 9.3189 9.3189 9.3559 9.3559 9.6554 9.6554 9.6783 9.6783 9.7766 9.7766 10.2453 10.2453 10.2854 10.2854 11.7196 11.7196 k = 0.0000 0.0000 0.0000 ( 8797 PWs) bands (ev): -68.8426 -68.8426 -68.8314 -68.8314 -38.6253 -38.6253 -38.6072 -38.6072 -37.4697 -37.4697 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3292 -4.3292 -2.3847 -2.3847 -2.3168 -2.3168 -0.0772 -0.0772 2.6845 2.6845 5.3977 5.3977 7.6622 7.6622 7.7496 7.7496 8.1830 8.1830 8.3587 8.3587 8.4253 8.4253 8.4425 8.4425 9.3189 9.3189 9.3559 9.3559 9.6554 9.6554 9.6783 9.6783 9.7766 9.7766 10.2453 10.2453 10.2854 10.2854 11.7196 11.7196 k = 0.0172 0.0099-0.0000 ( 8801 PWs) bands (ev): -68.8421 -68.8421 -68.8323 -68.8323 -38.6253 -38.6253 -38.6072 -38.6072 -37.4698 -37.4698 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3293 -4.3293 -2.3851 -2.3851 -2.3168 -2.3168 -0.0755 -0.0755 2.6805 2.6805 5.4032 5.4032 7.6593 7.6593 7.7464 7.7464 8.1864 8.1864 8.3581 8.3581 8.4250 8.4250 8.4388 8.4388 9.3174 9.3174 9.3576 9.3576 9.6571 9.6571 9.6800 9.6800 9.7770 9.7770 10.2510 10.2510 10.2815 10.2815 11.7191 11.7191 k = 0.0345 0.0198-0.0000 ( 8801 PWs) bands (ev): -68.8421 -68.8421 -68.8323 -68.8323 -38.6253 -38.6253 -38.6072 -38.6072 -37.4698 -37.4698 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3295 -4.3295 -2.3863 -2.3863 -2.3168 -2.3168 -0.0706 -0.0706 2.6690 2.6690 5.4194 5.4194 7.6570 7.6570 7.7433 7.7433 8.1866 8.1866 8.3557 8.3557 8.4235 8.4235 8.4316 8.4316 9.3126 9.3126 9.3605 9.3605 9.6599 9.6599 9.6829 9.6829 9.7777 9.7777 10.2683 10.2683 10.2785 10.2785 11.7248 11.7248 k = 0.0517 0.0298 0.0000 ( 8813 PWs) bands (ev): -68.8425 -68.8425 -68.8333 -68.8333 -38.6253 -38.6253 -38.6072 -38.6072 -37.4698 -37.4698 -37.4393 -37.4393 -37.3605 -37.3605 -37.3564 -37.3564 -17.6406 -17.6406 -4.3299 -4.3299 -2.3883 -2.3883 -2.3168 -2.3168 -0.0624 -0.0624 2.6501 2.6501 5.4457 5.4457 7.6548 7.6548 7.7400 7.7400 8.1866 8.1866 8.3510 8.3510 8.4203 8.4203 8.4212 8.4212 9.2894 9.2894 9.3647 9.3647 9.6623 9.6623 9.6856 9.6856 9.7784 9.7784 10.2717 10.2717 10.2957 10.2957 11.7361 11.7361 k = 0.0690 0.0397-0.0000 ( 8849 PWs) bands (ev): -68.8434 -68.8434 -68.8364 -68.8364 -38.6253 -38.6253 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3564 -37.3564 -17.6405 -17.6405 -4.3304 -4.3304 -2.3910 -2.3910 -2.3168 -2.3168 -0.0510 -0.0510 2.6241 2.6241 5.4814 5.4814 7.6494 7.6494 7.7329 7.7329 8.1871 8.1871 8.3448 8.3448 8.4028 8.4028 8.4165 8.4165 9.2498 9.2498 9.3664 9.3664 9.6677 9.6677 9.6906 9.6906 9.7748 9.7748 10.2644 10.2644 10.3305 10.3305 11.7492 11.7492 k = 0.0862 0.0496 0.0000 ( 8849 PWs) bands (ev): -68.8434 -68.8434 -68.8364 -68.8364 -38.6253 -38.6253 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3564 -37.3564 -17.6405 -17.6405 -4.3311 -4.3311 -2.3945 -2.3945 -2.3168 -2.3168 -0.0365 -0.0365 2.5923 2.5923 5.5259 5.5259 7.6481 7.6481 7.7299 7.7299 8.1885 8.1885 8.3371 8.3371 8.3868 8.3868 8.4122 8.4122 9.2159 9.2159 9.3710 9.3710 9.6764 9.6764 9.6995 9.6995 9.7789 9.7789 10.2642 10.2642 10.3733 10.3733 11.7722 11.7722 k = 0.1034 0.0595 0.0000 ( 8857 PWs) bands (ev): -68.8434 -68.8434 -68.8373 -68.8373 -38.6254 -38.6254 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3564 -37.3564 -17.6405 -17.6405 -4.3319 -4.3319 -2.3986 -2.3986 -2.3168 -2.3168 -0.0190 -0.0190 2.5550 2.5550 5.5788 5.5788 7.6442 7.6442 7.7237 7.7237 8.1893 8.1893 8.3266 8.3266 8.3686 8.3686 8.4067 8.4067 9.1781 9.1781 9.3816 9.3816 9.6859 9.6859 9.7086 9.7086 9.7811 9.7811 10.2627 10.2627 10.4214 10.4214 11.7974 11.7974 k = 0.1207 0.0694 0.0000 ( 8873 PWs) bands (ev): -68.8443 -68.8443 -68.8383 -68.8383 -38.6254 -38.6254 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3565 -37.3565 -17.6404 -17.6404 -4.3328 -4.3328 -2.4033 -2.4033 -2.3168 -2.3168 0.0013 0.0013 2.5129 2.5129 5.6384 5.6384 7.6421 7.6421 7.7192 7.7192 8.1886 8.1886 8.3114 8.3114 8.3486 8.3486 8.3994 8.3994 9.1364 9.1364 9.3941 9.3941 9.6929 9.6929 9.7153 9.7153 9.7821 9.7821 10.2580 10.2580 10.4732 10.4732 11.8294 11.8294 k = 0.1379 0.0793 0.0000 ( 8873 PWs) bands (ev): -68.8443 -68.8443 -68.8383 -68.8383 -38.6254 -38.6254 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3565 -37.3565 -17.6404 -17.6404 -4.3338 -4.3338 -2.4085 -2.4085 -2.3168 -2.3168 0.0245 0.0245 2.4670 2.4670 5.7038 5.7038 7.6403 7.6403 7.7147 7.7147 8.1896 8.1896 8.2935 8.2935 8.3325 8.3325 8.3924 8.3924 9.0954 9.0954 9.4092 9.4092 9.7053 9.7053 9.7260 9.7260 9.7859 9.7859 10.2578 10.2578 10.5285 10.5285 11.8665 11.8665 k = 0.1552 0.0893 0.0000 ( 8873 PWs) bands (ev): -68.8443 -68.8443 -68.8383 -68.8383 -38.6254 -38.6254 -38.6073 -38.6073 -37.4699 -37.4699 -37.4393 -37.4393 -37.3606 -37.3606 -37.3565 -37.3565 -17.6403 -17.6403 -4.3350 -4.3350 -2.4141 -2.4141 -2.3168 -2.3168 0.0501 0.0501 2.4179 2.4179 5.7737 5.7737 7.6384 7.6384 7.7100 7.7100 8.1907 8.1907 8.2720 8.2720 8.3180 8.3180 8.3848 8.3848 9.0538 9.0538 9.4266 9.4266 9.7191 9.7191 9.7363 9.7363 9.7914 9.7914 10.2576 10.2576 10.5858 10.5858 11.9079 11.9079 k = 0.1724 0.0992 0.0000 ( 8909 PWs) bands (ev): -68.8473 -68.8473 -68.8392 -68.8392 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3606 -37.3606 -37.3566 -37.3566 -17.6402 -17.6402 -4.3362 -4.3362 -2.4201 -2.4201 -2.3168 -2.3168 0.0781 0.0781 2.3661 2.3661 5.8458 5.8458 7.6346 7.6346 7.7030 7.7030 8.1900 8.1900 8.2460 8.2460 8.3018 8.3018 8.3739 8.3739 9.0121 9.0121 9.4405 9.4405 9.7239 9.7239 9.7337 9.7337 9.7884 9.7884 10.2554 10.2554 10.6441 10.6441 11.9512 11.9512 k = 0.1897 0.1091 0.0000 ( 8913 PWs) bands (ev): -68.8473 -68.8473 -68.8397 -68.8397 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3607 -37.3607 -37.3566 -37.3566 -17.6402 -17.6402 -4.3375 -4.3375 -2.4263 -2.4263 -2.3168 -2.3168 0.1084 0.1084 2.3125 2.3125 5.9210 5.9210 7.6324 7.6324 7.6974 7.6974 8.1913 8.1913 8.2218 8.2218 8.2887 8.2887 8.3653 8.3653 8.9682 8.9682 9.4632 9.4632 9.7395 9.7395 9.7403 9.7403 9.8000 9.8000 10.2552 10.2552 10.7009 10.7009 12.0000 12.0000 k = 0.2069 0.1190 0.0000 ( 8917 PWs) bands (ev): -68.8477 -68.8477 -68.8397 -68.8397 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3607 -37.3607 -37.3566 -37.3566 -17.6401 -17.6401 -4.3389 -4.3389 -2.4327 -2.4327 -2.3169 -2.3169 0.1407 0.1407 2.2575 2.2575 5.9967 5.9967 7.6304 7.6304 7.6920 7.6920 8.1925 8.1925 8.1980 8.1980 8.2754 8.2754 8.3560 8.3560 8.9284 8.9284 9.4873 9.4873 9.7439 9.7439 9.7549 9.7549 9.8133 9.8133 10.2551 10.2551 10.7592 10.7592 12.0527 12.0527 k = 0.2241 0.1289 0.0000 ( 8906 PWs) bands (ev): -68.8465 -68.8465 -68.8397 -68.8397 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3607 -37.3607 -37.3566 -37.3566 -17.6400 -17.6400 -4.3402 -4.3402 -2.4392 -2.4392 -2.3169 -2.3169 0.1748 0.1748 2.2017 2.2017 6.0721 6.0721 7.6284 7.6284 7.6866 7.6866 8.1758 8.1758 8.1976 8.1976 8.2638 8.2638 8.3484 8.3484 8.8898 8.8898 9.5155 9.5155 9.7503 9.7503 9.7773 9.7773 9.8347 9.8347 10.2550 10.2550 10.8166 10.8166 12.1085 12.1085 k = 0.2414 0.1388 0.0000 ( 8910 PWs) bands (ev): -68.8465 -68.8465 -68.8401 -68.8401 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3607 -37.3607 -37.3566 -37.3566 -17.6400 -17.6400 -4.3417 -4.3417 -2.4458 -2.4458 -2.3169 -2.3169 0.2105 0.2105 2.1454 2.1454 6.1459 6.1459 7.6244 7.6244 7.6789 7.6789 8.1561 8.1561 8.1990 8.1990 8.2511 8.2511 8.3393 8.3393 8.8543 8.8543 9.5482 9.5482 9.7524 9.7524 9.7952 9.7952 9.8528 9.8528 10.2542 10.2542 10.8738 10.8738 12.1647 12.1647 k = 0.2586 0.1488 0.0000 ( 8910 PWs) bands (ev): -68.8473 -68.8473 -68.8393 -68.8393 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3606 -37.3606 -37.3566 -37.3566 -17.6399 -17.6399 -4.3431 -4.3431 -2.4522 -2.4522 -2.3169 -2.3169 0.2474 0.2474 2.0891 2.0891 6.2168 6.2168 7.6245 7.6245 7.6756 7.6756 8.1397 8.1397 8.1999 8.1999 8.2376 8.2376 8.3290 8.3290 8.8212 8.8212 9.5843 9.5843 9.7518 9.7518 9.8093 9.8093 9.8679 9.8679 10.2542 10.2542 10.9305 10.9305 12.2275 12.2275 k = 0.2759 0.1587 0.0000 ( 8910 PWs) bands (ev): -68.8473 -68.8473 -68.8393 -68.8393 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3606 -37.3606 -37.3566 -37.3566 -17.6398 -17.6398 -4.3445 -4.3445 -2.4585 -2.4585 -2.3169 -2.3169 0.2854 0.2854 2.0332 2.0332 6.2847 6.2847 7.6224 7.6224 7.6701 7.6701 8.1296 8.1296 8.2011 8.2011 8.2250 8.2250 8.3191 8.3191 8.7880 8.7880 9.6306 9.6306 9.7495 9.7495 9.8248 9.8248 9.8843 9.8843 10.2524 10.2524 10.9830 10.9830 12.2898 12.2898 k = 0.2931 0.1686 0.0000 ( 8926 PWs) bands (ev): -68.8482 -68.8482 -68.8402 -68.8402 -38.6254 -38.6254 -38.6073 -38.6073 -37.4700 -37.4700 -37.4394 -37.4394 -37.3607 -37.3607 -37.3566 -37.3566 -17.6398 -17.6398 -4.3459 -4.3459 -2.4646 -2.4646 -2.3169 -2.3169 0.3241 0.3241 1.9779 1.9779 6.3459 6.3459 7.6190 7.6190 7.6631 7.6631 8.1194 8.1194 8.2022 8.2022 8.2126 8.2126 8.3098 8.3098 8.7535 8.7535 9.6715 9.6715 9.7501 9.7501 9.8411 9.8411 9.9019 9.9019 10.2521 10.2521 11.0285 11.0285 12.3518 12.3518 k = 0.3103 0.1785 0.0000 ( 8938 PWs) bands (ev): -68.8499 -68.8499 -68.8398 -68.8398 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3567 -37.3567 -17.6397 -17.6397 -4.3473 -4.3473 -2.4705 -2.4705 -2.3169 -2.3169 0.3631 0.3631 1.9238 1.9238 6.4022 6.4022 7.6185 7.6185 7.6594 7.6594 8.1150 8.1150 8.1953 8.1953 8.2009 8.2009 8.3003 8.3003 8.7243 8.7243 9.7196 9.7196 9.7435 9.7435 9.8565 9.8565 9.9180 9.9180 10.2521 10.2521 11.0748 11.0748 12.4176 12.4176 k = 0.3276 0.1884 0.0000 ( 8942 PWs) bands (ev): -68.8504 -68.8504 -68.8398 -68.8398 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3567 -37.3567 -17.6396 -17.6396 -4.3486 -4.3486 -2.4760 -2.4760 -2.3169 -2.3169 0.4023 0.4023 1.8710 1.8710 6.4515 6.4515 7.6169 7.6169 7.6547 7.6547 8.1130 8.1130 8.1905 8.1905 8.1965 8.1965 8.2923 8.2923 8.6972 8.6972 9.7439 9.7439 9.7718 9.7718 9.8752 9.8752 9.9366 9.9366 10.2521 10.2521 11.1176 11.1176 12.4819 12.4819 k = 0.3448 0.1983 0.0000 ( 8942 PWs) bands (ev): -68.8495 -68.8495 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3566 -37.3566 -17.6396 -17.6396 -4.3498 -4.3498 -2.4811 -2.4811 -2.3170 -2.3170 0.4410 0.4410 1.8202 1.8202 6.4944 6.4944 7.6129 7.6129 7.6477 7.6477 8.1165 8.1165 8.1830 8.1830 8.1995 8.1995 8.2862 8.2862 8.6726 8.6726 9.7446 9.7446 9.8300 9.8300 9.9003 9.9003 9.9583 9.9583 10.2483 10.2483 11.1569 11.1569 12.5417 12.5417 k = 0.3621 0.2083 0.0000 ( 8942 PWs) bands (ev): -68.8495 -68.8495 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3566 -37.3566 -17.6395 -17.6395 -4.3509 -4.3509 -2.4859 -2.4859 -2.3170 -2.3170 0.4789 0.4789 1.7717 1.7717 6.5307 6.5307 7.6115 7.6115 7.6437 7.6437 8.1218 8.1218 8.1765 8.1765 8.2004 8.2004 8.2794 8.2794 8.6504 8.6504 9.7449 9.7449 9.8796 9.8796 9.9345 9.9345 9.9751 9.9751 10.2484 10.2484 11.1925 11.1925 12.5327 12.5327 k = 0.3793 0.2182 0.0000 ( 8946 PWs) bands (ev): -68.8500 -68.8500 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3566 -37.3566 -17.6394 -17.6394 -4.3520 -4.3520 -2.4901 -2.4901 -2.3170 -2.3170 0.5153 0.5153 1.7261 1.7261 6.5608 6.5608 7.6102 7.6102 7.6401 7.6401 8.1283 8.1283 8.1741 8.1741 8.1980 8.1980 8.2723 8.2723 8.6307 8.6307 9.7434 9.7434 9.9045 9.9045 9.9879 9.9879 9.9963 9.9963 10.2485 10.2485 11.2243 11.2243 12.3776 12.3776 k = 0.3966 0.2281 0.0000 ( 8934 PWs) bands (ev): -68.8487 -68.8487 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3566 -37.3566 -17.6394 -17.6394 -4.3529 -4.3529 -2.4939 -2.4939 -2.3170 -2.3170 0.5497 0.5497 1.6840 1.6840 6.5836 6.5836 7.6080 7.6080 7.6358 7.6358 8.1322 8.1322 8.1798 8.1798 8.2007 8.2007 8.2682 8.2682 8.6173 8.6173 9.7439 9.7439 9.9248 9.9248 10.0059 10.0059 10.0722 10.0722 10.2486 10.2486 11.2584 11.2584 12.2186 12.2186 k = 0.4138 0.2380 0.0000 ( 8942 PWs) bands (ev): -68.8496 -68.8496 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3566 -37.3566 -17.6394 -17.6394 -4.3537 -4.3537 -2.4971 -2.4971 -2.3170 -2.3170 0.5811 0.5811 1.6460 1.6460 6.6022 6.6022 7.6080 7.6080 7.6340 7.6340 8.1307 8.1307 8.1865 8.1865 8.1956 8.1956 8.2631 8.2631 8.5987 8.5987 9.7418 9.7418 9.9363 9.9363 10.0171 10.0171 10.1507 10.1507 10.2564 10.2564 11.2748 11.2748 12.0633 12.0633 k = 0.4310 0.2479 0.0000 ( 8962 PWs) bands (ev): -68.8517 -68.8517 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3567 -37.3567 -17.6393 -17.6393 -4.3544 -4.3544 -2.4998 -2.4998 -2.3170 -2.3170 0.6088 0.6088 1.6129 1.6129 6.6161 6.6161 7.6072 7.6072 7.6317 7.6317 8.1259 8.1259 8.1893 8.1893 8.1934 8.1934 8.2572 8.2572 8.5867 8.5867 9.7375 9.7375 9.9399 9.9399 10.0213 10.0213 10.2256 10.2256 10.2607 10.2607 11.2941 11.2941 11.9171 11.9171 k = 0.4483 0.2579 0.0000 ( 8954 PWs) bands (ev): -68.8509 -68.8509 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3567 -37.3567 -17.6393 -17.6393 -4.3549 -4.3549 -2.5019 -2.5019 -2.3170 -2.3170 0.6318 0.6318 1.5859 1.5859 6.6262 6.6262 7.6066 7.6066 7.6300 7.6300 8.1244 8.1244 8.1937 8.1937 8.2001 8.2001 8.2555 8.2555 8.5773 8.5773 9.7384 9.7384 9.9515 9.9515 10.0333 10.0333 10.2515 10.2515 10.3127 10.3127 11.3091 11.3091 11.7894 11.7894 k = 0.4655 0.2678 0.0000 ( 8954 PWs) bands (ev): -68.8509 -68.8509 -68.8407 -68.8407 -38.6254 -38.6254 -38.6074 -38.6074 -37.4700 -37.4700 -37.4395 -37.4395 -37.3607 -37.3607 -37.3567 -37.3567 -17.6393 -17.6393 -4.3553 -4.3553 -2.5034 -2.5034 -2.3170 -2.3170 0.6491 0.6491 1.5657 1.5657 6.6331 6.6331 7.6062 7.6062 7.6287 7.6287 8.1222 8.1222 8.1940 8.1940 8.2068 8.2068 8.2533 8.2533 8.5705 8.5705 9.7384 9.7384 9.9570 9.9570 10.0391 10.0391 10.2531 10.2531 10.3778 10.3778 11.3198 11.3198 11.6862 11.6862 k = 0.4828 0.2777 0.0000 ( 8934 PWs) bands (ev): -68.8505 -68.8505 -68.8390 -68.8390 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6393 -17.6393 -4.3555 -4.3555 -2.5043 -2.5043 -2.3170 -2.3170 0.6600 0.6600 1.5533 1.5533 6.6388 6.6388 7.6107 7.6107 7.6329 7.6329 8.1214 8.1214 8.1952 8.1952 8.2116 8.2116 8.2527 8.2527 8.5671 8.5671 9.7385 9.7385 9.9623 9.9623 10.0446 10.0446 10.2554 10.2554 10.4245 10.4245 11.3277 11.3277 11.6178 11.6178 k = 0.5000 0.2876 0.0000 ( 8934 PWs) bands (ev): -68.8505 -68.8505 -68.8390 -68.8390 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6393 -17.6393 -4.3556 -4.3556 -2.5046 -2.5046 -2.3170 -2.3170 0.6636 0.6636 1.5490 1.5490 6.6401 6.6401 7.6106 7.6106 7.6327 7.6327 8.1209 8.1209 8.1953 8.1953 8.2131 8.2131 8.2522 8.2522 8.5658 8.5658 9.7385 9.7385 9.9634 9.9634 10.0458 10.0458 10.2555 10.2555 10.4413 10.4413 11.3298 11.3298 11.5935 11.5935 k = 0.5000 0.2876 0.0000 ( 8934 PWs) bands (ev): -68.8505 -68.8505 -68.8390 -68.8390 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6393 -17.6393 -4.3556 -4.3556 -2.5046 -2.5046 -2.3170 -2.3170 0.6636 0.6636 1.5490 1.5490 6.6401 6.6401 7.6106 7.6106 7.6327 7.6327 8.1209 8.1209 8.1953 8.1953 8.2131 8.2131 8.2522 8.2522 8.5658 8.5658 9.7385 9.7385 9.9634 9.9634 10.0458 10.0458 10.2555 10.2555 10.4413 10.4413 11.3298 11.3298 11.5935 11.5935 k = 0.4930 0.2997 0.0139 ( 8936 PWs) bands (ev): -68.8505 -68.8505 -68.8392 -68.8392 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6392 -17.6392 -4.3558 -4.3558 -2.5046 -2.5046 -2.3177 -2.3177 0.6651 0.6651 1.5494 1.5494 6.6396 6.6396 7.6100 7.6100 7.6321 7.6321 8.1160 8.1160 8.1953 8.1953 8.2145 8.2145 8.2468 8.2468 8.5731 8.5731 9.7376 9.7376 9.9579 9.9579 10.0392 10.0392 10.2595 10.2595 10.4469 10.4469 11.3330 11.3330 11.5924 11.5924 k = 0.4861 0.3118 0.0279 ( 8934 PWs) bands (ev): -68.8498 -68.8498 -68.8396 -68.8396 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6391 -17.6391 -4.3562 -4.3562 -2.5046 -2.5046 -2.3196 -2.3196 0.6696 0.6696 1.5505 1.5505 6.6394 6.6394 7.6096 7.6096 7.6322 7.6322 8.1009 8.1009 8.1976 8.1976 8.2196 8.2196 8.2341 8.2341 8.5924 8.5924 9.7390 9.7390 9.9421 9.9421 10.0215 10.0215 10.2651 10.2651 10.4627 10.4627 11.3419 11.3419 11.5900 11.5900 k = 0.4791 0.3239 0.0418 ( 8940 PWs) bands (ev): -68.8496 -68.8496 -68.8405 -68.8405 -38.6253 -38.6253 -38.6074 -38.6074 -37.4699 -37.4699 -37.4396 -37.4396 -37.3607 -37.3607 -37.3567 -37.3567 -17.6390 -17.6390 -4.3569 -4.3569 -2.5046 -2.5046 -2.3228 -2.3228 0.6770 0.6770 1.5523 1.5523 6.6397 6.6397 7.6035 7.6035 7.6307 7.6307 8.0744 8.0744 8.1951 8.1951 8.2207 8.2207 8.2282 8.2282 8.6212 8.6212 9.7350 9.7350 9.9156 9.9156 9.9959 9.9959 10.2808 10.2808 10.4860 10.4860 11.3563 11.3563 11.5844 11.5844 k = 0.4722 0.3360 0.0558 ( 8944 PWs) bands (ev): -68.8491 -68.8491 -68.8414 -68.8414 -38.6253 -38.6253 -38.6075 -38.6075 -37.4698 -37.4698 -37.4397 -37.4397 -37.3607 -37.3607 -37.3567 -37.3567 -17.6387 -17.6387 -4.3579 -4.3579 -2.5047 -2.5047 -2.3271 -2.3271 0.6872 0.6872 1.5549 1.5549 6.6388 6.6388 7.5978 7.5978 7.6316 7.6316 8.0376 8.0376 8.1815 8.1815 8.2183 8.2183 8.2379 8.2379 8.6544 8.6544 9.7323 9.7323 9.8811 9.8811 9.9681 9.9681 10.2979 10.2979 10.5132 10.5132 11.3768 11.3768 11.5762 11.5762 k = 0.4652 0.3481 0.0697 ( 8956 PWs) bands (ev): -68.8491 -68.8491 -68.8427 -68.8427 -38.6252 -38.6252 -38.6076 -38.6076 -37.4697 -37.4697 -37.4398 -37.4398 -37.3607 -37.3607 -37.3567 -37.3567 -17.6384 -17.6384 -4.3591 -4.3591 -2.5050 -2.5050 -2.3324 -2.3324 0.7003 0.7003 1.5581 1.5581 6.6401 6.6401 7.5918 7.5918 7.6319 7.6319 7.9914 7.9914 8.1626 8.1626 8.2228 8.2228 8.2501 8.2501 8.6890 8.6890 9.7241 9.7241 9.8367 9.8367 9.9366 9.9366 10.3076 10.3076 10.5430 10.5430 11.4011 11.4011 11.5650 11.5650 k = 0.4583 0.3601 0.0837 ( 8948 PWs) bands (ev): -68.8486 -68.8486 -68.8423 -68.8423 -38.6251 -38.6251 -38.6077 -38.6077 -37.4695 -37.4695 -37.4400 -37.4400 -37.3606 -37.3606 -37.3567 -37.3567 -17.6381 -17.6381 -4.3607 -4.3607 -2.5056 -2.5056 -2.3384 -2.3384 0.7159 0.7159 1.5621 1.5621 6.6412 6.6412 7.5845 7.5845 7.6362 7.6362 7.9404 7.9404 8.1425 8.1425 8.2273 8.2273 8.2640 8.2640 8.7279 8.7279 9.7142 9.7142 9.7928 9.7928 9.9110 9.9110 10.3336 10.3336 10.5747 10.5747 11.4328 11.4328 11.5497 11.5497 k = 0.4513 0.3722 0.0976 ( 8948 PWs) bands (ev): -68.8486 -68.8486 -68.8423 -68.8423 -38.6250 -38.6250 -38.6078 -38.6078 -37.4694 -37.4694 -37.4402 -37.4402 -37.3606 -37.3606 -37.3567 -37.3567 -17.6376 -17.6376 -4.3625 -4.3625 -2.5067 -2.5067 -2.3448 -2.3448 0.7339 0.7339 1.5669 1.5669 6.6406 6.6406 7.5760 7.5760 7.6416 7.6416 7.8850 7.8850 8.1197 8.1197 8.2338 8.2338 8.2810 8.2810 8.7655 8.7655 9.6999 9.6999 9.7453 9.7453 9.8821 9.8821 10.3571 10.3571 10.6053 10.6053 11.4679 11.4679 11.5318 11.5318 k = 0.4444 0.3843 0.1116 ( 8944 PWs) bands (ev): -68.8482 -68.8482 -68.8423 -68.8423 -38.6249 -38.6249 -38.6079 -38.6079 -37.4691 -37.4691 -37.4404 -37.4404 -37.3606 -37.3606 -37.3567 -37.3567 -17.6372 -17.6372 -4.3646 -4.3646 -2.5084 -2.5084 -2.3514 -2.3514 0.7542 0.7542 1.5724 1.5724 6.6387 6.6387 7.5670 7.5670 7.6481 7.6481 7.8281 7.8281 8.0955 8.0955 8.2403 8.2403 8.3003 8.3003 8.8031 8.8031 9.6750 9.6750 9.7096 9.7096 9.8545 9.8545 10.3803 10.3803 10.6362 10.6362 11.5030 11.5030 11.5135 11.5135 k = 0.4374 0.3964 0.1255 ( 8936 PWs) bands (ev): -68.8477 -68.8477 -68.8419 -68.8419 -38.6247 -38.6247 -38.6080 -38.6080 -37.4689 -37.4689 -37.4406 -37.4406 -37.3606 -37.3606 -37.3568 -37.3568 -17.6366 -17.6366 -4.3669 -4.3669 -2.5109 -2.5109 -2.3579 -2.3579 0.7766 0.7766 1.5787 1.5787 6.6350 6.6350 7.5594 7.5594 7.6561 7.6561 7.7705 7.7705 8.0695 8.0695 8.2478 8.2478 8.3197 8.3197 8.8394 8.8394 9.6341 9.6341 9.6913 9.6913 9.8273 9.8273 10.4037 10.4037 10.6662 10.6662 11.4830 11.4830 11.5498 11.5498 k = 0.4305 0.4085 0.1395 ( 8940 PWs) bands (ev): -68.8476 -68.8476 -68.8424 -68.8424 -38.6246 -38.6246 -38.6082 -38.6082 -37.4687 -37.4687 -37.4409 -37.4409 -37.3605 -37.3605 -37.3568 -37.3568 -17.6361 -17.6361 -4.3695 -4.3695 -2.5145 -2.5145 -2.3638 -2.3638 0.8007 0.8007 1.5857 1.5857 6.6274 6.6274 7.5503 7.5503 7.6643 7.6643 7.7136 7.7136 8.0425 8.0425 8.2556 8.2556 8.3387 8.3387 8.8726 8.8726 9.5868 9.5868 9.6724 9.6724 9.8006 9.8006 10.4238 10.4238 10.6940 10.6940 11.4514 11.4514 11.5941 11.5941 k = 0.4235 0.4206 0.1534 ( 8944 PWs) bands (ev): -68.8482 -68.8482 -68.8422 -68.8422 -38.6244 -38.6244 -38.6084 -38.6084 -37.4684 -37.4684 -37.4412 -37.4412 -37.3605 -37.3605 -37.3569 -37.3569 -17.6355 -17.6355 -4.3724 -4.3724 -2.5192 -2.5192 -2.3689 -2.3689 0.8264 0.8264 1.5935 1.5935 6.6180 6.6180 7.5409 7.5409 7.6586 7.6586 7.6734 7.6734 8.0135 8.0135 8.2646 8.2646 8.3578 8.3578 8.9059 8.9059 9.5393 9.5393 9.6473 9.6473 9.7736 9.7736 10.4445 10.4445 10.7211 10.7211 11.4142 11.4142 11.6412 11.6412 k = 0.4165 0.4327 0.1674 ( 8946 PWs) bands (ev): -68.8488 -68.8488 -68.8418 -68.8418 -38.6242 -38.6242 -38.6086 -38.6086 -37.4680 -37.4680 -37.4416 -37.4416 -37.3604 -37.3604 -37.3569 -37.3569 -17.6348 -17.6348 -4.3755 -4.3755 -2.5254 -2.5254 -2.3729 -2.3729 0.8535 0.8535 1.6020 1.6020 6.6048 6.6048 7.5337 7.5337 7.6072 7.6072 7.6831 7.6831 7.9823 7.9823 8.2727 8.2727 8.3765 8.3765 8.9371 8.9371 9.4951 9.4951 9.6263 9.6263 9.7436 9.7436 10.4608 10.4608 10.7469 10.7469 11.3741 11.3741 11.6904 11.6904 k = 0.4096 0.4448 0.1813 ( 8950 PWs) bands (ev): -68.8488 -68.8488 -68.8422 -68.8422 -38.6240 -38.6240 -38.6088 -38.6088 -37.4677 -37.4677 -37.4419 -37.4419 -37.3604 -37.3604 -37.3570 -37.3570 -17.6341 -17.6341 -4.3788 -4.3788 -2.5329 -2.5329 -2.3757 -2.3757 0.8816 0.8816 1.6113 1.6113 6.5862 6.5862 7.5259 7.5259 7.5600 7.5600 7.6934 7.6934 7.9505 7.9505 8.2836 8.2836 8.3962 8.3962 8.9645 8.9645 9.4521 9.4521 9.6086 9.6086 9.7127 9.7127 10.4717 10.4717 10.7694 10.7694 11.3296 11.3296 11.7405 11.7405 k = 0.4026 0.4569 0.1953 ( 8954 PWs) bands (ev): -68.8483 -68.8483 -68.8431 -68.8431 -38.6238 -38.6238 -38.6090 -38.6090 -37.4674 -37.4674 -37.4423 -37.4423 -37.3604 -37.3604 -37.3570 -37.3570 -17.6334 -17.6334 -4.3823 -4.3823 -2.5416 -2.5416 -2.3773 -2.3773 0.9105 0.9105 1.6214 1.6214 6.5615 6.5615 7.5163 7.5163 7.5194 7.5194 7.7043 7.7043 7.9185 7.9185 8.2971 8.2971 8.4164 8.4164 8.9886 8.9886 9.4114 9.4114 9.5902 9.5902 9.6831 9.6831 10.4812 10.4812 10.7880 10.7880 11.2801 11.2801 11.7911 11.7911 k = 0.3957 0.4690 0.2092 ( 8950 PWs) bands (ev): -68.8491 -68.8491 -68.8419 -68.8419 -38.6236 -38.6236 -38.6093 -38.6093 -37.4669 -37.4669 -37.4427 -37.4427 -37.3603 -37.3603 -37.3571 -37.3571 -17.6326 -17.6326 -4.3860 -4.3860 -2.5515 -2.5515 -2.3776 -2.3776 0.9399 0.9399 1.6322 1.6322 6.5323 6.5323 7.4830 7.4830 7.5131 7.5131 7.7183 7.7183 7.8860 7.8860 8.3122 8.3122 8.4331 8.4331 9.0106 9.0106 9.3712 9.3712 9.5634 9.5634 9.6566 9.6566 10.4954 10.4954 10.8031 10.8031 11.2283 11.2283 11.8432 11.8432 k = 0.3887 0.4811 0.2232 ( 8950 PWs) bands (ev): -68.8490 -68.8490 -68.8419 -68.8419 -38.6233 -38.6233 -38.6095 -38.6095 -37.4665 -37.4665 -37.4432 -37.4432 -37.3602 -37.3602 -37.3572 -37.3572 -17.6319 -17.6319 -4.3899 -4.3899 -2.5623 -2.5623 -2.3769 -2.3769 0.9696 0.9696 1.6439 1.6439 6.4971 6.4971 7.4540 7.4540 7.5075 7.5075 7.7301 7.7301 7.8528 7.8528 8.3268 8.3268 8.4513 8.4513 9.0303 9.0303 9.3368 9.3368 9.5417 9.5417 9.6269 9.6269 10.5029 10.5029 10.8136 10.8136 11.1731 11.1731 11.8927 11.8927 k = 0.3818 0.4931 0.2371 ( 8950 PWs) bands (ev): -68.8485 -68.8485 -68.8424 -68.8424 -38.6231 -38.6231 -38.6098 -38.6098 -37.4661 -37.4661 -37.4436 -37.4436 -37.3602 -37.3602 -37.3572 -37.3572 -17.6311 -17.6311 -4.3940 -4.3940 -2.5736 -2.5736 -2.3752 -2.3752 0.9992 0.9992 1.6564 1.6564 6.4560 6.4560 7.4301 7.4301 7.5037 7.5037 7.7427 7.7427 7.8197 7.8197 8.3426 8.3426 8.4686 8.4686 9.0459 9.0459 9.3080 9.3080 9.5188 9.5188 9.5967 9.5967 10.5075 10.5075 10.8179 10.8179 11.1160 11.1160 11.9381 11.9381 k = 0.3748 0.5052 0.2511 ( 8966 PWs) bands (ev): -68.8502 -68.8502 -68.8424 -68.8424 -38.6228 -38.6228 -38.6101 -38.6101 -37.4657 -37.4657 -37.4441 -37.4441 -37.3601 -37.3601 -37.3573 -37.3573 -17.6303 -17.6303 -4.3981 -4.3981 -2.5854 -2.5854 -2.3727 -2.3727 1.0285 1.0285 1.6696 1.6696 6.4106 6.4106 7.4128 7.4128 7.5009 7.5009 7.7550 7.7550 7.7859 7.7859 8.3555 8.3555 8.4834 8.4834 9.0540 9.0540 9.2770 9.2770 9.4873 9.4873 9.5646 9.5646 10.5102 10.5102 10.8141 10.8141 11.0560 11.0560 11.9804 11.9804 k = 0.3679 0.5173 0.2650 ( 8974 PWs) bands (ev): -68.8506 -68.8506 -68.8429 -68.8429 -38.6225 -38.6225 -38.6104 -38.6104 -37.4652 -37.4652 -37.4447 -37.4447 -37.3601 -37.3601 -37.3574 -37.3574 -17.6296 -17.6296 -4.4023 -4.4023 -2.5973 -2.5973 -2.3697 -2.3697 1.0572 1.0572 1.6837 1.6837 6.3613 6.3613 7.4006 7.4006 7.4993 7.4993 7.7529 7.7529 7.7680 7.7680 8.3713 8.3713 8.4970 8.4970 9.0587 9.0587 9.2531 9.2531 9.4604 9.4604 9.5323 9.5323 10.5101 10.5101 10.8043 10.8043 10.9957 10.9957 12.0181 12.0181 k = 0.3609 0.5294 0.2790 ( 8998 PWs) bands (ev): -68.8510 -68.8510 -68.8451 -68.8451 -38.6223 -38.6223 -38.6107 -38.6107 -37.4648 -37.4648 -37.4452 -37.4452 -37.3601 -37.3601 -37.3575 -37.3575 -17.6288 -17.6288 -4.4066 -4.4066 -2.6092 -2.6092 -2.3661 -2.3661 1.0849 1.0849 1.6985 1.6985 6.3090 6.3090 7.3910 7.3910 7.4960 7.4960 7.7199 7.7199 7.7783 7.7783 8.3880 8.3880 8.5090 8.5090 9.0554 9.0554 9.2293 9.2293 9.4349 9.4349 9.4989 9.4989 10.5083 10.5083 10.7858 10.7858 10.9310 10.9310 12.0507 12.0507 k = 0.3540 0.5415 0.2929 ( 8986 PWs) bands (ev): -68.8505 -68.8505 -68.8443 -68.8443 -38.6220 -38.6220 -38.6110 -38.6110 -37.4642 -37.4642 -37.4457 -37.4457 -37.3600 -37.3600 -37.3576 -37.3576 -17.6280 -17.6280 -4.4109 -4.4109 -2.6209 -2.6209 -2.3622 -2.3622 1.1114 1.1114 1.7142 1.7142 6.2561 6.2561 7.3863 7.3863 7.4992 7.4992 7.6891 7.6891 7.7935 7.7935 8.4087 8.4087 8.5211 8.5211 9.0516 9.0516 9.2128 9.2128 9.4149 9.4149 9.4708 9.4708 10.5103 10.5103 10.7621 10.7621 10.8752 10.8752 12.0855 12.0855 k = 0.3470 0.5536 0.3069 ( 8978 PWs) bands (ev): -68.8504 -68.8504 -68.8434 -68.8434 -38.6216 -38.6216 -38.6113 -38.6113 -37.4637 -37.4637 -37.4463 -37.4463 -37.3599 -37.3599 -37.3576 -37.3576 -17.6273 -17.6273 -4.4151 -4.4151 -2.6323 -2.6323 -2.3581 -2.3581 1.1365 1.1365 1.7308 1.7308 6.2025 6.2025 7.3843 7.3843 7.5016 7.5016 7.6588 7.6588 7.8082 7.8082 8.4290 8.4290 8.5281 8.5281 9.0483 9.0483 9.2032 9.2032 9.3908 9.3908 9.4414 9.4414 10.5104 10.5104 10.7338 10.7338 10.8170 10.8170 12.1238 12.1238 k = 0.3400 0.5657 0.3208 ( 8978 PWs) bands (ev): -68.8514 -68.8514 -68.8424 -68.8424 -38.6213 -38.6213 -38.6117 -38.6117 -37.4631 -37.4631 -37.4469 -37.4469 -37.3598 -37.3598 -37.3577 -37.3577 -17.6266 -17.6266 -4.4193 -4.4193 -2.6431 -2.6431 -2.3537 -2.3537 1.1598 1.1598 1.7481 1.7481 6.1497 6.1497 7.3837 7.3837 7.5049 7.5049 7.6294 7.6294 7.8226 7.8226 8.4487 8.4487 8.5343 8.5343 9.0393 9.0393 9.1942 9.1942 9.3610 9.3610 9.4118 9.4118 10.5099 10.5099 10.6991 10.6991 10.7591 10.7591 12.1640 12.1640 k = 0.3331 0.5778 0.3348 ( 8972 PWs) bands (ev): -68.8513 -68.8513 -68.8418 -68.8418 -38.6209 -38.6209 -38.6120 -38.6120 -37.4625 -37.4625 -37.4475 -37.4475 -37.3597 -37.3597 -37.3578 -37.3578 -17.6259 -17.6259 -4.4234 -4.4234 -2.6535 -2.6535 -2.3493 -2.3493 1.1809 1.1809 1.7662 1.7662 6.0982 6.0982 7.3828 7.3828 7.5111 7.5111 7.6007 7.6007 7.8373 7.8373 8.4717 8.4717 8.5392 8.5392 9.0292 9.0292 9.1841 9.1841 9.3404 9.3404 9.3797 9.3797 10.5064 10.5064 10.6601 10.6601 10.7085 10.7085 12.2090 12.2090 k = 0.3261 0.5899 0.3487 ( 8972 PWs) bands (ev): -68.8511 -68.8511 -68.8421 -68.8421 -38.6206 -38.6206 -38.6124 -38.6124 -37.4619 -37.4619 -37.4481 -37.4481 -37.3596 -37.3596 -37.3579 -37.3579 -17.6253 -17.6253 -4.4273 -4.4273 -2.6631 -2.6631 -2.3449 -2.3449 1.1997 1.1997 1.7852 1.7852 6.0486 6.0486 7.3805 7.3805 7.5143 7.5143 7.5734 7.5734 7.8525 7.8525 8.4956 8.4956 8.5441 8.5441 9.0192 9.0192 9.1760 9.1760 9.3197 9.3197 9.3480 9.3480 10.5030 10.5030 10.6132 10.6132 10.6559 10.6559 12.2593 12.2593 k = 0.3192 0.6020 0.3627 ( 8966 PWs) bands (ev): -68.8497 -68.8497 -68.8428 -68.8428 -38.6203 -38.6203 -38.6127 -38.6127 -37.4614 -37.4614 -37.4486 -37.4486 -37.3596 -37.3596 -37.3579 -37.3579 -17.6247 -17.6247 -4.4311 -4.4311 -2.6721 -2.6721 -2.3405 -2.3405 1.2158 1.2158 1.8049 1.8049 6.0018 6.0018 7.3774 7.3774 7.5202 7.5202 7.5469 7.5469 7.8695 7.8695 8.5244 8.5244 8.5501 8.5501 9.0092 9.0092 9.1635 9.1635 9.3025 9.3025 9.3132 9.3132 10.4962 10.4962 10.5644 10.5644 10.6119 10.6119 12.3141 12.3141 k = 0.3122 0.6141 0.3766 ( 8972 PWs) bands (ev): -68.8494 -68.8494 -68.8438 -68.8438 -38.6199 -38.6199 -38.6131 -38.6131 -37.4608 -37.4608 -37.4492 -37.4492 -37.3595 -37.3595 -37.3580 -37.3580 -17.6241 -17.6241 -4.4346 -4.4346 -2.6803 -2.6803 -2.3362 -2.3362 1.2290 1.2290 1.8255 1.8255 5.9585 5.9585 7.3715 7.3715 7.5200 7.5200 7.5267 7.5267 7.8845 7.8845 8.5368 8.5368 8.5623 8.5623 9.0012 9.0012 9.1534 9.1534 9.2750 9.2750 9.2893 9.2893 10.4904 10.4904 10.5092 10.5092 10.5692 10.5692 12.3720 12.3720 k = 0.3053 0.6261 0.3906 ( 8976 PWs) bands (ev): -68.8493 -68.8493 -68.8443 -68.8443 -38.6196 -38.6196 -38.6134 -38.6134 -37.4602 -37.4602 -37.4499 -37.4499 -37.3594 -37.3594 -37.3581 -37.3581 -17.6236 -17.6236 -4.4378 -4.4378 -2.6877 -2.6877 -2.3321 -2.3321 1.2390 1.2390 1.8468 1.8468 5.9190 5.9190 7.3638 7.3638 7.4980 7.4980 7.5318 7.5318 7.8994 7.8994 8.5373 8.5373 8.5855 8.5855 8.9927 8.9927 9.1407 9.1407 9.2432 9.2432 9.2731 9.2731 10.4543 10.4543 10.4858 10.4858 10.5329 10.5329 12.4187 12.4187 k = 0.2983 0.6382 0.4045 ( 8980 PWs) bands (ev): -68.8496 -68.8496 -68.8444 -68.8444 -38.6192 -38.6192 -38.6138 -38.6138 -37.4596 -37.4596 -37.4505 -37.4505 -37.3593 -37.3593 -37.3582 -37.3582 -17.6231 -17.6231 -4.4407 -4.4407 -2.6943 -2.6943 -2.3282 -2.3282 1.2458 1.2458 1.8690 1.8690 5.8840 5.8840 7.3532 7.3532 7.4761 7.4761 7.5386 7.5386 7.9132 7.9132 8.5335 8.5335 8.6098 8.6098 8.9862 8.9862 9.1337 9.1337 9.2107 9.2107 9.2596 9.2596 10.4016 10.4016 10.4723 10.4723 10.5049 10.5049 12.3749 12.3749 k = 0.2914 0.6503 0.4185 ( 8982 PWs) bands (ev): -68.8487 -68.8487 -68.8456 -68.8456 -38.6188 -38.6188 -38.6142 -38.6142 -37.4590 -37.4590 -37.4511 -37.4511 -37.3593 -37.3593 -37.3583 -37.3583 -17.6227 -17.6227 -4.4433 -4.4433 -2.7000 -2.7000 -2.3244 -2.3244 1.2490 1.2490 1.8919 1.8919 5.8534 5.8534 7.3392 7.3392 7.4555 7.4555 7.5451 7.5451 7.9281 7.9281 8.5287 8.5287 8.6379 8.6379 8.9840 8.9840 9.1221 9.1221 9.1763 9.1763 9.2536 9.2536 10.3490 10.3490 10.4457 10.4457 10.4927 10.4927 12.2999 12.2999 k = 0.2914 0.6503 0.4185 ( 8982 PWs) bands (ev): -68.8487 -68.8487 -68.8456 -68.8456 -38.6188 -38.6188 -38.6142 -38.6142 -37.4590 -37.4590 -37.4511 -37.4511 -37.3593 -37.3593 -37.3583 -37.3583 -17.6227 -17.6227 -4.4433 -4.4433 -2.7000 -2.7000 -2.3244 -2.3244 1.2490 1.2490 1.8919 1.8919 5.8534 5.8534 7.3392 7.3392 7.4555 7.4555 7.5451 7.5451 7.9281 7.9281 8.5287 8.5287 8.6379 8.6379 8.9840 8.9840 9.1221 9.1221 9.1763 9.1763 9.2536 9.2536 10.3490 10.3490 10.4457 10.4457 10.4927 10.4927 12.2999 12.2999 k = 0.2731 0.6458 0.4236 ( 8973 PWs) bands (ev): -68.8483 -68.8483 -68.8450 -68.8450 -38.6187 -38.6187 -38.6143 -38.6143 -37.4587 -37.4587 -37.4514 -37.4514 -37.3592 -37.3592 -37.3583 -37.3583 -17.6226 -17.6226 -4.4442 -4.4442 -2.7018 -2.7018 -2.3231 -2.3231 1.2488 1.2488 1.9011 1.9011 5.8455 5.8455 7.3240 7.3240 7.4480 7.4480 7.5552 7.5552 7.9365 7.9365 8.5255 8.5255 8.6514 8.6514 8.9848 8.9848 9.1216 9.1216 9.1659 9.1659 9.2507 9.2507 10.2965 10.2965 10.4664 10.4664 10.4960 10.4960 12.2730 12.2730 k = 0.2549 0.6413 0.4288 ( 8975 PWs) bands (ev): -68.8485 -68.8485 -68.8450 -68.8450 -38.6185 -38.6185 -38.6145 -38.6145 -37.4585 -37.4585 -37.4516 -37.4516 -37.3592 -37.3592 -37.3583 -37.3583 -17.6225 -17.6225 -4.4450 -4.4450 -2.7036 -2.7036 -2.3216 -2.3216 1.2474 1.2474 1.9108 1.9108 5.8426 5.8426 7.2918 7.2918 7.4399 7.4399 7.5772 7.5772 7.9435 7.9435 8.5175 8.5175 8.6627 8.6627 8.9871 8.9871 9.1185 9.1185 9.1551 9.1551 9.2463 9.2463 10.2225 10.2225 10.4811 10.4811 10.5306 10.5306 12.2465 12.2465 k = 0.2367 0.6368 0.4340 ( 8972 PWs) bands (ev): -68.8485 -68.8485 -68.8446 -68.8446 -38.6184 -38.6184 -38.6146 -38.6146 -37.4582 -37.4582 -37.4519 -37.4519 -37.3591 -37.3591 -37.3584 -37.3584 -17.6224 -17.6224 -4.4457 -4.4457 -2.7052 -2.7052 -2.3202 -2.3202 1.2451 1.2451 1.9207 1.9207 5.8448 5.8448 7.2486 7.2486 7.4321 7.4321 7.6057 7.6057 7.9511 7.9511 8.5058 8.5058 8.6748 8.6748 8.9951 8.9951 9.1162 9.1162 9.1470 9.1470 9.2412 9.2412 10.1493 10.1493 10.4808 10.4808 10.5866 10.5866 12.2224 12.2224 k = 0.2185 0.6324 0.4392 ( 8972 PWs) bands (ev): -68.8483 -68.8483 -68.8449 -68.8449 -38.6182 -38.6182 -38.6148 -38.6148 -37.4580 -37.4580 -37.4521 -37.4521 -37.3591 -37.3591 -37.3584 -37.3584 -17.6223 -17.6223 -4.4464 -4.4464 -2.7068 -2.7068 -2.3187 -2.3187 1.2421 1.2421 1.9306 1.9306 5.8521 5.8521 7.1978 7.1978 7.4246 7.4246 7.6365 7.6365 7.9589 7.9589 8.4905 8.4905 8.6877 8.6877 9.0048 9.0048 9.1117 9.1117 9.1401 9.1401 9.2367 9.2367 10.0792 10.0792 10.4784 10.4784 10.6449 10.6449 12.2015 12.2015 k = 0.2003 0.6279 0.4444 ( 8973 PWs) bands (ev): -68.8483 -68.8483 -68.8450 -68.8450 -38.6181 -38.6181 -38.6149 -38.6149 -37.4577 -37.4577 -37.4523 -37.4523 -37.3591 -37.3591 -37.3584 -37.3584 -17.6222 -17.6222 -4.4470 -4.4470 -2.7082 -2.7082 -2.3172 -2.3172 1.2388 1.2388 1.9402 1.9402 5.8645 5.8645 7.1420 7.1420 7.4173 7.4173 7.6690 7.6690 7.9657 7.9657 8.4732 8.4732 8.6994 8.6994 9.0144 9.0144 9.1060 9.1060 9.1367 9.1367 9.2337 9.2337 10.0127 10.0127 10.4744 10.4744 10.7063 10.7063 12.1819 12.1819 k = 0.1821 0.6234 0.4496 ( 8967 PWs) bands (ev): -68.8476 -68.8476 -68.8451 -68.8451 -38.6180 -38.6180 -38.6151 -38.6151 -37.4575 -37.4575 -37.4526 -37.4526 -37.3591 -37.3591 -37.3585 -37.3585 -17.6221 -17.6221 -4.4475 -4.4475 -2.7095 -2.7095 -2.3157 -2.3157 1.2352 1.2352 1.9492 1.9492 5.8817 5.8817 7.0824 7.0824 7.4112 7.4112 7.7017 7.7017 7.9743 7.9743 8.4533 8.4533 8.7139 8.7139 9.0244 9.0244 9.1010 9.1010 9.1364 9.1364 9.2319 9.2319 9.9508 9.9508 10.4719 10.4719 10.7692 10.7692 12.1634 12.1634 k = 0.1639 0.6189 0.4547 ( 8969 PWs) bands (ev): -68.8475 -68.8475 -68.8453 -68.8453 -38.6178 -38.6178 -38.6152 -38.6152 -37.4573 -37.4573 -37.4528 -37.4528 -37.3590 -37.3590 -37.3585 -37.3585 -17.6220 -17.6220 -4.4480 -4.4480 -2.7106 -2.7106 -2.3142 -2.3142 1.2316 1.2316 1.9574 1.9574 5.9037 5.9037 7.0200 7.0200 7.4047 7.4047 7.7347 7.7347 7.9821 7.9821 8.4308 8.4308 8.7269 8.7269 9.0297 9.0297 9.0944 9.0944 9.1392 9.1392 9.2314 9.2314 9.8903 9.8903 10.4666 10.4666 10.8340 10.8340 12.1283 12.1283 k = 0.1457 0.6144 0.4599 ( 8969 PWs) bands (ev): -68.8471 -68.8471 -68.8458 -68.8458 -38.6177 -38.6177 -38.6153 -38.6153 -37.4570 -37.4570 -37.4531 -37.4531 -37.3590 -37.3590 -37.3585 -37.3585 -17.6219 -17.6219 -4.4485 -4.4485 -2.7117 -2.7117 -2.3129 -2.3129 1.2282 1.2282 1.9649 1.9649 5.9300 5.9300 6.9564 6.9564 7.3989 7.3989 7.7666 7.7666 7.9884 7.9884 8.4088 8.4088 8.7386 8.7386 9.0327 9.0327 9.0915 9.0915 9.1411 9.1411 9.2342 9.2342 9.8361 9.8361 10.4618 10.4618 10.8990 10.8990 12.0607 12.0607 k = 0.1275 0.6099 0.4651 ( 8962 PWs) bands (ev): -68.8466 -68.8466 -68.8455 -68.8455 -38.6175 -38.6175 -38.6155 -38.6155 -37.4568 -37.4568 -37.4533 -37.4533 -37.3590 -37.3590 -37.3585 -37.3585 -17.6219 -17.6219 -4.4488 -4.4488 -2.7126 -2.7126 -2.3116 -2.3116 1.2249 1.2249 1.9716 1.9716 5.9603 5.9603 6.8925 6.8925 7.3947 7.3947 7.7981 7.7981 7.9949 7.9949 8.3868 8.3868 8.7509 8.7509 9.0336 9.0336 9.0934 9.0934 9.1441 9.1441 9.2371 9.2371 9.7870 9.7870 10.4590 10.4590 10.9654 10.9654 11.9856 11.9856 k = 0.1093 0.6054 0.4703 ( 8955 PWs) bands (ev): -68.8461 -68.8461 -68.8452 -68.8452 -38.6174 -38.6174 -38.6156 -38.6156 -37.4565 -37.4565 -37.4535 -37.4535 -37.3589 -37.3589 -37.3585 -37.3585 -17.6218 -17.6218 -4.4492 -4.4492 -2.7134 -2.7134 -2.3105 -2.3105 1.2220 1.2220 1.9774 1.9774 5.9940 5.9940 6.8290 6.8290 7.3907 7.3907 7.8283 7.8283 8.0015 8.0015 8.3634 8.3634 8.7640 8.7640 9.0306 9.0306 9.0972 9.0972 9.1470 9.1470 9.2441 9.2441 9.7421 9.7421 10.4555 10.4555 11.0324 11.0324 11.9089 11.9089 k = 0.0910 0.6009 0.4755 ( 8947 PWs) bands (ev): -68.8456 -68.8456 -68.8449 -68.8449 -38.6172 -38.6172 -38.6158 -38.6158 -37.4563 -37.4563 -37.4538 -37.4538 -37.3589 -37.3589 -37.3585 -37.3585 -17.6218 -17.6218 -4.4495 -4.4495 -2.7141 -2.7141 -2.3094 -2.3094 1.2194 1.2194 1.9823 1.9823 6.0302 6.0302 6.7671 6.7671 7.3868 7.3868 7.8564 7.8564 8.0068 8.0068 8.3413 8.3413 8.7757 8.7757 9.0249 9.0249 9.1034 9.1034 9.1492 9.1492 9.2557 9.2557 9.7031 9.7031 10.4510 10.4510 11.0996 11.0996 11.8332 11.8332 k = 0.0728 0.5964 0.4807 ( 8945 PWs) bands (ev): -68.8455 -68.8455 -68.8447 -68.8447 -38.6171 -38.6171 -38.6159 -38.6159 -37.4560 -37.4560 -37.4540 -37.4540 -37.3589 -37.3589 -37.3586 -37.3586 -17.6218 -17.6218 -4.4497 -4.4497 -2.7146 -2.7146 -2.3086 -2.3086 1.2171 1.2171 1.9863 1.9863 6.0674 6.0674 6.7082 6.7082 7.3840 7.3840 7.8818 7.8818 8.0117 8.0117 8.3196 8.3196 8.7863 8.7863 9.0188 9.0188 9.1081 9.1081 9.1493 9.1493 9.2659 9.2659 9.6670 9.6670 10.4475 10.4475 11.1662 11.1662 11.7580 11.7580 k = 0.0546 0.5919 0.4858 ( 8947 PWs) bands (ev): -68.8455 -68.8455 -68.8450 -68.8450 -38.6169 -38.6169 -38.6160 -38.6160 -37.4558 -37.4558 -37.4543 -37.4543 -37.3588 -37.3588 -37.3586 -37.3586 -17.6217 -17.6217 -4.4499 -4.4499 -2.7151 -2.7151 -2.3079 -2.3079 1.2154 1.2154 1.9893 1.9893 6.1038 6.1038 6.6548 6.6548 7.3806 7.3806 7.9026 7.9026 8.0150 8.0150 8.3005 8.3005 8.7949 8.7949 9.0103 9.0103 9.1138 9.1138 9.1484 9.1484 9.2782 9.2782 9.6377 9.6377 10.4421 10.4421 11.2315 11.2315 11.6856 11.6856 k = 0.0364 0.5874 0.4910 ( 8942 PWs) bands (ev): -68.8450 -68.8450 -68.8449 -68.8449 -38.6168 -38.6168 -38.6162 -38.6162 -37.4555 -37.4555 -37.4545 -37.4545 -37.3588 -37.3588 -37.3586 -37.3586 -17.6217 -17.6217 -4.4500 -4.4500 -2.7154 -2.7154 -2.3074 -2.3074 1.2142 1.2142 1.9916 1.9916 6.1360 6.1360 6.6105 6.6105 7.3782 7.3782 7.9199 7.9199 8.0182 8.0182 8.2862 8.2862 8.8022 8.8022 9.0040 9.0040 9.1188 9.1188 9.1476 9.1476 9.2909 9.2909 9.6161 9.6161 10.4384 10.4384 11.2972 11.2972 11.6166 11.6166 k = 0.0182 0.5829 0.4962 ( 8946 PWs) bands (ev): -68.8454 -68.8454 -68.8450 -68.8450 -38.6166 -38.6166 -38.6163 -38.6163 -37.4553 -37.4553 -37.4548 -37.4548 -37.3588 -37.3588 -37.3587 -37.3587 -17.6217 -17.6217 -4.4501 -4.4501 -2.7156 -2.7156 -2.3071 -2.3071 1.2134 1.2134 1.9928 1.9928 6.1590 6.1590 6.5799 6.5799 7.3771 7.3771 7.9312 7.9312 8.0195 8.0195 8.2769 8.2769 8.8059 8.8059 9.0004 9.0004 9.1207 9.1207 9.1439 9.1439 9.2965 9.2965 9.5992 9.5992 10.4367 10.4367 11.3556 11.3556 11.5558 11.5558 k = 0.0000 0.5784 0.5014 ( 8946 PWs) bands (ev): -68.8452 -68.8452 -68.8452 -68.8452 -38.6165 -38.6165 -38.6165 -38.6165 -37.4550 -37.4550 -37.4550 -37.4550 -37.3587 -37.3587 -37.3587 -37.3587 -17.6217 -17.6217 -4.4501 -4.4501 -2.7156 -2.7156 -2.3070 -2.3070 1.2132 1.2132 1.9932 1.9932 6.1676 6.1676 6.5688 6.5688 7.3765 7.3765 7.9357 7.9357 8.0201 8.0201 8.2743 8.2743 8.8075 8.8075 8.9986 8.9986 9.1225 9.1225 9.1418 9.1418 9.2997 9.2997 9.5924 9.5924 10.4356 10.4356 11.3873 11.3873 11.5244 11.5244 k = 0.0000 0.5784 0.5014 ( 8946 PWs) bands (ev): -68.8452 -68.8452 -68.8452 -68.8452 -38.6165 -38.6165 -38.6165 -38.6165 -37.4550 -37.4550 -37.4550 -37.4550 -37.3587 -37.3587 -37.3587 -37.3587 -17.6217 -17.6217 -4.4501 -4.4501 -2.7156 -2.7156 -2.3070 -2.3070 1.2132 1.2132 1.9932 1.9932 6.1676 6.1676 6.5688 6.5688 7.3765 7.3765 7.9357 7.9357 8.0201 8.0201 8.2743 8.2743 8.8075 8.8075 8.9986 8.9986 9.1225 9.1225 9.1418 9.1418 9.2997 9.2997 9.5924 9.5924 10.4356 10.4356 11.3873 11.3873 11.5244 11.5244 k = 0.0069 0.5664 0.5153 ( 8944 PWs) bands (ev): -68.8451 -68.8451 -68.8451 -68.8451 -38.6165 -38.6165 -38.6165 -38.6165 -37.4550 -37.4550 -37.4550 -37.4550 -37.3587 -37.3587 -37.3587 -37.3587 -17.6217 -17.6217 -4.4501 -4.4501 -2.7154 -2.7154 -2.3074 -2.3074 1.2124 1.2124 1.9940 1.9940 6.1687 6.1687 6.5666 6.5666 7.3786 7.3786 7.9347 7.9347 8.0195 8.0195 8.2741 8.2741 8.8090 8.8090 8.9959 8.9959 9.1253 9.1253 9.1437 9.1437 9.2990 9.2990 9.5939 9.5939 10.4364 10.4364 11.3824 11.3824 11.5245 11.5245 k = 0.0139 0.5543 0.5293 ( 8940 PWs) bands (ev): -68.8449 -68.8449 -68.8448 -68.8448 -38.6165 -38.6165 -38.6165 -38.6165 -37.4550 -37.4550 -37.4550 -37.4550 -37.3587 -37.3587 -37.3587 -37.3587 -17.6216 -17.6216 -4.4501 -4.4501 -2.7148 -2.7148 -2.3086 -2.3086 1.2100 1.2100 1.9965 1.9965 6.1720 6.1720 6.5601 6.5601 7.3843 7.3843 7.9326 7.9326 8.0169 8.0169 8.2763 8.2763 8.8120 8.8120 8.9880 8.9880 9.1313 9.1313 9.1495 9.1495 9.2960 9.2960 9.5951 9.5951 10.4377 10.4377 11.3693 11.3693 11.5261 11.5261 k = 0.0208 0.5422 0.5432 ( 8954 PWs) bands (ev): -68.8456 -68.8456 -68.8456 -68.8456 -38.6165 -38.6165 -38.6165 -38.6165 -37.4551 -37.4551 -37.4550 -37.4550 -37.3587 -37.3587 -37.3587 -37.3587 -17.6214 -17.6214 -4.4501 -4.4501 -2.7138 -2.7138 -2.3105 -2.3105 1.2061 1.2061 2.0006 2.0006 6.1770 6.1770 6.5495 6.5495 7.3926 7.3926 7.9281 7.9281 8.0093 8.0093 8.2777 8.2777 8.8117 8.8117 8.9739 8.9739 9.1352 9.1352 9.1591 9.1591 9.2892 9.2892 9.5946 9.5946 10.4378 10.4378 11.3463 11.3463 11.5273 11.5273 k = 0.0278 0.5301 0.5571 ( 8950 PWs) bands (ev): -68.8454 -68.8454 -68.8454 -68.8454 -38.6165 -38.6165 -38.6165 -38.6165 -37.4551 -37.4551 -37.4550 -37.4550 -37.3587 -37.3587 -37.3586 -37.3586 -17.6212 -17.6212 -4.4500 -4.4500 -2.7124 -2.7124 -2.3132 -2.3132 1.2007 1.2007 2.0064 2.0064 6.1845 6.1845 6.5355 6.5355 7.4039 7.4039 7.9244 7.9244 8.0022 8.0022 8.2825 8.2825 8.8161 8.8161 8.9589 8.9589 9.1419 9.1419 9.1744 9.1744 9.2815 9.2815 9.5989 9.5989 10.4381 10.4381 11.3187 11.3187 11.5295 11.5295 k = 0.0347 0.5181 0.5710 ( 8944 PWs) bands (ev): -68.8451 -68.8451 -68.8451 -68.8451 -38.6165 -38.6165 -38.6165 -38.6165 -37.4551 -37.4551 -37.4550 -37.4550 -37.3587 -37.3587 -37.3586 -37.3586 -17.6209 -17.6209 -4.4500 -4.4500 -2.7106 -2.7106 -2.3166 -2.3166 1.1938 1.1938 2.0138 2.0138 6.1937 6.1937 6.5185 6.5185 7.4171 7.4171 7.9206 7.9206 7.9950 7.9950 8.2893 8.2893 8.8230 8.8230 8.9429 8.9429 9.1484 9.1484 9.1902 9.1902 9.2725 9.2725 9.6026 9.6026 10.4375 10.4375 11.2856 11.2856 11.5291 11.5291 k = 0.0417 0.5060 0.5850 ( 8962 PWs) bands (ev): -68.8461 -68.8461 -68.8460 -68.8460 -38.6165 -38.6165 -38.6165 -38.6165 -37.4552 -37.4552 -37.4551 -37.4551 -37.3587 -37.3587 -37.3586 -37.3586 -17.6206 -17.6206 -4.4500 -4.4500 -2.7084 -2.7084 -2.3206 -2.3206 1.1854 1.1854 2.0226 2.0226 6.2039 6.2039 6.4988 6.4988 7.4302 7.4302 7.9142 7.9142 7.9831 7.9831 8.2938 8.2938 8.8259 8.8259 8.9236 8.9236 9.1520 9.1520 9.2043 9.2043 9.2603 9.2603 9.6042 9.6042 10.4335 10.4335 11.2453 11.2453 11.5162 11.5162 k = 0.0486 0.4939 0.5989 ( 8966 PWs) bands (ev): -68.8463 -68.8463 -68.8463 -68.8463 -38.6165 -38.6165 -38.6165 -38.6165 -37.4552 -37.4552 -37.4551 -37.4551 -37.3587 -37.3587 -37.3586 -37.3586 -17.6202 -17.6202 -4.4500 -4.4500 -2.7060 -2.7060 -2.3252 -2.3252 1.1757 1.1757 2.0330 2.0330 6.2158 6.2158 6.4773 6.4773 7.4438 7.4438 7.9095 7.9095 7.9731 7.9731 8.3010 8.3010 8.8338 8.8338 8.9056 8.9056 9.1574 9.1574 9.2170 9.2170 9.2501 9.2501 9.6083 9.6083 10.4273 10.4273 11.2035 11.2035 11.4724 11.4724 k = 0.0556 0.4818 0.6128 ( 8960 PWs) bands (ev): -68.8459 -68.8459 -68.8459 -68.8459 -38.6166 -38.6166 -38.6165 -38.6165 -37.4552 -37.4552 -37.4551 -37.4551 -37.3587 -37.3587 -37.3585 -37.3585 -17.6197 -17.6197 -4.4500 -4.4500 -2.7032 -2.7032 -2.3303 -2.3303 1.1646 1.1646 2.0450 2.0450 6.2285 6.2285 6.4545 6.4545 7.4580 7.4580 7.9067 7.9067 7.9634 7.9634 8.3102 8.3102 8.8422 8.8422 8.8894 8.8894 9.1643 9.1643 9.2263 9.2263 9.2452 9.2452 9.6142 9.6142 10.4212 10.4212 11.1609 11.1609 11.3956 11.3956 k = 0.0625 0.4698 0.6267 ( 8960 PWs) bands (ev): -68.8459 -68.8459 -68.8459 -68.8459 -38.6166 -38.6166 -38.6165 -38.6165 -37.4553 -37.4553 -37.4551 -37.4551 -37.3587 -37.3587 -37.3585 -37.3585 -17.6192 -17.6192 -4.4500 -4.4500 -2.7001 -2.7001 -2.3358 -2.3358 1.1522 1.1522 2.0582 2.0582 6.2417 6.2417 6.4309 6.4309 7.4709 7.4709 7.9046 7.9046 7.9523 7.9523 8.3186 8.3186 8.8494 8.8494 8.8738 8.8738 9.1662 9.1662 9.2228 9.2228 9.2556 9.2556 9.6184 9.6184 10.4141 10.4141 11.1159 11.1159 11.3080 11.3080 k = 0.0694 0.4577 0.6407 ( 8958 PWs) bands (ev): -68.8459 -68.8459 -68.8458 -68.8458 -38.6166 -38.6166 -38.6165 -38.6165 -37.4553 -37.4553 -37.4551 -37.4551 -37.3587 -37.3587 -37.3584 -37.3584 -17.6187 -17.6187 -4.4501 -4.4501 -2.6969 -2.6969 -2.3417 -2.3417 1.1386 1.1386 2.0729 2.0729 6.2550 6.2550 6.4069 6.4069 7.4817 7.4817 7.9039 7.9039 7.9422 7.9422 8.3276 8.3276 8.8505 8.8505 8.8661 8.8661 9.1624 9.1624 9.2218 9.2218 9.2684 9.2684 9.6246 9.6246 10.4017 10.4017 11.0716 11.0716 11.2218 11.2218 k = 0.0764 0.4456 0.6546 ( 8950 PWs) bands (ev): -68.8454 -68.8454 -68.8454 -68.8454 -38.6166 -38.6166 -38.6165 -38.6165 -37.4553 -37.4553 -37.4552 -37.4552 -37.3586 -37.3586 -37.3584 -37.3584 -17.6181 -17.6181 -4.4502 -4.4502 -2.6934 -2.6934 -2.3478 -2.3478 1.1238 1.1238 2.0889 2.0889 6.2678 6.2678 6.3831 6.3831 7.4904 7.4904 7.9062 7.9062 7.9328 7.9328 8.3374 8.3374 8.8396 8.8396 8.8715 8.8715 9.1526 9.1526 9.2284 9.2284 9.2824 9.2824 9.6316 9.6316 10.3878 10.3878 11.0284 11.0284 11.1396 11.1396 k = 0.0833 0.4336 0.6685 ( 8952 PWs) bands (ev): -68.8456 -68.8456 -68.8456 -68.8456 -38.6166 -38.6166 -38.6165 -38.6165 -37.4554 -37.4554 -37.4552 -37.4552 -37.3586 -37.3586 -37.3583 -37.3583 -17.6175 -17.6175 -4.4503 -4.4503 -2.6898 -2.6898 -2.3540 -2.3540 1.1081 1.1081 2.1060 2.1060 6.2793 6.2793 6.3595 6.3595 7.4963 7.4963 7.9079 7.9079 7.9249 7.9249 8.3460 8.3460 8.8265 8.8265 8.8789 8.8789 9.1379 9.1379 9.2373 9.2373 9.2939 9.2939 9.6374 9.6374 10.3680 10.3680 10.9851 10.9851 11.0609 11.0609 k = 0.0903 0.4215 0.6825 ( 8952 PWs) bands (ev): -68.8456 -68.8456 -68.8456 -68.8456 -38.6166 -38.6166 -38.6165 -38.6165 -37.4554 -37.4554 -37.4552 -37.4552 -37.3586 -37.3586 -37.3583 -37.3583 -17.6169 -17.6169 -4.4505 -4.4505 -2.6860 -2.6860 -2.3603 -2.3603 1.0914 1.0914 2.1243 2.1243 6.2887 6.2887 6.3373 6.3373 7.4998 7.4998 7.9079 7.9079 7.9235 7.9235 8.3544 8.3544 8.8148 8.8148 8.8860 8.8860 9.1202 9.1202 9.2473 9.2473 9.3064 9.3064 9.6429 9.6429 10.3470 10.3470 10.9428 10.9428 10.9873 10.9873 k = 0.0972 0.4094 0.6964 ( 8952 PWs) bands (ev): -68.8456 -68.8456 -68.8456 -68.8456 -38.6166 -38.6166 -38.6166 -38.6166 -37.4555 -37.4555 -37.4553 -37.4553 -37.3585 -37.3585 -37.3582 -37.3582 -17.6162 -17.6162 -4.4508 -4.4508 -2.6823 -2.6823 -2.3665 -2.3665 1.0739 1.0739 2.1435 2.1435 6.2928 6.2928 6.3192 6.3192 7.5001 7.5001 7.9038 7.9038 7.9305 7.9305 8.3627 8.3627 8.8037 8.8037 8.8936 8.8936 9.1025 9.1025 9.2591 9.2591 9.3168 9.3168 9.6488 9.6488 10.3213 10.3213 10.9006 10.9006 10.9221 10.9221 k = 0.1042 0.3973 0.7103 ( 8956 PWs) bands (ev): -68.8458 -68.8458 -68.8458 -68.8458 -38.6166 -38.6166 -38.6166 -38.6166 -37.4556 -37.4556 -37.4553 -37.4553 -37.3585 -37.3585 -37.3582 -37.3582 -17.6155 -17.6155 -4.4511 -4.4511 -2.6786 -2.6786 -2.3725 -2.3725 1.0557 1.0557 2.1636 2.1636 6.2829 6.2829 6.3137 6.3137 7.4979 7.4979 7.8999 7.8999 7.9404 7.9404 8.3696 8.3696 8.7938 8.7938 8.9005 8.9005 9.0842 9.0842 9.2704 9.2704 9.3256 9.3256 9.6533 9.6533 10.2914 10.2914 10.8516 10.8516 10.8717 10.8717 k = 0.1111 0.3853 0.7242 ( 8954 PWs) bands (ev): -68.8457 -68.8457 -68.8457 -68.8457 -38.6167 -38.6167 -38.6166 -38.6166 -37.4556 -37.4556 -37.4553 -37.4553 -37.3585 -37.3585 -37.3582 -37.3582 -17.6148 -17.6148 -4.4515 -4.4515 -2.6749 -2.6749 -2.3783 -2.3783 1.0370 1.0370 2.1845 2.1845 6.2647 6.2647 6.3154 6.3154 7.4940 7.4940 7.8982 7.8982 7.9531 7.9531 8.3759 8.3759 8.7854 8.7854 8.9084 8.9084 9.0667 9.0667 9.2817 9.2817 9.3358 9.3358 9.6582 9.6582 10.2600 10.2600 10.7995 10.7995 10.8342 10.8342 k = 0.1181 0.3732 0.7382 ( 8948 PWs) bands (ev): -68.8453 -68.8453 -68.8453 -68.8453 -38.6167 -38.6167 -38.6166 -38.6166 -37.4556 -37.4556 -37.4554 -37.4554 -37.3584 -37.3584 -37.3581 -37.3581 -17.6140 -17.6140 -4.4520 -4.4520 -2.6714 -2.6714 -2.3838 -2.3838 1.0178 1.0178 2.2061 2.2061 6.2457 6.2457 6.3162 6.3162 7.4891 7.4891 7.8985 7.8985 7.9677 7.9677 8.3828 8.3828 8.7792 8.7792 8.9148 8.9148 9.0496 9.0496 9.2940 9.2940 9.3458 9.3458 9.6640 9.6640 10.2274 10.2274 10.7506 10.7506 10.8011 10.8011 k = 0.1250 0.3611 0.7521 ( 8944 PWs) bands (ev): -68.8451 -68.8451 -68.8451 -68.8451 -38.6167 -38.6167 -38.6166 -38.6166 -37.4557 -37.4557 -37.4554 -37.4554 -37.3584 -37.3584 -37.3580 -37.3580 -17.6133 -17.6133 -4.4525 -4.4525 -2.6681 -2.6681 -2.3888 -2.3888 0.9983 0.9983 2.2282 2.2282 6.2271 6.2271 6.3141 6.3141 7.4827 7.4827 7.9022 7.9022 7.9828 7.9828 8.3878 8.3878 8.7752 8.7752 8.9204 8.9204 9.0345 9.0345 9.3060 9.3060 9.3548 9.3548 9.6682 9.6682 10.1923 10.1923 10.7069 10.7069 10.7688 10.7688 k = 0.1319 0.3490 0.7660 ( 8956 PWs) bands (ev): -68.8458 -68.8458 -68.8458 -68.8458 -38.6167 -38.6167 -38.6166 -38.6166 -37.4558 -37.4558 -37.4555 -37.4555 -37.3584 -37.3584 -37.3580 -37.3580 -17.6126 -17.6126 -4.4531 -4.4531 -2.6651 -2.6651 -2.3933 -2.3933 0.9787 0.9787 2.2506 2.2506 6.2092 6.2092 6.3091 6.3091 7.4750 7.4750 7.9077 7.9077 7.9976 7.9976 8.3897 8.3897 8.7700 8.7700 8.9222 8.9222 9.0188 9.0188 9.3147 9.3147 9.3608 9.3608 9.6699 9.6699 10.1533 10.1533 10.6667 10.6667 10.7366 10.7366 k = 0.1389 0.3370 0.7800 ( 8962 PWs) bands (ev): -68.8461 -68.8461 -68.8461 -68.8461 -38.6167 -38.6167 -38.6166 -38.6166 -37.4558 -37.4558 -37.4555 -37.4555 -37.3583 -37.3583 -37.3580 -37.3580 -17.6118 -17.6118 -4.4538 -4.4538 -2.6623 -2.6623 -2.3973 -2.3973 0.9591 0.9591 2.2731 2.2731 6.1925 6.1925 6.3008 6.3008 7.4674 7.4674 7.9161 7.9161 8.0123 8.0123 8.3920 8.3920 8.7688 8.7688 8.9221 8.9221 9.0079 9.0079 9.3234 9.3234 9.3671 9.3671 9.6715 9.6715 10.1143 10.1143 10.6306 10.6306 10.7065 10.7065 k = 0.1458 0.3249 0.7939 ( 8964 PWs) bands (ev): -68.8462 -68.8462 -68.8462 -68.8462 -38.6167 -38.6167 -38.6167 -38.6167 -37.4559 -37.4559 -37.4556 -37.4556 -37.3583 -37.3583 -37.3579 -37.3579 -17.6111 -17.6111 -4.4545 -4.4545 -2.6599 -2.6599 -2.4006 -2.4006 0.9396 0.9396 2.2958 2.2958 6.1773 6.1773 6.2901 6.2901 7.4604 7.4604 7.9274 7.9274 8.0268 8.0268 8.3943 8.3943 8.7675 8.7675 8.9170 8.9170 9.0011 9.0011 9.3315 9.3315 9.3738 9.3738 9.6720 9.6720 10.0747 10.0747 10.6023 10.6023 10.6825 10.6825 k = 0.1528 0.3128 0.8078 ( 8968 PWs) bands (ev): -68.8464 -68.8464 -68.8464 -68.8464 -38.6168 -38.6168 -38.6167 -38.6167 -37.4559 -37.4559 -37.4556 -37.4556 -37.3583 -37.3583 -37.3579 -37.3579 -17.6104 -17.6104 -4.4552 -4.4552 -2.6578 -2.6578 -2.4034 -2.4034 0.9205 0.9205 2.3183 2.3183 6.1630 6.1630 6.2772 6.2772 7.4532 7.4532 7.9406 7.9406 8.0415 8.0415 8.3941 8.3941 8.7676 8.7676 8.9108 8.9108 8.9962 8.9962 9.3390 9.3390 9.3815 9.3815 9.6713 9.6713 10.0348 10.0348 10.5777 10.5777 10.6584 10.6584 k = 0.1597 0.3008 0.8217 ( 8968 PWs) bands (ev): -68.8464 -68.8464 -68.8464 -68.8464 -38.6168 -38.6168 -38.6167 -38.6167 -37.4560 -37.4560 -37.4556 -37.4556 -37.3582 -37.3582 -37.3578 -37.3578 -17.6097 -17.6097 -4.4560 -4.4560 -2.6561 -2.6561 -2.4056 -2.4056 0.9018 0.9018 2.3405 2.3405 6.1499 6.1499 6.2622 6.2622 7.4464 7.4464 7.9558 7.9558 8.0549 8.0549 8.3938 8.3938 8.7691 8.7691 8.9015 8.9015 8.9957 8.9957 9.3477 9.3477 9.3885 9.3885 9.6714 9.6714 9.9955 9.9955 10.5588 10.5588 10.6371 10.6371 k = 0.1667 0.2887 0.8357 ( 8970 PWs) bands (ev): -68.8465 -68.8465 -68.8465 -68.8465 -38.6168 -38.6168 -38.6167 -38.6167 -37.4560 -37.4560 -37.4557 -37.4557 -37.3582 -37.3582 -37.3578 -37.3578 -17.6091 -17.6091 -4.4568 -4.4568 -2.6547 -2.6547 -2.4071 -2.4071 0.8838 0.8838 2.3621 2.3621 6.1377 6.1377 6.2453 6.2453 7.4398 7.4398 7.9725 7.9725 8.0677 8.0677 8.3914 8.3914 8.7720 8.7720 8.8908 8.8908 8.9954 8.9954 9.3579 9.3579 9.3969 9.3969 9.6707 9.6707 9.9567 9.9567 10.5425 10.5425 10.6161 10.6161 k = 0.1736 0.2766 0.8496 ( 8966 PWs) bands (ev): -68.8463 -68.8463 -68.8463 -68.8463 -38.6168 -38.6168 -38.6167 -38.6167 -37.4560 -37.4560 -37.4557 -37.4557 -37.3582 -37.3582 -37.3578 -37.3578 -17.6085 -17.6085 -4.4576 -4.4576 -2.6537 -2.6537 -2.4082 -2.4082 0.8665 0.8665 2.3831 2.3831 6.1268 6.1268 6.2280 6.2280 7.4339 7.4339 7.9901 7.9901 8.0806 8.0806 8.3878 8.3878 8.7758 8.7758 8.8802 8.8802 8.9964 8.9964 9.3675 9.3675 9.4074 9.4074 9.6686 9.6686 9.9196 9.9196 10.5328 10.5328 10.6004 10.6004 k = 0.1806 0.2645 0.8635 ( 8962 PWs) bands (ev): -68.8461 -68.8461 -68.8461 -68.8461 -38.6168 -38.6168 -38.6167 -38.6167 -37.4561 -37.4561 -37.4557 -37.4557 -37.3582 -37.3582 -37.3577 -37.3577 -17.6079 -17.6079 -4.4584 -4.4584 -2.6530 -2.6530 -2.4087 -2.4087 0.8502 0.8502 2.4031 2.4031 6.1164 6.1164 6.2098 6.2098 7.4288 7.4288 8.0084 8.0084 8.0926 8.0926 8.3843 8.3843 8.7811 8.7811 8.8707 8.8707 8.9970 8.9970 9.3792 9.3792 9.4186 9.4186 9.6658 9.6658 9.8831 9.8831 10.5236 10.5236 10.5841 10.5841 k = 0.1875 0.2525 0.8774 ( 8958 PWs) bands (ev): -68.8459 -68.8459 -68.8459 -68.8459 -38.6168 -38.6168 -38.6167 -38.6167 -37.4561 -37.4561 -37.4557 -37.4557 -37.3581 -37.3581 -37.3577 -37.3577 -17.6073 -17.6073 -4.4592 -4.4592 -2.6525 -2.6525 -2.4089 -2.4089 0.8349 0.8349 2.4220 2.4220 6.1069 6.1069 6.1918 6.1918 7.4240 7.4240 8.0265 8.0265 8.1042 8.1042 8.3800 8.3800 8.7861 8.7861 8.8611 8.8611 8.9975 8.9975 9.3919 9.3919 9.4324 9.4324 9.6607 9.6607 9.8485 9.8485 10.5169 10.5169 10.5691 10.5691 k = 0.1944 0.2404 0.8914 ( 8960 PWs) bands (ev): -68.8460 -68.8460 -68.8460 -68.8460 -38.6168 -38.6168 -38.6167 -38.6167 -37.4561 -37.4561 -37.4558 -37.4558 -37.3581 -37.3581 -37.3576 -37.3576 -17.6068 -17.6068 -4.4600 -4.4600 -2.6523 -2.6523 -2.4087 -2.4087 0.8208 0.8208 2.4395 2.4395 6.0980 6.0980 6.1744 6.1744 7.4202 7.4202 8.0431 8.0431 8.1134 8.1134 8.3761 8.3761 8.7901 8.7901 8.8510 8.8510 8.9965 8.9965 9.4047 9.4047 9.4434 9.4434 9.6547 9.6547 9.8122 9.8122 10.5125 10.5125 10.5581 10.5581 k = 0.2014 0.2283 0.9053 ( 8964 PWs) bands (ev): -68.8462 -68.8462 -68.8462 -68.8462 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4558 -37.4558 -37.3581 -37.3581 -37.3576 -37.3576 -17.6064 -17.6064 -4.4607 -4.4607 -2.6522 -2.6522 -2.4083 -2.4083 0.8080 0.8080 2.4556 2.4556 6.0895 6.0895 6.1585 6.1585 7.4167 7.4167 8.0586 8.0586 8.1226 8.1226 8.3704 8.3704 8.7936 8.7936 8.8416 8.8416 8.9955 8.9955 9.4184 9.4184 9.4566 9.4566 9.6468 9.6468 9.7780 9.7780 10.5096 10.5096 10.5464 10.5464 k = 0.2083 0.2162 0.9192 ( 8958 PWs) bands (ev): -68.8459 -68.8459 -68.8459 -68.8459 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4558 -37.4558 -37.3581 -37.3581 -37.3576 -37.3576 -17.6060 -17.6060 -4.4613 -4.4613 -2.6523 -2.6523 -2.4078 -2.4078 0.7968 0.7968 2.4699 2.4699 6.0817 6.0817 6.1445 6.1445 7.4141 7.4141 8.0727 8.0727 8.1317 8.1317 8.3665 8.3665 8.7985 8.7985 8.8352 8.8352 8.9946 8.9946 9.4347 9.4347 9.4717 9.4717 9.6389 9.6389 9.7457 9.7457 10.5093 10.5093 10.5390 10.5390 k = 0.2153 0.2042 0.9332 ( 8962 PWs) bands (ev): -68.8461 -68.8461 -68.8461 -68.8461 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4558 -37.4558 -37.3580 -37.3580 -37.3576 -37.3576 -17.6057 -17.6057 -4.4619 -4.4619 -2.6524 -2.6524 -2.4072 -2.4072 0.7870 0.7870 2.4824 2.4824 6.0740 6.0740 6.1326 6.1326 7.4119 7.4119 8.0847 8.0847 8.1400 8.1400 8.3621 8.3621 8.8015 8.8015 8.8285 8.8285 8.9934 8.9934 9.4504 9.4504 9.4858 9.4858 9.6279 9.6279 9.7133 9.7133 10.5071 10.5071 10.5300 10.5300 k = 0.2222 0.1921 0.9471 ( 8966 PWs) bands (ev): -68.8464 -68.8464 -68.8464 -68.8464 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3576 -37.3576 -17.6054 -17.6054 -4.4624 -4.4624 -2.6526 -2.6526 -2.4065 -2.4065 0.7789 0.7789 2.4928 2.4928 6.0671 6.0671 6.1233 6.1233 7.4102 7.4102 8.0941 8.0941 8.1474 8.1474 8.3580 8.3580 8.8026 8.8026 8.8220 8.8220 8.9921 8.9921 9.4671 9.4671 9.5010 9.5010 9.6152 9.6152 9.6827 9.6827 10.5071 10.5071 10.5242 10.5242 k = 0.2292 0.1800 0.9610 ( 8966 PWs) bands (ev): -68.8464 -68.8464 -68.8464 -68.8464 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3576 -37.3576 -17.6052 -17.6052 -4.4628 -4.4628 -2.6528 -2.6528 -2.4060 -2.4060 0.7725 0.7725 2.5011 2.5011 6.0611 6.0611 6.1163 6.1163 7.4091 7.4091 8.1012 8.1012 8.1537 8.1537 8.3552 8.3552 8.8047 8.8047 8.8192 8.8192 8.9918 8.9918 9.4852 9.4852 9.5167 9.5167 9.6021 9.6021 9.6539 9.6539 10.5067 10.5067 10.5190 10.5190 k = 0.2361 0.1679 0.9749 ( 8964 PWs) bands (ev): -68.8463 -68.8463 -68.8463 -68.8463 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6050 -17.6050 -4.4630 -4.4630 -2.6529 -2.6529 -2.4056 -2.4056 0.7679 0.7679 2.5071 2.5071 6.0566 6.0566 6.1117 6.1117 7.4082 7.4082 8.1067 8.1067 8.1594 8.1594 8.3523 8.3523 8.8045 8.8045 8.8168 8.8168 8.9901 8.9901 9.5038 9.5038 9.5344 9.5344 9.5873 9.5873 9.6304 9.6304 10.5082 10.5082 10.5175 10.5175 k = 0.2431 0.1559 0.9889 ( 8960 PWs) bands (ev): -68.8461 -68.8461 -68.8460 -68.8460 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4632 -4.4632 -2.6530 -2.6530 -2.4053 -2.4053 0.7651 0.7651 2.5107 2.5107 6.0538 6.0538 6.1092 6.1092 7.4078 7.4078 8.1097 8.1097 8.1626 8.1626 8.3514 8.3514 8.8048 8.8048 8.8166 8.8166 8.9904 8.9904 9.5214 9.5214 9.5492 9.5492 9.5742 9.5742 9.6090 9.6090 10.5098 10.5098 10.5173 10.5173 k = 0.2500 0.1438 1.0028 ( 8968 PWs) bands (ev): -68.8465 -68.8465 -68.8465 -68.8465 -38.6169 -38.6169 -38.6168 -38.6168 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6530 -2.6530 -2.4052 -2.4052 0.7642 0.7642 2.5120 2.5120 6.0527 6.0527 6.1081 6.1081 7.4077 7.4077 8.1099 8.1099 8.1628 8.1628 8.3516 8.3516 8.8027 8.8027 8.8146 8.8146 8.9912 8.9912 9.5292 9.5292 9.5528 9.5528 9.5676 9.5676 9.5966 9.5966 10.5080 10.5080 10.5150 10.5150 k = 0.2500 0.1438 1.0028 ( 8968 PWs) bands (ev): -68.8465 -68.8465 -68.8465 -68.8465 -38.6169 -38.6169 -38.6168 -38.6168 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6530 -2.6530 -2.4052 -2.4052 0.7642 0.7642 2.5120 2.5120 6.0527 6.0527 6.1081 6.1081 7.4077 7.4077 8.1099 8.1099 8.1628 8.1628 8.3516 8.3516 8.8027 8.8027 8.8146 8.8146 8.9912 8.9912 9.5292 9.5292 9.5528 9.5528 9.5676 9.5676 9.5966 9.5966 10.5080 10.5080 10.5150 10.5150 k = 0.2647 0.1523 0.9930 ( 8959 PWs) bands (ev): -68.8462 -68.8462 -68.8458 -68.8458 -38.6168 -38.6168 -38.6167 -38.6167 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6530 -2.6530 -2.4052 -2.4052 0.7644 0.7644 2.5118 2.5118 6.0483 6.0483 6.1136 6.1136 7.4063 7.4063 8.1102 8.1102 8.1638 8.1638 8.3527 8.3527 8.8043 8.8043 8.8163 8.8163 8.9908 8.9908 9.5248 9.5248 9.5535 9.5535 9.5694 9.5694 9.6047 9.6047 10.5097 10.5097 10.5183 10.5183 k = 0.2794 0.1607 0.9833 ( 8957 PWs) bands (ev): -68.8464 -68.8464 -68.8454 -68.8454 -38.6168 -38.6168 -38.6167 -38.6167 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4632 -4.4632 -2.6530 -2.6530 -2.4053 -2.4053 0.7650 0.7650 2.5112 2.5112 6.0384 6.0384 6.1258 6.1258 7.4023 7.4023 8.1083 8.1083 8.1632 8.1632 8.3566 8.3566 8.8062 8.8062 8.8179 8.8179 8.9905 8.9905 9.5090 9.5090 9.5527 9.5527 9.5769 9.5769 9.6166 9.6166 10.5092 10.5092 10.5180 10.5180 k = 0.2941 0.1692 0.9735 ( 8955 PWs) bands (ev): -68.8458 -68.8458 -68.8457 -68.8457 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4558 -37.4558 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4631 -4.4631 -2.6530 -2.6530 -2.4054 -2.4054 0.7659 0.7659 2.5100 2.5100 6.0278 6.0278 6.1411 6.1411 7.3957 7.3957 8.1047 8.1047 8.1628 8.1628 8.3635 8.3635 8.8074 8.8074 8.8184 8.8184 8.9901 8.9901 9.4890 9.4890 9.5544 9.5544 9.5858 9.5858 9.6281 9.6281 10.5074 10.5074 10.5213 10.5213 k = 0.3088 0.1776 0.9638 ( 8954 PWs) bands (ev): -68.8462 -68.8462 -68.8452 -68.8452 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4558 -37.4558 -37.3580 -37.3580 -37.3575 -37.3575 -17.6050 -17.6050 -4.4630 -4.4630 -2.6529 -2.6529 -2.4056 -2.4056 0.7674 0.7674 2.5081 2.5081 6.0179 6.0179 6.1579 6.1579 7.3868 7.3868 8.1003 8.1003 8.1620 8.1620 8.3714 8.3714 8.8079 8.8079 8.8188 8.8188 8.9890 8.9890 9.4678 9.4678 9.5530 9.5530 9.5987 9.5987 9.6428 9.6428 10.5074 10.5074 10.5214 10.5214 k = 0.3235 0.1861 0.9540 ( 8952 PWs) bands (ev): -68.8460 -68.8460 -68.8451 -68.8451 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4558 -37.4558 -37.3580 -37.3580 -37.3575 -37.3575 -17.6051 -17.6051 -4.4629 -4.4629 -2.6528 -2.6528 -2.4058 -2.4058 0.7693 0.7693 2.5054 2.5054 6.0105 6.0105 6.1755 6.1755 7.3761 7.3761 8.0936 8.0936 8.1615 8.1615 8.3829 8.3829 8.8083 8.8083 8.8197 8.8197 8.9884 8.9884 9.4462 9.4462 9.5525 9.5525 9.6108 9.6108 9.6551 9.6551 10.5057 10.5057 10.5229 10.5229 k = 0.3382 0.1946 0.9442 ( 8946 PWs) bands (ev): -68.8456 -68.8456 -68.8449 -68.8449 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4557 -37.4557 -37.3580 -37.3580 -37.3575 -37.3575 -17.6052 -17.6052 -4.4628 -4.4628 -2.6527 -2.6527 -2.4061 -2.4061 0.7718 0.7718 2.5018 2.5018 6.0055 6.0055 6.1934 6.1934 7.3637 7.3637 8.0866 8.0866 8.1608 8.1608 8.3952 8.3952 8.8111 8.8111 8.8212 8.8212 8.9874 8.9874 9.4250 9.4250 9.5521 9.5521 9.6236 9.6236 9.6694 9.6694 10.5035 10.5035 10.5259 10.5259 k = 0.3529 0.2030 0.9345 ( 8947 PWs) bands (ev): -68.8457 -68.8457 -68.8449 -68.8449 -38.6169 -38.6169 -38.6166 -38.6166 -37.4564 -37.4564 -37.4557 -37.4557 -37.3580 -37.3580 -37.3575 -37.3575 -17.6053 -17.6053 -4.4626 -4.4626 -2.6525 -2.6525 -2.4065 -2.4065 0.7748 0.7748 2.4972 2.4972 6.0035 6.0035 6.2114 6.2114 7.3501 7.3501 8.0776 8.0776 8.1598 8.1598 8.4076 8.4076 8.8096 8.8096 8.8209 8.8209 8.9843 8.9843 9.4047 9.4047 9.5537 9.5537 9.6372 9.6372 9.6823 9.6823 10.5015 10.5015 10.5253 10.5253 k = 0.3676 0.2115 0.9247 ( 8945 PWs) bands (ev): -68.8454 -68.8454 -68.8449 -68.8449 -38.6170 -38.6170 -38.6166 -38.6166 -37.4564 -37.4564 -37.4556 -37.4556 -37.3580 -37.3580 -37.3576 -37.3576 -17.6054 -17.6054 -4.4624 -4.4624 -2.6523 -2.6523 -2.4070 -2.4070 0.7784 0.7784 2.4915 2.4915 6.0047 6.0047 6.2291 6.2291 7.3359 7.3359 8.0675 8.0675 8.1584 8.1584 8.4215 8.4215 8.8104 8.8104 8.8203 8.8203 8.9813 8.9813 9.3855 9.3855 9.5538 9.5538 9.6522 9.6522 9.6955 9.6955 10.4987 10.4987 10.5250 10.5250 k = 0.3824 0.2199 0.9150 ( 8944 PWs) bands (ev): -68.8451 -68.8451 -68.8451 -68.8451 -38.6170 -38.6170 -38.6166 -38.6166 -37.4565 -37.4565 -37.4555 -37.4555 -37.3580 -37.3580 -37.3576 -37.3576 -17.6055 -17.6055 -4.4622 -4.4622 -2.6520 -2.6520 -2.4076 -2.4076 0.7825 0.7825 2.4845 2.4845 6.0094 6.0094 6.2461 6.2461 7.3214 7.3214 8.0557 8.0557 8.1572 8.1572 8.4357 8.4357 8.8095 8.8095 8.8180 8.8180 8.9754 8.9754 9.3690 9.3690 9.5543 9.5543 9.6695 9.6695 9.7080 9.7080 10.4971 10.4971 10.5253 10.5253 k = 0.3971 0.2284 0.9052 ( 8953 PWs) bands (ev): -68.8461 -68.8461 -68.8450 -68.8450 -38.6170 -38.6170 -38.6165 -38.6165 -37.4566 -37.4566 -37.4555 -37.4555 -37.3580 -37.3580 -37.3576 -37.3576 -17.6056 -17.6056 -4.4619 -4.4619 -2.6517 -2.6517 -2.4082 -2.4082 0.7873 0.7873 2.4765 2.4765 6.0175 6.0175 6.2625 6.2625 7.3072 7.3072 8.0416 8.0416 8.1553 8.1553 8.4502 8.4502 8.8067 8.8067 8.8149 8.8149 8.9693 8.9693 9.3517 9.3517 9.5542 9.5542 9.6823 9.6823 9.7170 9.7170 10.4919 10.4919 10.5244 10.5244 k = 0.4118 0.2369 0.8955 ( 8960 PWs) bands (ev): -68.8463 -68.8463 -68.8456 -68.8456 -38.6171 -38.6171 -38.6165 -38.6165 -37.4566 -37.4566 -37.4554 -37.4554 -37.3580 -37.3580 -37.3577 -37.3577 -17.6058 -17.6058 -4.4616 -4.4616 -2.6514 -2.6514 -2.4090 -2.4090 0.7926 0.7926 2.4672 2.4672 6.0289 6.0289 6.2785 6.2785 7.2936 7.2936 8.0267 8.0267 8.1524 8.1524 8.4636 8.4636 8.8034 8.8034 8.8156 8.8156 8.9639 8.9639 9.3344 9.3344 9.5507 9.5507 9.6965 9.6965 9.7273 9.7273 10.4895 10.4895 10.5217 10.5217 k = 0.4265 0.2453 0.8857 ( 8964 PWs) bands (ev): -68.8465 -68.8465 -68.8458 -68.8458 -38.6171 -38.6171 -38.6164 -38.6164 -37.4567 -37.4567 -37.4553 -37.4553 -37.3580 -37.3580 -37.3577 -37.3577 -17.6060 -17.6060 -4.4613 -4.4613 -2.6510 -2.6510 -2.4098 -2.4098 0.7985 0.7985 2.4569 2.4569 6.0437 6.0437 6.2934 6.2934 7.2809 7.2809 8.0116 8.0116 8.1497 8.1497 8.4769 8.4769 8.8002 8.8002 8.8157 8.8157 8.9564 8.9564 9.3202 9.3202 9.5464 9.5464 9.7116 9.7116 9.7407 9.7407 10.4868 10.4868 10.5201 10.5201 k = 0.4412 0.2538 0.8759 ( 8963 PWs) bands (ev): -68.8461 -68.8461 -68.8461 -68.8461 -38.6172 -38.6172 -38.6164 -38.6164 -37.4568 -37.4568 -37.4552 -37.4552 -37.3580 -37.3580 -37.3577 -37.3577 -17.6062 -17.6062 -4.4610 -4.4610 -2.6505 -2.6505 -2.4107 -2.4107 0.8050 0.8050 2.4456 2.4456 6.0609 6.0609 6.3077 6.3077 7.2695 7.2695 7.9961 7.9961 8.1467 8.1467 8.4889 8.4889 8.7955 8.7955 8.8179 8.8179 8.9511 8.9511 9.3082 9.3082 9.5473 9.5473 9.7262 9.7262 9.7570 9.7570 10.4839 10.4839 10.5149 10.5149 k = 0.4559 0.2622 0.8662 ( 8965 PWs) bands (ev): -68.8470 -68.8470 -68.8455 -68.8455 -38.6172 -38.6172 -38.6163 -38.6163 -37.4569 -37.4569 -37.4551 -37.4551 -37.3580 -37.3580 -37.3578 -37.3578 -17.6064 -17.6064 -4.4606 -4.4606 -2.6500 -2.6500 -2.4116 -2.4116 0.8119 0.8119 2.4332 2.4332 6.0816 6.0816 6.3205 6.3205 7.2594 7.2594 7.9785 7.9785 8.1440 8.1440 8.5008 8.5008 8.7900 8.7900 8.8167 8.8167 8.9407 8.9407 9.2992 9.2992 9.5512 9.5512 9.7359 9.7359 9.7737 9.7737 10.4821 10.4821 10.5146 10.5146 k = 0.4706 0.2707 0.8564 ( 8956 PWs) bands (ev): -68.8463 -68.8463 -68.8452 -68.8452 -38.6173 -38.6173 -38.6162 -38.6162 -37.4569 -37.4569 -37.4550 -37.4550 -37.3579 -37.3579 -37.3578 -37.3578 -17.6066 -17.6066 -4.4602 -4.4602 -2.6495 -2.6495 -2.4126 -2.4126 0.8194 0.8194 2.4201 2.4201 6.1047 6.1047 6.3332 6.3332 7.2511 7.2511 7.9618 7.9618 8.1399 8.1399 8.5117 8.5117 8.7861 8.7861 8.8171 8.8171 8.9361 8.9361 9.2896 9.2896 9.5526 9.5526 9.7474 9.7474 9.7949 9.7949 10.4828 10.4828 10.5158 10.5158 k = 0.4853 0.2791 0.8467 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6173 -38.6173 -38.6162 -38.6162 -37.4570 -37.4570 -37.4549 -37.4549 -37.3579 -37.3579 -37.3578 -37.3578 -17.6068 -17.6068 -4.4597 -4.4597 -2.6489 -2.6489 -2.4136 -2.4136 0.8272 0.8272 2.4063 2.4063 6.1299 6.1299 6.3442 6.3442 7.2444 7.2444 7.9439 7.9439 8.1356 8.1356 8.5192 8.5192 8.7773 8.7773 8.8196 8.8196 8.9297 8.9297 9.2818 9.2818 9.5518 9.5518 9.7554 9.7554 9.8153 9.8153 10.4812 10.4812 10.5155 10.5155 k = 0.5000 0.2876 0.8369 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6174 -38.6174 -38.6161 -38.6161 -37.4571 -37.4571 -37.4547 -37.4547 -37.3579 -37.3579 -37.3579 -37.3579 -17.6071 -17.6071 -4.4593 -4.4593 -2.6482 -2.6482 -2.4147 -2.4147 0.8354 0.8354 2.3920 2.3920 6.1562 6.1562 6.3542 6.3542 7.2397 7.2397 7.9262 7.9262 8.1316 8.1316 8.5244 8.5244 8.7699 8.7699 8.8192 8.8192 8.9220 8.9220 9.2778 9.2778 9.5513 9.5513 9.7632 9.7632 9.8402 9.8402 10.4803 10.4803 10.5156 10.5156 k = 0.5000 0.2876 0.8369 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6174 -38.6174 -38.6161 -38.6161 -37.4571 -37.4571 -37.4547 -37.4547 -37.3579 -37.3579 -37.3579 -37.3579 -17.6071 -17.6071 -4.4593 -4.4593 -2.6482 -2.6482 -2.4147 -2.4147 0.8354 0.8354 2.3920 2.3920 6.1562 6.1562 6.3542 6.3542 7.2397 7.2397 7.9262 7.9262 8.1316 8.1316 8.5244 8.5244 8.7699 8.7699 8.8192 8.8192 8.9220 8.9220 9.2778 9.2778 9.5513 9.5513 9.7632 9.7632 9.8402 9.8402 10.4803 10.4803 10.5156 10.5156 k = 0.5000 0.2876 0.8170 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6175 -38.6175 -38.6160 -38.6160 -37.4573 -37.4573 -37.4545 -37.4545 -37.3579 -37.3579 -37.3579 -37.3579 -17.6076 -17.6076 -4.4582 -4.4582 -2.6467 -2.6467 -2.4170 -2.4170 0.8531 0.8531 2.3614 2.3614 6.2132 6.2132 6.3748 6.3748 7.2313 7.2313 7.8883 7.8883 8.1213 8.1213 8.5357 8.5357 8.7562 8.7562 8.8237 8.8237 8.9081 8.9081 9.2683 9.2683 9.5498 9.5498 9.7771 9.7771 9.8892 9.8892 10.4790 10.4790 10.5165 10.5165 k = 0.5000 0.2876 0.7970 ( 8958 PWs) bands (ev): -68.8463 -68.8463 -68.8454 -68.8454 -38.6177 -38.6177 -38.6158 -38.6158 -37.4575 -37.4575 -37.4542 -37.4542 -37.3580 -37.3580 -37.3579 -37.3579 -17.6082 -17.6082 -4.4570 -4.4570 -2.6449 -2.6449 -2.4195 -2.4195 0.8718 0.8718 2.3291 2.3291 6.2730 6.2730 6.3979 6.3979 7.2216 7.2216 7.8481 7.8481 8.1104 8.1104 8.5464 8.5464 8.7395 8.7395 8.8335 8.8335 8.8945 8.8945 9.2614 9.2614 9.5463 9.5463 9.7935 9.7935 9.9429 9.9429 10.4783 10.4783 10.5166 10.5166 k = 0.5000 0.2876 0.7771 ( 8950 PWs) bands (ev): -68.8459 -68.8459 -68.8450 -68.8450 -38.6178 -38.6178 -38.6156 -38.6156 -37.4578 -37.4578 -37.4538 -37.4538 -37.3580 -37.3580 -37.3579 -37.3579 -17.6089 -17.6089 -4.4557 -4.4557 -2.6429 -2.6429 -2.4221 -2.4221 0.8913 0.8913 2.2953 2.2953 6.3358 6.3358 6.4241 6.4241 7.2105 7.2105 7.8071 7.8071 8.0989 8.0989 8.5604 8.5604 8.7239 8.7239 8.8428 8.8428 8.8799 8.8799 9.2591 9.2591 9.5448 9.5448 9.8152 9.8152 9.9971 9.9971 10.4791 10.4791 10.5199 10.5199 k = 0.5000 0.2876 0.7572 ( 8952 PWs) bands (ev): -68.8466 -68.8466 -68.8445 -68.8445 -38.6180 -38.6180 -38.6154 -38.6154 -37.4580 -37.4580 -37.4535 -37.4535 -37.3581 -37.3581 -37.3579 -37.3579 -17.6096 -17.6096 -4.4542 -4.4542 -2.6405 -2.6405 -2.4247 -2.4247 0.9113 0.9113 2.2606 2.2606 6.3980 6.3980 6.4550 6.4550 7.1978 7.1978 7.7664 7.7664 8.0852 8.0852 8.5752 8.5752 8.7046 8.7046 8.8505 8.8505 8.8639 8.8639 9.2535 9.2535 9.5420 9.5420 9.8423 9.8423 10.0527 10.0527 10.4796 10.4796 10.5227 10.5227 k = 0.5000 0.2876 0.7373 ( 8954 PWs) bands (ev): -68.8475 -68.8475 -68.8438 -68.8438 -38.6182 -38.6182 -38.6152 -38.6152 -37.4583 -37.4583 -37.4532 -37.4532 -37.3582 -37.3582 -37.3579 -37.3579 -17.6103 -17.6103 -4.4525 -4.4525 -2.6377 -2.6377 -2.4275 -2.4275 0.9314 0.9314 2.2253 2.2253 6.4527 6.4527 6.4973 6.4973 7.1828 7.1828 7.7257 7.7257 8.0714 8.0714 8.5885 8.5885 8.6849 8.6849 8.8453 8.8453 8.8622 8.8622 9.2500 9.2500 9.5390 9.5390 9.8708 9.8708 10.1128 10.1128 10.4826 10.4826 10.5279 10.5279 k = 0.5000 0.2876 0.7173 ( 8952 PWs) bands (ev): -68.8469 -68.8469 -68.8442 -68.8442 -38.6184 -38.6184 -38.6150 -38.6150 -37.4586 -37.4586 -37.4527 -37.4527 -37.3583 -37.3583 -37.3579 -37.3579 -17.6111 -17.6111 -4.4507 -4.4507 -2.6345 -2.6345 -2.4303 -2.4303 0.9515 0.9515 2.1896 2.1896 6.4939 6.4939 6.5573 6.5573 7.1655 7.1655 7.6867 7.6867 8.0562 8.0562 8.6095 8.6095 8.6663 8.6663 8.8309 8.8309 8.8670 8.8670 9.2489 9.2489 9.5372 9.5372 9.9027 9.9027 10.1711 10.1711 10.4853 10.4853 10.5362 10.5362 k = 0.5000 0.2876 0.6974 ( 8952 PWs) bands (ev): -68.8470 -68.8470 -68.8441 -68.8441 -38.6186 -38.6186 -38.6147 -38.6147 -37.4590 -37.4590 -37.4523 -37.4523 -37.3584 -37.3584 -37.3579 -37.3579 -17.6120 -17.6120 -4.4488 -4.4488 -2.6310 -2.6310 -2.4332 -2.4332 0.9709 0.9709 2.1539 2.1539 6.5295 6.5295 6.6245 6.6245 7.1456 7.1456 7.6505 7.6505 8.0410 8.0410 8.6186 8.6186 8.6539 8.6539 8.8158 8.8158 8.8753 8.8753 9.2516 9.2516 9.5348 9.5348 9.9382 9.9382 10.2328 10.2328 10.4885 10.4885 10.5471 10.5471 k = 0.5000 0.2876 0.6775 ( 8952 PWs) bands (ev): -68.8470 -68.8470 -68.8441 -68.8441 -38.6188 -38.6188 -38.6145 -38.6145 -37.4593 -37.4593 -37.4519 -37.4519 -37.3585 -37.3585 -37.3578 -37.3578 -17.6128 -17.6128 -4.4466 -4.4466 -2.6270 -2.6270 -2.4361 -2.4361 0.9896 0.9896 2.1183 2.1183 6.5650 6.5650 6.6935 6.6935 7.1231 7.1231 7.6180 7.6180 8.0252 8.0252 8.6098 8.6098 8.6607 8.6607 8.7999 8.7999 8.8844 8.8844 9.2564 9.2564 9.5321 9.5321 9.9773 9.9773 10.2965 10.2965 10.4914 10.4914 10.5613 10.5613 k = 0.5000 0.2876 0.6576 ( 8952 PWs) bands (ev): -68.8467 -68.8467 -68.8445 -68.8445 -38.6191 -38.6191 -38.6142 -38.6142 -37.4597 -37.4597 -37.4514 -37.4514 -37.3586 -37.3586 -37.3578 -37.3578 -17.6137 -17.6137 -4.4443 -4.4443 -2.6225 -2.6225 -2.4389 -2.4389 1.0071 1.0071 2.0832 2.0832 6.6013 6.6013 6.7628 6.7628 7.0974 7.0974 7.5887 7.5887 8.0091 8.0091 8.5900 8.5900 8.6823 8.6823 8.7841 8.7841 8.8959 8.8959 9.2636 9.2636 9.5295 9.5295 10.0156 10.0156 10.3623 10.3623 10.4926 10.4926 10.5790 10.5790 k = 0.5000 0.2876 0.6376 ( 8954 PWs) bands (ev): -68.8469 -68.8469 -68.8444 -68.8444 -38.6193 -38.6193 -38.6140 -38.6140 -37.4601 -37.4601 -37.4510 -37.4510 -37.3587 -37.3587 -37.3578 -37.3578 -17.6147 -17.6147 -4.4419 -4.4419 -2.6176 -2.6176 -2.4417 -2.4417 1.0231 1.0231 2.0487 2.0487 6.6392 6.6392 6.8294 6.8294 7.0699 7.0699 7.5653 7.5653 7.9928 7.9928 8.5669 8.5669 8.7036 8.7036 8.7677 8.7677 8.9064 8.9064 9.2754 9.2754 9.5272 9.5272 10.0614 10.0614 10.4300 10.4300 10.4945 10.4945 10.5980 10.5980 k = 0.5000 0.2876 0.6177 ( 8946 PWs) bands (ev): -68.8470 -68.8470 -68.8434 -68.8434 -38.6195 -38.6195 -38.6137 -38.6137 -37.4605 -37.4605 -37.4504 -37.4504 -37.3588 -37.3588 -37.3578 -37.3578 -17.6157 -17.6157 -4.4393 -4.4393 -2.6121 -2.6121 -2.4445 -2.4445 1.0373 1.0373 2.0150 2.0150 6.6787 6.6787 6.8956 6.8956 7.0408 7.0408 7.5471 7.5471 7.9768 7.9768 8.5404 8.5404 8.7294 8.7294 8.7498 8.7498 8.9242 8.9242 9.2886 9.2886 9.5260 9.5260 10.1110 10.1110 10.4961 10.4961 10.5033 10.5033 10.6239 10.6239 k = 0.5000 0.2876 0.5978 ( 8942 PWs) bands (ev): -68.8470 -68.8470 -68.8430 -68.8430 -38.6198 -38.6198 -38.6134 -38.6134 -37.4608 -37.4608 -37.4500 -37.4500 -37.3589 -37.3589 -37.3577 -37.3577 -17.6167 -17.6167 -4.4365 -4.4365 -2.6062 -2.6062 -2.4471 -2.4471 1.0496 1.0496 1.9822 1.9822 6.7192 6.7192 6.9579 6.9579 7.0112 7.0112 7.5343 7.5343 7.9611 7.9611 8.5183 8.5183 8.7297 8.7297 8.7583 8.7583 8.9368 8.9368 9.3009 9.3009 9.5230 9.5230 10.1643 10.1643 10.4999 10.4999 10.5748 10.5748 10.6529 10.6529 k = 0.5000 0.2876 0.5779 ( 8950 PWs) bands (ev): -68.8475 -68.8475 -68.8433 -68.8433 -38.6201 -38.6201 -38.6131 -38.6131 -37.4613 -37.4613 -37.4495 -37.4495 -37.3590 -37.3590 -37.3577 -37.3577 -17.6177 -17.6177 -4.4336 -4.4336 -2.5999 -2.5999 -2.4497 -2.4497 1.0595 1.0595 1.9504 1.9504 6.7610 6.7610 6.9768 6.9768 7.0212 7.0212 7.5258 7.5258 7.9433 7.9433 8.4960 8.4960 8.7135 8.7135 8.7847 8.7847 8.9465 8.9465 9.3124 9.3124 9.5167 9.5167 10.2185 10.2185 10.4982 10.4982 10.6464 10.6464 10.6858 10.6858 k = 0.5000 0.2876 0.5579 ( 8946 PWs) bands (ev): -68.8476 -68.8476 -68.8428 -68.8428 -38.6203 -38.6203 -38.6128 -38.6128 -37.4617 -37.4617 -37.4490 -37.4490 -37.3591 -37.3591 -37.3577 -37.3577 -17.6187 -17.6187 -4.4306 -4.4306 -2.5930 -2.5930 -2.4521 -2.4521 1.0669 1.0669 1.9198 1.9198 6.8048 6.8048 6.9469 6.9469 7.0769 7.0769 7.5220 7.5220 7.9260 7.9260 8.4751 8.4751 8.6969 8.6969 8.8143 8.8143 8.9597 8.9597 9.3263 9.3263 9.5145 9.5145 10.2751 10.2751 10.5022 10.5022 10.7158 10.7158 10.7281 10.7281 k = 0.5000 0.2876 0.5380 ( 8938 PWs) bands (ev): -68.8468 -68.8468 -68.8428 -68.8428 -38.6206 -38.6206 -38.6125 -38.6125 -37.4621 -37.4621 -37.4484 -37.4484 -37.3592 -37.3592 -37.3576 -37.3576 -17.6198 -17.6198 -4.4274 -4.4274 -2.5857 -2.5857 -2.4543 -2.4543 1.0716 1.0716 1.8905 1.8905 6.8494 6.8494 6.9168 6.9168 7.1297 7.1297 7.5221 7.5221 7.9091 7.9091 8.4573 8.4573 8.6815 8.6815 8.8446 8.8446 8.9720 8.9720 9.3468 9.3468 9.5157 9.5157 10.3315 10.3315 10.5036 10.5036 10.7611 10.7611 10.8002 10.8002 k = 0.5000 0.2876 0.5181 ( 8956 PWs) bands (ev): -68.8484 -68.8484 -68.8431 -68.8431 -38.6208 -38.6208 -38.6123 -38.6123 -37.4625 -37.4625 -37.4480 -37.4480 -37.3593 -37.3593 -37.3576 -37.3576 -17.6209 -17.6209 -4.4241 -4.4241 -2.5780 -2.5780 -2.4562 -2.4562 1.0734 1.0734 1.8624 1.8624 6.8825 6.8825 6.9004 6.9004 7.1766 7.1766 7.5260 7.5260 7.8906 7.8906 8.4331 8.4331 8.6612 8.6612 8.8743 8.8743 8.9829 8.9829 9.3608 9.3608 9.5126 9.5126 10.3874 10.3874 10.5041 10.5041 10.8021 10.8021 10.8760 10.8760 k = 0.5000 0.2876 0.4982 ( 8946 PWs) bands (ev): -68.8476 -68.8476 -68.8428 -68.8428 -38.6211 -38.6211 -38.6120 -38.6120 -37.4630 -37.4630 -37.4474 -37.4474 -37.3594 -37.3594 -37.3576 -37.3576 -17.6219 -17.6219 -4.4207 -4.4207 -2.5700 -2.5700 -2.4579 -2.4579 1.0725 1.0725 1.8357 1.8357 6.8584 6.8584 6.9443 6.9443 7.2221 7.2221 7.5346 7.5346 7.8747 7.8747 8.4147 8.4147 8.6488 8.6488 8.9087 8.9087 8.9922 8.9922 9.3834 9.3834 9.5124 9.5124 10.4408 10.4408 10.5106 10.5106 10.8497 10.8497 10.9577 10.9577 k = 0.5000 0.2876 0.4782 ( 8950 PWs) bands (ev): -68.8481 -68.8481 -68.8428 -68.8428 -38.6214 -38.6214 -38.6117 -38.6117 -37.4634 -37.4634 -37.4469 -37.4469 -37.3595 -37.3595 -37.3575 -37.3575 -17.6230 -17.6230 -4.4172 -4.4172 -2.5617 -2.5617 -2.4592 -2.4592 1.0685 1.0685 1.8103 1.8103 6.8330 6.8330 6.9926 6.9926 7.2630 7.2630 7.5464 7.5464 7.8565 7.8565 8.3974 8.3974 8.6304 8.6304 8.9412 8.9412 9.0031 9.0031 9.4003 9.4003 9.5130 9.5130 10.4744 10.4744 10.5350 10.5350 10.8986 10.8986 11.0375 11.0375 k = 0.5000 0.2876 0.4583 ( 8950 PWs) bands (ev): -68.8481 -68.8481 -68.8427 -68.8427 -38.6216 -38.6216 -38.6114 -38.6114 -37.4638 -37.4638 -37.4464 -37.4464 -37.3596 -37.3596 -37.3575 -37.3575 -17.6241 -17.6241 -4.4136 -4.4136 -2.5533 -2.5533 -2.4600 -2.4600 1.0617 1.0617 1.7863 1.7863 6.8092 6.8092 7.0419 7.0419 7.2999 7.2999 7.5615 7.5615 7.8397 7.8397 8.3812 8.3812 8.6127 8.6127 8.9785 8.9785 9.0124 9.0124 9.4181 9.4181 9.5153 9.5153 10.4832 10.4832 10.5817 10.5817 10.9485 10.9485 11.1208 11.1208 k = 0.5000 0.2876 0.4384 ( 8958 PWs) bands (ev): -68.8486 -68.8486 -68.8431 -68.8431 -38.6219 -38.6219 -38.6111 -38.6111 -37.4643 -37.4643 -37.4459 -37.4459 -37.3597 -37.3597 -37.3574 -37.3574 -17.6251 -17.6251 -4.4100 -4.4100 -2.5449 -2.5449 -2.4602 -2.4602 1.0520 1.0520 1.7636 1.7636 6.7871 6.7871 7.0925 7.0925 7.3320 7.3320 7.5792 7.5792 7.8216 7.8216 8.3613 8.3613 8.5944 8.5944 9.0158 9.0158 9.0225 9.0225 9.4349 9.4349 9.5202 9.5202 10.4857 10.4857 10.6316 10.6316 10.9985 10.9985 11.2035 11.2035 k = 0.5000 0.2876 0.4185 ( 8946 PWs) bands (ev): -68.8483 -68.8483 -68.8422 -68.8422 -38.6222 -38.6222 -38.6108 -38.6108 -37.4647 -37.4647 -37.4454 -37.4454 -37.3598 -37.3598 -37.3574 -37.3574 -17.6262 -17.6262 -4.4063 -4.4063 -2.5368 -2.5368 -2.4596 -2.4596 1.0397 1.0397 1.7423 1.7423 6.7676 6.7676 7.1438 7.1438 7.3620 7.3620 7.6013 7.6013 7.8072 7.8072 8.3472 8.3472 8.5763 8.5763 9.0296 9.0296 9.0620 9.0620 9.4544 9.4544 9.5280 9.5280 10.4871 10.4871 10.6819 10.6819 11.0497 11.0497 11.2922 11.2922 k = 0.5000 0.2876 0.3985 ( 8958 PWs) bands (ev): -68.8496 -68.8496 -68.8422 -68.8422 -38.6224 -38.6224 -38.6106 -38.6106 -37.4651 -37.4651 -37.4450 -37.4450 -37.3598 -37.3598 -37.3574 -37.3574 -17.6272 -17.6272 -4.4026 -4.4026 -2.5292 -2.5292 -2.4579 -2.4579 1.0247 1.0247 1.7223 1.7223 6.7499 6.7499 7.1957 7.1957 7.3875 7.3875 7.6256 7.6256 7.7916 7.7916 8.3298 8.3298 8.5566 8.5566 9.0327 9.0327 9.0992 9.0992 9.4694 9.4694 9.5343 9.5343 10.4844 10.4844 10.7261 10.7261 11.0995 11.0995 11.3803 11.3803 k = 0.5000 0.2876 0.3786 ( 8954 PWs) bands (ev): -68.8492 -68.8492 -68.8421 -68.8421 -38.6227 -38.6227 -38.6103 -38.6103 -37.4655 -37.4655 -37.4445 -37.4445 -37.3599 -37.3599 -37.3573 -37.3573 -17.6283 -17.6283 -4.3989 -4.3989 -2.5225 -2.5225 -2.4548 -2.4548 1.0075 1.0075 1.7036 1.7036 6.7339 6.7339 7.2484 7.2484 7.4108 7.4108 7.6532 7.6532 7.7754 7.7754 8.3180 8.3180 8.5370 8.5370 9.0354 9.0354 9.1440 9.1440 9.4902 9.4902 9.5476 9.5476 10.4819 10.4819 10.7642 10.7642 11.1481 11.1481 11.4685 11.4685 k = 0.5000 0.2876 0.3587 ( 8954 PWs) bands (ev): -68.8489 -68.8489 -68.8425 -68.8425 -38.6229 -38.6229 -38.6100 -38.6100 -37.4659 -37.4659 -37.4440 -37.4440 -37.3600 -37.3600 -37.3572 -37.3572 -17.6292 -17.6292 -4.3952 -4.3952 -2.5169 -2.5169 -2.4502 -2.4502 0.9882 0.9882 1.6861 1.6861 6.7200 6.7200 7.3017 7.3017 7.4317 7.4317 7.6836 7.6836 7.7602 7.7602 8.3062 8.3062 8.5184 8.5184 9.0292 9.0292 9.1891 9.1891 9.5123 9.5123 9.5633 9.5633 10.4761 10.4761 10.7947 10.7947 11.1955 11.1955 11.5588 11.5588 k = 0.5000 0.2876 0.3387 ( 8946 PWs) bands (ev): -68.8480 -68.8480 -68.8424 -68.8424 -38.6232 -38.6232 -38.6097 -38.6097 -37.4663 -37.4663 -37.4435 -37.4435 -37.3601 -37.3601 -37.3572 -37.3572 -17.6302 -17.6302 -4.3916 -4.3916 -2.5126 -2.5126 -2.4439 -2.4439 0.9672 0.9672 1.6699 1.6699 6.7077 6.7077 7.3553 7.3553 7.4509 7.4509 7.7161 7.7161 7.7466 7.7466 8.3021 8.3021 8.4998 8.4998 9.0219 9.0219 9.2349 9.2349 9.5337 9.5337 9.5801 9.5801 10.4708 10.4708 10.8161 10.8161 11.2406 11.2406 11.6512 11.6512 k = 0.5000 0.2876 0.3188 ( 8946 PWs) bands (ev): -68.8481 -68.8481 -68.8424 -68.8424 -38.6234 -38.6234 -38.6095 -38.6095 -37.4667 -37.4667 -37.4431 -37.4431 -37.3602 -37.3602 -37.3571 -37.3571 -17.6312 -17.6312 -4.3880 -4.3880 -2.5095 -2.5095 -2.4362 -2.4362 0.9446 0.9446 1.6549 1.6549 6.6964 6.6964 7.4090 7.4090 7.4681 7.4681 7.7339 7.7339 7.7522 7.7522 8.2906 8.2906 8.4781 8.4781 9.0099 9.0099 9.2841 9.2841 9.5538 9.5538 9.5994 9.5994 10.4650 10.4650 10.8272 10.8272 11.2825 11.2825 11.7468 11.7468 k = 0.5000 0.2876 0.2989 ( 8938 PWs) bands (ev): -68.8473 -68.8473 -68.8423 -68.8423 -38.6236 -38.6236 -38.6092 -38.6092 -37.4671 -37.4671 -37.4426 -37.4426 -37.3602 -37.3602 -37.3571 -37.3571 -17.6321 -17.6321 -4.3846 -4.3846 -2.5074 -2.5074 -2.4273 -2.4273 0.9210 0.9210 1.6411 1.6411 6.6870 6.6870 7.4608 7.4608 7.4865 7.4865 7.7196 7.7196 7.7886 7.7886 8.2838 8.2838 8.4573 8.4573 8.9977 8.9977 9.3346 9.3346 9.5784 9.5784 9.6236 9.6236 10.4583 10.4583 10.8300 10.8300 11.3223 11.3223 11.8386 11.8386 k = 0.5000 0.2876 0.2790 ( 8934 PWs) bands (ev): -68.8482 -68.8482 -68.8410 -68.8410 -38.6238 -38.6238 -38.6090 -38.6090 -37.4674 -37.4674 -37.4423 -37.4423 -37.3603 -37.3603 -37.3570 -37.3570 -17.6329 -17.6329 -4.3812 -4.3812 -2.5060 -2.5060 -2.4175 -2.4175 0.8966 0.8966 1.6283 1.6283 6.6806 6.6806 7.4930 7.4930 7.5246 7.5246 7.7101 7.7101 7.8270 7.8270 8.2741 8.2741 8.4345 8.4345 8.9804 8.9804 9.3824 9.3824 9.5969 9.5969 9.6438 9.6438 10.4516 10.4516 10.8248 10.8248 11.3595 11.3595 11.9356 11.9356 k = 0.5000 0.2876 0.2590 ( 8936 PWs) bands (ev): -68.8487 -68.8487 -68.8407 -68.8407 -38.6240 -38.6240 -38.6088 -38.6088 -37.4677 -37.4677 -37.4419 -37.4419 -37.3603 -37.3603 -37.3570 -37.3570 -17.6337 -17.6337 -4.3780 -4.3780 -2.5052 -2.5052 -2.4072 -2.4072 0.8717 0.8717 1.6166 1.6166 6.6734 6.6734 7.5085 7.5085 7.5779 7.5779 7.6989 7.6989 7.8654 7.8654 8.2624 8.2624 8.4142 8.4142 8.9594 8.9594 9.4317 9.4317 9.6163 9.6163 9.6683 9.6683 10.4432 10.4432 10.8095 10.8095 11.3937 11.3937 11.8778 11.8778 k = 0.5000 0.2876 0.2391 ( 8944 PWs) bands (ev): -68.8488 -68.8488 -68.8416 -68.8416 -38.6242 -38.6242 -38.6086 -38.6086 -37.4681 -37.4681 -37.4416 -37.4416 -37.3604 -37.3604 -37.3570 -37.3570 -17.6345 -17.6345 -4.3749 -4.3749 -2.5047 -2.5047 -2.3967 -2.3967 0.8468 0.8468 1.6061 1.6061 6.6665 6.6665 7.5212 7.5212 7.6328 7.6328 7.6858 7.6858 7.9042 7.9042 8.2551 8.2551 8.3918 8.3918 8.9330 8.9330 9.4833 9.4833 9.6361 9.6361 9.6936 9.6936 10.4300 10.4300 10.7872 10.7872 11.4243 11.4243 11.7980 11.7980 k = 0.5000 0.2876 0.2192 ( 8940 PWs) bands (ev): -68.8480 -68.8480 -68.8420 -68.8420 -38.6244 -38.6244 -38.6084 -38.6084 -37.4684 -37.4684 -37.4412 -37.4412 -37.3604 -37.3604 -37.3569 -37.3569 -17.6352 -17.6352 -4.3720 -4.3720 -2.5044 -2.5044 -2.3862 -2.3862 0.8222 0.8222 1.5965 1.5965 6.6606 6.6606 7.5330 7.5330 7.6747 7.6747 7.6889 7.6889 7.9438 7.9438 8.2499 8.2499 8.3698 8.3698 8.9055 8.9055 9.5395 9.5395 9.6554 9.6554 9.7249 9.7249 10.4159 10.4159 10.7611 10.7611 11.4521 11.4521 11.7241 11.7241 k = 0.5000 0.2876 0.1993 ( 8942 PWs) bands (ev): -68.8483 -68.8483 -68.8420 -68.8420 -38.6246 -38.6246 -38.6082 -38.6082 -37.4687 -37.4687 -37.4409 -37.4409 -37.3605 -37.3605 -37.3568 -37.3568 -17.6359 -17.6359 -4.3693 -4.3693 -2.5043 -2.5043 -2.3759 -2.3759 0.7983 0.7983 1.5879 1.5879 6.6561 6.6561 7.5445 7.5445 7.6658 7.6658 7.7437 7.7437 7.9823 7.9823 8.2445 8.2445 8.3476 8.3476 8.8747 8.8747 9.5918 9.5918 9.6693 9.6693 9.7546 9.7546 10.4016 10.4016 10.7306 10.7306 11.4772 11.4772 11.6559 11.6559 k = 0.5000 0.2876 0.1793 ( 8932 PWs) bands (ev): -68.8477 -68.8477 -68.8415 -68.8415 -38.6247 -38.6247 -38.6080 -38.6080 -37.4689 -37.4689 -37.4406 -37.4406 -37.3605 -37.3605 -37.3568 -37.3568 -17.6365 -17.6365 -4.3668 -4.3668 -2.5043 -2.5043 -2.3660 -2.3660 0.7754 0.7754 1.5803 1.5803 6.6520 6.6520 7.5557 7.5557 7.6579 7.6579 7.7984 7.7984 8.0203 8.0203 8.2398 8.2398 8.3270 8.3270 8.8428 8.8428 9.6454 9.6454 9.6894 9.6894 9.7891 9.7891 10.3896 10.3896 10.6977 10.6977 11.5002 11.5002 11.5947 11.5947 k = 0.5000 0.2876 0.1594 ( 8928 PWs) bands (ev): -68.8477 -68.8477 -68.8411 -68.8411 -38.6249 -38.6249 -38.6079 -38.6079 -37.4691 -37.4691 -37.4404 -37.4404 -37.3605 -37.3605 -37.3567 -37.3567 -17.6371 -17.6371 -4.3645 -4.3645 -2.5043 -2.5043 -2.3566 -2.3566 0.7539 0.7539 1.5736 1.5736 6.6485 6.6485 7.5683 7.5683 7.6510 7.6510 7.8522 7.8522 8.0560 8.0560 8.2342 8.2342 8.3067 8.3067 8.8078 8.8078 9.6860 9.6860 9.7149 9.7149 9.8231 9.8231 10.3735 10.3735 10.6622 10.6622 11.5196 11.5196 11.5402 11.5402 k = 0.5000 0.2876 0.1395 ( 8940 PWs) bands (ev): -68.8486 -68.8486 -68.8415 -68.8415 -38.6250 -38.6250 -38.6078 -38.6078 -37.4693 -37.4693 -37.4402 -37.4402 -37.3606 -37.3606 -37.3567 -37.3567 -17.6376 -17.6376 -4.3625 -4.3625 -2.5043 -2.5043 -2.3480 -2.3480 0.7340 0.7340 1.5676 1.5676 6.6453 6.6453 7.5778 7.5778 7.6424 7.6424 7.9041 7.9041 8.0890 8.0890 8.2288 8.2288 8.2850 8.2850 8.7704 8.7704 9.7022 9.7022 9.7557 9.7557 9.8557 9.8557 10.3539 10.3539 10.6249 10.6249 11.4882 11.4882 11.5384 11.5384 k = 0.5000 0.2876 0.1196 ( 8948 PWs) bands (ev): -68.8491 -68.8491 -68.8419 -68.8419 -38.6251 -38.6251 -38.6077 -38.6077 -37.4695 -37.4695 -37.4400 -37.4400 -37.3606 -37.3606 -37.3567 -37.3567 -17.6380 -17.6380 -4.3607 -4.3607 -2.5044 -2.5044 -2.3402 -2.3402 0.7162 0.7162 1.5626 1.5626 6.6419 6.6419 7.5856 7.5856 7.6363 7.6363 7.9540 7.9540 8.1202 8.1202 8.2224 8.2224 8.2658 8.2658 8.7321 8.7321 9.7135 9.7135 9.8023 9.8023 9.8903 9.8903 10.3347 10.3347 10.5878 10.5878 11.4452 11.4452 11.5525 11.5525 k = 0.5000 0.2876 0.0996 ( 8960 PWs) bands (ev): -68.8495 -68.8495 -68.8427 -68.8427 -38.6252 -38.6252 -38.6076 -38.6076 -37.4697 -37.4697 -37.4398 -37.4398 -37.3607 -37.3607 -37.3567 -37.3567 -17.6384 -17.6384 -4.3592 -4.3592 -2.5045 -2.5045 -2.3333 -2.3333 0.7006 0.7006 1.5584 1.5584 6.6381 6.6381 7.5924 7.5924 7.6306 7.6306 8.0000 8.0000 8.1487 8.1487 8.2181 8.2181 8.2498 8.2498 8.6925 8.6925 9.7215 9.7215 9.8454 9.8454 9.9237 9.9237 10.3130 10.3130 10.5511 10.5511 11.4079 11.4079 11.5651 11.5651 k = 0.5000 0.2876 0.0797 ( 8950 PWs) bands (ev): -68.8493 -68.8493 -68.8418 -68.8418 -38.6253 -38.6253 -38.6075 -38.6075 -37.4698 -37.4698 -37.4397 -37.4397 -37.3607 -37.3607 -37.3567 -37.3567 -17.6387 -17.6387 -4.3579 -4.3579 -2.5045 -2.5045 -2.3276 -2.3276 0.6876 0.6876 1.5550 1.5550 6.6396 6.6396 7.5987 7.5987 7.6281 7.6281 8.0417 8.0417 8.1747 8.1747 8.2176 8.2176 8.2379 8.2379 8.6565 8.6565 9.7280 9.7280 9.8852 9.8852 9.9594 9.9594 10.2934 10.2934 10.5186 10.5186 11.3797 11.3797 11.5761 11.5761 k = 0.5000 0.2876 0.0598 ( 8942 PWs) bands (ev): -68.8494 -68.8494 -68.8410 -68.8410 -38.6253 -38.6253 -38.6074 -38.6074 -37.4699 -37.4699 -37.4396 -37.4396 -37.3607 -37.3607 -37.3566 -37.3566 -17.6389 -17.6389 -4.3569 -4.3569 -2.5046 -2.5046 -2.3230 -2.3230 0.6772 0.6772 1.5524 1.5524 6.6386 6.6386 7.6043 7.6043 7.6282 7.6282 8.0759 8.0759 8.1921 8.1921 8.2187 8.2187 8.2282 8.2282 8.6226 8.6226 9.7393 9.7393 9.9174 9.9174 9.9927 9.9927 10.2794 10.2794 10.4880 10.4880 11.3580 11.3580 11.5847 11.5847 k = 0.5000 0.2876 0.0399 ( 8938 PWs) bands (ev): -68.8498 -68.8498 -68.8401 -68.8401 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6391 -17.6391 -4.3562 -4.3562 -2.5046 -2.5046 -2.3197 -2.3197 0.6697 0.6697 1.5505 1.5505 6.6379 6.6379 7.6083 7.6083 7.6315 7.6315 8.1008 8.1008 8.1967 8.1967 8.2203 8.2203 8.2326 8.2326 8.5926 8.5926 9.7417 9.7417 9.9412 9.9412 10.0195 10.0195 10.2676 10.2676 10.4629 10.4629 11.3415 11.3415 11.5903 11.5903 k = 0.5000 0.2876 0.0199 ( 8934 PWs) bands (ev): -68.8505 -68.8505 -68.8390 -68.8390 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6392 -17.6392 -4.3558 -4.3558 -2.5046 -2.5046 -2.3177 -2.3177 0.6652 0.6652 1.5494 1.5494 6.6402 6.6402 7.6103 7.6103 7.6325 7.6325 8.1160 8.1160 8.1954 8.1954 8.2145 8.2145 8.2466 8.2466 8.5734 8.5734 9.7376 9.7376 9.9579 9.9579 10.0390 10.0390 10.2595 10.2595 10.4473 10.4473 11.3331 11.3331 11.5923 11.5923 k = 0.5000 0.2876 0.0000 ( 8934 PWs) bands (ev): -68.8505 -68.8505 -68.8390 -68.8390 -38.6254 -38.6254 -38.6074 -38.6074 -37.4699 -37.4699 -37.4395 -37.4395 -37.3606 -37.3606 -37.3566 -37.3566 -17.6393 -17.6393 -4.3556 -4.3556 -2.5046 -2.5046 -2.3170 -2.3170 0.6636 0.6636 1.5490 1.5490 6.6401 6.6401 7.6106 7.6106 7.6327 7.6327 8.1209 8.1209 8.1953 8.1953 8.2131 8.2131 8.2522 8.2522 8.5658 8.5658 9.7385 9.7385 9.9634 9.9634 10.0458 10.0458 10.2555 10.2555 10.4413 10.4413 11.3298 11.3298 11.5935 11.5935 k = 0.0000 0.0000 1.0028 ( 8954 PWs) bands (ev): -68.8469 -68.8469 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4047 -2.4047 0.7580 0.7580 2.5292 2.5292 5.9101 5.9101 6.2719 6.2719 7.2707 7.2707 8.0912 8.0912 8.1728 8.1728 8.4786 8.4786 8.7950 8.7950 8.8337 8.8337 8.9850 8.9850 9.3922 9.3922 9.5553 9.5553 9.5608 9.5608 9.7361 9.7361 10.4907 10.4907 10.5324 10.5324 k = 0.0167 0.0096 1.0028 ( 8950 PWs) bands (ev): -68.8465 -68.8465 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4047 -2.4047 0.7580 0.7580 2.5290 2.5290 5.9111 5.9111 6.2707 6.2707 7.2720 7.2720 8.0911 8.0911 8.1730 8.1730 8.4789 8.4789 8.7980 8.7980 8.8303 8.8303 8.9843 8.9843 9.3939 9.3939 9.5557 9.5557 9.5642 9.5642 9.7347 9.7347 10.4940 10.4940 10.5323 10.5323 k = 0.0333 0.0192 1.0028 ( 8946 PWs) bands (ev): -68.8469 -68.8469 -68.8433 -68.8433 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4048 -2.4048 0.7583 0.7583 2.5284 2.5284 5.9139 5.9139 6.2671 6.2671 7.2760 7.2760 8.0909 8.0909 8.1735 8.1735 8.4773 8.4773 8.8004 8.8004 8.8292 8.8292 8.9831 8.9831 9.3988 9.3988 9.5590 9.5590 9.5640 9.5640 9.7309 9.7309 10.4937 10.4937 10.5337 10.5337 k = 0.0500 0.0288 1.0028 ( 8934 PWs) bands (ev): -68.8463 -68.8463 -68.8427 -68.8427 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3574 -37.3574 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4048 -2.4048 0.7586 0.7586 2.5275 2.5275 5.9183 5.9183 6.2620 6.2620 7.2826 7.2826 8.0929 8.0929 8.1735 8.1735 8.4742 8.4742 8.8017 8.8017 8.8308 8.8308 8.9849 8.9849 9.4042 9.4042 9.5598 9.5598 9.5671 9.5671 9.7293 9.7293 10.4957 10.4957 10.5340 10.5340 k = 0.0667 0.0383 1.0028 ( 8940 PWs) bands (ev): -68.8459 -68.8459 -68.8438 -68.8438 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4048 -2.4048 0.7591 0.7591 2.5264 2.5264 5.9242 5.9242 6.2546 6.2546 7.2914 7.2914 8.0940 8.0940 8.1728 8.1728 8.4642 8.4642 8.8031 8.8031 8.8282 8.8282 8.9879 8.9879 9.4100 9.4100 9.5586 9.5586 9.5613 9.5613 9.7238 9.7238 10.4967 10.4967 10.5302 10.5302 k = 0.0833 0.0479 1.0028 ( 8952 PWs) bands (ev): -68.8468 -68.8468 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6532 -2.6532 -2.4048 -2.4048 0.7595 0.7595 2.5249 2.5249 5.9317 5.9317 6.2450 6.2450 7.3021 7.3021 8.0952 8.0952 8.1722 8.1722 8.4509 8.4509 8.8000 8.8000 8.8264 8.8264 8.9880 8.9880 9.4182 9.4182 9.5524 9.5524 9.5605 9.5605 9.7163 9.7163 10.4941 10.4941 10.5306 10.5306 k = 0.1000 0.0575 1.0028 ( 8960 PWs) bands (ev): -68.8473 -68.8473 -68.8446 -68.8446 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4049 -2.4049 0.7601 0.7601 2.5232 2.5232 5.9407 5.9407 6.2338 6.2338 7.3145 7.3145 8.0955 8.0955 8.1714 8.1714 8.4376 8.4376 8.7996 8.7996 8.8248 8.8248 8.9877 8.9877 9.4278 9.4278 9.5511 9.5511 9.5595 9.5595 9.7047 9.7047 10.4943 10.4943 10.5294 10.5294 k = 0.1167 0.0671 1.0028 ( 8956 PWs) bands (ev): -68.8473 -68.8473 -68.8442 -68.8442 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3581 -37.3581 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4049 -2.4049 0.7608 0.7608 2.5215 2.5215 5.9518 5.9518 6.2211 6.2211 7.3282 7.3282 8.0973 8.0973 8.1711 8.1711 8.4262 8.4262 8.7997 8.7997 8.8241 8.8241 8.9884 8.9884 9.4407 9.4407 9.5504 9.5504 9.5606 9.5606 9.6945 9.6945 10.4958 10.4958 10.5313 10.5313 k = 0.1333 0.0767 1.0028 ( 8964 PWs) bands (ev): -68.8471 -68.8471 -68.8453 -68.8453 -38.6168 -38.6168 -38.6168 -38.6168 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4050 -2.4050 0.7614 0.7614 2.5195 2.5195 5.9627 5.9627 6.2066 6.2066 7.3423 7.3423 8.0986 8.0986 8.1693 8.1693 8.4104 8.4104 8.8056 8.8056 8.8229 8.8229 8.9855 8.9855 9.4510 9.4510 9.5506 9.5506 9.5613 9.5613 9.6815 9.6815 10.5009 10.5009 10.5229 10.5229 k = 0.1500 0.0863 1.0028 ( 8956 PWs) bands (ev): -68.8458 -68.8458 -68.8457 -68.8457 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4050 -2.4050 0.7620 0.7620 2.5179 2.5179 5.9757 5.9757 6.1916 6.1916 7.3566 7.3566 8.1010 8.1010 8.1683 8.1683 8.3967 8.3967 8.8067 8.8067 8.8199 8.8199 8.9890 8.9890 9.4648 9.4648 9.5582 9.5582 9.5631 9.5631 9.6699 9.6699 10.5054 10.5054 10.5208 10.5208 k = 0.1667 0.0959 1.0028 ( 8960 PWs) bands (ev): -68.8462 -68.8462 -68.8458 -68.8458 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4051 -2.4051 0.7626 0.7626 2.5162 2.5162 5.9898 5.9898 6.1755 6.1755 7.3702 7.3702 8.1032 8.1032 8.1672 8.1672 8.3843 8.3843 8.8066 8.8066 8.8193 8.8193 8.9892 8.9892 9.4790 9.4790 9.5561 9.5561 9.5602 9.5602 9.6564 9.6564 10.5069 10.5069 10.5177 10.5177 k = 0.1833 0.1055 1.0028 ( 8948 PWs) bands (ev): -68.8458 -68.8458 -68.8450 -68.8450 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4051 -2.4051 0.7632 0.7632 2.5148 2.5148 6.0047 6.0047 6.1590 6.1590 7.3827 7.3827 8.1063 8.1063 8.1665 8.1665 8.3736 8.3736 8.8074 8.8074 8.8193 8.8193 8.9907 8.9907 9.4943 9.4943 9.5611 9.5611 9.5651 9.5651 9.6451 9.6451 10.5096 10.5096 10.5181 10.5181 k = 0.2000 0.1150 1.0028 ( 8948 PWs) bands (ev): -68.8454 -68.8454 -68.8454 -68.8454 -38.6168 -38.6168 -38.6167 -38.6167 -37.4562 -37.4562 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4051 -2.4051 0.7636 0.7636 2.5136 2.5136 6.0200 6.0200 6.1423 6.1423 7.3932 7.3932 8.1082 8.1082 8.1656 8.1656 8.3646 8.3646 8.8064 8.8064 8.8204 8.8204 8.9911 8.9911 9.5088 9.5088 9.5588 9.5588 9.5670 9.5670 9.6306 9.6306 10.5091 10.5091 10.5177 10.5177 k = 0.2167 0.1246 1.0028 ( 8956 PWs) bands (ev): -68.8462 -68.8462 -68.8454 -68.8454 -38.6169 -38.6169 -38.6167 -38.6167 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4052 -2.4052 0.7639 0.7639 2.5127 2.5127 6.0348 6.0348 6.1265 6.1265 7.4010 7.4010 8.1095 8.1095 8.1645 8.1645 8.3564 8.3564 8.8064 8.8064 8.8190 8.8190 8.9902 8.9902 9.5198 9.5198 9.5581 9.5581 9.5635 9.5635 9.6165 9.6165 10.5094 10.5094 10.5156 10.5156 k = 0.2333 0.1342 1.0028 ( 8970 PWs) bands (ev): -68.8469 -68.8469 -68.8463 -68.8463 -38.6169 -38.6169 -38.6168 -38.6168 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6531 -2.6531 -2.4052 -2.4052 0.7641 0.7641 2.5121 2.5121 6.0472 6.0472 6.1133 6.1133 7.4060 7.4060 8.1096 8.1096 8.1629 8.1629 8.3521 8.3521 8.8038 8.8038 8.8155 8.8155 8.9901 8.9901 9.5260 9.5260 9.5524 9.5524 9.5652 9.5652 9.6023 9.6023 10.5072 10.5072 10.5141 10.5141 k = 0.2500 0.1438 1.0028 ( 8968 PWs) bands (ev): -68.8465 -68.8465 -68.8465 -68.8465 -38.6169 -38.6169 -38.6168 -38.6168 -37.4563 -37.4563 -37.4559 -37.4559 -37.3580 -37.3580 -37.3575 -37.3575 -17.6049 -17.6049 -4.4633 -4.4633 -2.6530 -2.6530 -2.4052 -2.4052 0.7642 0.7642 2.5120 2.5120 6.0527 6.0527 6.1081 6.1081 7.4077 7.4077 8.1099 8.1099 8.1628 8.1628 8.3516 8.3516 8.8027 8.8027 8.8146 8.8146 8.9912 8.9912 9.5292 9.5292 9.5528 9.5528 9.5676 9.5676 9.5966 9.5966 10.5080 10.5080 10.5150 10.5150 Writing output data file BaxMnGex2.save init_run : 0.29s CPU 0.49s WALL ( 1 calls) electrons : 308.09s CPU 311.55s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 308.09s CPU 311.54s 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 : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.13s WALL ( 326 calls) cegterg : 276.82s CPU 279.40s WALL ( 326 calls) Called by sum_band: Called by *egterg: h_psi : 215.05s CPU 217.02s WALL ( 5226 calls) s_psi : 5.23s CPU 5.15s WALL ( 5226 calls) g_psi : 0.56s CPU 0.51s WALL ( 4574 calls) cdiaghg : 47.38s CPU 47.99s WALL ( 4900 calls) cegterg:over : 11.78s CPU 11.87s WALL ( 4574 calls) cegterg:upda : 12.22s CPU 12.43s WALL ( 4574 calls) cegterg:last : 5.76s CPU 5.75s WALL ( 979 calls) cdiaghg:chol : 2.82s CPU 2.78s WALL ( 4900 calls) cdiaghg:inve : 1.87s CPU 1.97s WALL ( 4900 calls) cdiaghg:para : 3.09s CPU 3.22s WALL ( 9800 calls) Called by h_psi: h_psi:vloc : 200.18s CPU 202.09s WALL ( 5226 calls) h_psi:vnl : 14.32s CPU 14.45s WALL ( 5226 calls) add_vuspsi : 7.09s CPU 7.17s WALL ( 5226 calls) General routines calbec : 7.22s CPU 7.25s WALL ( 5226 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 189.83s CPU 191.69s WALL ( 797524 calls) davcio : 0.30s CPU 0.42s WALL ( 652 calls) Parallel routines fft_scatter : 58.31s CPU 58.41s WALL ( 797539 calls) PWSCF : 5m36.62s CPU 5m58.23s WALL This run was terminated on: 14: 5:15 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=