Program PWSCF v.5.4.0 starts on 10Feb2017 at 15:46: 9 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./ZnCu2GeSe4.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 95 63 18 2517 1363 207 Max 96 64 19 2519 1378 209 Sum 3433 2289 649 90651 49425 7497 bravais-lattice index = 14 lattice parameter (alat) = 12.8524 a.u. unit-cell volume = 1173.3166 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 62.00 number of Kohn-Sham states= 74 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 276.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.852381 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.659806 celldm(5)= -0.659806 celldm(6)= 0.319613 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.319613 0.947548 0.000000 ) a(3) = ( -0.659806 -0.473774 0.583261 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.337305 0.857249 ) b(2) = ( 0.000000 1.055355 0.857249 ) b(3) = ( 0.000000 0.000000 1.714498 ) 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 Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Se 6.00 78.96000 Se( 1.00) Cu 11.00 63.54600 Cu( 1.00) Zn 12.00 65.40900 Zn( 1.00) 2 Sym. Ops. (no 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 inv. 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 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 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 s 2 inv. 180 deg rotation - cart. axis [0,0,1] -s -2 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 276 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 2) = ( 0.0000000 0.0000000 0.0214312), wk = 0.0036232 k( 3) = ( 0.0000000 0.0000000 0.0428624), wk = 0.0036232 k( 4) = ( 0.0000000 0.0000000 0.0642937), wk = 0.0036232 k( 5) = ( 0.0000000 0.0000000 0.0857249), wk = 0.0036232 k( 6) = ( 0.0000000 0.0000000 0.1071561), wk = 0.0036232 k( 7) = ( 0.0000000 0.0000000 0.1285873), wk = 0.0036232 k( 8) = ( 0.0000000 0.0000000 0.1500185), wk = 0.0036232 k( 9) = ( 0.0000000 0.0000000 0.1714498), wk = 0.0036232 k( 10) = ( 0.0000000 0.0000000 0.1928810), wk = 0.0036232 k( 11) = ( 0.0000000 0.0000000 0.2143122), wk = 0.0036232 k( 12) = ( 0.0000000 0.0000000 0.2357434), wk = 0.0036232 k( 13) = ( 0.0000000 0.0000000 0.2571746), wk = 0.0036232 k( 14) = ( 0.0000000 0.0000000 0.2786059), wk = 0.0036232 k( 15) = ( 0.0000000 0.0000000 0.3000371), wk = 0.0036232 k( 16) = ( 0.0000000 0.0000000 0.3214683), wk = 0.0036232 k( 17) = ( 0.0000000 0.0000000 0.3428995), wk = 0.0036232 k( 18) = ( 0.0000000 0.0000000 0.3643307), wk = 0.0036232 k( 19) = ( 0.0000000 0.0000000 0.3857620), wk = 0.0036232 k( 20) = ( 0.0000000 0.0000000 0.4071932), wk = 0.0036232 k( 21) = ( 0.0000000 0.0000000 0.4286244), wk = 0.0036232 k( 22) = ( 0.0000000 0.0000000 0.4500556), wk = 0.0036232 k( 23) = ( 0.0000000 0.0000000 0.4714868), wk = 0.0036232 k( 24) = ( 0.0000000 0.0000000 0.4929181), wk = 0.0036232 k( 25) = ( 0.0000000 0.0000000 0.5143493), wk = 0.0036232 k( 26) = ( 0.0000000 0.0000000 0.5357805), wk = 0.0036232 k( 27) = ( 0.0000000 0.0000000 0.5572117), wk = 0.0036232 k( 28) = ( 0.0000000 0.0000000 0.5786429), wk = 0.0036232 k( 29) = ( 0.0000000 0.0000000 0.6000742), wk = 0.0036232 k( 30) = ( 0.0000000 0.0000000 0.6215054), wk = 0.0036232 k( 31) = ( 0.0000000 0.0000000 0.6429366), wk = 0.0036232 k( 32) = ( 0.0000000 0.0000000 0.6643678), wk = 0.0036232 k( 33) = ( 0.0000000 0.0000000 0.6857990), wk = 0.0036232 k( 34) = ( 0.0000000 0.0000000 0.7072303), wk = 0.0036232 k( 35) = ( 0.0000000 0.0000000 0.7286615), wk = 0.0036232 k( 36) = ( 0.0000000 0.0000000 0.7500927), wk = 0.0036232 k( 37) = ( 0.0000000 0.0000000 0.7715239), wk = 0.0036232 k( 38) = ( 0.0000000 0.0000000 0.7929551), wk = 0.0036232 k( 39) = ( 0.0000000 0.0000000 0.8143864), wk = 0.0036232 k( 40) = ( 0.0000000 0.0000000 0.8358176), wk = 0.0036232 k( 41) = ( 0.0000000 0.0000000 0.8572488), wk = 0.0036232 k( 42) = ( 0.0000000 0.0000000 0.8572488), wk = 0.0036232 k( 43) = ( -0.0117181 0.0163193 0.8572488), wk = 0.0036232 k( 44) = ( -0.0234362 0.0326386 0.8572488), wk = 0.0036232 k( 45) = ( -0.0351543 0.0489580 0.8572488), wk = 0.0036232 k( 46) = ( -0.0468724 0.0652773 0.8572488), wk = 0.0036232 k( 47) = ( -0.0585905 0.0815966 0.8572488), wk = 0.0036232 k( 48) = ( -0.0703086 0.0979159 0.8572488), wk = 0.0036232 k( 49) = ( -0.0820267 0.1142353 0.8572488), wk = 0.0036232 k( 50) = ( -0.0937448 0.1305546 0.8572488), wk = 0.0036232 k( 51) = ( -0.1054629 0.1468739 0.8572488), wk = 0.0036232 k( 52) = ( -0.1171810 0.1631933 0.8572488), wk = 0.0036232 k( 53) = ( -0.1288991 0.1795126 0.8572488), wk = 0.0036232 k( 54) = ( -0.1288991 0.1795126 0.8572488), wk = 0.0036232 k( 55) = ( -0.1377348 0.1918178 0.8420999), wk = 0.0036232 k( 56) = ( -0.1465705 0.2041229 0.8269511), wk = 0.0036232 k( 57) = ( -0.1554063 0.2164281 0.8118022), wk = 0.0036232 k( 58) = ( -0.1642420 0.2287333 0.7966534), wk = 0.0036232 k( 59) = ( -0.1730778 0.2410385 0.7815046), wk = 0.0036232 k( 60) = ( -0.1819135 0.2533436 0.7663557), wk = 0.0036232 k( 61) = ( -0.1907492 0.2656488 0.7512068), wk = 0.0036232 k( 62) = ( -0.1995850 0.2779540 0.7360580), wk = 0.0036232 k( 63) = ( -0.2084207 0.2902592 0.7209092), wk = 0.0036232 k( 64) = ( -0.2172564 0.3025643 0.7057603), wk = 0.0036232 k( 65) = ( -0.2260922 0.3148695 0.6906115), wk = 0.0036232 k( 66) = ( -0.2349279 0.3271747 0.6754626), wk = 0.0036232 k( 67) = ( -0.2437636 0.3394799 0.6603138), wk = 0.0036232 k( 68) = ( -0.2525994 0.3517851 0.6451649), wk = 0.0036232 k( 69) = ( -0.2614351 0.3640902 0.6300161), wk = 0.0036232 k( 70) = ( -0.2702709 0.3763954 0.6148672), wk = 0.0036232 k( 71) = ( -0.2791066 0.3887006 0.5997184), wk = 0.0036232 k( 72) = ( -0.2879423 0.4010058 0.5845695), wk = 0.0036232 k( 73) = ( -0.2967781 0.4133109 0.5694207), wk = 0.0036232 k( 74) = ( -0.3056138 0.4256161 0.5542718), wk = 0.0036232 k( 75) = ( -0.3144495 0.4379213 0.5391230), wk = 0.0036232 k( 76) = ( -0.3144495 0.4379213 0.5391230), wk = 0.0036232 k( 77) = ( -0.3057148 0.4257568 0.5241473), wk = 0.0036232 k( 78) = ( -0.2969801 0.4135923 0.5091717), wk = 0.0036232 k( 79) = ( -0.2882454 0.4014279 0.4941961), wk = 0.0036232 k( 80) = ( -0.2795107 0.3892634 0.4792204), wk = 0.0036232 k( 81) = ( -0.2707760 0.3770989 0.4642448), wk = 0.0036232 k( 82) = ( -0.2620413 0.3649344 0.4492691), wk = 0.0036232 k( 83) = ( -0.2533066 0.3527699 0.4342935), wk = 0.0036232 k( 84) = ( -0.2445719 0.3406055 0.4193179), wk = 0.0036232 k( 85) = ( -0.2358371 0.3284410 0.4043422), wk = 0.0036232 k( 86) = ( -0.2271024 0.3162765 0.3893666), wk = 0.0036232 k( 87) = ( -0.2183677 0.3041120 0.3743909), wk = 0.0036232 k( 88) = ( -0.2096330 0.2919475 0.3594153), wk = 0.0036232 k( 89) = ( -0.2008983 0.2797830 0.3444397), wk = 0.0036232 k( 90) = ( -0.1921636 0.2676186 0.3294640), wk = 0.0036232 k( 91) = ( -0.1834289 0.2554541 0.3144884), wk = 0.0036232 k( 92) = ( -0.1746942 0.2432896 0.2995128), wk = 0.0036232 k( 93) = ( -0.1659595 0.2311251 0.2845371), wk = 0.0036232 k( 94) = ( -0.1572248 0.2189607 0.2695615), wk = 0.0036232 k( 95) = ( -0.1484901 0.2067962 0.2545859), wk = 0.0036232 k( 96) = ( -0.1397554 0.1946317 0.2396102), wk = 0.0036232 k( 97) = ( -0.1310206 0.1824672 0.2246346), wk = 0.0036232 k( 98) = ( -0.1222859 0.1703027 0.2096589), wk = 0.0036232 k( 99) = ( -0.1135512 0.1581382 0.1946833), wk = 0.0036232 k( 100) = ( -0.1048165 0.1459738 0.1797077), wk = 0.0036232 k( 101) = ( -0.0960818 0.1338093 0.1647320), wk = 0.0036232 k( 102) = ( -0.0873471 0.1216448 0.1497564), wk = 0.0036232 k( 103) = ( -0.0786124 0.1094803 0.1347807), wk = 0.0036232 k( 104) = ( -0.0698777 0.0973158 0.1198051), wk = 0.0036232 k( 105) = ( -0.0611430 0.0851514 0.1048295), wk = 0.0036232 k( 106) = ( -0.0524083 0.0729869 0.0898538), wk = 0.0036232 k( 107) = ( -0.0436735 0.0608224 0.0748782), wk = 0.0036232 k( 108) = ( -0.0349388 0.0486579 0.0599026), wk = 0.0036232 k( 109) = ( -0.0262041 0.0364934 0.0449269), wk = 0.0036232 k( 110) = ( -0.0174694 0.0243290 0.0299513), wk = 0.0036232 k( 111) = ( -0.0087347 0.0121645 0.0149756), wk = 0.0036232 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 114) = ( 0.0172414 0.0123802 -0.0000000), wk = 0.0036232 k( 115) = ( 0.0344828 0.0247604 -0.0000000), wk = 0.0036232 k( 116) = ( 0.0517241 0.0371405 0.0000000), wk = 0.0036232 k( 117) = ( 0.0689655 0.0495207 -0.0000000), wk = 0.0036232 k( 118) = ( 0.0862069 0.0619009 -0.0000000), wk = 0.0036232 k( 119) = ( 0.1034483 0.0742811 0.0000000), wk = 0.0036232 k( 120) = ( 0.1206897 0.0866613 -0.0000000), wk = 0.0036232 k( 121) = ( 0.1379310 0.0990414 -0.0000000), wk = 0.0036232 k( 122) = ( 0.1551724 0.1114216 0.0000000), wk = 0.0036232 k( 123) = ( 0.1724138 0.1238018 0.0000000), wk = 0.0036232 k( 124) = ( 0.1896552 0.1361820 -0.0000000), wk = 0.0036232 k( 125) = ( 0.2068966 0.1485621 0.0000000), wk = 0.0036232 k( 126) = ( 0.2241379 0.1609423 0.0000000), wk = 0.0036232 k( 127) = ( 0.2413793 0.1733225 0.0000000), wk = 0.0036232 k( 128) = ( 0.2586207 0.1857027 -0.0000000), wk = 0.0036232 k( 129) = ( 0.2758621 0.1980829 -0.0000000), wk = 0.0036232 k( 130) = ( 0.2931034 0.2104630 0.0000000), wk = 0.0036232 k( 131) = ( 0.3103448 0.2228432 0.0000000), wk = 0.0036232 k( 132) = ( 0.3275862 0.2352234 -0.0000000), wk = 0.0036232 k( 133) = ( 0.3448276 0.2476036 -0.0000000), wk = 0.0036232 k( 134) = ( 0.3620690 0.2599837 -0.0000000), wk = 0.0036232 k( 135) = ( 0.3793103 0.2723639 -0.0000000), wk = 0.0036232 k( 136) = ( 0.3965517 0.2847441 0.0000000), wk = 0.0036232 k( 137) = ( 0.4137931 0.2971243 0.0000000), wk = 0.0036232 k( 138) = ( 0.4310345 0.3095045 0.0000000), wk = 0.0036232 k( 139) = ( 0.4482759 0.3218846 0.0000000), wk = 0.0036232 k( 140) = ( 0.4655172 0.3342648 0.0000000), wk = 0.0036232 k( 141) = ( 0.4827586 0.3466450 0.0000000), wk = 0.0036232 k( 142) = ( 0.5000000 0.3590252 0.0000000), wk = 0.0036232 k( 143) = ( 0.5000000 0.3590252 0.0000000), wk = 0.0036232 k( 144) = ( 0.4911643 0.3713303 0.0151489), wk = 0.0036232 k( 145) = ( 0.4823285 0.3836355 0.0302977), wk = 0.0036232 k( 146) = ( 0.4734928 0.3959407 0.0454465), wk = 0.0036232 k( 147) = ( 0.4646571 0.4082459 0.0605954), wk = 0.0036232 k( 148) = ( 0.4558213 0.4205510 0.0757442), wk = 0.0036232 k( 149) = ( 0.4469856 0.4328562 0.0908931), wk = 0.0036232 k( 150) = ( 0.4381498 0.4451614 0.1060420), wk = 0.0036232 k( 151) = ( 0.4293141 0.4574666 0.1211908), wk = 0.0036232 k( 152) = ( 0.4204784 0.4697718 0.1363396), wk = 0.0036232 k( 153) = ( 0.4116426 0.4820769 0.1514885), wk = 0.0036232 k( 154) = ( 0.4028069 0.4943821 0.1666373), wk = 0.0036232 k( 155) = ( 0.3939712 0.5066873 0.1817862), wk = 0.0036232 k( 156) = ( 0.3851354 0.5189925 0.1969350), wk = 0.0036232 k( 157) = ( 0.3762997 0.5312976 0.2120839), wk = 0.0036232 k( 158) = ( 0.3674639 0.5436028 0.2272327), wk = 0.0036232 k( 159) = ( 0.3586282 0.5559080 0.2423816), wk = 0.0036232 k( 160) = ( 0.3497925 0.5682132 0.2575304), wk = 0.0036232 k( 161) = ( 0.3409567 0.5805184 0.2726793), wk = 0.0036232 k( 162) = ( 0.3321210 0.5928235 0.2878281), wk = 0.0036232 k( 163) = ( 0.3232853 0.6051287 0.3029770), wk = 0.0036232 k( 164) = ( 0.3144495 0.6174339 0.3181258), wk = 0.0036232 k( 165) = ( 0.3144495 0.6174339 0.3181258), wk = 0.0036232 k( 166) = ( 0.2947964 0.6118241 0.3250320), wk = 0.0036232 k( 167) = ( 0.2751433 0.6062144 0.3319382), wk = 0.0036232 k( 168) = ( 0.2554902 0.6006046 0.3388443), wk = 0.0036232 k( 169) = ( 0.2358371 0.5949948 0.3457505), wk = 0.0036232 k( 170) = ( 0.2161840 0.5893850 0.3526566), wk = 0.0036232 k( 171) = ( 0.1965310 0.5837753 0.3595628), wk = 0.0036232 k( 172) = ( 0.1768779 0.5781655 0.3664690), wk = 0.0036232 k( 173) = ( 0.1572248 0.5725557 0.3733751), wk = 0.0036232 k( 174) = ( 0.1375717 0.5669460 0.3802813), wk = 0.0036232 k( 175) = ( 0.1179186 0.5613362 0.3871874), wk = 0.0036232 k( 176) = ( 0.0982655 0.5557264 0.3940936), wk = 0.0036232 k( 177) = ( 0.0786124 0.5501167 0.4009998), wk = 0.0036232 k( 178) = ( 0.0589593 0.5445069 0.4079059), wk = 0.0036232 k( 179) = ( 0.0393062 0.5388971 0.4148121), wk = 0.0036232 k( 180) = ( 0.0196531 0.5332874 0.4217182), wk = 0.0036232 k( 181) = ( 0.0000000 0.5276776 0.4286244), wk = 0.0036232 k( 182) = ( 0.0000000 0.5276776 0.4286244), wk = 0.0036232 k( 183) = ( 0.0089286 0.5152431 0.4439324), wk = 0.0036232 k( 184) = ( 0.0178571 0.5028087 0.4592404), wk = 0.0036232 k( 185) = ( 0.0267857 0.4903742 0.4745484), wk = 0.0036232 k( 186) = ( 0.0357143 0.4779397 0.4898565), wk = 0.0036232 k( 187) = ( 0.0446429 0.4655053 0.5051645), wk = 0.0036232 k( 188) = ( 0.0535714 0.4530708 0.5204725), wk = 0.0036232 k( 189) = ( 0.0625000 0.4406363 0.5357805), wk = 0.0036232 k( 190) = ( 0.0714286 0.4282019 0.5510885), wk = 0.0036232 k( 191) = ( 0.0803571 0.4157674 0.5663965), wk = 0.0036232 k( 192) = ( 0.0892857 0.4033330 0.5817045), wk = 0.0036232 k( 193) = ( 0.0982143 0.3908985 0.5970126), wk = 0.0036232 k( 194) = ( 0.1071429 0.3784640 0.6123206), wk = 0.0036232 k( 195) = ( 0.1160714 0.3660295 0.6276286), wk = 0.0036232 k( 196) = ( 0.1250000 0.3535951 0.6429366), wk = 0.0036232 k( 197) = ( 0.1339286 0.3411606 0.6582446), wk = 0.0036232 k( 198) = ( 0.1428571 0.3287262 0.6735526), wk = 0.0036232 k( 199) = ( 0.1517857 0.3162917 0.6888606), wk = 0.0036232 k( 200) = ( 0.1607143 0.3038572 0.7041687), wk = 0.0036232 k( 201) = ( 0.1696429 0.2914228 0.7194767), wk = 0.0036232 k( 202) = ( 0.1785714 0.2789883 0.7347847), wk = 0.0036232 k( 203) = ( 0.1875000 0.2665538 0.7500927), wk = 0.0036232 k( 204) = ( 0.1964286 0.2541194 0.7654007), wk = 0.0036232 k( 205) = ( 0.2053571 0.2416849 0.7807087), wk = 0.0036232 k( 206) = ( 0.2142857 0.2292504 0.7960167), wk = 0.0036232 k( 207) = ( 0.2232143 0.2168160 0.8113248), wk = 0.0036232 k( 208) = ( 0.2321429 0.2043815 0.8266328), wk = 0.0036232 k( 209) = ( 0.2410714 0.1919470 0.8419408), wk = 0.0036232 k( 210) = ( 0.2500000 0.1795126 0.8572488), wk = 0.0036232 k( 211) = ( 0.2500000 0.1795126 0.8572488), wk = 0.0036232 k( 212) = ( 0.2638889 0.1894855 0.8449712), wk = 0.0036232 k( 213) = ( 0.2777778 0.1994584 0.8326936), wk = 0.0036232 k( 214) = ( 0.2916667 0.2094313 0.8204160), wk = 0.0036232 k( 215) = ( 0.3055556 0.2194043 0.8081383), wk = 0.0036232 k( 216) = ( 0.3194444 0.2293772 0.7958607), wk = 0.0036232 k( 217) = ( 0.3333333 0.2393501 0.7835831), wk = 0.0036232 k( 218) = ( 0.3472222 0.2493230 0.7713055), wk = 0.0036232 k( 219) = ( 0.3611111 0.2592960 0.7590278), wk = 0.0036232 k( 220) = ( 0.3750000 0.2692689 0.7467502), wk = 0.0036232 k( 221) = ( 0.3888889 0.2792418 0.7344726), wk = 0.0036232 k( 222) = ( 0.4027778 0.2892147 0.7221950), wk = 0.0036232 k( 223) = ( 0.4166667 0.2991876 0.7099174), wk = 0.0036232 k( 224) = ( 0.4305556 0.3091606 0.6976398), wk = 0.0036232 k( 225) = ( 0.4444444 0.3191335 0.6853621), wk = 0.0036232 k( 226) = ( 0.4583333 0.3291064 0.6730845), wk = 0.0036232 k( 227) = ( 0.4722222 0.3390793 0.6608069), wk = 0.0036232 k( 228) = ( 0.4861111 0.3490522 0.6485293), wk = 0.0036232 k( 229) = ( 0.5000000 0.3590252 0.6362517), wk = 0.0036232 k( 230) = ( 0.5000000 0.3590252 0.6362517), wk = 0.0036232 k( 231) = ( 0.5000000 0.3590252 0.6150433), wk = 0.0036232 k( 232) = ( 0.5000000 0.3590252 0.5938349), wk = 0.0036232 k( 233) = ( 0.5000000 0.3590252 0.5726265), wk = 0.0036232 k( 234) = ( 0.5000000 0.3590252 0.5514181), wk = 0.0036232 k( 235) = ( 0.5000000 0.3590252 0.5302097), wk = 0.0036232 k( 236) = ( 0.5000000 0.3590252 0.5090013), wk = 0.0036232 k( 237) = ( 0.5000000 0.3590252 0.4877929), wk = 0.0036232 k( 238) = ( 0.5000000 0.3590252 0.4665845), wk = 0.0036232 k( 239) = ( 0.5000000 0.3590252 0.4453762), wk = 0.0036232 k( 240) = ( 0.5000000 0.3590252 0.4241678), wk = 0.0036232 k( 241) = ( 0.5000000 0.3590252 0.4029594), wk = 0.0036232 k( 242) = ( 0.5000000 0.3590252 0.3817510), wk = 0.0036232 k( 243) = ( 0.5000000 0.3590252 0.3605426), wk = 0.0036232 k( 244) = ( 0.5000000 0.3590252 0.3393342), wk = 0.0036232 k( 245) = ( 0.5000000 0.3590252 0.3181258), wk = 0.0036232 k( 246) = ( 0.5000000 0.3590252 0.2969174), wk = 0.0036232 k( 247) = ( 0.5000000 0.3590252 0.2757090), wk = 0.0036232 k( 248) = ( 0.5000000 0.3590252 0.2545007), wk = 0.0036232 k( 249) = ( 0.5000000 0.3590252 0.2332923), wk = 0.0036232 k( 250) = ( 0.5000000 0.3590252 0.2120839), wk = 0.0036232 k( 251) = ( 0.5000000 0.3590252 0.1908755), wk = 0.0036232 k( 252) = ( 0.5000000 0.3590252 0.1696671), wk = 0.0036232 k( 253) = ( 0.5000000 0.3590252 0.1484587), wk = 0.0036232 k( 254) = ( 0.5000000 0.3590252 0.1272503), wk = 0.0036232 k( 255) = ( 0.5000000 0.3590252 0.1060420), wk = 0.0036232 k( 256) = ( 0.5000000 0.3590252 0.0848335), wk = 0.0036232 k( 257) = ( 0.5000000 0.3590252 0.0636252), wk = 0.0036232 k( 258) = ( 0.5000000 0.3590252 0.0424168), wk = 0.0036232 k( 259) = ( 0.5000000 0.3590252 0.0212084), wk = 0.0036232 k( 260) = ( 0.5000000 0.3590252 0.0000000), wk = 0.0036232 k( 261) = ( 0.0000000 0.0000000 0.8572488), wk = 0.0036232 k( 262) = ( 0.0166667 0.0119675 0.8572488), wk = 0.0036232 k( 263) = ( 0.0333333 0.0239350 0.8572488), wk = 0.0036232 k( 264) = ( 0.0500000 0.0359025 0.8572488), wk = 0.0036232 k( 265) = ( 0.0666667 0.0478700 0.8572488), wk = 0.0036232 k( 266) = ( 0.0833333 0.0598375 0.8572488), wk = 0.0036232 k( 267) = ( 0.1000000 0.0718050 0.8572488), wk = 0.0036232 k( 268) = ( 0.1166667 0.0837725 0.8572488), wk = 0.0036232 k( 269) = ( 0.1333333 0.0957400 0.8572488), wk = 0.0036232 k( 270) = ( 0.1500000 0.1077075 0.8572488), wk = 0.0036232 k( 271) = ( 0.1666667 0.1196751 0.8572488), wk = 0.0036232 k( 272) = ( 0.1833333 0.1316426 0.8572488), wk = 0.0036232 k( 273) = ( 0.2000000 0.1436101 0.8572488), wk = 0.0036232 k( 274) = ( 0.2166667 0.1555776 0.8572488), wk = 0.0036232 k( 275) = ( 0.2333333 0.1675451 0.8572488), wk = 0.0036232 k( 276) = ( 0.2500000 0.1795126 0.8572488), wk = 0.0036232 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 2) = ( 0.0000000 0.0000000 0.0125000), wk = 0.0036232 k( 3) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0036232 k( 4) = ( 0.0000000 0.0000000 0.0375000), wk = 0.0036232 k( 5) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0036232 k( 6) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0036232 k( 7) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0036232 k( 8) = ( 0.0000000 0.0000000 0.0875000), wk = 0.0036232 k( 9) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0036232 k( 10) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0036232 k( 11) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0036232 k( 12) = ( 0.0000000 0.0000000 0.1375000), wk = 0.0036232 k( 13) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0036232 k( 14) = ( 0.0000000 0.0000000 0.1625000), wk = 0.0036232 k( 15) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0036232 k( 16) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0036232 k( 17) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0036232 k( 18) = ( 0.0000000 0.0000000 0.2125000), wk = 0.0036232 k( 19) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0036232 k( 20) = ( 0.0000000 0.0000000 0.2375000), wk = 0.0036232 k( 21) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0036232 k( 22) = ( 0.0000000 0.0000000 0.2625000), wk = 0.0036232 k( 23) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0036232 k( 24) = ( 0.0000000 0.0000000 0.2875000), wk = 0.0036232 k( 25) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0036232 k( 26) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0036232 k( 27) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0036232 k( 28) = ( 0.0000000 0.0000000 0.3375000), wk = 0.0036232 k( 29) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0036232 k( 30) = ( 0.0000000 0.0000000 0.3625000), wk = 0.0036232 k( 31) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0036232 k( 32) = ( 0.0000000 0.0000000 0.3875000), wk = 0.0036232 k( 33) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0036232 k( 34) = ( 0.0000000 0.0000000 0.4125000), wk = 0.0036232 k( 35) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0036232 k( 36) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0036232 k( 37) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0036232 k( 38) = ( 0.0000000 0.0000000 0.4625000), wk = 0.0036232 k( 39) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0036232 k( 40) = ( 0.0000000 0.0000000 0.4875000), wk = 0.0036232 k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036232 k( 42) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036232 k( 43) = ( -0.0117181 0.0117181 0.5000000), wk = 0.0036232 k( 44) = ( -0.0234362 0.0234362 0.5000000), wk = 0.0036232 k( 45) = ( -0.0351543 0.0351543 0.5000000), wk = 0.0036232 k( 46) = ( -0.0468724 0.0468724 0.5000000), wk = 0.0036232 k( 47) = ( -0.0585905 0.0585905 0.5000000), wk = 0.0036232 k( 48) = ( -0.0703086 0.0703086 0.5000000), wk = 0.0036232 k( 49) = ( -0.0820267 0.0820267 0.5000000), wk = 0.0036232 k( 50) = ( -0.0937448 0.0937448 0.5000000), wk = 0.0036232 k( 51) = ( -0.1054629 0.1054629 0.5000000), wk = 0.0036232 k( 52) = ( -0.1171810 0.1171810 0.5000000), wk = 0.0036232 k( 53) = ( -0.1288991 0.1288991 0.5000000), wk = 0.0036232 k( 54) = ( -0.1288991 0.1288991 0.5000000), wk = 0.0036232 k( 55) = ( -0.1377348 0.1377348 0.4911643), wk = 0.0036232 k( 56) = ( -0.1465705 0.1465705 0.4823285), wk = 0.0036232 k( 57) = ( -0.1554063 0.1554063 0.4734928), wk = 0.0036232 k( 58) = ( -0.1642420 0.1642420 0.4646571), wk = 0.0036232 k( 59) = ( -0.1730778 0.1730778 0.4558213), wk = 0.0036232 k( 60) = ( -0.1819135 0.1819135 0.4469856), wk = 0.0036232 k( 61) = ( -0.1907492 0.1907492 0.4381498), wk = 0.0036232 k( 62) = ( -0.1995850 0.1995850 0.4293141), wk = 0.0036232 k( 63) = ( -0.2084207 0.2084207 0.4204784), wk = 0.0036232 k( 64) = ( -0.2172564 0.2172564 0.4116426), wk = 0.0036232 k( 65) = ( -0.2260922 0.2260922 0.4028069), wk = 0.0036232 k( 66) = ( -0.2349279 0.2349279 0.3939712), wk = 0.0036232 k( 67) = ( -0.2437636 0.2437636 0.3851354), wk = 0.0036232 k( 68) = ( -0.2525994 0.2525994 0.3762997), wk = 0.0036232 k( 69) = ( -0.2614351 0.2614351 0.3674639), wk = 0.0036232 k( 70) = ( -0.2702709 0.2702709 0.3586282), wk = 0.0036232 k( 71) = ( -0.2791066 0.2791066 0.3497925), wk = 0.0036232 k( 72) = ( -0.2879423 0.2879423 0.3409567), wk = 0.0036232 k( 73) = ( -0.2967781 0.2967781 0.3321210), wk = 0.0036232 k( 74) = ( -0.3056138 0.3056138 0.3232853), wk = 0.0036232 k( 75) = ( -0.3144495 0.3144495 0.3144495), wk = 0.0036232 k( 76) = ( -0.3144495 0.3144495 0.3144495), wk = 0.0036232 k( 77) = ( -0.3057148 0.3057148 0.3057148), wk = 0.0036232 k( 78) = ( -0.2969801 0.2969801 0.2969801), wk = 0.0036232 k( 79) = ( -0.2882454 0.2882454 0.2882454), wk = 0.0036232 k( 80) = ( -0.2795107 0.2795107 0.2795107), wk = 0.0036232 k( 81) = ( -0.2707760 0.2707760 0.2707760), wk = 0.0036232 k( 82) = ( -0.2620413 0.2620413 0.2620413), wk = 0.0036232 k( 83) = ( -0.2533066 0.2533066 0.2533066), wk = 0.0036232 k( 84) = ( -0.2445719 0.2445719 0.2445719), wk = 0.0036232 k( 85) = ( -0.2358371 0.2358371 0.2358372), wk = 0.0036232 k( 86) = ( -0.2271024 0.2271024 0.2271024), wk = 0.0036232 k( 87) = ( -0.2183677 0.2183677 0.2183677), wk = 0.0036232 k( 88) = ( -0.2096330 0.2096330 0.2096330), wk = 0.0036232 k( 89) = ( -0.2008983 0.2008983 0.2008983), wk = 0.0036232 k( 90) = ( -0.1921636 0.1921636 0.1921636), wk = 0.0036232 k( 91) = ( -0.1834289 0.1834289 0.1834289), wk = 0.0036232 k( 92) = ( -0.1746942 0.1746942 0.1746942), wk = 0.0036232 k( 93) = ( -0.1659595 0.1659595 0.1659595), wk = 0.0036232 k( 94) = ( -0.1572248 0.1572248 0.1572248), wk = 0.0036232 k( 95) = ( -0.1484901 0.1484901 0.1484901), wk = 0.0036232 k( 96) = ( -0.1397554 0.1397554 0.1397554), wk = 0.0036232 k( 97) = ( -0.1310206 0.1310206 0.1310206), wk = 0.0036232 k( 98) = ( -0.1222859 0.1222859 0.1222859), wk = 0.0036232 k( 99) = ( -0.1135512 0.1135512 0.1135512), wk = 0.0036232 k( 100) = ( -0.1048165 0.1048165 0.1048165), wk = 0.0036232 k( 101) = ( -0.0960818 0.0960818 0.0960818), wk = 0.0036232 k( 102) = ( -0.0873471 0.0873471 0.0873471), wk = 0.0036232 k( 103) = ( -0.0786124 0.0786124 0.0786124), wk = 0.0036232 k( 104) = ( -0.0698777 0.0698777 0.0698777), wk = 0.0036232 k( 105) = ( -0.0611430 0.0611430 0.0611430), wk = 0.0036232 k( 106) = ( -0.0524083 0.0524083 0.0524083), wk = 0.0036232 k( 107) = ( -0.0436735 0.0436735 0.0436736), wk = 0.0036232 k( 108) = ( -0.0349388 0.0349388 0.0349388), wk = 0.0036232 k( 109) = ( -0.0262041 0.0262041 0.0262041), wk = 0.0036232 k( 110) = ( -0.0174694 0.0174694 0.0174694), wk = 0.0036232 k( 111) = ( -0.0087347 0.0087347 0.0087347), wk = 0.0036232 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 114) = ( 0.0172414 0.0172414 -0.0172414), wk = 0.0036232 k( 115) = ( 0.0344828 0.0344828 -0.0344828), wk = 0.0036232 k( 116) = ( 0.0517241 0.0517241 -0.0517241), wk = 0.0036232 k( 117) = ( 0.0689655 0.0689655 -0.0689655), wk = 0.0036232 k( 118) = ( 0.0862069 0.0862069 -0.0862069), wk = 0.0036232 k( 119) = ( 0.1034483 0.1034483 -0.1034483), wk = 0.0036232 k( 120) = ( 0.1206897 0.1206897 -0.1206897), wk = 0.0036232 k( 121) = ( 0.1379310 0.1379310 -0.1379310), wk = 0.0036232 k( 122) = ( 0.1551724 0.1551724 -0.1551724), wk = 0.0036232 k( 123) = ( 0.1724138 0.1724138 -0.1724138), wk = 0.0036232 k( 124) = ( 0.1896552 0.1896552 -0.1896552), wk = 0.0036232 k( 125) = ( 0.2068966 0.2068966 -0.2068965), wk = 0.0036232 k( 126) = ( 0.2241379 0.2241379 -0.2241379), wk = 0.0036232 k( 127) = ( 0.2413793 0.2413793 -0.2413793), wk = 0.0036232 k( 128) = ( 0.2586207 0.2586207 -0.2586207), wk = 0.0036232 k( 129) = ( 0.2758621 0.2758621 -0.2758621), wk = 0.0036232 k( 130) = ( 0.2931034 0.2931034 -0.2931034), wk = 0.0036232 k( 131) = ( 0.3103448 0.3103448 -0.3103448), wk = 0.0036232 k( 132) = ( 0.3275862 0.3275862 -0.3275862), wk = 0.0036232 k( 133) = ( 0.3448276 0.3448276 -0.3448276), wk = 0.0036232 k( 134) = ( 0.3620690 0.3620690 -0.3620690), wk = 0.0036232 k( 135) = ( 0.3793103 0.3793103 -0.3793103), wk = 0.0036232 k( 136) = ( 0.3965517 0.3965517 -0.3965517), wk = 0.0036232 k( 137) = ( 0.4137931 0.4137931 -0.4137931), wk = 0.0036232 k( 138) = ( 0.4310345 0.4310345 -0.4310345), wk = 0.0036232 k( 139) = ( 0.4482759 0.4482759 -0.4482759), wk = 0.0036232 k( 140) = ( 0.4655172 0.4655172 -0.4655172), wk = 0.0036232 k( 141) = ( 0.4827586 0.4827586 -0.4827586), wk = 0.0036232 k( 142) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036232 k( 143) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036232 k( 144) = ( 0.4911643 0.5088357 -0.4911643), wk = 0.0036232 k( 145) = ( 0.4823285 0.5176715 -0.4823285), wk = 0.0036232 k( 146) = ( 0.4734928 0.5265072 -0.4734928), wk = 0.0036232 k( 147) = ( 0.4646571 0.5353429 -0.4646571), wk = 0.0036232 k( 148) = ( 0.4558213 0.5441787 -0.4558213), wk = 0.0036232 k( 149) = ( 0.4469856 0.5530144 -0.4469856), wk = 0.0036232 k( 150) = ( 0.4381498 0.5618502 -0.4381498), wk = 0.0036232 k( 151) = ( 0.4293141 0.5706859 -0.4293141), wk = 0.0036232 k( 152) = ( 0.4204784 0.5795216 -0.4204784), wk = 0.0036232 k( 153) = ( 0.4116426 0.5883574 -0.4116426), wk = 0.0036232 k( 154) = ( 0.4028069 0.5971931 -0.4028069), wk = 0.0036232 k( 155) = ( 0.3939712 0.6060288 -0.3939712), wk = 0.0036232 k( 156) = ( 0.3851354 0.6148646 -0.3851354), wk = 0.0036232 k( 157) = ( 0.3762997 0.6237003 -0.3762997), wk = 0.0036232 k( 158) = ( 0.3674639 0.6325361 -0.3674639), wk = 0.0036232 k( 159) = ( 0.3586282 0.6413718 -0.3586282), wk = 0.0036232 k( 160) = ( 0.3497925 0.6502075 -0.3497925), wk = 0.0036232 k( 161) = ( 0.3409567 0.6590433 -0.3409567), wk = 0.0036232 k( 162) = ( 0.3321210 0.6678790 -0.3321210), wk = 0.0036232 k( 163) = ( 0.3232853 0.6767147 -0.3232853), wk = 0.0036232 k( 164) = ( 0.3144495 0.6855505 -0.3144495), wk = 0.0036232 k( 165) = ( 0.3144495 0.6855505 -0.3144495), wk = 0.0036232 k( 166) = ( 0.2947964 0.6739536 -0.2947964), wk = 0.0036232 k( 167) = ( 0.2751433 0.6623567 -0.2751433), wk = 0.0036232 k( 168) = ( 0.2554902 0.6507597 -0.2554903), wk = 0.0036232 k( 169) = ( 0.2358371 0.6391628 -0.2358372), wk = 0.0036232 k( 170) = ( 0.2161840 0.6275659 -0.2161841), wk = 0.0036232 k( 171) = ( 0.1965310 0.6159690 -0.1965310), wk = 0.0036232 k( 172) = ( 0.1768779 0.6043721 -0.1768779), wk = 0.0036232 k( 173) = ( 0.1572248 0.5927752 -0.1572248), wk = 0.0036232 k( 174) = ( 0.1375717 0.5811783 -0.1375717), wk = 0.0036232 k( 175) = ( 0.1179186 0.5695814 -0.1179186), wk = 0.0036232 k( 176) = ( 0.0982655 0.5579845 -0.0982655), wk = 0.0036232 k( 177) = ( 0.0786124 0.5463876 -0.0786124), wk = 0.0036232 k( 178) = ( 0.0589593 0.5347907 -0.0589593), wk = 0.0036232 k( 179) = ( 0.0393062 0.5231938 -0.0393062), wk = 0.0036232 k( 180) = ( 0.0196531 0.5115969 -0.0196531), wk = 0.0036232 k( 181) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036232 k( 182) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036232 k( 183) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0036232 k( 184) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0036232 k( 185) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0036232 k( 186) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0036232 k( 187) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0036232 k( 188) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0036232 k( 189) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0036232 k( 190) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0036232 k( 191) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0036232 k( 192) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0036232 k( 193) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0036232 k( 194) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0036232 k( 195) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0036232 k( 196) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0036232 k( 197) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0036232 k( 198) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0036232 k( 199) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0036232 k( 200) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0036232 k( 201) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0036232 k( 202) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0036232 k( 203) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0036232 k( 204) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0036232 k( 205) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0036232 k( 206) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0036232 k( 207) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0036232 k( 208) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0036232 k( 209) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0036232 k( 210) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036232 k( 211) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036232 k( 212) = ( 0.2638889 0.2638889 0.2289501), wk = 0.0036232 k( 213) = ( 0.2777778 0.2777778 0.2079001), wk = 0.0036232 k( 214) = ( 0.2916667 0.2916667 0.1868502), wk = 0.0036232 k( 215) = ( 0.3055556 0.3055556 0.1658002), wk = 0.0036232 k( 216) = ( 0.3194444 0.3194444 0.1447503), wk = 0.0036232 k( 217) = ( 0.3333333 0.3333333 0.1237003), wk = 0.0036232 k( 218) = ( 0.3472222 0.3472222 0.1026504), wk = 0.0036232 k( 219) = ( 0.3611111 0.3611111 0.0816004), wk = 0.0036232 k( 220) = ( 0.3750000 0.3750000 0.0605505), wk = 0.0036232 k( 221) = ( 0.3888889 0.3888889 0.0395005), wk = 0.0036232 k( 222) = ( 0.4027778 0.4027778 0.0184506), wk = 0.0036232 k( 223) = ( 0.4166667 0.4166667 -0.0025994), wk = 0.0036232 k( 224) = ( 0.4305556 0.4305556 -0.0236493), wk = 0.0036232 k( 225) = ( 0.4444444 0.4444444 -0.0446993), wk = 0.0036232 k( 226) = ( 0.4583333 0.4583333 -0.0657492), wk = 0.0036232 k( 227) = ( 0.4722222 0.4722222 -0.0867992), wk = 0.0036232 k( 228) = ( 0.4861111 0.4861111 -0.1078491), wk = 0.0036232 k( 229) = ( 0.5000000 0.5000000 -0.1288991), wk = 0.0036232 k( 230) = ( 0.5000000 0.5000000 -0.1288991), wk = 0.0036232 k( 231) = ( 0.5000000 0.5000000 -0.1412691), wk = 0.0036232 k( 232) = ( 0.5000000 0.5000000 -0.1536391), wk = 0.0036232 k( 233) = ( 0.5000000 0.5000000 -0.1660092), wk = 0.0036232 k( 234) = ( 0.5000000 0.5000000 -0.1783792), wk = 0.0036232 k( 235) = ( 0.5000000 0.5000000 -0.1907492), wk = 0.0036232 k( 236) = ( 0.5000000 0.5000000 -0.2031193), wk = 0.0036232 k( 237) = ( 0.5000000 0.5000000 -0.2154893), wk = 0.0036232 k( 238) = ( 0.5000000 0.5000000 -0.2278593), wk = 0.0036232 k( 239) = ( 0.5000000 0.5000000 -0.2402293), wk = 0.0036232 k( 240) = ( 0.5000000 0.5000000 -0.2525994), wk = 0.0036232 k( 241) = ( 0.5000000 0.5000000 -0.2649694), wk = 0.0036232 k( 242) = ( 0.5000000 0.5000000 -0.2773394), wk = 0.0036232 k( 243) = ( 0.5000000 0.5000000 -0.2897095), wk = 0.0036232 k( 244) = ( 0.5000000 0.5000000 -0.3020795), wk = 0.0036232 k( 245) = ( 0.5000000 0.5000000 -0.3144495), wk = 0.0036232 k( 246) = ( 0.5000000 0.5000000 -0.3268196), wk = 0.0036232 k( 247) = ( 0.5000000 0.5000000 -0.3391896), wk = 0.0036232 k( 248) = ( 0.5000000 0.5000000 -0.3515596), wk = 0.0036232 k( 249) = ( 0.5000000 0.5000000 -0.3639297), wk = 0.0036232 k( 250) = ( 0.5000000 0.5000000 -0.3762997), wk = 0.0036232 k( 251) = ( 0.5000000 0.5000000 -0.3886697), wk = 0.0036232 k( 252) = ( 0.5000000 0.5000000 -0.4010397), wk = 0.0036232 k( 253) = ( 0.5000000 0.5000000 -0.4134098), wk = 0.0036232 k( 254) = ( 0.5000000 0.5000000 -0.4257798), wk = 0.0036232 k( 255) = ( 0.5000000 0.5000000 -0.4381498), wk = 0.0036232 k( 256) = ( 0.5000000 0.5000000 -0.4505199), wk = 0.0036232 k( 257) = ( 0.5000000 0.5000000 -0.4628899), wk = 0.0036232 k( 258) = ( 0.5000000 0.5000000 -0.4752599), wk = 0.0036232 k( 259) = ( 0.5000000 0.5000000 -0.4876300), wk = 0.0036232 k( 260) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036232 k( 261) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036232 k( 262) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0036232 k( 263) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0036232 k( 264) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0036232 k( 265) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0036232 k( 266) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0036232 k( 267) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0036232 k( 268) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0036232 k( 269) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0036232 k( 270) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0036232 k( 271) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0036232 k( 272) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0036232 k( 273) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0036232 k( 274) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0036232 k( 275) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0036232 k( 276) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036232 Dense grid: 90651 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 49425 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.41 Mb ( 366, 74) NL pseudopotentials 0.48 Mb ( 183, 172) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2518) G-vector shells 0.01 Mb ( 1115) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.65 Mb ( 366, 296) Each subspace H/S matrix 0.08 Mb ( 74, 74) Each matrix 0.39 Mb ( 172, 2, 74) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./ZnCu2GeSe4.save/charge-density.dat Starting wfc are 94 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 5.5 secs Computing kpt #: 3 total cpu time spent up to now is 6.5 secs Computing kpt #: 4 total cpu time spent up to now is 7.6 secs Computing kpt #: 5 total cpu time spent up to now is 8.6 secs Computing kpt #: 6 total cpu time spent up to now is 9.6 secs Computing kpt #: 7 total cpu time spent up to now is 10.6 secs Computing kpt #: 8 total cpu time spent up to now is 11.6 secs Computing kpt #: 9 total cpu time spent up to now is 12.6 secs Computing kpt #: 10 total cpu time spent up to now is 13.6 secs Computing kpt #: 11 total cpu time spent up to now is 14.6 secs Computing kpt #: 12 total cpu time spent up to now is 15.6 secs Computing kpt #: 13 total cpu time spent up to now is 16.6 secs Computing kpt #: 14 total cpu time spent up to now is 17.6 secs Computing kpt #: 15 total cpu time spent up to now is 18.6 secs Computing kpt #: 16 total cpu time spent up to now is 19.6 secs Computing kpt #: 17 total cpu time spent up to now is 20.6 secs Computing kpt #: 18 total cpu time spent up to now is 21.6 secs Computing kpt #: 19 total cpu time spent up to now is 22.7 secs Computing kpt #: 20 total cpu time spent up to now is 23.7 secs Computing kpt #: 21 total cpu time spent up to now is 24.8 secs Computing kpt #: 22 total cpu time spent up to now is 25.9 secs Computing kpt #: 23 total cpu time spent up to now is 26.9 secs Computing kpt #: 24 total cpu time spent up to now is 28.1 secs Computing kpt #: 25 total cpu time spent up to now is 29.3 secs Computing kpt #: 26 total cpu time spent up to now is 30.6 secs Computing kpt #: 27 total cpu time spent up to now is 31.9 secs Computing kpt #: 28 total cpu time spent up to now is 33.2 secs Computing kpt #: 29 total cpu time spent up to now is 34.5 secs Computing kpt #: 30 total cpu time spent up to now is 35.7 secs Computing kpt #: 31 total cpu time spent up to now is 37.0 secs Computing kpt #: 32 total cpu time spent up to now is 38.3 secs Computing kpt #: 33 total cpu time spent up to now is 39.6 secs Computing kpt #: 34 total cpu time spent up to now is 40.9 secs Computing kpt #: 35 total cpu time spent up to now is 42.1 secs Computing kpt #: 36 total cpu time spent up to now is 43.2 secs Computing kpt #: 37 total cpu time spent up to now is 44.5 secs Computing kpt #: 38 total cpu time spent up to now is 45.9 secs Computing kpt #: 39 total cpu time spent up to now is 47.2 secs Computing kpt #: 40 total cpu time spent up to now is 48.6 secs Computing kpt #: 41 total cpu time spent up to now is 49.9 secs Computing kpt #: 42 total cpu time spent up to now is 51.3 secs Computing kpt #: 43 total cpu time spent up to now is 52.6 secs Computing kpt #: 44 total cpu time spent up to now is 53.9 secs Computing kpt #: 45 total cpu time spent up to now is 55.3 secs Computing kpt #: 46 total cpu time spent up to now is 56.6 secs Computing kpt #: 47 total cpu time spent up to now is 57.9 secs Computing kpt #: 48 total cpu time spent up to now is 59.2 secs Computing kpt #: 49 total cpu time spent up to now is 60.5 secs Computing kpt #: 50 total cpu time spent up to now is 61.8 secs Computing kpt #: 51 total cpu time spent up to now is 63.1 secs Computing kpt #: 52 total cpu time spent up to now is 64.4 secs Computing kpt #: 53 total cpu time spent up to now is 65.8 secs Computing kpt #: 54 total cpu time spent up to now is 67.1 secs Computing kpt #: 55 total cpu time spent up to now is 68.4 secs Computing kpt #: 56 total cpu time spent up to now is 69.7 secs Computing kpt #: 57 total cpu time spent up to now is 71.0 secs Computing kpt #: 58 total cpu time spent up to now is 72.3 secs Computing kpt #: 59 total cpu time spent up to now is 73.5 secs Computing kpt #: 60 total cpu time spent up to now is 74.5 secs Computing kpt #: 61 total cpu time spent up to now is 75.6 secs Computing kpt #: 62 total cpu time spent up to now is 76.7 secs Computing kpt #: 63 total cpu time spent up to now is 77.7 secs Computing kpt #: 64 total cpu time spent up to now is 78.8 secs Computing kpt #: 65 total cpu time spent up to now is 79.9 secs Computing kpt #: 66 total cpu time spent up to now is 81.0 secs Computing kpt #: 67 total cpu time spent up to now is 82.1 secs Computing kpt #: 68 total cpu time spent up to now is 83.1 secs Computing kpt #: 69 total cpu time spent up to now is 84.2 secs Computing kpt #: 70 total cpu time spent up to now is 85.3 secs Computing kpt #: 71 total cpu time spent up to now is 86.4 secs Computing kpt #: 72 total cpu time spent up to now is 87.5 secs Computing kpt #: 73 total cpu time spent up to now is 88.6 secs Computing kpt #: 74 total cpu time spent up to now is 89.7 secs Computing kpt #: 75 total cpu time spent up to now is 90.7 secs Computing kpt #: 76 total cpu time spent up to now is 91.8 secs Computing kpt #: 77 total cpu time spent up to now is 92.9 secs Computing kpt #: 78 total cpu time spent up to now is 94.1 secs Computing kpt #: 79 total cpu time spent up to now is 95.1 secs Computing kpt #: 80 total cpu time spent up to now is 96.3 secs Computing kpt #: 81 total cpu time spent up to now is 97.6 secs Computing kpt #: 82 total cpu time spent up to now is 99.0 secs Computing kpt #: 83 total cpu time spent up to now is 100.3 secs Computing kpt #: 84 total cpu time spent up to now is 101.6 secs Computing kpt #: 85 total cpu time spent up to now is 102.9 secs Computing kpt #: 86 total cpu time spent up to now is 104.1 secs Computing kpt #: 87 total cpu time spent up to now is 105.2 secs Computing kpt #: 88 total cpu time spent up to now is 106.3 secs Computing kpt #: 89 total cpu time spent up to now is 107.4 secs Computing kpt #: 90 total cpu time spent up to now is 108.5 secs Computing kpt #: 91 total cpu time spent up to now is 109.7 secs Computing kpt #: 92 total cpu time spent up to now is 110.7 secs Computing kpt #: 93 total cpu time spent up to now is 111.8 secs Computing kpt #: 94 total cpu time spent up to now is 112.8 secs Computing kpt #: 95 total cpu time spent up to now is 113.9 secs Computing kpt #: 96 total cpu time spent up to now is 115.0 secs Computing kpt #: 97 total cpu time spent up to now is 116.0 secs Computing kpt #: 98 total cpu time spent up to now is 117.1 secs Computing kpt #: 99 total cpu time spent up to now is 118.1 secs Computing kpt #: 100 total cpu time spent up to now is 119.0 secs Computing kpt #: 101 total cpu time spent up to now is 120.0 secs Computing kpt #: 102 total cpu time spent up to now is 121.0 secs Computing kpt #: 103 total cpu time spent up to now is 122.0 secs Computing kpt #: 104 total cpu time spent up to now is 123.0 secs Computing kpt #: 105 total cpu time spent up to now is 124.1 secs Computing kpt #: 106 total cpu time spent up to now is 125.0 secs Computing kpt #: 107 total cpu time spent up to now is 126.1 secs Computing kpt #: 108 total cpu time spent up to now is 127.1 secs Computing kpt #: 109 total cpu time spent up to now is 128.1 secs Computing kpt #: 110 total cpu time spent up to now is 129.0 secs Computing kpt #: 111 total cpu time spent up to now is 130.0 secs Computing kpt #: 112 total cpu time spent up to now is 131.0 secs Computing kpt #: 113 total cpu time spent up to now is 132.0 secs Computing kpt #: 114 total cpu time spent up to now is 133.0 secs Computing kpt #: 115 total cpu time spent up to now is 134.0 secs Computing kpt #: 116 total cpu time spent up to now is 135.1 secs Computing kpt #: 117 total cpu time spent up to now is 136.1 secs Computing kpt #: 118 total cpu time spent up to now is 137.1 secs Computing kpt #: 119 total cpu time spent up to now is 138.1 secs Computing kpt #: 120 total cpu time spent up to now is 139.1 secs Computing kpt #: 121 total cpu time spent up to now is 140.1 secs Computing kpt #: 122 total cpu time spent up to now is 141.1 secs Computing kpt #: 123 total cpu time spent up to now is 142.1 secs Computing kpt #: 124 total cpu time spent up to now is 143.1 secs Computing kpt #: 125 total cpu time spent up to now is 144.0 secs Computing kpt #: 126 total cpu time spent up to now is 145.1 secs Computing kpt #: 127 total cpu time spent up to now is 146.0 secs Computing kpt #: 128 total cpu time spent up to now is 147.0 secs Computing kpt #: 129 total cpu time spent up to now is 148.1 secs Computing kpt #: 130 total cpu time spent up to now is 149.1 secs Computing kpt #: 131 total cpu time spent up to now is 150.1 secs Computing kpt #: 132 total cpu time spent up to now is 151.1 secs Computing kpt #: 133 total cpu time spent up to now is 152.1 secs Computing kpt #: 134 total cpu time spent up to now is 153.3 secs Computing kpt #: 135 total cpu time spent up to now is 154.3 secs Computing kpt #: 136 total cpu time spent up to now is 155.5 secs Computing kpt #: 137 total cpu time spent up to now is 156.5 secs Computing kpt #: 138 total cpu time spent up to now is 157.6 secs Computing kpt #: 139 total cpu time spent up to now is 158.7 secs Computing kpt #: 140 total cpu time spent up to now is 159.8 secs Computing kpt #: 141 total cpu time spent up to now is 160.9 secs Computing kpt #: 142 total cpu time spent up to now is 161.9 secs Computing kpt #: 143 total cpu time spent up to now is 163.0 secs Computing kpt #: 144 total cpu time spent up to now is 164.1 secs Computing kpt #: 145 total cpu time spent up to now is 165.1 secs Computing kpt #: 146 total cpu time spent up to now is 166.3 secs Computing kpt #: 147 total cpu time spent up to now is 167.5 secs Computing kpt #: 148 total cpu time spent up to now is 168.9 secs Computing kpt #: 149 total cpu time spent up to now is 169.9 secs Computing kpt #: 150 total cpu time spent up to now is 171.1 secs Computing kpt #: 151 total cpu time spent up to now is 172.2 secs Computing kpt #: 152 total cpu time spent up to now is 173.3 secs Computing kpt #: 153 total cpu time spent up to now is 174.3 secs Computing kpt #: 154 total cpu time spent up to now is 175.5 secs Computing kpt #: 155 total cpu time spent up to now is 176.5 secs Computing kpt #: 156 total cpu time spent up to now is 177.7 secs Computing kpt #: 157 total cpu time spent up to now is 178.8 secs Computing kpt #: 158 total cpu time spent up to now is 180.0 secs Computing kpt #: 159 total cpu time spent up to now is 181.2 secs Computing kpt #: 160 total cpu time spent up to now is 182.5 secs Computing kpt #: 161 total cpu time spent up to now is 183.6 secs Computing kpt #: 162 total cpu time spent up to now is 184.7 secs Computing kpt #: 163 total cpu time spent up to now is 185.8 secs Computing kpt #: 164 total cpu time spent up to now is 186.9 secs Computing kpt #: 165 total cpu time spent up to now is 188.0 secs Computing kpt #: 166 total cpu time spent up to now is 189.1 secs Computing kpt #: 167 total cpu time spent up to now is 190.1 secs Computing kpt #: 168 total cpu time spent up to now is 191.3 secs Computing kpt #: 169 total cpu time spent up to now is 192.4 secs Computing kpt #: 170 total cpu time spent up to now is 193.5 secs Computing kpt #: 171 total cpu time spent up to now is 194.6 secs Computing kpt #: 172 total cpu time spent up to now is 195.7 secs Computing kpt #: 173 total cpu time spent up to now is 196.8 secs Computing kpt #: 174 total cpu time spent up to now is 197.9 secs Computing kpt #: 175 total cpu time spent up to now is 199.2 secs Computing kpt #: 176 total cpu time spent up to now is 200.5 secs Computing kpt #: 177 total cpu time spent up to now is 201.6 secs Computing kpt #: 178 total cpu time spent up to now is 202.8 secs Computing kpt #: 179 total cpu time spent up to now is 203.9 secs Computing kpt #: 180 total cpu time spent up to now is 205.0 secs Computing kpt #: 181 total cpu time spent up to now is 206.2 secs Computing kpt #: 182 total cpu time spent up to now is 207.3 secs Computing kpt #: 183 total cpu time spent up to now is 208.4 secs Computing kpt #: 184 total cpu time spent up to now is 209.6 secs Computing kpt #: 185 total cpu time spent up to now is 210.7 secs Computing kpt #: 186 total cpu time spent up to now is 211.9 secs Computing kpt #: 187 total cpu time spent up to now is 213.0 secs Computing kpt #: 188 total cpu time spent up to now is 214.2 secs Computing kpt #: 189 total cpu time spent up to now is 215.4 secs Computing kpt #: 190 total cpu time spent up to now is 216.5 secs Computing kpt #: 191 total cpu time spent up to now is 217.6 secs Computing kpt #: 192 total cpu time spent up to now is 218.8 secs Computing kpt #: 193 total cpu time spent up to now is 220.0 secs Computing kpt #: 194 total cpu time spent up to now is 221.2 secs Computing kpt #: 195 total cpu time spent up to now is 222.4 secs Computing kpt #: 196 total cpu time spent up to now is 223.5 secs Computing kpt #: 197 total cpu time spent up to now is 224.7 secs Computing kpt #: 198 total cpu time spent up to now is 225.7 secs Computing kpt #: 199 total cpu time spent up to now is 226.9 secs Computing kpt #: 200 total cpu time spent up to now is 228.0 secs Computing kpt #: 201 total cpu time spent up to now is 229.2 secs Computing kpt #: 202 total cpu time spent up to now is 230.3 secs Computing kpt #: 203 total cpu time spent up to now is 231.4 secs Computing kpt #: 204 total cpu time spent up to now is 232.5 secs Computing kpt #: 205 total cpu time spent up to now is 233.8 secs Computing kpt #: 206 total cpu time spent up to now is 234.9 secs Computing kpt #: 207 total cpu time spent up to now is 236.1 secs Computing kpt #: 208 total cpu time spent up to now is 237.2 secs Computing kpt #: 209 total cpu time spent up to now is 238.4 secs Computing kpt #: 210 total cpu time spent up to now is 239.7 secs Computing kpt #: 211 total cpu time spent up to now is 240.8 secs Computing kpt #: 212 total cpu time spent up to now is 242.1 secs Computing kpt #: 213 total cpu time spent up to now is 243.3 secs Computing kpt #: 214 total cpu time spent up to now is 244.6 secs Computing kpt #: 215 total cpu time spent up to now is 245.9 secs Computing kpt #: 216 total cpu time spent up to now is 247.0 secs Computing kpt #: 217 total cpu time spent up to now is 248.1 secs Computing kpt #: 218 total cpu time spent up to now is 249.4 secs Computing kpt #: 219 total cpu time spent up to now is 250.7 secs Computing kpt #: 220 total cpu time spent up to now is 251.9 secs Computing kpt #: 221 total cpu time spent up to now is 253.2 secs Computing kpt #: 222 total cpu time spent up to now is 254.5 secs Computing kpt #: 223 total cpu time spent up to now is 255.8 secs Computing kpt #: 224 total cpu time spent up to now is 257.1 secs Computing kpt #: 225 total cpu time spent up to now is 258.4 secs Computing kpt #: 226 total cpu time spent up to now is 259.7 secs Computing kpt #: 227 total cpu time spent up to now is 261.0 secs Computing kpt #: 228 total cpu time spent up to now is 262.3 secs Computing kpt #: 229 total cpu time spent up to now is 263.6 secs Computing kpt #: 230 total cpu time spent up to now is 265.0 secs Computing kpt #: 231 total cpu time spent up to now is 266.3 secs Computing kpt #: 232 total cpu time spent up to now is 267.6 secs Computing kpt #: 233 total cpu time spent up to now is 268.7 secs Computing kpt #: 234 total cpu time spent up to now is 269.8 secs Computing kpt #: 235 total cpu time spent up to now is 270.9 secs Computing kpt #: 236 total cpu time spent up to now is 272.0 secs Computing kpt #: 237 total cpu time spent up to now is 273.1 secs Computing kpt #: 238 total cpu time spent up to now is 274.2 secs Computing kpt #: 239 total cpu time spent up to now is 275.3 secs Computing kpt #: 240 total cpu time spent up to now is 276.4 secs Computing kpt #: 241 total cpu time spent up to now is 277.5 secs Computing kpt #: 242 total cpu time spent up to now is 278.6 secs Computing kpt #: 243 total cpu time spent up to now is 279.7 secs Computing kpt #: 244 total cpu time spent up to now is 280.8 secs Computing kpt #: 245 total cpu time spent up to now is 281.9 secs Computing kpt #: 246 total cpu time spent up to now is 283.0 secs Computing kpt #: 247 total cpu time spent up to now is 284.2 secs Computing kpt #: 248 total cpu time spent up to now is 285.3 secs Computing kpt #: 249 total cpu time spent up to now is 286.4 secs Computing kpt #: 250 total cpu time spent up to now is 287.5 secs Computing kpt #: 251 total cpu time spent up to now is 288.6 secs Computing kpt #: 252 total cpu time spent up to now is 289.7 secs Computing kpt #: 253 total cpu time spent up to now is 290.8 secs Computing kpt #: 254 total cpu time spent up to now is 291.8 secs Computing kpt #: 255 total cpu time spent up to now is 292.9 secs Computing kpt #: 256 total cpu time spent up to now is 294.0 secs Computing kpt #: 257 total cpu time spent up to now is 295.1 secs Computing kpt #: 258 total cpu time spent up to now is 296.1 secs Computing kpt #: 259 total cpu time spent up to now is 297.2 secs Computing kpt #: 260 total cpu time spent up to now is 298.3 secs Computing kpt #: 261 total cpu time spent up to now is 299.7 secs Computing kpt #: 262 total cpu time spent up to now is 301.0 secs Computing kpt #: 263 total cpu time spent up to now is 302.3 secs Computing kpt #: 264 total cpu time spent up to now is 303.6 secs Computing kpt #: 265 total cpu time spent up to now is 304.9 secs Computing kpt #: 266 total cpu time spent up to now is 306.2 secs Computing kpt #: 267 total cpu time spent up to now is 307.6 secs Computing kpt #: 268 total cpu time spent up to now is 308.9 secs Computing kpt #: 269 total cpu time spent up to now is 310.2 secs Computing kpt #: 270 total cpu time spent up to now is 311.4 secs Computing kpt #: 271 total cpu time spent up to now is 312.7 secs Computing kpt #: 272 total cpu time spent up to now is 314.0 secs Computing kpt #: 273 total cpu time spent up to now is 315.3 secs Computing kpt #: 274 total cpu time spent up to now is 316.6 secs Computing kpt #: 275 total cpu time spent up to now is 317.7 secs Computing kpt #: 276 total cpu time spent up to now is 318.8 secs ethr = 1.61E-08, avg # of iterations = 19.4 total cpu time spent up to now is 318.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6163 PWs) bands (ev): -8.2637 -8.2637 -6.7110 -6.7110 -6.7035 -6.7035 -6.6927 -6.6927 -2.4552 -2.4552 -0.8604 -0.8604 -0.8567 -0.8567 -0.5638 -0.5638 -0.5062 -0.5062 -0.4972 -0.4972 0.8829 0.8829 1.3995 1.3995 1.8625 1.8625 2.0068 2.0068 2.0295 2.0295 2.6087 2.6087 3.0805 3.0805 3.1545 3.1545 3.4405 3.4405 3.6503 3.6503 3.6755 3.6755 4.5264 4.5264 4.5722 4.5722 4.6511 4.6511 4.6735 4.6735 4.8503 4.8503 4.8784 4.8784 4.9895 4.9895 6.3473 6.3473 6.5461 6.5461 6.6156 6.6156 6.6856 6.6856 8.2299 8.2299 9.4192 9.4192 10.1460 10.1460 10.2209 10.2209 10.3250 10.3250 k = 0.0000 0.0000 0.0214 ( 6183 PWs) bands (ev): -8.2629 -8.2629 -6.7118 -6.7114 -6.7041 -6.7041 -6.6930 -6.6923 -2.4548 -2.4541 -0.8634 -0.8604 -0.8583 -0.8520 -0.5665 -0.5614 -0.5077 -0.5054 -0.5009 -0.4924 0.8827 0.8847 1.3962 1.4010 1.8357 1.8741 2.0021 2.0106 2.0204 2.0551 2.6073 2.6119 3.0797 3.0812 3.1524 3.1557 3.4400 3.4409 3.6452 3.6473 3.6699 3.6780 4.5249 4.5317 4.5630 4.5822 4.6496 4.6529 4.6652 4.6829 4.8429 4.8582 4.8709 4.8882 4.9901 4.9910 6.3386 6.3517 6.4993 6.5158 6.6277 6.6371 6.6981 6.7181 8.2304 8.2358 9.4218 9.4253 10.1346 10.1477 10.2224 10.2227 10.3178 10.3332 k = 0.0000 0.0000 0.0429 ( 6199 PWs) bands (ev): -8.2608 -8.2607 -6.7140 -6.7132 -6.7061 -6.7058 -6.6932 -6.6920 -2.4530 -2.4517 -0.8680 -0.8608 -0.8580 -0.8466 -0.5693 -0.5595 -0.5090 -0.5078 -0.5008 -0.4873 0.8840 0.8879 1.3913 1.4010 1.8020 1.8622 2.0084 2.0143 2.0240 2.0880 2.6077 2.6167 3.0783 3.0815 3.1495 3.1561 3.4394 3.4412 3.6260 3.6384 3.6680 3.6751 4.5274 4.5404 4.5549 4.5929 4.6485 4.6551 4.6583 4.6932 4.8374 4.8653 4.8657 4.9013 4.9926 4.9946 6.3222 6.3525 6.4298 6.4601 6.6353 6.6434 6.7558 6.7782 8.2376 8.2483 9.4331 9.4400 10.1168 10.1393 10.2247 10.2282 10.3120 10.3418 k = 0.0000 0.0000 0.0643 ( 6201 PWs) bands (ev): -8.2571 -8.2571 -6.7178 -6.7165 -6.7090 -6.7084 -6.6933 -6.6917 -2.4499 -2.4478 -0.8726 -0.8613 -0.8574 -0.8410 -0.5723 -0.5579 -0.5116 -0.5099 -0.4988 -0.4820 0.8866 0.8924 1.3855 1.3998 1.7648 1.8324 2.0185 2.0188 2.0414 2.1231 2.6099 2.6231 3.0759 3.0807 3.1465 3.1565 3.4388 3.4412 3.5954 3.6211 3.6687 3.6701 4.5335 4.5474 4.5521 4.6043 4.6474 4.6535 4.6579 4.7040 4.8349 4.8610 4.8725 4.9176 4.9973 5.0005 6.2916 6.3425 6.3644 6.4108 6.6366 6.6416 6.8260 6.8479 8.2515 8.2675 9.4526 9.4630 10.0953 10.1237 10.2259 10.2351 10.3077 10.3503 k = 0.0000 0.0000 0.0857 ( 6189 PWs) bands (ev): -8.2520 -8.2520 -6.7232 -6.7216 -6.7125 -6.7117 -6.6935 -6.6916 -2.4453 -2.4426 -0.8768 -0.8617 -0.8566 -0.8354 -0.5753 -0.5567 -0.5153 -0.5104 -0.4963 -0.4767 0.8903 0.8980 1.3795 1.3984 1.7255 1.7941 2.0236 2.0245 2.0706 2.1589 2.6140 2.6309 3.0719 3.0781 3.1447 3.1576 3.4379 3.4405 3.5578 3.5944 3.6659 3.6701 4.5415 4.5421 4.5647 4.6160 4.6450 4.6519 4.6613 4.7144 4.8363 4.8583 4.8788 4.9367 5.0042 5.0090 6.2417 6.2765 6.3505 6.3763 6.6351 6.6378 6.8987 6.9205 8.2727 8.2936 9.4795 9.4934 10.0719 10.1041 10.2256 10.2409 10.3050 10.3583 k = 0.0000 0.0000 0.1072 ( 6189 PWs) bands (ev): -8.2455 -8.2455 -6.7303 -6.7284 -6.7165 -6.7155 -6.6937 -6.6914 -2.4396 -2.4362 -0.8807 -0.8621 -0.8558 -0.8298 -0.5782 -0.5559 -0.5187 -0.5105 -0.4937 -0.4716 0.8946 0.9041 1.3742 1.3976 1.6847 1.7517 2.0277 2.0285 2.1041 2.1949 2.6199 2.6400 3.0659 3.0726 3.1452 3.1602 3.4365 3.4376 3.5171 3.5601 3.6629 3.6718 4.5363 4.5523 4.5780 4.6278 4.6420 4.6525 4.6652 4.7232 4.8419 4.8578 4.8851 4.9573 5.0132 5.0205 6.1783 6.2010 6.3422 6.3516 6.6318 6.6328 6.9715 6.9934 8.3014 8.3268 9.5125 9.5299 10.0484 10.0831 10.2237 10.2444 10.3041 10.3656 k = 0.0000 0.0000 0.1286 ( 6185 PWs) bands (ev): -8.2376 -8.2375 -6.7390 -6.7370 -6.7211 -6.7200 -6.6940 -6.6914 -2.4326 -2.4287 -0.8842 -0.8625 -0.8549 -0.8244 -0.5809 -0.5555 -0.5219 -0.5102 -0.4909 -0.4666 0.8990 0.9103 1.3710 1.3987 1.6429 1.7069 2.0298 2.0300 2.1396 2.2310 2.6276 2.6503 3.0583 3.0641 3.1484 3.1642 3.4269 3.4339 3.4812 3.5215 3.6606 3.6734 4.5320 4.5631 4.5911 4.6395 4.6398 4.6544 4.6695 4.7299 4.8491 4.8629 4.8916 4.9783 5.0246 5.0360 6.1088 6.1251 6.3292 6.3307 6.6267 6.6272 7.0433 7.0651 8.3383 8.3675 9.5500 9.5706 10.0265 10.0631 10.2202 10.2452 10.3049 10.3724 k = 0.0000 0.0000 0.1500 ( 6181 PWs) bands (ev): -8.2283 -8.2282 -6.7491 -6.7470 -6.7263 -6.7251 -6.6944 -6.6915 -2.4247 -2.4202 -0.8873 -0.8629 -0.8540 -0.8191 -0.5833 -0.5555 -0.5249 -0.5096 -0.4882 -0.4621 0.9028 0.9160 1.3707 1.4027 1.6003 1.6606 2.0272 2.0293 2.1763 2.2673 2.6368 2.6617 3.0497 3.0531 3.1539 3.1693 3.3970 3.4272 3.4633 3.4837 3.6587 3.6748 4.5283 4.5737 4.6034 4.6388 4.6509 4.6570 4.6744 4.7344 4.8539 4.8775 4.8988 4.9982 5.0387 5.0570 6.0371 6.0494 6.3055 6.3150 6.6194 6.6213 7.1130 7.1342 8.3839 8.4160 9.5892 9.6123 10.0092 10.0470 10.2153 10.2436 10.3073 10.3790 k = 0.0000 0.0000 0.1714 ( 6188 PWs) bands (ev): -8.2177 -8.2176 -6.7606 -6.7584 -6.7320 -6.7307 -6.6949 -6.6917 -2.4158 -2.4107 -0.8900 -0.8633 -0.8530 -0.8142 -0.5855 -0.5557 -0.5277 -0.5087 -0.4855 -0.4581 0.9054 0.9207 1.3745 1.4107 1.5575 1.6135 2.0195 2.0246 2.2140 2.3037 2.6477 2.6740 3.0406 3.0410 3.1612 3.1749 3.3549 3.4068 3.4582 3.4583 3.6570 3.6761 4.5251 4.5837 4.6144 4.6391 4.6603 4.6615 4.6797 4.7369 4.8593 4.8980 4.9070 5.0159 5.0560 5.0838 5.9649 5.9747 6.2786 6.2947 6.6111 6.6142 7.1795 7.1994 8.4385 8.4727 9.6262 9.6504 10.0003 10.0381 10.2091 10.2398 10.3112 10.3860 k = 0.0000 0.0000 0.1929 ( 6184 PWs) bands (ev): -8.2057 -8.2056 -6.7732 -6.7710 -6.7384 -6.7370 -6.6955 -6.6921 -2.4061 -2.4006 -0.8922 -0.8637 -0.8520 -0.8095 -0.5873 -0.5561 -0.5302 -0.5076 -0.4828 -0.4547 0.9061 0.9237 1.3824 1.4234 1.5153 1.5660 2.0056 2.0152 2.2527 2.3403 2.6599 2.6872 3.0270 3.0329 3.1696 3.1795 3.3125 3.3709 3.4490 3.4569 3.6553 3.6772 4.5224 4.5926 4.6235 4.6412 4.6644 4.6713 4.6857 4.7378 4.8673 4.9164 4.9214 5.0320 5.0771 5.1158 5.8932 5.9014 6.2479 6.2697 6.6018 6.6061 7.2418 7.2597 8.5023 8.5374 9.6558 9.6783 10.0054 10.0408 10.2019 10.2344 10.3169 10.3944 k = 0.0000 0.0000 0.2143 ( 6188 PWs) bands (ev): -8.1924 -8.1923 -6.7870 -6.7846 -6.7452 -6.7438 -6.6964 -6.6927 -2.3958 -2.3898 -0.8941 -0.8641 -0.8509 -0.8053 -0.5887 -0.5567 -0.5326 -0.5063 -0.4802 -0.4519 0.9043 0.9248 1.3926 1.4407 1.4765 1.5192 1.9851 2.0007 2.2921 2.3772 2.6736 2.7012 3.0121 3.0250 3.1788 3.1804 3.2762 3.3317 3.4457 3.4566 3.6538 3.6781 4.5198 4.6005 4.6300 4.6455 4.6691 4.6801 4.6922 4.7376 4.8783 4.9275 4.9458 5.0472 5.1024 5.1519 5.8228 5.8299 6.2130 6.2399 6.5916 6.5970 7.2992 7.3143 8.5748 8.6099 9.6734 9.6907 10.0280 10.0583 10.1939 10.2280 10.3254 10.4057 k = 0.0000 0.0000 0.2357 ( 6194 PWs) bands (ev): -8.1779 -8.1778 -6.8016 -6.7992 -6.7527 -6.7512 -6.6975 -6.6936 -2.3851 -2.3787 -0.8956 -0.8645 -0.8498 -0.8015 -0.5896 -0.5573 -0.5348 -0.5049 -0.4778 -0.4500 0.8999 0.9237 1.3914 1.4516 1.4552 1.4847 1.9581 1.9814 2.3323 2.4144 2.6884 2.7160 2.9950 3.0155 3.1735 3.1883 3.2534 3.2955 3.4441 3.4568 3.6522 3.6787 4.5174 4.6071 4.6344 4.6517 4.6744 4.6881 4.6990 4.7367 4.8929 4.9405 4.9702 5.0621 5.1324 5.1913 5.7541 5.7607 6.1740 6.2053 6.5804 6.5870 7.3511 7.3627 8.6552 8.6894 9.6769 9.6872 10.0650 10.0895 10.1861 10.2214 10.3385 10.4221 k = 0.0000 0.0000 0.2572 ( 6186 PWs) bands (ev): -8.1623 -8.1621 -6.8170 -6.8145 -6.7605 -6.7590 -6.6988 -6.6947 -2.3739 -2.3672 -0.8966 -0.8649 -0.8487 -0.7983 -0.5901 -0.5580 -0.5368 -0.5034 -0.4754 -0.4488 0.8928 0.9202 1.3620 1.4154 1.4682 1.5033 1.9254 1.9581 2.3731 2.4518 2.7043 2.7315 2.9745 3.0005 3.1607 3.1978 3.2464 3.2654 3.4432 3.4573 3.6506 3.6790 4.5152 4.6127 4.6379 4.6583 4.6803 4.6956 4.7058 4.7354 4.9109 4.9557 4.9938 5.0771 5.1671 5.2333 5.6876 5.6941 6.1309 6.1662 6.5684 6.5760 7.3973 7.4050 8.7419 8.7747 9.6682 9.6719 10.1053 10.1260 10.1823 10.2171 10.3600 10.4467 k = 0.0000 0.0000 0.2786 ( 6186 PWs) bands (ev): -8.1455 -8.1453 -6.8330 -6.8304 -6.7688 -6.7672 -6.7005 -6.6961 -2.3627 -2.3556 -0.8973 -0.8653 -0.8475 -0.7956 -0.5903 -0.5587 -0.5387 -0.5020 -0.4732 -0.4484 0.8828 0.9144 1.3216 1.3688 1.4977 1.5379 1.8886 1.9322 2.4144 2.4893 2.7209 2.7478 2.9491 2.9757 3.1524 3.2064 3.2440 3.2484 3.4427 3.4579 3.6488 3.6789 4.5131 4.6171 4.6413 4.6645 4.6866 4.7028 4.7116 4.7347 4.9322 4.9734 5.0165 5.0922 5.2061 5.2776 5.6236 5.6304 6.0841 6.1229 6.5554 6.5642 7.4379 7.4415 8.8326 8.8639 9.6495 9.6511 10.1270 10.1514 10.1956 10.2220 10.3955 10.4839 k = 0.0000 0.0000 0.3000 ( 6186 PWs) bands (ev): -8.1276 -8.1274 -6.8495 -6.8469 -6.7774 -6.7758 -6.7026 -6.6980 -2.3513 -2.3441 -0.8977 -0.8658 -0.8463 -0.7936 -0.5900 -0.5593 -0.5404 -0.5005 -0.4712 -0.4488 0.8703 0.9063 1.2788 1.3217 1.5338 1.5776 1.8501 1.9062 2.4560 2.5265 2.7381 2.7649 2.9184 2.9407 3.1539 3.2116 3.2344 3.2540 3.4427 3.4588 3.6470 3.6785 4.5112 4.6207 4.6447 4.6699 4.6934 4.7098 4.7153 4.7358 4.9565 4.9939 5.0385 5.1077 5.2488 5.3237 5.5624 5.5700 6.0340 6.0757 6.5417 6.5515 7.4725 7.4730 8.9246 8.9546 9.6239 9.6292 10.1232 10.1544 10.2257 10.2393 10.4492 10.5369 k = 0.0000 0.0000 0.3215 ( 6182 PWs) bands (ev): -8.1088 -8.1085 -6.8663 -6.8636 -6.7864 -6.7847 -6.7051 -6.7003 -2.3401 -2.3327 -0.8978 -0.8662 -0.8451 -0.7921 -0.5893 -0.5599 -0.5419 -0.4992 -0.4693 -0.4499 0.8551 0.8958 1.2357 1.2750 1.5720 1.6183 1.8145 1.8836 2.4977 2.5630 2.7548 2.7827 2.8839 2.8981 3.1636 3.2112 3.2376 3.2609 3.4433 3.4601 3.6450 3.6777 4.5095 4.6234 4.6480 4.6744 4.7007 4.7152 4.7173 4.7399 4.9836 5.0172 5.0603 5.1236 5.2940 5.3712 5.5048 5.5130 5.9809 6.0253 6.5272 6.5379 7.4987 7.5031 9.0136 9.0430 9.5991 9.6062 10.1096 10.1442 10.2545 10.2583 10.5197 10.6054 k = 0.0000 0.0000 0.3429 ( 6166 PWs) bands (ev): -8.0890 -8.0887 -6.8832 -6.8805 -6.7956 -6.7938 -6.7080 -6.7031 -2.3290 -2.3215 -0.8976 -0.8667 -0.8438 -0.7913 -0.5882 -0.5605 -0.5433 -0.4979 -0.4676 -0.4515 0.8373 0.8828 1.1929 1.2289 1.6073 1.6500 1.7933 1.8701 2.5392 2.5979 2.7674 2.8013 2.8508 2.8511 3.1785 3.2107 3.2464 3.2683 3.4447 3.4619 3.6429 3.6765 4.5082 4.6255 4.6514 4.6781 4.7085 4.7136 4.7241 4.7464 5.0128 5.0435 5.0827 5.1400 5.3399 5.4196 5.4520 5.4599 5.9255 5.9720 6.5118 6.5236 7.5205 7.5285 9.0931 9.1235 9.5803 9.5873 10.0918 10.1282 10.2748 10.2777 10.6007 10.6852 k = 0.0000 0.0000 0.3643 ( 6172 PWs) bands (ev): -8.0684 -8.0681 -6.9002 -6.8974 -6.8049 -6.8032 -6.7115 -6.7064 -2.3183 -2.3107 -0.8972 -0.8672 -0.8426 -0.7911 -0.5869 -0.5610 -0.5445 -0.4970 -0.4661 -0.4537 0.8169 0.8670 1.1507 1.1838 1.6322 1.6535 1.8068 1.8738 2.5801 2.6289 2.7639 2.8002 2.8218 2.8344 3.1959 3.2120 3.2565 3.2758 3.4473 3.4646 3.6406 3.6750 4.5071 4.6271 4.6544 4.6809 4.7107 4.7165 4.7309 4.7541 5.0429 5.0722 5.1068 5.1574 5.3705 5.4099 5.4193 5.4695 5.8683 5.9166 6.4958 6.5084 7.5384 7.5496 9.1532 9.1864 9.5766 9.5810 10.0709 10.1084 10.2899 10.2968 10.6863 10.7706 k = 0.0000 0.0000 0.3858 ( 6174 PWs) bands (ev): -8.0470 -8.0467 -6.9170 -6.9141 -6.8144 -6.8126 -6.7156 -6.7103 -2.3079 -2.3004 -0.8967 -0.8677 -0.8413 -0.7916 -0.5853 -0.5615 -0.5455 -0.4963 -0.4647 -0.4562 0.7939 0.8483 1.1092 1.1396 1.6319 1.6416 1.8527 1.9007 2.6197 2.6483 2.7441 2.7499 2.8417 2.8436 3.2138 3.2143 3.2667 3.2832 3.4513 3.4686 3.6381 3.6731 4.5065 4.6282 4.6571 4.6829 4.7073 4.7250 4.7375 4.7625 5.0722 5.1025 5.1343 5.1764 5.3398 5.3645 5.4525 5.5190 5.8100 5.8595 6.4790 6.4924 7.5526 7.5667 9.1823 9.2192 9.5984 9.5990 10.0473 10.0854 10.3051 10.3138 10.7712 10.8555 k = 0.0000 0.0000 0.4072 ( 6182 PWs) bands (ev): -8.0250 -8.0247 -6.9335 -6.9306 -6.8240 -6.8222 -6.7203 -6.7149 -2.2981 -2.2907 -0.8960 -0.8683 -0.8401 -0.7926 -0.5835 -0.5620 -0.5464 -0.4962 -0.4635 -0.4588 0.7682 0.8261 1.0687 1.0967 1.6039 1.6383 1.9136 1.9485 2.6373 2.6540 2.7024 2.7420 2.8629 2.8636 3.2164 3.2306 3.2765 3.2902 3.4573 3.4745 3.6355 3.6709 4.5064 4.6290 4.6592 4.6844 4.7037 4.7339 4.7438 4.7715 5.0984 5.1326 5.1671 5.1985 5.2974 5.3233 5.5017 5.5687 5.7511 5.8016 6.4615 6.4757 7.5632 7.5799 9.1768 9.2164 9.6457 9.6483 10.0208 10.0592 10.3215 10.3304 10.8511 10.9347 k = 0.0000 0.0000 0.4286 ( 6180 PWs) bands (ev): -8.0025 -8.0022 -6.9495 -6.9466 -6.8335 -6.8318 -6.7257 -6.7201 -2.2888 -2.2816 -0.8952 -0.8689 -0.8389 -0.7941 -0.5814 -0.5623 -0.5471 -0.4966 -0.4623 -0.4611 0.7399 0.8005 1.0293 1.0550 1.5776 1.6294 1.9817 2.0105 2.5992 2.6366 2.7050 2.7617 2.8853 2.8875 3.2176 3.2453 3.2853 3.2966 3.4653 3.4828 3.6328 3.6683 4.5070 4.6296 4.6604 4.6856 4.7001 4.7433 4.7496 4.7809 5.1202 5.1592 5.2057 5.2256 5.2581 5.2879 5.5528 5.6181 5.6925 5.7434 6.4435 6.4583 7.5704 7.5893 9.1446 9.1854 9.7132 9.7179 9.9915 10.0297 10.3399 10.3476 10.9228 11.0041 k = 0.0000 0.0000 0.4501 ( 6170 PWs) bands (ev): -7.9796 -7.9792 -6.9649 -6.9620 -6.8430 -6.8413 -6.7319 -6.7261 -2.2802 -2.2731 -0.8943 -0.8696 -0.8378 -0.7960 -0.5793 -0.5627 -0.5476 -0.4977 -0.4631 -0.4614 0.7093 0.7713 0.9911 1.0147 1.5561 1.6200 2.0539 2.0814 2.5520 2.5868 2.7386 2.7871 2.9087 2.9138 3.2174 3.2572 3.2929 3.3021 3.4755 3.4938 3.6300 3.6654 4.5082 4.6301 4.6605 4.6868 4.6966 4.7532 4.7549 4.7907 5.1358 5.1793 5.2224 5.2421 5.2522 5.2761 5.6040 5.6346 5.6668 5.6858 6.4249 6.4403 7.5739 7.5947 9.0954 9.1364 9.7906 9.7969 9.9595 9.9969 10.3610 10.3662 10.9849 11.0623 k = 0.0000 0.0000 0.4715 ( 6180 PWs) bands (ev): -7.9565 -7.9560 -6.9796 -6.9766 -6.8524 -6.8507 -6.7387 -6.7329 -2.2722 -2.2653 -0.8934 -0.8703 -0.8367 -0.7983 -0.5771 -0.5631 -0.5480 -0.4995 -0.4645 -0.4605 0.6765 0.7388 0.9542 0.9760 1.5406 1.6129 2.1285 2.1582 2.5020 2.5358 2.7722 2.8128 2.9331 2.9415 3.2155 3.2662 3.2992 3.3062 3.4875 3.5076 3.6271 3.6622 4.5103 4.6304 4.6593 4.6881 4.6933 4.7595 4.7636 4.8009 5.1385 5.1880 5.2036 5.2269 5.2999 5.3134 5.5784 5.6291 5.6547 5.7146 6.4058 6.4217 7.5734 7.5960 9.0355 9.0763 9.8701 9.8747 9.9292 9.9619 10.3852 10.3868 11.0375 11.1103 k = 0.0000 0.0000 0.4929 ( 6184 PWs) bands (ev): -7.9332 -7.9327 -6.9933 -6.9902 -6.8617 -6.8600 -6.7464 -6.7405 -2.2648 -2.2582 -0.8926 -0.8711 -0.8356 -0.8009 -0.5750 -0.5635 -0.5482 -0.5020 -0.4654 -0.4597 0.6421 0.7036 0.9188 0.9388 1.5314 1.6093 2.2034 2.2388 2.4515 2.4866 2.8041 2.8374 2.9586 2.9701 3.2118 3.2726 3.3044 3.3089 3.5010 3.5236 3.6242 3.6588 4.5132 4.6307 4.6569 4.6896 4.6901 4.7636 4.7745 4.8112 5.1220 5.1757 5.2043 5.2272 5.3519 5.3617 5.5246 5.5747 5.7045 5.7611 6.3864 6.4027 7.5686 7.5927 8.9690 9.0089 9.8759 9.9095 9.9627 9.9721 10.4100 10.4131 11.0824 11.1506 k = 0.0000 0.0000 0.5143 ( 6188 PWs) bands (ev): -7.9099 -7.9094 -7.0060 -7.0029 -6.8707 -6.8690 -6.7549 -6.7490 -2.2581 -2.2519 -0.8917 -0.8719 -0.8347 -0.8037 -0.5729 -0.5639 -0.5482 -0.5050 -0.4657 -0.4590 0.6066 0.6662 0.8849 0.9033 1.5284 1.6098 2.2746 2.3215 2.4016 2.4427 2.8339 2.8604 2.9848 2.9990 3.2066 3.2766 3.3090 3.3107 3.5154 3.5413 3.6213 3.6552 4.5171 4.6310 4.6534 4.6871 4.6915 4.7669 4.7860 4.8217 5.0970 5.1544 5.2147 5.2360 5.4068 5.4148 5.4744 5.5232 5.7530 5.8061 6.3669 6.3834 7.5587 7.5842 8.8986 8.9372 9.8345 9.8696 10.0365 10.0520 10.4364 10.4454 11.1213 11.1854 k = 0.0000 0.0000 0.5358 ( 6186 PWs) bands (ev): -7.8868 -7.8863 -7.0174 -7.0142 -6.8794 -6.8778 -6.7643 -6.7583 -2.2521 -2.2462 -0.8910 -0.8728 -0.8337 -0.8066 -0.5709 -0.5644 -0.5480 -0.5082 -0.4656 -0.4584 0.5705 0.6274 0.8527 0.8695 1.5310 1.6143 2.3237 2.3527 2.4051 2.4217 2.8616 2.8820 3.0115 3.0277 3.2006 3.2786 3.3122 3.3131 3.5300 3.5597 3.6185 3.6516 4.5220 4.6314 4.6489 4.6845 4.6936 4.7694 4.7979 4.8320 5.0713 5.1330 5.2264 5.2444 5.4270 5.4660 5.4699 5.4773 5.8000 5.8492 6.3473 6.3639 7.5432 7.5699 8.8267 8.8634 9.7876 9.8211 10.1106 10.1302 10.4667 10.4828 11.1558 11.2162 k = 0.0000 0.0000 0.5572 ( 6186 PWs) bands (ev): -7.8641 -7.8636 -7.0275 -7.0242 -6.8878 -6.8863 -6.7745 -6.7685 -2.2468 -2.2412 -0.8904 -0.8738 -0.8329 -0.8095 -0.5692 -0.5650 -0.5477 -0.5114 -0.4653 -0.4579 0.5344 0.5881 0.8222 0.8375 1.5386 1.6224 2.3057 2.3125 2.4606 2.4873 2.8876 2.9020 3.0382 3.0556 3.1945 3.2794 3.3138 3.3170 3.5443 3.5781 3.6159 3.6481 4.5281 4.6319 4.6439 4.6820 4.6961 4.7712 4.8102 4.8421 5.0472 5.1129 5.2359 5.2499 5.3879 5.4341 5.5252 5.5306 5.8453 5.8904 6.3278 6.3444 7.5211 7.5490 8.7554 8.7898 9.7366 9.7683 10.1797 10.2036 10.5022 10.5259 11.1865 11.2435 k = 0.0000 0.0000 0.5786 ( 6178 PWs) bands (ev): -7.8420 -7.8415 -7.0360 -7.0327 -6.8958 -6.8944 -6.7855 -6.7795 -2.2420 -2.2369 -0.8898 -0.8749 -0.8321 -0.8123 -0.5677 -0.5657 -0.5471 -0.5144 -0.4647 -0.4574 0.4990 0.5490 0.7935 0.8075 1.5505 1.6338 2.2610 2.2760 2.5228 2.5663 2.9122 2.9206 3.0645 3.0825 3.1902 3.2801 3.3158 3.3210 3.5575 3.5953 3.6139 3.6453 4.5353 4.6324 4.6385 4.6798 4.6988 4.7722 4.8229 4.8517 5.0256 5.0939 5.2403 5.2507 5.3574 5.4005 5.5863 5.5916 5.8885 5.9293 6.3087 6.3252 7.4920 7.5208 8.6868 8.7184 9.6821 9.7117 10.2426 10.2702 10.5440 10.5752 11.2136 11.2670 k = 0.0000 0.0000 0.6001 ( 6164 PWs) bands (ev): -7.8206 -7.8201 -7.0429 -7.0396 -6.9035 -6.9021 -6.7974 -6.7915 -2.2379 -2.2332 -0.8894 -0.8760 -0.8315 -0.8150 -0.5666 -0.5664 -0.5463 -0.5172 -0.4641 -0.4569 0.4647 0.5107 0.7667 0.7793 1.5657 1.6478 2.2192 2.2372 2.5837 2.6389 2.9356 2.9378 3.0900 3.1079 3.1897 3.2826 3.3182 3.3251 3.5691 3.6096 3.6128 3.6445 4.5437 4.6330 4.6330 4.6779 4.7021 4.7725 4.8359 4.8602 5.0068 5.0755 5.2362 5.2453 5.3391 5.3766 5.6482 5.6539 5.9296 5.9658 6.2902 6.3064 7.4551 7.4847 8.6228 8.6512 9.6246 9.6519 10.2986 10.3286 10.5934 10.6310 11.2363 11.2861 k = 0.0000 0.0000 0.6215 ( 6158 PWs) bands (ev): -7.8002 -7.7997 -7.0481 -7.0446 -6.9106 -6.9093 -6.8102 -6.8042 -2.2343 -2.2300 -0.8890 -0.8772 -0.8309 -0.8174 -0.5673 -0.5658 -0.5452 -0.5197 -0.4634 -0.4566 0.4319 0.4739 0.7418 0.7532 1.5836 1.6635 2.1806 2.2002 2.6373 2.7014 2.9537 2.9581 3.1143 3.1316 3.1962 3.2890 3.3207 3.3297 3.5780 3.6133 3.6176 3.6488 4.5529 4.6277 4.6335 4.6761 4.7058 4.7722 4.8492 4.8674 4.9911 5.0571 5.2237 5.2342 5.3332 5.3625 5.7100 5.7164 5.9683 5.9997 6.2729 6.2886 7.4105 7.4405 8.5647 8.5899 9.5647 9.5897 10.3477 10.3780 10.6505 10.6926 11.2537 11.2999 k = 0.0000 0.0000 0.6429 ( 6158 PWs) bands (ev): -7.7809 -7.7804 -7.0513 -7.0478 -6.9173 -6.9161 -6.8237 -6.8178 -2.2313 -2.2274 -0.8888 -0.8785 -0.8304 -0.8197 -0.5682 -0.5654 -0.5440 -0.5218 -0.4627 -0.4564 0.4012 0.4390 0.7189 0.7292 1.6032 1.6803 2.1460 2.1663 2.6806 2.7495 2.9687 2.9792 3.1370 3.1534 3.2126 3.3013 3.3235 3.3351 3.5833 3.6162 3.6186 3.6585 4.5628 4.6228 4.6338 4.6744 4.7103 4.7716 4.8625 4.8725 4.9792 5.0382 5.2079 5.2206 5.3346 5.3555 5.7708 5.7783 6.0044 6.0308 6.2570 6.2721 7.3586 7.3884 8.5138 8.5357 9.5033 9.5258 10.3906 10.4194 10.7142 10.7591 11.2635 11.2868 k = 0.0000 0.0000 0.6644 ( 6150 PWs) bands (ev): -7.7630 -7.7625 -7.0526 -7.0490 -6.9235 -6.9223 -6.8379 -6.8320 -2.2287 -2.2252 -0.8887 -0.8798 -0.8300 -0.8217 -0.5692 -0.5653 -0.5427 -0.5235 -0.4620 -0.4562 0.3727 0.4064 0.6981 0.7072 1.6237 1.6970 2.1159 2.1363 2.7123 2.7803 2.9830 2.9981 3.1578 3.1732 3.2399 3.3205 3.3268 3.3422 3.5855 3.6163 3.6210 3.6700 4.5730 4.6188 4.6338 4.6726 4.7158 4.7711 4.8752 4.8759 4.9713 5.0187 5.1932 5.2080 5.3386 5.3521 5.8294 5.8382 6.0376 6.0588 6.2436 6.2577 7.3004 7.3296 8.4703 8.4891 9.4414 9.4613 10.4279 10.4540 10.7827 10.8292 11.2545 11.2773 k = 0.0000 0.0000 0.6858 ( 6158 PWs) bands (ev): -7.7465 -7.7461 -7.0519 -7.0481 -6.9290 -6.9280 -6.8527 -6.8470 -2.2265 -2.2235 -0.8887 -0.8811 -0.8297 -0.8234 -0.5701 -0.5656 -0.5413 -0.5249 -0.4614 -0.4561 0.3469 0.3766 0.6794 0.6874 1.6441 1.7127 2.0909 2.1107 2.7327 2.7944 2.9966 3.0142 3.1767 3.1907 3.2744 3.3287 3.3486 3.3540 3.5856 3.6129 3.6263 3.6807 4.5827 4.6161 4.6333 4.6707 4.7225 4.7710 4.8753 4.8892 4.9674 4.9985 5.1818 5.1984 5.3426 5.3497 5.8845 5.8949 6.0669 6.0831 6.2338 6.2465 7.2380 7.2658 8.4342 8.4501 9.3801 9.3976 10.4606 10.4833 10.8542 10.9018 11.2344 11.2591 k = 0.0000 0.0000 0.7072 ( 6162 PWs) bands (ev): -7.7317 -7.7313 -7.0491 -7.0453 -6.9340 -6.9331 -6.8681 -6.8625 -2.2247 -2.2221 -0.8887 -0.8824 -0.8295 -0.8249 -0.5710 -0.5660 -0.5399 -0.5261 -0.4609 -0.4561 0.3239 0.3496 0.6629 0.6697 1.6636 1.7262 2.0716 2.0899 2.7431 2.7952 3.0091 3.0269 3.1935 3.2059 3.3050 3.3317 3.3778 3.3817 3.5850 3.6091 3.6309 3.6898 4.5905 4.6158 4.6322 4.6683 4.7305 4.7719 4.8735 4.9023 4.9668 4.9783 5.1746 5.1929 5.3455 5.3468 5.9347 5.9468 6.0909 6.1026 6.2296 6.2402 7.1734 7.1992 8.4051 8.4182 9.3207 9.3358 10.4890 10.5081 10.9270 10.9757 11.2155 11.2370 k = 0.0000 0.0000 0.7287 ( 6158 PWs) bands (ev): -7.7187 -7.7183 -7.0443 -7.0404 -6.9384 -6.9376 -6.8839 -6.8784 -2.2233 -2.2210 -0.8887 -0.8835 -0.8294 -0.8261 -0.5716 -0.5666 -0.5385 -0.5271 -0.4603 -0.4562 0.3039 0.3257 0.6485 0.6543 1.6813 1.7367 2.0580 2.0742 2.7458 2.7874 3.0203 3.0367 3.2081 3.2188 3.3224 3.3346 3.4182 3.4182 3.5841 3.6054 3.6341 3.6966 4.5950 4.6189 4.6304 4.6656 4.7399 4.7742 4.8708 4.9151 4.9587 4.9683 5.1719 5.1915 5.3427 5.3464 5.9787 5.9922 6.1075 6.1158 6.2333 6.2410 7.1095 7.1327 8.3820 8.3928 9.2648 9.2775 10.5134 10.5291 10.9995 11.0498 11.1991 11.2178 k = 0.0000 0.0000 0.7501 ( 6166 PWs) bands (ev): -7.7075 -7.7072 -7.0376 -7.0335 -6.9421 -6.9414 -6.9001 -6.8947 -2.2221 -2.2202 -0.8888 -0.8846 -0.8294 -0.8271 -0.5721 -0.5674 -0.5371 -0.5279 -0.4598 -0.4563 0.2870 0.3050 0.6363 0.6412 1.6967 1.7437 2.0501 2.0633 2.7431 2.7748 3.0298 3.0440 3.2204 3.2294 3.3313 3.3373 3.4551 3.4663 3.5834 3.6018 3.6355 3.7008 4.5968 4.6245 4.6277 4.6627 4.7503 4.7776 4.8681 4.9268 4.9407 4.9708 5.1735 5.1938 5.3369 5.3448 6.0158 6.0297 6.1158 6.1222 6.2454 6.2496 7.0491 7.0691 8.3643 8.3728 9.2139 9.2244 10.5342 10.5467 11.0697 11.1227 11.1855 11.2018 k = 0.0000 0.0000 0.7715 ( 6158 PWs) bands (ev): -7.6983 -7.6981 -7.0291 -7.0248 -6.9453 -6.9446 -6.9163 -6.9111 -2.2211 -2.2197 -0.8888 -0.8856 -0.8293 -0.8278 -0.5724 -0.5682 -0.5358 -0.5286 -0.4594 -0.4565 0.2734 0.2877 0.6264 0.6303 1.7094 1.7472 2.0470 2.0569 2.7373 2.7604 3.0379 3.0493 3.2306 3.2377 3.3368 3.3398 3.4901 3.5139 3.5833 3.5988 3.6348 3.7017 4.5978 4.6243 4.6305 4.6597 4.7611 4.7818 4.8660 4.9214 4.9405 4.9733 5.1790 5.1993 5.3295 5.3407 6.0456 6.0588 6.1181 6.1231 6.2629 6.2643 6.9950 7.0114 8.3510 8.3576 9.1696 9.1779 10.5513 10.5608 11.1325 11.1712 11.1910 11.1967 k = 0.0000 0.0000 0.7930 ( 6166 PWs) bands (ev): -7.6911 -7.6909 -7.0188 -7.0144 -6.9478 -6.9470 -6.9325 -6.9275 -2.2204 -2.2193 -0.8888 -0.8865 -0.8293 -0.8284 -0.5725 -0.5691 -0.5346 -0.5293 -0.4589 -0.4568 0.2632 0.2738 0.6188 0.6217 1.7195 1.7478 2.0471 2.0539 2.7306 2.7464 3.0444 3.0530 3.2386 3.2439 3.3405 3.3420 3.5214 3.5551 3.5857 3.5965 3.6318 3.6987 4.5991 4.6201 4.6359 4.6568 4.7714 4.7863 4.8649 4.9063 4.9506 4.9752 5.1875 5.2066 5.3213 5.3340 6.0683 6.0796 6.1176 6.1211 6.2810 6.2813 6.9501 6.9626 8.3416 8.3464 9.1335 9.1396 10.5649 10.5717 11.1643 11.1643 11.2016 11.2448 k = 0.0000 0.0000 0.8144 ( 6170 PWs) bands (ev): -7.6860 -7.6858 -7.0070 -7.0024 -6.9511 -6.9488 -6.9469 -6.9438 -2.2198 -2.2191 -0.8887 -0.8872 -0.8293 -0.8288 -0.5724 -0.5700 -0.5335 -0.5300 -0.4585 -0.4571 0.2563 0.2634 0.6135 0.6154 1.7275 1.7462 2.0489 2.0529 2.7249 2.7347 3.0495 3.0552 3.2445 3.2480 3.3429 3.3436 3.5473 3.5748 3.5956 3.6028 3.6273 3.6913 4.6010 4.6156 4.6406 4.6539 4.7803 4.7899 4.8655 4.8930 4.9595 4.9758 5.1980 5.2138 5.3136 5.3256 6.0844 6.0928 6.1165 6.1186 6.2959 6.2967 6.9166 6.9250 8.3355 8.3386 9.1069 9.1109 10.5748 10.5793 11.1587 11.1619 11.2240 11.2399 k = 0.0000 0.0000 0.8358 ( 6168 PWs) bands (ev): -7.6829 -7.6828 -6.9939 -6.9892 -6.9649 -6.9596 -6.9499 -6.9499 -2.2194 -2.2191 -0.8885 -0.8878 -0.8293 -0.8291 -0.5720 -0.5708 -0.5325 -0.5308 -0.4581 -0.4574 0.2529 0.2564 0.6105 0.6114 1.7338 1.7431 2.0509 2.0527 2.7216 2.7263 3.0531 3.0559 3.2483 3.2501 3.3444 3.3447 3.5657 3.5768 3.5978 3.6135 3.6373 3.6787 4.6037 4.6112 4.6446 4.6510 4.7870 4.7917 4.8683 4.8820 4.9667 4.9748 5.2084 5.2179 5.3092 5.3169 6.0946 6.0991 6.1160 6.1168 6.3062 6.3068 6.8965 6.9008 8.3322 8.3338 9.0908 9.0928 10.5812 10.5834 11.1557 11.1576 11.2314 11.2362 k = 0.0000 0.0000 0.8572 ( 6164 PWs) bands (ev): -7.6818 -7.6818 -6.9799 -6.9799 -6.9747 -6.9747 -6.9503 -6.9503 -2.2192 -2.2192 -0.8882 -0.8882 -0.8292 -0.8292 -0.5715 -0.5715 -0.5316 -0.5316 -0.4578 -0.4578 0.2529 0.2529 0.6098 0.6098 1.7389 1.7389 2.0522 2.0522 2.7219 2.7219 3.0552 3.0552 3.2502 3.2502 3.3450 3.3450 3.5746 3.5746 3.6051 3.6051 3.6604 3.6604 4.6072 4.6072 4.6480 4.6480 4.7909 4.7909 4.8738 4.8738 4.9718 4.9718 5.2160 5.2160 5.3105 5.3105 6.0993 6.0993 6.1161 6.1161 6.3101 6.3101 6.8911 6.8911 8.3317 8.3317 9.0860 9.0860 10.5841 10.5841 11.1554 11.1554 11.2339 11.2339 k = 0.0000 0.0000 0.8572 ( 6164 PWs) bands (ev): -7.6818 -7.6818 -6.9799 -6.9799 -6.9747 -6.9747 -6.9503 -6.9503 -2.2192 -2.2192 -0.8882 -0.8882 -0.8292 -0.8292 -0.5715 -0.5715 -0.5316 -0.5316 -0.4578 -0.4578 0.2529 0.2529 0.6098 0.6098 1.7389 1.7389 2.0522 2.0522 2.7219 2.7219 3.0552 3.0552 3.2502 3.2502 3.3450 3.3450 3.5746 3.5746 3.6051 3.6051 3.6604 3.6604 4.6072 4.6072 4.6480 4.6480 4.7909 4.7909 4.8738 4.8738 4.9718 4.9718 5.2160 5.2160 5.3105 5.3105 6.0993 6.0993 6.1161 6.1161 6.3101 6.3101 6.8911 6.8911 8.3317 8.3317 9.0860 9.0860 10.5841 10.5841 11.1554 11.1554 11.2339 11.2339 k =-0.0117 0.0163 0.8572 ( 6168 PWs) bands (ev): -7.6819 -7.6819 -6.9799 -6.9796 -6.9747 -6.9747 -6.9508 -6.9504 -2.2191 -2.2184 -0.8891 -0.8870 -0.8308 -0.8275 -0.5728 -0.5699 -0.5328 -0.5303 -0.4588 -0.4569 0.2537 0.2542 0.6106 0.6123 1.7384 1.7400 2.0499 2.0543 2.7205 2.7231 3.0535 3.0548 3.2488 3.2505 3.3443 3.3444 3.5611 3.5821 3.5965 3.6138 3.6611 3.6626 4.6053 4.6083 4.6386 4.6563 4.7889 4.7921 4.8699 4.8753 4.9658 4.9768 5.2147 5.2161 5.3047 5.3195 6.0940 6.0984 6.1134 6.1142 6.3088 6.3091 6.8915 6.8989 8.3359 8.3414 9.0878 9.0882 10.5839 10.5853 11.1216 11.1367 11.2421 11.2618 k =-0.0234 0.0326 0.8572 ( 6172 PWs) bands (ev): -7.6823 -7.6822 -6.9798 -6.9791 -6.9746 -6.9743 -6.9520 -6.9510 -2.2181 -2.2167 -0.8899 -0.8856 -0.8324 -0.8257 -0.5739 -0.5681 -0.5339 -0.5290 -0.4599 -0.4561 0.2565 0.2577 0.6148 0.6180 1.7384 1.7418 2.0473 2.0560 2.7188 2.7242 3.0499 3.0523 3.2464 3.2496 3.3424 3.3429 3.5442 3.5729 3.5992 3.6209 3.6641 3.6672 4.6027 4.6084 4.6283 4.6632 4.7860 4.7927 4.8644 4.8739 4.9596 4.9803 5.2124 5.2149 5.3024 5.3313 6.0829 6.0916 6.1057 6.1078 6.3054 6.3058 6.9001 6.9145 8.3537 8.3647 9.0935 9.0943 10.5846 10.5874 11.0674 11.0840 11.2687 11.2942 k =-0.0352 0.0490 0.8572 ( 6168 PWs) bands (ev): -7.6829 -7.6828 -6.9800 -6.9787 -6.9740 -6.9733 -6.9536 -6.9523 -2.2162 -2.2141 -0.8903 -0.8840 -0.8338 -0.8237 -0.5748 -0.5659 -0.5348 -0.5276 -0.4612 -0.4554 0.2614 0.2633 0.6221 0.6270 1.7390 1.7441 2.0444 2.0575 2.7167 2.7251 3.0444 3.0474 3.2430 3.2477 3.3394 3.3404 3.5243 3.5551 3.6062 3.6270 3.6684 3.6733 4.5992 4.6066 4.6185 4.6688 4.7824 4.7926 4.8579 4.8691 4.9540 4.9823 5.2093 5.2124 5.3036 5.3452 6.0664 6.0794 6.0929 6.0970 6.3001 6.3005 6.9165 6.9374 8.3845 8.4011 9.1029 9.1042 10.5861 10.5902 11.0038 11.0197 11.2928 11.3211 k =-0.0469 0.0653 0.8572 ( 6166 PWs) bands (ev): -7.6838 -7.6837 -6.9806 -6.9788 -6.9724 -6.9715 -6.9559 -6.9542 -2.2136 -2.2108 -0.8906 -0.8823 -0.8352 -0.8215 -0.5756 -0.5634 -0.5355 -0.5263 -0.4627 -0.4547 0.2684 0.2711 0.6327 0.6391 1.7402 1.7470 2.0413 2.0587 2.7142 2.7258 3.0370 3.0398 3.2386 3.2445 3.3354 3.3372 3.5021 3.5339 3.6136 3.6327 3.6731 3.6801 4.5950 4.5991 4.6130 4.6732 4.7778 4.7916 4.8510 4.8610 4.9498 4.9830 5.2056 5.2088 5.3076 5.3605 6.0454 6.0622 6.0751 6.0821 6.2932 6.2933 6.9402 6.9668 8.4276 8.4497 9.1160 9.1177 10.5877 10.5930 10.9340 10.9486 11.3114 11.3407 k =-0.0586 0.0816 0.8572 ( 6176 PWs) bands (ev): -7.6850 -7.6849 -6.9815 -6.9793 -6.9700 -6.9688 -6.9587 -6.9567 -2.2103 -2.2067 -0.8906 -0.8805 -0.8367 -0.8191 -0.5763 -0.5608 -0.5358 -0.5251 -0.4643 -0.4542 0.2776 0.2811 0.6464 0.6544 1.7417 1.7504 2.0378 2.0598 2.7111 2.7263 3.0275 3.0292 3.2333 3.2402 3.3304 3.3334 3.4783 3.5105 3.6211 3.6379 3.6782 3.6869 4.5872 4.5898 4.6107 4.6763 4.7724 4.7894 4.8441 4.8505 4.9468 4.9825 5.2010 5.2040 5.3141 5.3768 6.0208 6.0407 6.0528 6.0630 6.2845 6.2849 6.9704 7.0019 8.4816 8.5093 9.1323 9.1346 10.5890 10.5954 10.8597 10.8729 11.3233 11.3528 k =-0.0703 0.0979 0.8572 ( 6174 PWs) bands (ev): -7.6866 -7.6865 -6.9825 -6.9800 -6.9673 -6.9654 -6.9616 -6.9598 -2.2063 -2.2021 -0.8905 -0.8787 -0.8381 -0.8166 -0.5770 -0.5582 -0.5354 -0.5239 -0.4661 -0.4536 0.2888 0.2935 0.6631 0.6726 1.7436 1.7542 2.0341 2.0606 2.7073 2.7265 3.0150 3.0159 3.2272 3.2349 3.3248 3.3293 3.4540 3.4857 3.6290 3.6424 3.6838 3.6934 4.5741 4.5837 4.6090 4.6785 4.7663 4.7851 4.8376 4.8394 4.9448 4.9811 5.1958 5.1986 5.3223 5.3937 5.9935 6.0155 6.0264 6.0400 6.2744 6.2755 7.0061 7.0420 8.5451 8.5786 9.1515 9.1545 10.5888 10.5963 10.7826 10.7945 11.3280 11.3573 k =-0.0820 0.1142 0.8572 ( 6178 PWs) bands (ev): -7.6885 -7.6884 -6.9834 -6.9807 -6.9676 -6.9637 -6.9614 -6.9613 -2.2019 -2.1969 -0.8903 -0.8769 -0.8395 -0.8138 -0.5777 -0.5558 -0.5340 -0.5229 -0.4680 -0.4529 0.3023 0.3083 0.6826 0.6937 1.7457 1.7583 2.0302 2.0612 2.7023 2.7265 2.9968 3.0022 3.2203 3.2285 3.3187 3.3251 3.4302 3.4602 3.6371 3.6458 3.6903 3.6996 4.5608 4.5768 4.6070 4.6797 4.7598 4.7777 4.8295 4.8316 4.9435 4.9793 5.1900 5.1925 5.3318 5.4108 5.9640 5.9869 5.9968 6.0135 6.2633 6.2653 7.0467 7.0863 8.6164 8.6559 9.1732 9.1770 10.5855 10.5944 10.7047 10.7155 11.3254 11.3547 k =-0.0937 0.1306 0.8572 ( 6182 PWs) bands (ev): -7.6910 -7.6908 -6.9841 -6.9812 -6.9717 -6.9680 -6.9573 -6.9566 -2.1971 -2.1914 -0.8901 -0.8752 -0.8409 -0.8108 -0.5783 -0.5541 -0.5314 -0.5221 -0.4700 -0.4523 0.3180 0.3255 0.7049 0.7175 1.7480 1.7625 2.0261 2.0617 2.6959 2.7261 2.9740 2.9865 3.2128 3.2212 3.3123 3.3207 3.4078 3.4349 3.6453 3.6477 3.6980 3.7055 4.5476 4.5690 4.6045 4.6803 4.7531 4.7666 4.8225 4.8263 4.9423 4.9770 5.1836 5.1857 5.3423 5.4279 5.9332 5.9550 5.9652 5.9840 6.2514 6.2542 7.0912 7.1339 8.6937 8.7394 9.1966 9.2014 10.5748 10.5859 10.6299 10.6407 11.3157 11.3449 k =-0.1055 0.1469 0.8572 ( 6178 PWs) bands (ev): -7.6939 -7.6938 -6.9845 -6.9815 -6.9766 -6.9729 -6.9522 -6.9513 -2.1922 -2.1856 -0.8897 -0.8736 -0.8423 -0.8077 -0.5790 -0.5532 -0.5273 -0.5214 -0.4722 -0.4517 0.3360 0.3454 0.7298 0.7438 1.7501 1.7668 2.0220 2.0622 2.6878 2.7253 2.9466 2.9688 3.2048 3.2131 3.3057 3.3164 3.3879 3.4105 3.6480 3.6534 3.7070 3.7112 4.5350 4.5605 4.6016 4.6805 4.7465 4.7523 4.8182 4.8217 4.9411 4.9744 5.1767 5.1784 5.3534 5.4447 5.9015 5.9197 5.9329 5.9520 6.2388 6.2425 7.1387 7.1842 8.7749 8.8272 9.2208 9.2271 10.5359 10.5412 10.5881 10.5909 11.2991 11.3284 k =-0.1172 0.1632 0.8572 ( 6196 PWs) bands (ev): -7.6974 -7.6972 -6.9850 -6.9837 -6.9799 -6.9780 -6.9465 -6.9455 -2.1871 -2.1798 -0.8894 -0.8723 -0.8438 -0.8044 -0.5797 -0.5529 -0.5221 -0.5209 -0.4745 -0.4511 0.3563 0.3678 0.7571 0.7726 1.7520 1.7707 2.0180 2.0626 2.6773 2.7241 2.9144 2.9496 3.1962 3.2043 3.2990 3.3121 3.3711 3.3879 3.6469 3.6610 3.7170 3.7171 4.5232 4.5513 4.5982 4.6804 4.7361 4.7401 4.8157 4.8175 4.9398 4.9716 5.1693 5.1706 5.3648 5.4611 5.8694 5.8815 5.9004 5.9180 6.2256 6.2301 7.1887 7.2366 8.8576 8.9171 9.2447 9.2531 10.4683 10.4708 10.5669 10.5690 11.2760 11.3056 k =-0.1289 0.1795 0.8572 ( 6188 PWs) bands (ev): -7.7015 -7.7013 -6.9897 -6.9875 -6.9809 -6.9794 -6.9402 -6.9391 -2.1821 -2.1741 -0.8891 -0.8712 -0.8452 -0.8010 -0.5804 -0.5531 -0.5207 -0.5158 -0.4768 -0.4505 0.3790 0.3928 0.7866 0.8037 1.7534 1.7741 2.0143 2.0631 2.6641 2.7223 2.8779 2.9295 3.1874 3.1950 3.2925 3.3082 3.3578 3.3677 3.6447 3.6677 3.7236 3.7280 4.5125 4.5416 4.5942 4.6804 4.7191 4.7340 4.8139 4.8143 4.9382 4.9688 5.1615 5.1624 5.3764 5.4770 5.8372 5.8414 5.8680 5.8826 6.2120 6.2173 7.2404 7.2903 8.9393 9.0069 9.2670 9.2785 10.3998 10.4032 10.5414 10.5444 11.2473 11.2775 k =-0.1289 0.1795 0.8572 ( 6188 PWs) bands (ev): -7.7015 -7.7013 -6.9897 -6.9875 -6.9809 -6.9794 -6.9402 -6.9391 -2.1821 -2.1741 -0.8891 -0.8712 -0.8452 -0.8010 -0.5804 -0.5531 -0.5207 -0.5158 -0.4768 -0.4505 0.3790 0.3928 0.7866 0.8037 1.7534 1.7741 2.0143 2.0631 2.6641 2.7223 2.8779 2.9295 3.1874 3.1950 3.2925 3.3082 3.3578 3.3677 3.6447 3.6677 3.7236 3.7280 4.5125 4.5416 4.5942 4.6804 4.7191 4.7340 4.8139 4.8143 4.9382 4.9688 5.1615 5.1624 5.3764 5.4770 5.8372 5.8414 5.8680 5.8826 6.2120 6.2173 7.2404 7.2903 8.9393 9.0069 9.2670 9.2785 10.3998 10.4032 10.5414 10.5444 11.2473 11.2775 k =-0.1377 0.1918 0.8421 ( 6182 PWs) bands (ev): -7.7053 -7.7051 -6.9947 -6.9918 -6.9838 -6.9809 -6.9326 -6.9300 -2.1785 -2.1700 -0.8889 -0.8705 -0.8463 -0.7984 -0.5809 -0.5534 -0.5205 -0.5108 -0.4786 -0.4501 0.3985 0.4143 0.8107 0.8289 1.7541 1.7766 2.0112 2.0629 2.6524 2.7213 2.8476 2.9139 3.1798 3.1868 3.2873 3.3046 3.3480 3.3562 3.6421 3.6715 3.7227 3.7402 4.5052 4.5342 4.5908 4.6804 4.7052 4.7307 4.8106 4.8143 4.9364 4.9678 5.1545 5.1565 5.3848 5.4883 5.8105 5.8138 5.8441 5.8555 6.2001 6.2064 7.2827 7.3339 8.9989 9.0735 9.2830 9.2979 10.3432 10.3554 10.5182 10.5305 11.2215 11.2523 k =-0.1466 0.2041 0.8270 ( 6174 PWs) bands (ev): -7.7099 -7.7097 -6.9997 -6.9966 -6.9897 -6.9862 -6.9202 -6.9165 -2.1751 -2.1660 -0.8887 -0.8699 -0.8472 -0.7960 -0.5813 -0.5536 -0.5204 -0.5055 -0.4803 -0.4499 0.4210 0.4389 0.8368 0.8560 1.7546 1.7796 2.0069 2.0613 2.6394 2.7212 2.8148 2.8978 3.1699 3.1766 3.2817 3.2991 3.3368 3.3502 3.6388 3.6735 3.7193 3.7502 4.4985 4.5270 4.5869 4.6800 4.6908 4.7287 4.8065 4.8143 4.9337 4.9696 5.1471 5.1503 5.3921 5.4980 5.7797 5.7919 5.8214 5.8285 6.1859 6.1941 7.3302 7.3824 9.0561 9.1385 9.2981 9.3182 10.2837 10.3020 10.5025 10.5219 11.1915 11.2233 k =-0.1554 0.2164 0.8118 ( 6183 PWs) bands (ev): -7.7152 -7.7149 -7.0046 -7.0016 -6.9967 -6.9931 -6.9054 -6.9011 -2.1718 -2.1622 -0.8885 -0.8692 -0.8480 -0.7937 -0.5818 -0.5537 -0.5204 -0.5003 -0.4819 -0.4497 0.4464 0.4664 0.8647 0.8849 1.7552 1.7829 2.0015 2.0582 2.6244 2.7213 2.7800 2.8820 3.1576 3.1642 3.2755 3.2907 3.3275 3.3472 3.6355 3.6740 3.7146 3.7567 4.4927 4.5201 4.5826 4.6729 4.6829 4.7276 4.8015 4.8142 4.9307 4.9739 5.1402 5.1442 5.3975 5.5054 5.7491 5.7719 5.8000 5.8017 6.1704 6.1812 7.3822 7.4351 9.1092 9.2011 9.3103 9.3380 10.2242 10.2443 10.4955 10.5184 11.1584 11.1913 k =-0.1642 0.2287 0.7967 ( 6177 PWs) bands (ev): -7.7209 -7.7206 -7.0095 -7.0069 -7.0036 -7.0004 -6.8895 -6.8848 -2.1687 -2.1587 -0.8884 -0.8685 -0.8487 -0.7915 -0.5822 -0.5535 -0.5203 -0.4954 -0.4831 -0.4496 0.4746 0.4969 0.8941 0.9153 1.7560 1.7867 1.9950 2.0536 2.6067 2.7189 2.7460 2.8668 3.1425 3.1497 3.2689 3.2794 3.3215 3.3460 3.6325 3.6734 3.7089 3.7598 4.4882 4.5134 4.5781 4.6583 4.6828 4.7270 4.7957 4.8137 4.9281 4.9805 5.1344 5.1389 5.4005 5.5100 5.7186 5.7536 5.7751 5.7803 6.1547 6.1689 7.4379 7.4914 9.1561 9.2598 9.3182 9.3569 10.1663 10.1851 10.4970 10.5211 11.1231 11.1569 k =-0.1731 0.2410 0.7815 ( 6175 PWs) bands (ev): -7.7270 -7.7267 -7.0145 -7.0131 -7.0096 -7.0075 -6.8730 -6.8681 -2.1657 -2.1554 -0.8884 -0.8676 -0.8493 -0.7896 -0.5827 -0.5531 -0.5202 -0.4918 -0.4831 -0.4497 0.5057 0.5301 0.9248 0.9470 1.7573 1.7908 1.9874 2.0478 2.5860 2.6972 2.7293 2.8525 3.1241 3.1328 3.2618 3.2664 3.3179 3.3464 3.6299 3.6721 3.7025 3.7599 4.4851 4.5072 4.5734 4.6433 4.6837 4.7269 4.7892 4.8127 4.9267 4.9889 5.1299 5.1352 5.4007 5.5113 5.6883 5.7361 5.7496 5.7615 6.1397 6.1579 7.4965 7.5504 9.1940 9.3056 9.3283 9.3749 10.1115 10.1266 10.5069 10.5305 11.0866 11.1210 k =-0.1819 0.2533 0.7664 ( 6173 PWs) bands (ev): -7.7333 -7.7330 -7.0204 -7.0193 -7.0152 -7.0135 -6.8564 -6.8513 -2.1630 -2.1524 -0.8884 -0.8667 -0.8498 -0.7879 -0.5832 -0.5524 -0.5200 -0.4909 -0.4803 -0.4497 0.5393 0.5658 0.9566 0.9797 1.7589 1.7954 1.9790 2.0410 2.5621 2.6594 2.7265 2.8391 3.1023 3.1135 3.2520 3.2553 3.3160 3.3480 3.6279 3.6703 3.6961 3.7575 4.4835 4.5013 4.5685 4.6285 4.6849 4.7268 4.7821 4.8109 4.9272 4.9986 5.1270 5.1338 5.3980 5.5088 5.6581 5.7159 5.7284 5.7435 6.1263 6.1488 7.5571 7.6115 9.2200 9.3062 9.3713 9.3936 10.0615 10.0709 10.5246 10.5468 11.0497 11.0843 k =-0.1907 0.2656 0.7512 ( 6181 PWs) bands (ev): -7.7398 -7.7394 -7.0272 -7.0251 -7.0208 -7.0183 -6.8399 -6.8347 -2.1605 -2.1497 -0.8886 -0.8656 -0.8502 -0.7866 -0.5838 -0.5514 -0.5198 -0.4918 -0.4761 -0.4498 0.5754 0.6039 0.9892 1.0131 1.7610 1.8005 1.9699 2.0334 2.5351 2.6189 2.7242 2.8264 3.0771 3.0916 3.2384 3.2479 3.3152 3.3507 3.6265 3.6682 3.6903 3.7529 4.4837 4.4959 4.5635 4.6141 4.6867 4.7268 4.7747 4.8083 4.9298 5.0096 5.1259 5.1351 5.3922 5.5024 5.6283 5.6911 5.7128 5.7262 6.1153 6.1422 7.6189 7.6738 9.2317 9.2915 9.4138 9.4170 10.0169 10.0202 10.5486 10.5690 11.0133 11.0478 k =-0.1996 0.2780 0.7361 ( 6184 PWs) bands (ev): -7.7462 -7.7459 -7.0339 -7.0313 -7.0256 -7.0225 -6.8238 -6.8184 -2.1582 -2.1472 -0.8888 -0.8645 -0.8504 -0.7855 -0.5845 -0.5501 -0.5195 -0.4932 -0.4718 -0.4497 0.6136 0.6441 1.0222 1.0468 1.7633 1.8058 1.9604 2.0253 2.5054 2.5775 2.7205 2.8142 3.0487 3.0669 3.2251 3.2407 3.3153 3.3541 3.6258 3.6657 3.6859 3.7469 4.4852 4.4913 4.5586 4.6002 4.6889 4.7267 4.7672 4.8052 4.9348 5.0214 5.1266 5.1390 5.3835 5.4920 5.5988 5.6650 5.6993 5.7096 6.1071 6.1381 7.6809 7.7363 9.2295 9.2690 9.4360 9.4578 9.9734 9.9810 10.5765 10.5947 10.9786 11.0126 k =-0.2084 0.2903 0.7209 ( 6184 PWs) bands (ev): -7.7525 -7.7522 -7.0402 -7.0376 -7.0298 -7.0264 -6.8081 -6.8026 -2.1561 -2.1450 -0.8891 -0.8633 -0.8504 -0.7848 -0.5853 -0.5486 -0.5191 -0.4946 -0.4681 -0.4491 0.6536 0.6862 1.0554 1.0805 1.7661 1.8115 1.9506 2.0169 2.4733 2.5358 2.7152 2.8020 3.0178 3.0396 3.2124 3.2338 3.3161 3.3581 3.6256 3.6632 3.6832 3.7398 4.4848 4.4906 4.5538 4.5871 4.6916 4.7264 4.7600 4.8015 4.9419 5.0338 5.1295 5.1453 5.3722 5.4777 5.5697 5.6387 5.6869 5.6938 6.1018 6.1364 7.7421 7.7981 9.2160 9.2408 9.4580 9.4938 9.9344 9.9510 10.6042 10.6205 10.9472 10.9806 k =-0.2173 0.3026 0.7058 ( 6189 PWs) bands (ev): -7.7587 -7.7583 -7.0462 -7.0437 -7.0336 -7.0301 -6.7932 -6.7875 -2.1543 -2.1430 -0.8895 -0.8622 -0.8501 -0.7843 -0.5861 -0.5470 -0.5185 -0.4960 -0.4656 -0.4477 0.6952 0.7297 1.0882 1.1139 1.7690 1.8175 1.9406 2.0085 2.4395 2.4940 2.7080 2.7897 2.9850 3.0100 3.2006 3.2272 3.3174 3.3625 3.6257 3.6611 3.6823 3.7322 4.4811 4.4950 4.5491 4.5748 4.6947 4.7260 4.7533 4.7977 4.9510 5.0465 5.1343 5.1539 5.3585 5.4598 5.5412 5.6125 5.6750 5.6793 6.0991 6.1367 7.8015 7.8581 9.1945 9.2093 9.4785 9.5249 9.9022 9.9285 10.6260 10.6411 10.9220 10.9549 k =-0.2261 0.3149 0.6906 ( 6189 PWs) bands (ev): -7.7645 -7.7642 -7.0517 -7.0494 -7.0371 -7.0335 -6.7790 -6.7733 -2.1526 -2.1413 -0.8899 -0.8613 -0.8495 -0.7842 -0.5869 -0.5455 -0.5176 -0.4972 -0.4644 -0.4453 0.7378 0.7743 1.1205 1.1464 1.7722 1.8236 1.9306 2.0003 2.4044 2.4525 2.6992 2.7770 2.9511 2.9787 3.1899 3.2210 3.3190 3.3670 3.6260 3.6600 3.6826 3.7245 4.4774 4.5009 4.5444 4.5639 4.6978 4.7257 4.7473 4.7939 4.9618 5.0591 5.1408 5.1644 5.3431 5.4389 5.5134 5.5866 5.6632 5.6670 6.0987 6.1388 7.8577 7.9149 9.1680 9.1771 9.4969 9.5515 9.8770 9.9129 10.6341 10.6498 10.9066 10.9394 k =-0.2349 0.3272 0.6755 ( 6192 PWs) bands (ev): -7.7701 -7.7697 -7.0568 -7.0546 -7.0403 -7.0367 -6.7658 -6.7600 -2.1511 -2.1398 -0.8903 -0.8607 -0.8485 -0.7843 -0.5877 -0.5441 -0.5165 -0.4983 -0.4644 -0.4422 0.7810 0.8194 1.1516 1.1775 1.7755 1.8297 1.9207 1.9926 2.3687 2.4115 2.6893 2.7641 2.9170 2.9461 3.1802 3.2153 3.3208 3.3714 3.6263 3.6604 3.6837 3.7171 4.4740 4.5072 4.5393 4.5553 4.7008 4.7259 4.7421 4.7903 4.9738 5.0716 5.1487 5.1765 5.3267 5.4157 5.4863 5.5609 5.6515 5.6568 6.1001 6.1420 7.9098 7.9674 9.1388 9.1472 9.5133 9.5742 9.8589 9.9037 10.6230 10.6409 10.9035 10.9368 k =-0.2438 0.3395 0.6603 ( 6191 PWs) bands (ev): -7.7751 -7.7748 -7.0614 -7.0594 -7.0432 -7.0396 -6.7537 -6.7478 -2.1498 -2.1386 -0.8907 -0.8603 -0.8471 -0.7846 -0.5885 -0.5428 -0.5153 -0.4992 -0.4651 -0.4388 0.8242 0.8644 1.1811 1.2069 1.7789 1.8359 1.9110 1.9855 2.3330 2.3715 2.6786 2.7511 2.8835 2.9132 3.1716 3.2102 3.3227 3.3757 3.6266 3.6621 3.6851 3.7105 4.4711 4.5123 4.5337 4.5506 4.7029 4.7268 4.7379 4.7870 4.9868 5.0838 5.1575 5.1894 5.3103 5.3913 5.4598 5.5358 5.6409 5.6480 6.1028 6.1459 7.9566 8.0145 9.1101 9.1203 9.5285 9.5936 9.8480 9.9004 10.5932 10.6135 10.9106 10.9448 k =-0.2526 0.3518 0.6452 ( 6191 PWs) bands (ev): -7.7798 -7.7794 -7.0655 -7.0637 -7.0457 -7.0421 -6.7427 -6.7367 -2.1487 -2.1375 -0.8910 -0.8600 -0.8456 -0.7851 -0.5892 -0.5418 -0.5139 -0.4997 -0.4664 -0.4354 0.8665 0.9085 1.2086 1.2338 1.7824 1.8419 1.9016 1.9792 2.2980 2.3329 2.6681 2.7384 2.8513 2.8807 3.1641 3.2056 3.3245 3.3796 3.6270 3.6649 3.6859 3.7054 4.4687 4.5131 4.5294 4.5507 4.7041 4.7286 4.7346 4.7841 5.0003 5.0957 5.1665 5.2025 5.2952 5.3666 5.4341 5.5112 5.6317 5.6404 6.1062 6.1502 7.9972 8.0551 9.0848 9.0968 9.5431 9.6102 9.8447 9.9029 10.5490 10.5712 10.9225 10.9578 k =-0.2614 0.3641 0.6300 ( 6195 PWs) bands (ev): -7.7839 -7.7835 -7.0691 -7.0675 -7.0480 -7.0444 -6.7331 -6.7270 -2.1477 -2.1367 -0.8913 -0.8600 -0.8439 -0.7857 -0.5898 -0.5410 -0.5125 -0.4998 -0.4680 -0.4321 0.9073 0.9509 1.2335 1.2578 1.7857 1.8475 1.8925 1.9737 2.2647 2.2961 2.6582 2.7264 2.8211 2.8496 3.1578 3.2016 3.3262 3.3830 3.6276 3.6683 3.6851 3.7027 4.4669 4.5084 4.5277 4.5552 4.7044 4.7311 4.7322 4.7817 5.0139 5.1069 5.1752 5.2142 5.2833 5.3430 5.4092 5.4874 5.6239 5.6338 6.1099 6.1545 8.0311 8.0887 9.0639 9.0773 9.5577 9.6244 9.8497 9.9111 10.4948 10.5183 10.9348 10.9712 k =-0.2703 0.3764 0.6149 ( 6194 PWs) bands (ev): -7.7874 -7.7870 -7.0721 -7.0707 -7.0499 -7.0463 -6.7247 -6.7186 -2.1469 -2.1360 -0.8916 -0.8600 -0.8422 -0.7865 -0.5904 -0.5405 -0.5114 -0.4993 -0.4698 -0.4293 0.9453 0.9903 1.2556 1.2784 1.7889 1.8526 1.8841 1.9691 2.2340 2.2619 2.6499 2.7157 2.7934 2.8208 3.1525 3.1982 3.3277 3.3860 3.6284 3.6719 3.6823 3.7027 4.4658 4.5016 4.5266 4.5622 4.7043 4.7304 4.7337 4.7799 5.0271 5.1173 5.1830 5.2221 5.2773 5.3219 5.3854 5.4644 5.6175 5.6281 6.1137 6.1585 8.0581 8.1151 9.0478 9.0622 9.5723 9.6360 9.8635 9.9256 10.4338 10.4586 10.9453 10.9826 k =-0.2791 0.3887 0.5997 ( 6196 PWs) bands (ev): -7.7904 -7.7900 -7.0746 -7.0734 -7.0515 -7.0479 -6.7178 -6.7116 -2.1463 -2.1354 -0.8918 -0.8601 -0.8407 -0.7872 -0.5909 -0.5401 -0.5106 -0.4983 -0.4717 -0.4268 0.9795 1.0256 1.2744 1.2951 1.7918 1.8568 1.8768 1.9655 2.2070 2.2313 2.6438 2.7066 2.7686 2.7954 3.1482 3.1954 3.3290 3.3884 3.6295 3.6751 3.6788 3.7040 4.4655 4.4946 4.5255 4.5698 4.7043 4.7293 4.7358 4.7786 5.0394 5.1266 5.1893 5.2240 5.2788 5.3054 5.3629 5.4427 5.6124 5.6234 6.1171 6.1621 8.0786 8.1348 9.0361 9.0510 9.5865 9.6450 9.8869 9.9469 10.3687 10.3948 10.9535 10.9914 k =-0.2879 0.4010 0.5846 ( 6198 PWs) bands (ev): -7.7927 -7.7923 -7.0765 -7.0756 -7.0528 -7.0491 -6.7124 -6.7062 -2.1458 -2.1350 -0.8920 -0.8602 -0.8393 -0.7879 -0.5913 -0.5399 -0.5101 -0.4970 -0.4735 -0.4249 1.0083 1.0552 1.2897 1.3076 1.7942 1.8593 1.8716 1.9628 2.1848 2.2054 2.6401 2.6990 2.7476 2.7741 3.1450 3.1932 3.3299 3.3903 3.6306 3.6747 3.6787 3.7057 4.4658 4.4882 4.5245 4.5769 4.7045 4.7289 4.7369 4.7779 5.0501 5.1344 5.1936 5.2216 5.2823 5.2983 5.3423 5.4224 5.6086 5.6197 6.1200 6.1651 8.0932 8.1486 9.0282 9.0435 9.5993 9.6514 9.9194 9.9752 10.3022 10.3295 10.9594 10.9977 k =-0.2968 0.4133 0.5694 ( 6194 PWs) bands (ev): -7.7943 -7.7940 -7.0778 -7.0771 -7.0537 -7.0500 -6.7085 -6.7022 -2.1454 -2.1347 -0.8921 -0.8602 -0.8383 -0.7884 -0.5915 -0.5397 -0.5098 -0.4955 -0.4752 -0.4234 1.0304 1.0778 1.3014 1.3157 1.7961 1.8588 1.8697 1.9610 2.1685 2.1854 2.6389 2.6928 2.7320 2.7578 3.1427 3.1916 3.3307 3.3916 3.6316 3.6720 3.6809 3.7072 4.4669 4.4827 4.5238 4.5824 4.7048 4.7290 4.7371 4.7775 5.0585 5.1404 5.1955 5.2186 5.2807 5.3045 5.3246 5.4047 5.6060 5.6171 6.1221 6.1673 8.1028 8.1576 9.0232 9.0387 9.6096 9.6555 9.9596 10.0096 10.2381 10.2658 10.9633 11.0019 k =-0.3056 0.4256 0.5543 ( 6196 PWs) bands (ev): -7.7953 -7.7950 -7.0786 -7.0781 -7.0542 -7.0506 -6.7061 -6.6998 -2.1452 -2.1345 -0.8922 -0.8603 -0.8376 -0.7888 -0.5917 -0.5397 -0.5097 -0.4944 -0.4764 -0.4226 1.0444 1.0919 1.3090 1.3199 1.7973 1.8570 1.8701 1.9599 2.1586 2.1726 2.6393 2.6878 2.7229 2.7472 3.1413 3.1907 3.3311 3.3925 3.6324 3.6701 3.6823 3.7081 4.4686 4.4783 4.5233 4.5860 4.7051 4.7293 4.7369 4.7774 5.0639 5.1443 5.1953 5.2168 5.2810 5.3077 5.3164 5.3913 5.6044 5.6154 6.1235 6.1686 8.1082 8.1625 9.0205 9.0361 9.6162 9.6575 10.0026 10.0441 10.1848 10.2086 10.9656 11.0042 k =-0.3144 0.4379 0.5391 ( 6206 PWs) bands (ev): -7.7957 -7.7953 -7.0789 -7.0784 -7.0544 -7.0507 -6.7053 -6.6991 -2.1452 -2.1345 -0.8922 -0.8603 -0.8374 -0.7889 -0.5918 -0.5397 -0.5097 -0.4940 -0.4769 -0.4223 1.0492 1.0967 1.3118 1.3210 1.7977 1.8561 1.8703 1.9596 2.1553 2.1681 2.6398 2.6857 2.7201 2.7435 3.1408 3.1904 3.3312 3.3927 3.6327 3.6695 3.6828 3.7085 4.4697 4.4763 4.5231 4.5872 4.7052 4.7295 4.7366 4.7773 5.0657 5.1457 5.1949 5.2164 5.2825 5.3028 5.3192 5.3858 5.6039 5.6149 6.1239 6.1691 8.1099 8.1640 9.0197 9.0353 9.6185 9.6582 10.0284 10.0591 10.1663 10.1753 10.9663 11.0049 k =-0.3144 0.4379 0.5391 ( 6206 PWs) bands (ev): -7.7957 -7.7953 -7.0789 -7.0784 -7.0544 -7.0507 -6.7053 -6.6991 -2.1452 -2.1345 -0.8922 -0.8603 -0.8374 -0.7889 -0.5918 -0.5397 -0.5097 -0.4940 -0.4769 -0.4223 1.0492 1.0967 1.3118 1.3210 1.7977 1.8561 1.8703 1.9596 2.1553 2.1681 2.6398 2.6857 2.7201 2.7435 3.1408 3.1904 3.3312 3.3927 3.6327 3.6695 3.6828 3.7085 4.4697 4.4763 4.5231 4.5872 4.7052 4.7295 4.7366 4.7773 5.0657 5.1457 5.1949 5.2164 5.2825 5.3028 5.3192 5.3858 5.6039 5.6149 6.1239 6.1691 8.1099 8.1640 9.0197 9.0353 9.6185 9.6582 10.0284 10.0591 10.1663 10.1753 10.9663 11.0049 k =-0.3057 0.4258 0.5241 ( 6190 PWs) bands (ev): -7.7931 -7.7927 -7.0942 -7.0935 -7.0416 -7.0377 -6.7044 -6.6980 -2.1420 -2.1321 -0.8903 -0.8593 -0.8330 -0.7910 -0.5881 -0.5424 -0.5062 -0.4933 -0.4692 -0.4245 1.0515 1.0942 1.2822 1.2919 1.7981 1.8377 1.9091 1.9752 2.1448 2.1571 2.6109 2.6574 2.7039 2.7332 3.1257 3.1844 3.3332 3.3994 3.6167 3.6478 3.6745 3.7000 4.4772 4.4827 4.5390 4.5810 4.7045 4.7389 4.7399 4.7771 5.0725 5.1689 5.1840 5.2230 5.2588 5.3126 5.3487 5.4128 5.6142 5.6276 6.1213 6.1664 8.1251 8.1781 9.0510 9.0631 9.6443 9.6775 10.0677 10.0954 10.2942 10.2977 10.9993 11.0300 k =-0.2970 0.4136 0.5092 ( 6192 PWs) bands (ev): -7.7927 -7.7923 -7.1067 -7.1060 -7.0285 -7.0245 -6.7035 -6.6969 -2.1400 -2.1310 -0.8884 -0.8588 -0.8283 -0.7938 -0.5845 -0.5452 -0.5028 -0.4928 -0.4619 -0.4277 1.0563 1.0933 1.2540 1.2641 1.7900 1.8197 1.9485 1.9991 2.1371 2.1475 2.5811 2.6285 2.6868 2.7203 3.1137 3.1797 3.3360 3.4056 3.6007 3.6265 3.6673 3.6919 4.4842 4.4879 4.5567 4.5751 4.7017 4.7412 4.7524 4.7774 5.0760 5.1600 5.1898 5.2423 5.2438 5.3197 5.3860 5.4418 5.6213 5.6371 6.1144 6.1593 8.1396 8.1907 9.0827 9.0911 9.6618 9.6890 10.1004 10.1265 10.4161 10.4169 11.0416 11.0643 k =-0.2882 0.4014 0.4942 ( 6192 PWs) bands (ev): -7.7948 -7.7945 -7.1161 -7.1153 -7.0151 -7.0110 -6.7026 -6.6959 -2.1394 -2.1314 -0.8865 -0.8585 -0.8235 -0.7970 -0.5808 -0.5481 -0.4996 -0.4926 -0.4550 -0.4317 1.0635 1.0939 1.2274 1.2379 1.7770 1.8027 1.9870 2.0249 2.1347 2.1401 2.5517 2.6003 2.6686 2.7042 3.1051 3.1765 3.3394 3.4114 3.5847 3.6056 3.6608 3.6841 4.4907 4.4925 4.5694 4.5753 4.6983 4.7437 4.7657 4.7782 5.0747 5.1343 5.1992 5.2483 5.2647 5.3282 5.4255 5.4729 5.6250 5.6430 6.1030 6.1477 8.1533 8.2020 9.1146 9.1196 9.6729 9.6944 10.1271 10.1518 10.5253 10.5255 11.0935 11.1079 k =-0.2795 0.3893 0.4792 ( 6188 PWs) bands (ev): -7.7996 -7.7993 -7.1222 -7.1213 -7.0016 -6.9974 -6.7017 -6.6949 -2.1401 -2.1332 -0.8847 -0.8586 -0.8187 -0.8005 -0.5772 -0.5510 -0.4966 -0.4926 -0.4486 -0.4364 1.0727 1.0956 1.2029 1.2135 1.7618 1.7868 2.0220 2.0448 2.1375 2.1429 2.5236 2.5733 2.6492 2.6850 3.0998 3.1746 3.3435 3.4170 3.5688 3.5850 3.6547 3.6764 4.4968 4.4971 4.5643 4.5940 4.6944 4.7464 4.7767 4.7816 5.0673 5.1085 5.1996 5.2716 5.2894 5.3379 5.4666 5.5061 5.6249 5.6453 6.0871 6.1315 8.1662 8.2118 9.1467 9.1485 9.6792 9.6958 10.1475 10.1708 10.6115 10.6136 11.1580 11.1639 k =-0.2708 0.3771 0.4642 ( 6175 PWs) bands (ev): -7.8071 -7.8068 -7.1248 -7.1239 -6.9880 -6.9837 -6.7009 -6.6940 -2.1422 -2.1364 -0.8830 -0.8588 -0.8139 -0.8044 -0.5737 -0.5540 -0.4938 -0.4929 -0.4427 -0.4417 1.0833 1.0979 1.1809 1.1911 1.7462 1.7723 2.0473 2.0528 2.1452 2.1659 2.4975 2.5481 2.6293 2.6632 3.0977 3.1741 3.3481 3.4222 3.5529 3.5645 3.6488 3.6687 4.5017 4.5028 4.5593 4.6127 4.6904 4.7494 4.7795 4.7931 5.0539 5.0833 5.2030 5.3017 5.3162 5.3485 5.5092 5.5410 5.6210 5.6437 6.0666 6.1108 8.1784 8.2202 9.1778 9.1788 9.6828 9.6948 10.1615 10.1832 10.6632 10.6689 11.2377 11.2405 k =-0.2620 0.3649 0.4493 ( 6179 PWs) bands (ev): -7.8172 -7.8170 -7.1241 -7.1232 -6.9742 -6.9699 -6.7001 -6.6932 -2.1457 -2.1410 -0.8816 -0.8592 -0.8092 -0.8083 -0.5705 -0.5570 -0.4936 -0.4913 -0.4472 -0.4374 1.0945 1.0995 1.1621 1.1712 1.7313 1.7595 2.0514 2.0568 2.1685 2.2000 2.4741 2.5253 2.6096 2.6397 3.0980 3.1746 3.3531 3.4271 3.5369 3.5441 3.6429 3.6608 4.5064 4.5085 4.5547 4.6309 4.6863 4.7525 4.7811 4.8050 5.0362 5.0589 5.2116 5.3345 5.3446 5.3603 5.5529 5.5776 5.6132 5.6382 6.0419 6.0855 8.1898 8.2271 9.2073 9.2106 9.6849 9.6930 10.1690 10.1889 10.6739 10.6834 11.3333 11.3432 k =-0.2533 0.3528 0.4343 ( 6175 PWs) bands (ev): -7.8299 -7.8296 -7.1201 -7.1191 -6.9605 -6.9560 -6.6993 -6.6924 -2.1504 -2.1469 -0.8804 -0.8598 -0.8122 -0.8047 -0.5677 -0.5601 -0.4945 -0.4890 -0.4529 -0.4327 1.0990 1.1048 1.1480 1.1547 1.7181 1.7487 2.0452 2.0541 2.2029 2.2394 2.4540 2.5057 2.5909 2.6152 3.1004 3.1760 3.3585 3.4316 3.5208 3.5239 3.6370 3.6527 4.5112 4.5141 4.5504 4.6486 4.6823 4.7559 4.7828 4.8157 5.0162 5.0355 5.2247 5.3691 5.3706 5.3772 5.5957 5.6036 5.6155 5.6291 6.0131 6.0561 8.2003 8.2325 9.2369 9.2417 9.6869 9.6913 10.1704 10.1880 10.6462 10.6587 11.4479 11.4618 k =-0.2446 0.3406 0.4193 ( 6179 PWs) bands (ev): -7.8448 -7.8445 -7.1131 -7.1120 -6.9467 -6.9422 -6.6986 -6.6917 -2.1565 -2.1542 -0.8797 -0.8605 -0.8159 -0.8005 -0.5652 -0.5631 -0.4958 -0.4869 -0.4584 -0.4286 1.0945 1.1109 1.1397 1.1443 1.7074 1.7401 2.0366 2.0451 2.2411 2.2802 2.4385 2.4905 2.5743 2.5907 3.1043 3.1779 3.3642 3.4355 3.5038 3.5045 3.6308 3.6442 4.5161 4.5196 4.5465 4.6655 4.6784 4.7596 4.7847 4.8248 4.9952 5.0133 5.2414 5.3853 5.4048 5.4079 5.5856 5.6157 5.6440 5.6554 5.9809 6.0228 8.2096 8.2362 9.2661 9.2716 9.6894 9.6903 10.1662 10.1812 10.5886 10.6027 11.5751 11.5781 k =-0.2358 0.3284 0.4043 ( 6177 PWs) bands (ev): -7.8617 -7.8614 -7.1032 -7.1022 -6.9330 -6.9285 -6.6980 -6.6910 -2.1639 -2.1627 -0.8795 -0.8613 -0.8193 -0.7965 -0.5661 -0.5634 -0.4975 -0.4851 -0.4635 -0.4252 1.0866 1.1081 1.1365 1.1438 1.6999 1.7340 2.0263 2.0326 2.2780 2.3188 2.4289 2.4820 2.5611 2.5669 3.1093 3.1803 3.3701 3.4383 3.4846 3.4881 3.6244 3.6353 4.5209 4.5251 4.5431 4.6745 4.6814 4.7634 4.7867 4.8321 4.9739 4.9923 5.2611 5.4000 5.4408 5.4408 5.5667 5.5991 5.6902 5.6960 5.9460 5.9865 8.2173 8.2378 9.2944 9.2998 9.6899 9.6926 10.1577 10.1697 10.5101 10.5248 11.5736 11.6421 k =-0.2271 0.3163 0.3894 ( 6179 PWs) bands (ev): -7.8802 -7.8800 -7.0910 -7.0899 -6.9194 -6.9148 -6.6974 -6.6904 -2.1724 -2.1724 -0.8799 -0.8622 -0.8222 -0.7929 -0.5690 -0.5623 -0.4993 -0.4836 -0.4680 -0.4224 1.0777 1.1005 1.1355 1.1485 1.6964 1.7306 2.0146 2.0175 2.3090 2.3503 2.4273 2.4848 2.5447 2.5534 3.1149 3.1830 3.3762 3.4374 3.4686 3.4713 3.6177 3.6260 4.5252 4.5305 4.5404 4.6707 4.6963 4.7674 4.7887 4.8375 4.9530 4.9724 5.2836 5.4159 5.4740 5.4759 5.5450 5.5796 5.7363 5.7376 5.9096 5.9483 8.2228 8.2369 9.3214 9.3256 9.6894 9.6961 10.1463 10.1548 10.4193 10.4331 11.5197 11.5876 k =-0.2184 0.3041 0.3744 ( 6187 PWs) bands (ev): -7.9000 -7.8998 -7.0766 -7.0755 -6.9059 -6.9013 -6.6968 -6.6899 -2.1831 -2.1821 -0.8808 -0.8632 -0.8245 -0.7898 -0.5719 -0.5621 -0.5012 -0.4823 -0.4719 -0.4202 1.0697 1.0930 1.1345 1.1527 1.6973 1.7298 2.0002 2.0016 2.3303 2.3696 2.4341 2.5029 2.5251 2.5543 3.1209 3.1857 3.3824 3.4271 3.4543 3.4616 3.6107 3.6163 4.5280 4.5359 4.5395 4.6670 4.7101 4.7715 4.7907 4.8410 4.9326 4.9537 5.3085 5.4331 5.5014 5.5070 5.5263 5.5589 5.7796 5.7802 5.8741 5.9112 8.2254 8.2327 9.3463 9.3484 9.6869 9.6985 10.1336 10.1384 10.3234 10.3352 11.4501 11.5173 k =-0.2096 0.2919 0.3594 ( 6187 PWs) bands (ev): -7.9208 -7.9206 -7.0604 -7.0593 -6.8926 -6.8880 -6.6963 -6.6895 -2.1949 -2.1928 -0.8822 -0.8642 -0.8263 -0.7870 -0.5746 -0.5627 -0.5030 -0.4813 -0.4752 -0.4186 1.0633 1.0875 1.1326 1.1541 1.7027 1.7316 1.9811 1.9871 2.3429 2.3780 2.4442 2.5042 2.5395 2.5681 3.1270 3.1884 3.3887 3.4088 3.4369 3.4622 3.6034 3.6062 4.5280 4.5411 4.5417 4.6635 4.7226 4.7756 4.7926 4.8424 4.9132 4.9364 5.3357 5.4514 5.4866 5.5173 5.5462 5.5509 5.8108 5.8184 5.8466 5.8878 8.2240 8.2245 9.3680 9.3687 9.6791 9.6967 10.1208 10.1225 10.2301 10.2390 11.3688 11.4337 k =-0.2009 0.2798 0.3444 ( 6187 PWs) bands (ev): -7.9423 -7.9421 -7.0428 -7.0417 -6.8795 -6.8749 -6.6959 -6.6891 -2.2074 -2.2045 -0.8841 -0.8652 -0.8276 -0.7848 -0.5772 -0.5641 -0.5044 -0.4805 -0.4780 -0.4175 1.0589 1.0844 1.1295 1.1522 1.7125 1.7358 1.9603 1.9712 2.3515 2.3815 2.4513 2.4888 2.5816 2.5960 3.1330 3.1908 3.3877 3.3951 3.4194 3.4653 3.5958 3.5959 4.5263 4.5459 4.5463 4.6601 4.7337 4.7797 4.7943 4.8417 4.8949 4.9203 5.3649 5.4542 5.4744 5.4954 5.5622 5.5742 5.8020 5.8155 5.8711 5.9074 8.2113 8.2175 9.3841 9.3882 9.6602 9.6854 10.1035 10.1090 10.1479 10.1592 11.2786 11.3402 k =-0.1922 0.2676 0.3295 ( 6165 PWs) bands (ev): -7.9642 -7.9640 -7.0241 -7.0229 -6.8666 -6.8621 -6.6955 -6.6888 -2.2208 -2.2170 -0.8861 -0.8661 -0.8284 -0.7831 -0.5796 -0.5661 -0.5053 -0.4804 -0.4800 -0.4169 1.0562 1.0839 1.1252 1.1468 1.7262 1.7420 1.9382 1.9541 2.3600 2.3845 2.4546 2.4754 2.6284 2.6344 3.1387 3.1929 3.3656 3.3994 3.4041 3.4691 3.5854 3.5882 4.5242 4.5507 4.5514 4.6569 4.7433 4.7836 4.7956 4.8390 4.8781 4.9056 5.3954 5.4230 5.4673 5.4954 5.5613 5.5928 5.7799 5.8114 5.9143 5.9503 8.1921 8.2047 9.3974 9.4044 9.6237 9.6562 10.0610 10.0857 10.0997 10.1279 11.1818 11.2395 k =-0.1834 0.2555 0.3145 ( 6173 PWs) bands (ev): -7.9863 -7.9861 -7.0044 -7.0033 -6.8540 -6.8496 -6.6951 -6.6885 -2.2348 -2.2303 -0.8884 -0.8671 -0.8290 -0.7820 -0.5819 -0.5685 -0.5059 -0.4827 -0.4798 -0.4170 1.0547 1.0861 1.1207 1.1383 1.7431 1.7500 1.9151 1.9358 2.3701 2.3889 2.4564 2.4645 2.6772 2.6789 3.1441 3.1944 3.3429 3.3834 3.4090 3.4729 3.5752 3.5804 4.5220 4.5556 4.5564 4.6537 4.7514 4.7872 4.7960 4.8341 4.8631 4.8922 5.3887 5.4181 5.4462 5.5192 5.5418 5.5912 5.7734 5.8258 5.9585 5.9978 8.1659 8.1844 9.4089 9.4159 9.5672 9.6019 10.0223 10.0494 10.0952 10.1257 11.0804 11.1339 k =-0.1747 0.2433 0.2995 ( 6181 PWs) bands (ev): -8.0083 -8.0081 -6.9842 -6.9830 -6.8418 -6.8374 -6.6948 -6.6884 -2.2492 -2.2442 -0.8907 -0.8681 -0.8294 -0.7815 -0.5839 -0.5710 -0.5062 -0.4848 -0.4799 -0.4174 1.0532 1.0909 1.1172 1.1271 1.7593 1.7622 1.8914 1.9166 2.3820 2.3951 2.4562 2.4584 2.7265 2.7268 3.1489 3.1952 3.3200 3.3657 3.4159 3.4765 3.5657 3.5727 4.5200 4.5604 4.5611 4.6507 4.7578 4.7904 4.7948 4.8275 4.8504 4.8803 5.3532 5.3962 5.4688 5.5098 5.5435 5.5679 5.7890 5.8545 6.0030 6.0466 8.1320 8.1556 9.4129 9.4197 9.5045 9.5241 10.0072 10.0365 10.0962 10.1324 10.9759 11.0253 k =-0.1660 0.2311 0.2845 ( 6177 PWs) bands (ev): -8.0301 -8.0299 -6.9635 -6.9623 -6.8299 -6.8256 -6.6945 -6.6882 -2.2641 -2.2585 -0.8927 -0.8690 -0.8298 -0.7817 -0.5856 -0.5734 -0.5064 -0.4868 -0.4802 -0.4184 1.0502 1.0978 1.1146 1.1167 1.7695 1.7827 1.8674 1.8968 2.3949 2.4020 2.4516 2.4619 2.7756 2.7765 3.1531 3.1952 3.2974 3.3485 3.4230 3.4794 3.5575 3.5654 4.5182 4.5652 4.5658 4.6479 4.7623 4.7907 4.7930 4.8206 4.8398 4.8700 5.3168 5.3635 5.4624 5.5110 5.5247 5.5758 5.8189 5.8916 6.0474 6.0957 8.0900 8.1177 9.3584 9.4200 9.4425 9.4808 10.0105 10.0405 10.1023 10.1445 10.8700 10.9152 k =-0.1572 0.2190 0.2696 ( 6185 PWs) bands (ev): -8.0515 -8.0513 -6.9426 -6.9415 -6.8185 -6.8142 -6.6943 -6.6882 -2.2792 -2.2732 -0.8946 -0.8698 -0.8302 -0.7824 -0.5872 -0.5753 -0.5065 -0.4888 -0.4807 -0.4198 1.0441 1.0958 1.1119 1.1208 1.7802 1.8037 1.8436 1.8769 2.4065 2.4069 2.4533 2.4684 2.8250 2.8256 3.1565 3.1942 3.2753 3.3320 3.4302 3.4808 3.5514 3.5587 4.5166 4.5697 4.5702 4.6452 4.7649 4.7829 4.7947 4.8146 4.8312 4.8617 5.2799 5.3294 5.4184 5.4798 5.5489 5.6057 5.8553 5.9331 6.0914 6.1444 8.0396 8.0706 9.2670 9.3264 9.4499 9.4891 10.0252 10.0550 10.1128 10.1604 10.7639 10.8050 k =-0.1485 0.2068 0.2546 ( 6171 PWs) bands (ev): -8.0723 -8.0722 -6.9218 -6.9207 -6.8074 -6.8032 -6.6941 -6.6882 -2.2944 -2.2881 -0.8961 -0.8705 -0.8306 -0.7838 -0.5883 -0.5768 -0.5065 -0.4908 -0.4814 -0.4216 1.0350 1.0807 1.1239 1.1301 1.7907 1.8211 1.8246 1.8572 2.4055 2.4153 2.4636 2.4800 2.8736 2.8738 3.1593 3.1922 3.2547 3.3170 3.4374 3.4804 3.5485 3.5532 4.5154 4.5741 4.5744 4.6427 4.7655 4.7722 4.7954 4.8079 4.8252 4.8555 5.2430 5.2951 5.3719 5.4323 5.5903 5.6386 5.8949 5.9769 6.1350 6.1924 7.9814 8.0145 9.1672 9.2229 9.4684 9.5062 10.0465 10.0753 10.1270 10.1787 10.6590 10.6962 k =-0.1398 0.1946 0.2396 ( 6175 PWs) bands (ev): -8.0925 -8.0924 -6.9012 -6.9001 -6.7968 -6.7928 -6.6940 -6.6882 -2.3096 -2.3031 -0.8972 -0.8711 -0.8312 -0.7857 -0.5892 -0.5777 -0.5067 -0.4928 -0.4824 -0.4239 1.0235 1.0639 1.1393 1.1437 1.7917 1.8091 1.8381 1.8451 2.3997 2.4184 2.4804 2.4970 2.9195 2.9209 3.1609 3.1891 3.2367 3.3044 3.4443 3.4776 3.5489 3.5491 4.5145 4.5781 4.5782 4.6403 4.7600 4.7641 4.7946 4.7986 4.8222 4.8516 5.2062 5.2612 5.3255 5.3845 5.6339 5.6740 5.9356 6.0214 6.1778 6.2395 7.9159 7.9504 9.0664 9.1197 9.4911 9.5275 10.0711 10.0977 10.1440 10.1978 10.5567 10.5901 k =-0.1310 0.1825 0.2246 ( 6175 PWs) bands (ev): -8.1119 -8.1117 -6.8809 -6.8799 -6.7867 -6.7828 -6.6938 -6.6883 -2.3246 -2.3180 -0.8978 -0.8716 -0.8320 -0.7882 -0.5898 -0.5780 -0.5069 -0.4949 -0.4836 -0.4265 1.0106 1.0467 1.1570 1.1609 1.7730 1.8184 1.8201 1.8646 2.3906 2.4168 2.5010 2.5177 2.9620 2.9649 3.1607 3.1852 3.2240 3.2955 3.4507 3.4733 3.5471 3.5526 4.5139 4.5816 4.5818 4.6382 4.7474 4.7606 4.7870 4.7925 4.8210 4.8497 5.1700 5.2280 5.2802 5.3377 5.6796 5.7119 5.9767 6.0657 6.2200 6.2854 7.8441 7.8791 8.9677 9.0190 9.5175 9.5520 10.0970 10.1192 10.1635 10.2157 10.4590 10.4889 k =-0.1223 0.1703 0.2097 ( 6179 PWs) bands (ev): -8.1304 -8.1303 -6.8612 -6.8602 -6.7771 -6.7733 -6.6938 -6.6884 -2.3393 -2.3328 -0.8980 -0.8720 -0.8329 -0.7912 -0.5900 -0.5776 -0.5072 -0.4971 -0.4849 -0.4295 0.9971 1.0294 1.1768 1.1811 1.7531 1.8036 1.8306 1.8831 2.3788 2.4112 2.5232 2.5400 2.9992 3.0040 3.1571 3.1808 3.2203 3.2920 3.4563 3.4681 3.5476 3.5587 4.5137 4.5846 4.5850 4.6363 4.7346 4.7552 4.7741 4.7893 4.8204 4.8495 5.1346 5.1957 5.2368 5.2926 5.7272 5.7522 6.0173 6.1088 6.2612 6.3297 7.7670 7.8020 8.8726 8.9222 9.5467 9.5782 10.1224 10.1362 10.1851 10.2280 10.3687 10.3977 k =-0.1136 0.1581 0.1947 ( 6179 PWs) bands (ev): -8.1479 -8.1478 -6.8422 -6.8412 -6.7681 -6.7644 -6.6937 -6.6886 -2.3536 -2.3472 -0.8977 -0.8722 -0.8341 -0.7946 -0.5899 -0.5766 -0.5077 -0.4992 -0.4863 -0.4329 0.9833 1.0123 1.1983 1.2037 1.7348 1.7891 1.8435 1.9006 2.3641 2.4020 2.5454 2.5621 3.0285 3.0357 3.1504 3.1762 3.2288 3.2962 3.4607 3.4630 3.5511 3.5666 4.5140 4.5871 4.5878 4.6346 4.7218 4.7482 4.7600 4.7852 4.8200 4.8504 5.1003 5.1644 5.1962 5.2497 5.7768 5.7951 6.0571 6.1501 6.3016 6.3721 7.6857 7.7202 8.7822 8.8301 9.5772 9.6046 10.1432 10.1450 10.2077 10.2205 10.2925 10.3327 k =-0.1048 0.1460 0.1797 ( 6183 PWs) bands (ev): -8.1644 -8.1643 -6.8239 -6.8230 -6.7596 -6.7560 -6.6936 -6.6888 -2.3674 -2.3611 -0.8970 -0.8723 -0.8355 -0.7985 -0.5894 -0.5750 -0.5083 -0.5013 -0.4879 -0.4367 0.9697 0.9958 1.2209 1.2281 1.7185 1.7770 1.8569 1.9171 2.3465 2.3891 2.5662 2.5827 3.0480 3.0581 3.1431 3.1718 3.2494 3.3099 3.4583 3.4642 3.5574 3.5757 4.5147 4.5887 4.5899 4.6333 4.7092 4.7398 4.7451 4.7805 4.8197 4.8518 5.0673 5.1340 5.1593 5.2095 5.8283 5.8405 6.0955 6.1887 6.3409 6.4124 7.6013 7.6350 8.6975 8.7435 9.6069 9.6286 10.1276 10.1493 10.1873 10.2291 10.2459 10.3155 k =-0.0961 0.1338 0.1647 ( 6179 PWs) bands (ev): -8.1798 -8.1796 -6.8067 -6.8058 -6.7517 -6.7483 -6.6936 -6.6890 -2.3805 -2.3745 -0.8957 -0.8722 -0.8370 -0.8026 -0.5886 -0.5730 -0.5091 -0.5031 -0.4895 -0.4407 0.9565 0.9799 1.2443 1.2537 1.7050 1.7678 1.8706 1.9326 2.3257 2.3725 2.5843 2.6007 3.0585 3.0714 3.1374 3.1677 3.2800 3.3329 3.4544 3.4674 3.5663 3.5858 4.5158 4.5894 4.5913 4.6324 4.6970 4.7296 4.7304 4.7753 4.8193 4.8533 5.0361 5.1037 5.1269 5.1723 5.8818 5.8883 6.1322 6.2243 6.3792 6.4504 7.5147 7.5475 8.6190 8.6630 9.6325 9.6464 10.0877 10.0958 10.1944 10.2316 10.2509 10.3217 k =-0.0873 0.1216 0.1498 ( 6173 PWs) bands (ev): -8.1940 -8.1939 -6.7905 -6.7897 -6.7443 -6.7411 -6.6936 -6.6893 -2.3929 -2.3871 -0.8940 -0.8719 -0.8387 -0.8070 -0.5874 -0.5705 -0.5103 -0.5045 -0.4911 -0.4451 0.9440 0.9649 1.2677 1.2797 1.6948 1.7621 1.8848 1.9471 2.3016 2.3521 2.5989 2.6153 3.0632 3.0778 3.1337 3.1639 3.3171 3.3621 3.4515 3.4714 3.5773 3.5964 4.5176 4.5888 4.5919 4.6319 4.6853 4.7137 4.7200 4.7694 4.8191 4.8546 5.0070 5.0735 5.0995 5.1381 5.9370 5.9385 6.1670 6.2561 6.4163 6.4857 7.4269 7.4586 8.5473 8.5890 9.6492 9.6529 10.0410 10.0485 10.2084 10.2337 10.2678 10.3321 k =-0.0786 0.1095 0.1348 ( 6183 PWs) bands (ev): -8.2069 -8.2069 -6.7755 -6.7748 -6.7376 -6.7346 -6.6936 -6.6895 -2.4043 -2.3990 -0.8919 -0.8715 -0.8406 -0.8117 -0.5860 -0.5679 -0.5118 -0.5056 -0.4929 -0.4498 0.9323 0.9508 1.2905 1.3053 1.6887 1.7605 1.8992 1.9606 2.2744 2.3281 2.6094 2.6260 3.0654 3.0804 3.1318 3.1605 3.3576 3.3924 3.4500 3.4789 3.5896 3.6071 4.5198 4.5864 4.5913 4.6317 4.6745 4.6978 4.7091 4.7628 4.8190 4.8555 4.9804 5.0443 5.0764 5.1073 5.9910 5.9941 6.1994 6.2839 6.4520 6.5180 7.3386 7.3692 8.4827 8.5218 9.6440 9.6509 10.0044 10.0259 10.2198 10.2384 10.2814 10.3418 k =-0.0699 0.0973 0.1198 ( 6185 PWs) bands (ev): -8.2187 -8.2186 -6.7619 -6.7613 -6.7314 -6.7287 -6.6936 -6.6898 -2.4148 -2.4099 -0.8893 -0.8709 -0.8426 -0.8166 -0.5842 -0.5651 -0.5133 -0.5062 -0.4945 -0.4547 0.9216 0.9379 1.3121 1.3293 1.6876 1.7635 1.9137 1.9728 2.2440 2.3006 2.6156 2.6326 3.0672 3.0813 3.1314 3.1577 3.3978 3.4167 3.4515 3.4940 3.6027 3.6178 4.5227 4.5817 4.5893 4.6321 4.6650 4.6822 4.6980 4.7553 4.8192 4.8559 4.9568 5.0169 5.0569 5.0799 6.0456 6.0529 6.2296 6.3077 6.4860 6.5472 7.2504 7.2800 8.4255 8.4617 9.6198 9.6344 9.9909 10.0226 10.2277 10.2425 10.2915 10.3494 k =-0.0611 0.0852 0.1048 ( 6187 PWs) bands (ev): -8.2291 -8.2290 -6.7496 -6.7492 -6.7259 -6.7234 -6.6936 -6.6901 -2.4243 -2.4199 -0.8864 -0.8701 -0.8447 -0.8216 -0.5822 -0.5625 -0.5146 -0.5066 -0.4962 -0.4599 0.9121 0.9262 1.3317 1.3507 1.6922 1.7714 1.9283 1.9838 2.2109 2.2699 2.6181 2.6354 3.0692 3.0816 3.1323 3.1558 3.4272 3.4306 3.4647 3.5190 3.6162 3.6280 4.5261 4.5744 4.5854 4.6328 4.6566 4.6683 4.6874 4.7468 4.8199 4.8559 4.9364 4.9916 5.0404 5.0562 6.1020 6.1132 6.2574 6.3273 6.5178 6.5730 7.1630 7.1916 8.3758 8.4086 9.5856 9.6034 9.9973 10.0343 10.2324 10.2450 10.2984 10.3544 k =-0.0524 0.0730 0.0899 ( 6195 PWs) bands (ev): -8.2382 -8.2381 -6.7389 -6.7386 -6.7209 -6.7187 -6.6936 -6.6905 -2.4326 -2.4287 -0.8831 -0.8692 -0.8469 -0.8267 -0.5799 -0.5603 -0.5154 -0.5067 -0.4979 -0.4652 0.9037 0.9157 1.3489 1.3685 1.7033 1.7844 1.9426 1.9933 2.1755 2.2363 2.6177 2.6349 3.0714 3.0818 3.1345 3.1548 3.4357 3.4370 3.4982 3.5493 3.6297 3.6375 4.5303 4.5649 4.5794 4.6327 4.6484 4.6586 4.6779 4.7372 4.8213 4.8558 4.9191 4.9686 5.0267 5.0362 6.1596 6.1747 6.2833 6.3434 6.5470 6.5951 7.0769 7.1045 8.3336 8.3627 9.5477 9.5654 10.0161 10.0547 10.2343 10.2453 10.3026 10.3566 k =-0.0437 0.0608 0.0749 ( 6187 PWs) bands (ev): -8.2459 -8.2459 -6.7298 -6.7297 -6.7164 -6.7146 -6.6935 -6.6908 -2.4396 -2.4364 -0.8795 -0.8680 -0.8491 -0.8318 -0.5774 -0.5588 -0.5153 -0.5065 -0.4994 -0.4707 0.8967 0.9066 1.3633 1.3822 1.7210 1.8021 1.9564 2.0010 2.1387 2.2006 2.6154 2.6318 3.0737 3.0820 3.1377 3.1546 3.4376 3.4397 3.5367 3.5791 3.6430 3.6460 4.5353 4.5540 4.5711 4.6273 4.6438 4.6541 4.6699 4.7266 4.8236 4.8560 4.9044 4.9480 5.0154 5.0200 6.2167 6.2366 6.3090 6.3567 6.5733 6.6133 6.9924 7.0192 8.2988 8.3238 9.5109 9.5267 10.0410 10.0787 10.2339 10.2435 10.3051 10.3561 k =-0.0349 0.0487 0.0599 ( 6183 PWs) bands (ev): -8.2523 -8.2523 -6.7226 -6.7224 -6.7124 -6.7112 -6.6935 -6.6912 -2.4455 -2.4428 -0.8755 -0.8667 -0.8513 -0.8369 -0.5747 -0.5581 -0.5143 -0.5061 -0.5009 -0.4762 0.8910 0.8989 1.3750 1.3918 1.7448 1.8235 1.9695 2.0067 2.1015 2.1633 2.6123 2.6271 3.0757 3.0820 3.1416 3.1550 3.4385 3.4409 3.5731 3.6050 3.6533 3.6556 4.5409 4.5433 4.5612 4.6163 4.6450 4.6526 4.6636 4.7154 4.8268 4.8569 4.8917 4.9296 5.0064 5.0075 6.2683 6.2955 6.3392 6.3708 6.5961 6.6273 6.9102 6.9362 8.2713 8.2918 9.4783 9.4915 10.0676 10.1027 10.2317 10.2397 10.3070 10.3530 k =-0.0262 0.0365 0.0449 ( 6197 PWs) bands (ev): -8.2573 -8.2572 -6.7173 -6.7169 -6.7089 -6.7082 -6.6934 -6.6916 -2.4500 -2.4479 -0.8714 -0.8653 -0.8535 -0.8421 -0.5720 -0.5585 -0.5124 -0.5054 -0.5023 -0.4818 0.8868 0.8927 1.3842 1.3976 1.7733 1.8465 1.9814 2.0100 2.0661 2.1256 2.6095 2.6216 3.0773 3.0819 3.1456 3.1556 3.4390 3.4412 3.6050 3.6249 3.6591 3.6668 4.5340 4.5469 4.5509 4.6044 4.6472 4.6540 4.6588 4.7041 4.8311 4.8590 4.8806 4.9135 4.9987 4.9993 6.3047 6.3370 6.3834 6.4000 6.6147 6.6365 6.8310 6.8564 8.2509 8.2666 9.4519 9.4619 10.0934 10.1239 10.2286 10.2342 10.3092 10.3478 k =-0.0175 0.0243 0.0300 ( 6191 PWs) bands (ev): -8.2608 -8.2608 -6.7138 -6.7133 -6.7060 -6.7057 -6.6932 -6.6920 -2.4531 -2.4517 -0.8670 -0.8637 -0.8556 -0.8472 -0.5692 -0.5596 -0.5100 -0.5039 -0.5037 -0.4872 0.8840 0.8879 1.3912 1.4005 1.8048 1.8665 1.9919 2.0108 2.0371 2.0886 2.6077 2.6163 3.0787 3.0816 3.1494 3.1559 3.4395 3.4412 3.6303 3.6388 3.6640 3.6750 4.5276 4.5399 4.5550 4.5929 4.6485 4.6553 4.6586 4.6931 4.8365 4.8615 4.8716 4.8996 4.9930 4.9942 6.3259 6.3502 6.4411 6.4544 6.6282 6.6398 6.7569 6.7815 8.2373 8.2479 9.4328 9.4396 10.1164 10.1398 10.2251 10.2280 10.3127 10.3409 k =-0.0087 0.0122 0.0150 ( 6191 PWs) bands (ev): -8.2630 -8.2629 -6.7118 -6.7114 -6.7041 -6.7041 -6.6930 -6.6923 -2.4548 -2.4542 -0.8625 -0.8619 -0.8574 -0.8522 -0.5664 -0.5615 -0.5079 -0.5050 -0.5012 -0.4924 0.8827 0.8846 1.3962 1.4010 1.8362 1.8744 2.0005 2.0097 2.0224 2.0549 2.6073 2.6118 3.0797 3.0812 3.1524 3.1556 3.4400 3.4409 3.6459 3.6472 3.6694 3.6781 4.5249 4.5316 4.5631 4.5821 4.6496 4.6528 4.6653 4.6828 4.8429 4.8581 4.8714 4.8879 4.9901 4.9909 6.3390 6.3514 6.5024 6.5142 6.6299 6.6330 6.6981 6.7183 8.2304 8.2357 9.4218 9.4252 10.1347 10.1479 10.2221 10.2230 10.3180 10.3330 k = 0.0000 0.0000 0.0000 ( 6163 PWs) bands (ev): -8.2637 -8.2637 -6.7110 -6.7110 -6.7035 -6.7035 -6.6927 -6.6927 -2.4552 -2.4552 -0.8604 -0.8604 -0.8567 -0.8567 -0.5638 -0.5638 -0.5062 -0.5062 -0.4972 -0.4972 0.8829 0.8829 1.3995 1.3995 1.8625 1.8625 2.0068 2.0068 2.0295 2.0295 2.6087 2.6087 3.0805 3.0805 3.1545 3.1545 3.4405 3.4405 3.6503 3.6503 3.6755 3.6755 4.5264 4.5264 4.5722 4.5722 4.6511 4.6511 4.6735 4.6735 4.8503 4.8503 4.8784 4.8784 4.9895 4.9895 6.3473 6.3473 6.5461 6.5461 6.6156 6.6156 6.6856 6.6856 8.2299 8.2299 9.4192 9.4192 10.1460 10.1460 10.2209 10.2209 10.3250 10.3250 k = 0.0000 0.0000 0.0000 ( 6163 PWs) bands (ev): -8.2637 -8.2637 -6.7110 -6.7110 -6.7035 -6.7035 -6.6927 -6.6927 -2.4552 -2.4552 -0.8604 -0.8604 -0.8567 -0.8567 -0.5638 -0.5638 -0.5062 -0.5062 -0.4972 -0.4972 0.8829 0.8829 1.3995 1.3995 1.8625 1.8625 2.0068 2.0068 2.0295 2.0295 2.6087 2.6087 3.0805 3.0805 3.1545 3.1545 3.4405 3.4405 3.6503 3.6503 3.6755 3.6755 4.5264 4.5264 4.5722 4.5722 4.6511 4.6511 4.6735 4.6735 4.8503 4.8503 4.8784 4.8784 4.9895 4.9895 6.3473 6.3473 6.5461 6.5461 6.6156 6.6156 6.6856 6.6856 8.2299 8.2299 9.4192 9.4192 10.1460 10.1460 10.2209 10.2209 10.3250 10.3250 k = 0.0172 0.0124-0.0000 ( 6163 PWs) bands (ev): -8.2630 -8.2630 -6.7110 -6.7110 -6.7035 -6.7035 -6.6939 -6.6939 -2.4546 -2.4546 -0.8605 -0.8605 -0.8567 -0.8567 -0.5639 -0.5639 -0.5063 -0.5063 -0.4971 -0.4971 0.8821 0.8821 1.4027 1.4027 1.8604 1.8604 2.0073 2.0073 2.0297 2.0297 2.6119 2.6119 3.0805 3.0805 3.1542 3.1542 3.4389 3.4389 3.6511 3.6511 3.6769 3.6769 4.5269 4.5269 4.5726 4.5726 4.6512 4.6512 4.6737 4.6737 4.8505 4.8505 4.8785 4.8785 4.9890 4.9890 6.3161 6.3161 6.5597 6.5597 6.6320 6.6320 6.6833 6.6833 8.2302 8.2302 9.4208 9.4208 10.1400 10.1400 10.2178 10.2178 10.3208 10.3208 k = 0.0345 0.0248-0.0000 ( 6155 PWs) bands (ev): -8.2610 -8.2610 -6.7112 -6.7112 -6.7036 -6.7036 -6.6976 -6.6976 -2.4530 -2.4530 -0.8607 -0.8607 -0.8567 -0.8567 -0.5641 -0.5641 -0.5067 -0.5067 -0.4970 -0.4970 0.8800 0.8800 1.4122 1.4122 1.8541 1.8541 2.0086 2.0086 2.0304 2.0304 2.6215 2.6215 3.0805 3.0805 3.1531 3.1531 3.4341 3.4341 3.6534 3.6534 3.6810 3.6810 4.5286 4.5286 4.5736 4.5736 4.6514 4.6514 4.6744 4.6744 4.8507 4.8507 4.8791 4.8791 4.9876 4.9876 6.2497 6.2497 6.5660 6.5660 6.6709 6.6709 6.6939 6.6939 8.2312 8.2312 9.4255 9.4255 10.1226 10.1226 10.2083 10.2083 10.3078 10.3078 k = 0.0517 0.0371 0.0000 ( 6163 PWs) bands (ev): -8.2576 -8.2576 -6.7118 -6.7118 -6.7038 -6.7038 -6.7034 -6.7034 -2.4502 -2.4502 -0.8612 -0.8612 -0.8567 -0.8567 -0.5645 -0.5645 -0.5072 -0.5072 -0.4968 -0.4968 0.8768 0.8768 1.4274 1.4274 1.8440 1.8440 2.0109 2.0109 2.0317 2.0317 2.6368 2.6368 3.0803 3.0803 3.1514 3.1514 3.4259 3.4259 3.6572 3.6572 3.6876 3.6876 4.5311 4.5311 4.5755 4.5755 4.6516 4.6516 4.6754 4.6754 4.8512 4.8512 4.8798 4.8798 4.9855 4.9855 6.1734 6.1734 6.5587 6.5587 6.6607 6.6607 6.7700 6.7700 8.2329 8.2329 9.4330 9.4330 10.0950 10.0950 10.1913 10.1913 10.2857 10.2857 k = 0.0690 0.0495-0.0000 ( 6167 PWs) bands (ev): -8.2530 -8.2530 -6.7148 -6.7148 -6.7093 -6.7093 -6.7040 -6.7040 -2.4464 -2.4464 -0.8618 -0.8618 -0.8568 -0.8568 -0.5650 -0.5650 -0.5080 -0.5080 -0.4965 -0.4965 0.8732 0.8732 1.4479 1.4479 1.8305 1.8305 2.0140 2.0140 2.0338 2.0338 2.6572 2.6572 3.0802 3.0802 3.1492 3.1492 3.4147 3.4147 3.6625 3.6625 3.6966 3.6966 4.5347 4.5347 4.5779 4.5779 4.6521 4.6521 4.6768 4.6768 4.8518 4.8518 4.8804 4.8804 4.9831 4.9831 6.0953 6.0953 6.5446 6.5446 6.6432 6.6432 6.8554 6.8554 8.2354 8.2354 9.4430 9.4430 10.0596 10.0596 10.1657 10.1657 10.2535 10.2535 k = 0.0862 0.0619-0.0000 ( 6179 PWs) bands (ev): -8.2470 -8.2470 -6.7246 -6.7246 -6.7108 -6.7108 -6.7044 -6.7044 -2.4416 -2.4416 -0.8626 -0.8626 -0.8569 -0.8569 -0.5658 -0.5658 -0.5088 -0.5088 -0.4962 -0.4962 0.8697 0.8697 1.4726 1.4726 1.8141 1.8141 2.0179 2.0179 2.0370 2.0370 2.6819 2.6819 3.0802 3.0802 3.1464 3.1464 3.4003 3.4003 3.6694 3.6694 3.7078 3.7078 4.5391 4.5391 4.5811 4.5811 4.6528 4.6528 4.6783 4.6783 4.8527 4.8527 4.8804 4.8804 4.9809 4.9809 6.0180 6.0180 6.5257 6.5257 6.6209 6.6209 6.9430 6.9430 8.2386 8.2386 9.4547 9.4547 10.0189 10.0189 10.1300 10.1300 10.2107 10.2107 k = 0.1034 0.0743 0.0000 ( 6183 PWs) bands (ev): -8.2398 -8.2398 -6.7376 -6.7376 -6.7113 -6.7113 -6.7047 -6.7047 -2.4360 -2.4360 -0.8636 -0.8636 -0.8571 -0.8571 -0.5667 -0.5667 -0.5099 -0.5099 -0.4958 -0.4958 0.8670 0.8670 1.5009 1.5009 1.7958 1.7958 2.0227 2.0227 2.0412 2.0412 2.7100 2.7100 3.0803 3.0803 3.1432 3.1432 3.3829 3.3829 3.6779 3.6779 3.7210 3.7210 4.5445 4.5445 4.5848 4.5848 4.6538 4.6538 4.6797 4.6797 4.8537 4.8537 4.8793 4.8793 4.9797 4.9797 5.9431 5.9431 6.5026 6.5026 6.5945 6.5945 7.0306 7.0306 8.2426 8.2426 9.4671 9.4671 9.9761 9.9761 10.0835 10.0835 10.1570 10.1570 k = 0.1207 0.0867-0.0000 ( 6183 PWs) bands (ev): -8.2313 -8.2313 -6.7530 -6.7530 -6.7117 -6.7117 -6.7052 -6.7052 -2.4295 -2.4295 -0.8646 -0.8646 -0.8573 -0.8573 -0.5677 -0.5677 -0.5111 -0.5111 -0.4954 -0.4954 0.8656 0.8656 1.5315 1.5315 1.7764 1.7764 2.0283 2.0283 2.0464 2.0464 2.7408 2.7408 3.0805 3.0805 3.1398 3.1398 3.3627 3.3627 3.6878 3.6878 3.7360 3.7360 4.5502 4.5502 4.5892 4.5892 4.6551 4.6551 4.6809 4.6809 4.8550 4.8550 4.8768 4.8768 4.9804 4.9804 5.8710 5.8710 6.4760 6.4760 6.5642 6.5642 7.1169 7.1169 8.2475 8.2475 9.4783 9.4783 9.9347 9.9347 10.0261 10.0261 10.0929 10.0929 k = 0.1379 0.0990-0.0000 ( 6191 PWs) bands (ev): -8.2216 -8.2216 -6.7704 -6.7704 -6.7122 -6.7122 -6.7057 -6.7057 -2.4223 -2.4223 -0.8658 -0.8658 -0.8576 -0.8576 -0.5689 -0.5689 -0.5124 -0.5124 -0.4951 -0.4951 0.8661 0.8661 1.5630 1.5630 1.7573 1.7573 2.0346 2.0346 2.0525 2.0525 2.7734 2.7734 3.0810 3.0810 3.1361 3.1361 3.3396 3.3396 3.6990 3.6990 3.7525 3.7525 4.5561 4.5561 4.5941 4.5941 4.6569 4.6569 4.6813 4.6813 4.8564 4.8564 4.8728 4.8728 4.9833 4.9833 5.8024 5.8024 6.4462 6.4462 6.5306 6.5306 7.2008 7.2008 8.2532 8.2532 9.4858 9.4858 9.8978 9.8978 9.9588 9.9588 10.0204 10.0204 k = 0.1552 0.1114 0.0000 ( 6203 PWs) bands (ev): -8.2107 -8.2107 -6.7897 -6.7897 -6.7126 -6.7126 -6.7062 -6.7062 -2.4146 -2.4146 -0.8672 -0.8672 -0.8579 -0.8579 -0.5703 -0.5703 -0.5138 -0.5138 -0.4947 -0.4947 0.8687 0.8687 1.5930 1.5930 1.7408 1.7408 2.0415 2.0415 2.0595 2.0595 2.8072 2.8072 3.0819 3.0819 3.1323 3.1323 3.3141 3.3141 3.7113 3.7113 3.7704 3.7704 4.5619 4.5619 4.5995 4.5995 4.6591 4.6591 4.6807 4.6807 4.8577 4.8577 4.8681 4.8681 4.9888 4.9888 5.7375 5.7375 6.4136 6.4136 6.4941 6.4941 7.2815 7.2815 8.2598 8.2598 9.4866 9.4866 9.8622 9.8622 9.8869 9.8869 9.9449 9.9449 k = 0.1724 0.1238 0.0000 ( 6219 PWs) bands (ev): -8.1987 -8.1987 -6.8107 -6.8107 -6.7130 -6.7130 -6.7068 -6.7068 -2.4064 -2.4064 -0.8687 -0.8687 -0.8583 -0.8583 -0.5718 -0.5718 -0.5153 -0.5153 -0.4944 -0.4944 0.8739 0.8739 1.6165 1.6165 1.7317 1.7317 2.0491 2.0491 2.0671 2.0671 2.8416 2.8416 3.0834 3.0834 3.1285 3.1285 3.2864 3.2864 3.7248 3.7248 3.7895 3.7895 4.5669 4.5669 4.6053 4.6053 4.6619 4.6619 4.6787 4.6787 4.8574 4.8574 4.8650 4.8650 4.9968 4.9968 5.6766 5.6766 6.3786 6.3786 6.4554 6.4554 7.3581 7.3581 8.2672 8.2672 9.4781 9.4781 9.7919 9.7919 9.8260 9.8260 9.8944 9.8944 k = 0.1897 0.1362-0.0000 ( 6199 PWs) bands (ev): -8.1857 -8.1857 -6.8333 -6.8333 -6.7135 -6.7135 -6.7074 -6.7074 -2.3979 -2.3979 -0.8703 -0.8703 -0.8587 -0.8587 -0.5734 -0.5734 -0.5169 -0.5169 -0.4940 -0.4940 0.8818 0.8818 1.6255 1.6255 1.7378 1.7378 2.0571 2.0571 2.0753 2.0753 2.8758 2.8758 3.0855 3.0855 3.1246 3.1246 3.2569 3.2569 3.7392 3.7392 3.8096 3.8096 4.5708 4.5708 4.6116 4.6116 4.6647 4.6647 4.6758 4.6758 4.8543 4.8543 4.8659 4.8659 5.0072 5.0072 5.6196 5.6196 6.3418 6.3418 6.4149 6.4149 7.4298 7.4298 8.2756 8.2756 9.4601 9.4601 9.7038 9.7038 9.7425 9.7425 9.8909 9.8909 k = 0.2069 0.1486 0.0000 ( 6195 PWs) bands (ev): -8.1716 -8.1716 -6.8571 -6.8571 -6.7140 -6.7140 -6.7081 -6.7081 -2.3891 -2.3891 -0.8720 -0.8720 -0.8591 -0.8591 -0.5752 -0.5752 -0.5185 -0.5185 -0.4937 -0.4937 0.8926 0.8926 1.6188 1.6188 1.7599 1.7599 2.0655 2.0655 2.0839 2.0839 2.9091 2.9091 3.0885 3.0885 3.1206 3.1206 3.2263 3.2263 3.7543 3.7543 3.8305 3.8305 4.5721 4.5721 4.6182 4.6182 4.6636 4.6636 4.6758 4.6758 4.8515 4.8515 4.8687 4.8687 5.0193 5.0193 5.5668 5.5668 6.3034 6.3034 6.3731 6.3731 7.4960 7.4960 8.2846 8.2846 9.4343 9.4343 9.6115 9.6115 9.6501 9.6501 9.9096 9.9096 k = 0.2241 0.1609 0.0000 ( 6195 PWs) bands (ev): -8.1567 -8.1567 -6.8822 -6.8822 -6.7145 -6.7145 -6.7087 -6.7087 -2.3802 -2.3802 -0.8739 -0.8739 -0.8596 -0.8596 -0.5770 -0.5770 -0.5202 -0.5202 -0.4934 -0.4934 0.9063 0.9063 1.6038 1.6038 1.7901 1.7901 2.0742 2.0742 2.0928 2.0928 2.9409 2.9409 3.0927 3.0927 3.1163 3.1163 3.1954 3.1954 3.7700 3.7700 3.8521 3.8521 4.5697 4.5697 4.6250 4.6250 4.6574 4.6574 4.6811 4.6811 4.8505 4.8505 4.8721 4.8721 5.0331 5.0331 5.5179 5.5179 6.2640 6.2640 6.3306 6.3306 7.5561 7.5561 8.2944 8.2944 9.4032 9.4032 9.5175 9.5175 9.5564 9.5564 9.9415 9.9415 k = 0.2414 0.1733 0.0000 ( 6187 PWs) bands (ev): -8.1409 -8.1409 -6.9081 -6.9081 -6.7150 -6.7150 -6.7094 -6.7094 -2.3713 -2.3713 -0.8758 -0.8758 -0.8601 -0.8601 -0.5789 -0.5789 -0.5219 -0.5219 -0.4931 -0.4931 0.9230 0.9230 1.5858 1.5858 1.8227 1.8227 2.0831 2.0831 2.1019 2.1019 2.9702 2.9702 3.0980 3.0980 3.1115 3.1115 3.1659 3.1659 3.7860 3.7860 3.8740 3.8740 4.5622 4.5622 4.6320 4.6320 4.6503 4.6503 4.6887 4.6887 4.8519 4.8519 4.8760 4.8760 5.0483 5.0483 5.4730 5.4730 6.2238 6.2238 6.2879 6.2879 7.6096 7.6096 8.3049 8.3049 9.3668 9.3668 9.4241 9.4241 9.4663 9.4663 9.9827 9.9827 k = 0.2586 0.1857-0.0000 ( 6195 PWs) bands (ev): -8.1244 -8.1244 -6.9348 -6.9348 -6.7155 -6.7155 -6.7101 -6.7101 -2.3625 -2.3625 -0.8779 -0.8779 -0.8606 -0.8606 -0.5809 -0.5809 -0.5236 -0.5236 -0.4929 -0.4929 0.9426 0.9426 1.5669 1.5669 1.8550 1.8550 2.0921 2.0921 2.1111 2.1111 2.9958 2.9958 3.0966 3.0966 3.1114 3.1114 3.1418 3.1418 3.8023 3.8023 3.8962 3.8962 4.5484 4.5484 4.6390 4.6390 4.6445 4.6445 4.6976 4.6976 4.8556 4.8556 4.8804 4.8804 5.0647 5.0647 5.4319 5.4319 6.1833 6.1833 6.2455 6.2455 7.6564 7.6564 8.3159 8.3159 9.3138 9.3138 9.3354 9.3354 9.3915 9.3915 10.0305 10.0305 k = 0.2759 0.1981-0.0000 ( 6206 PWs) bands (ev): -8.1073 -8.1073 -6.9619 -6.9619 -6.7159 -6.7159 -6.7108 -6.7108 -2.3540 -2.3540 -0.8800 -0.8800 -0.8611 -0.8611 -0.5830 -0.5830 -0.5254 -0.5254 -0.4927 -0.4927 0.9650 0.9650 1.5483 1.5483 1.8853 1.8853 2.1011 2.1011 2.1201 2.1201 3.0166 3.0166 3.0791 3.0791 3.1208 3.1208 3.1293 3.1293 3.8186 3.8186 3.9184 3.9184 4.5289 4.5289 4.6402 4.6402 4.6463 4.6463 4.7076 4.7076 4.8610 4.8610 4.8852 4.8852 5.0818 5.0818 5.3945 5.3945 6.1430 6.1430 6.2039 6.2039 7.6963 7.6963 8.3273 8.3273 9.2327 9.2327 9.2523 9.2523 9.3460 9.3460 10.0831 10.0831 k = 0.2931 0.2105 0.0000 ( 6206 PWs) bands (ev): -8.0898 -8.0898 -6.9892 -6.9892 -6.7164 -6.7164 -6.7115 -6.7115 -2.3457 -2.3457 -0.8821 -0.8821 -0.8616 -0.8616 -0.5850 -0.5850 -0.5270 -0.5270 -0.4925 -0.4925 0.9899 0.9899 1.5303 1.5303 1.9123 1.9123 2.1099 2.1099 2.1289 2.1289 3.0314 3.0314 3.0561 3.0561 3.1194 3.1194 3.1400 3.1400 3.8347 3.8347 3.9403 3.9403 4.5049 4.5049 4.6378 4.6378 4.6531 4.6531 4.7182 4.7182 4.8679 4.8679 4.8905 4.8905 5.0996 5.0996 5.3606 5.3606 6.1032 6.1032 6.1635 6.1635 7.7295 7.7295 8.3393 8.3393 9.1464 9.1464 9.1676 9.1676 9.3166 9.3166 10.1388 10.1388 k = 0.3103 0.2228 0.0000 ( 6210 PWs) bands (ev): -8.0720 -8.0720 -7.0164 -7.0164 -6.7169 -6.7169 -6.7122 -6.7122 -2.3379 -2.3379 -0.8843 -0.8843 -0.8621 -0.8621 -0.5870 -0.5870 -0.5286 -0.5286 -0.4924 -0.4924 1.0171 1.0171 1.5132 1.5132 1.9353 1.9353 2.1185 2.1185 2.1373 2.1373 3.0271 3.0271 3.0476 3.0476 3.1162 3.1162 3.1585 3.1585 3.8505 3.8505 3.9619 3.9619 4.4777 4.4777 4.6364 4.6364 4.6598 4.6598 4.7291 4.7291 4.8758 4.8758 4.8961 4.8961 5.1177 5.1177 5.3299 5.3299 6.0643 6.0643 6.1248 6.1248 7.7563 7.7563 8.3516 8.3516 9.0631 9.0631 9.0845 9.0845 9.2937 9.2937 10.1962 10.1962 k = 0.3276 0.2352-0.0000 ( 6218 PWs) bands (ev): -8.0541 -8.0541 -7.0432 -7.0432 -6.7173 -6.7173 -6.7128 -6.7128 -2.3305 -2.3305 -0.8864 -0.8864 -0.8625 -0.8625 -0.5889 -0.5889 -0.5302 -0.5302 -0.4923 -0.4923 1.0463 1.0463 1.4973 1.4973 1.9533 1.9533 2.1266 2.1266 2.1452 2.1452 3.0066 3.0066 3.0547 3.0547 3.1142 3.1142 3.1786 3.1786 3.8658 3.8658 3.9828 3.9828 4.4487 4.4487 4.6355 4.6355 4.6660 4.6660 4.7402 4.7402 4.8844 4.8844 4.9020 4.9020 5.1356 5.1356 5.3026 5.3026 6.0269 6.0269 6.0882 6.0882 7.7773 7.7773 8.3643 8.3643 8.9842 8.9842 9.0053 9.0053 9.2745 9.2745 10.2539 10.2539 k = 0.3448 0.2476-0.0000 ( 6218 PWs) bands (ev): -8.0364 -8.0364 -7.0693 -7.0693 -6.7177 -6.7177 -6.7134 -6.7134 -2.3237 -2.3237 -0.8884 -0.8884 -0.8630 -0.8630 -0.5908 -0.5908 -0.5316 -0.5316 -0.4922 -0.4922 1.0770 1.0770 1.4827 1.4827 1.9660 1.9660 2.1342 2.1342 2.1525 2.1525 2.9885 2.9885 3.0609 3.0609 3.1129 3.1129 3.1988 3.1988 3.8804 3.8804 4.0028 4.0028 4.4189 4.4189 4.6349 4.6349 4.6718 4.6718 4.7511 4.7511 4.8932 4.8932 4.9080 4.9080 5.1531 5.1531 5.2784 5.2784 5.9913 5.9913 6.0540 6.0540 7.7930 7.7930 8.3773 8.3773 8.9107 8.9107 8.9313 8.9313 9.2579 9.2579 10.3104 10.3104 k = 0.3621 0.2600-0.0000 ( 6222 PWs) bands (ev): -8.0191 -8.0191 -7.0943 -7.0943 -6.7180 -6.7180 -6.7140 -6.7140 -2.3174 -2.3174 -0.8903 -0.8903 -0.8634 -0.8634 -0.5925 -0.5925 -0.5330 -0.5330 -0.4921 -0.4921 1.1087 1.1087 1.4694 1.4694 1.9729 1.9729 2.1410 2.1410 2.1593 2.1593 2.9744 2.9744 3.0659 3.0659 3.1120 3.1120 3.2181 3.2181 3.8940 3.8940 4.0217 4.0217 4.3891 4.3891 4.6345 4.6345 4.6770 4.6770 4.7617 4.7617 4.9019 4.9019 4.9141 4.9141 5.1694 5.1694 5.2575 5.2575 5.9580 5.9580 6.0224 6.0224 7.8043 7.8043 8.3905 8.3905 8.8432 8.8432 8.8631 8.8631 9.2433 9.2433 10.3627 10.3627 k = 0.3793 0.2724-0.0000 ( 6230 PWs) bands (ev): -8.0026 -8.0026 -7.1179 -7.1179 -6.7184 -6.7184 -6.7145 -6.7145 -2.3118 -2.3118 -0.8921 -0.8921 -0.8638 -0.8638 -0.5942 -0.5942 -0.5342 -0.5342 -0.4921 -0.4921 1.1407 1.1407 1.4575 1.4575 1.9743 1.9743 2.1471 2.1471 2.1654 2.1654 2.9647 2.9647 3.0700 3.0700 3.1116 3.1116 3.2359 3.2359 3.9066 3.9066 4.0392 4.0392 4.3602 4.3602 4.6342 4.6342 4.6815 4.6815 4.7717 4.7717 4.9103 4.9103 4.9199 4.9199 5.1833 5.1833 5.2408 5.2408 5.9274 5.9274 5.9939 5.9939 7.8119 7.8119 8.4036 8.4036 8.7823 8.7823 8.8014 8.8014 9.2303 9.2303 10.2922 10.2922 k = 0.3966 0.2847 0.0000 ( 6226 PWs) bands (ev): -7.9871 -7.9871 -7.1396 -7.1396 -6.7187 -6.7187 -6.7150 -6.7150 -2.3068 -2.3068 -0.8937 -0.8937 -0.8641 -0.8641 -0.5956 -0.5956 -0.5353 -0.5353 -0.4920 -0.4920 1.1723 1.1723 1.4471 1.4471 1.9707 1.9707 2.1524 2.1524 2.1709 2.1709 2.9590 2.9590 3.0735 3.0735 3.1114 3.1114 3.2519 3.2519 3.9179 3.9179 4.0550 4.0550 4.3330 4.3330 4.6340 4.6340 4.6855 4.6855 4.7810 4.7810 4.9181 4.9181 4.9254 4.9254 5.1918 5.1918 5.2309 5.2309 5.9001 5.9001 5.9687 5.9687 7.8166 7.8166 8.4162 8.4162 8.7285 8.7285 8.7469 8.7469 9.2184 9.2184 10.2268 10.2268 k = 0.4138 0.2971 0.0000 ( 6222 PWs) bands (ev): -7.9730 -7.9730 -7.1591 -7.1591 -6.7189 -6.7189 -6.7154 -6.7154 -2.3026 -2.3026 -0.8951 -0.8951 -0.8644 -0.8644 -0.5968 -0.5968 -0.5362 -0.5362 -0.4920 -0.4920 1.2026 1.2026 1.4381 1.4381 1.9632 1.9632 2.1569 2.1569 2.1756 2.1756 2.9565 2.9565 3.0765 3.0765 3.1115 3.1115 3.2656 3.2656 3.9278 3.9278 4.0690 4.0690 4.3082 4.3082 4.6338 4.6338 4.6889 4.6889 4.7891 4.7891 4.9251 4.9251 4.9305 4.9305 5.1907 5.1907 5.2315 5.2315 5.8762 5.8762 5.9469 5.9469 7.8193 7.8193 8.4281 8.4281 8.6822 8.6822 8.6998 8.6998 9.2079 9.2079 10.1707 10.1707 k = 0.4310 0.3095 0.0000 ( 6218 PWs) bands (ev): -7.9608 -7.9608 -7.1758 -7.1758 -6.7191 -6.7191 -6.7158 -6.7158 -2.2991 -2.2991 -0.8963 -0.8963 -0.8646 -0.8646 -0.5978 -0.5978 -0.5370 -0.5370 -0.4920 -0.4920 1.2302 1.2302 1.4307 1.4307 1.9532 1.9532 2.1606 2.1606 2.1796 2.1796 2.9565 2.9565 3.0789 3.0789 3.1116 3.1116 3.2771 3.2771 3.9361 3.9361 4.0808 4.0808 4.2867 4.2867 4.6336 4.6336 4.6916 4.6916 4.7961 4.7961 4.9312 4.9312 4.9349 4.9349 5.1838 5.1838 5.2384 5.2384 5.8562 5.8562 5.9288 5.9288 7.8205 7.8205 8.4387 8.4387 8.6439 8.6439 8.6607 8.6607 9.1986 9.1986 10.1241 10.1241 k = 0.4483 0.3219 0.0000 ( 6218 PWs) bands (ev): -7.9507 -7.9507 -7.1893 -7.1893 -6.7193 -6.7193 -6.7161 -6.7161 -2.2963 -2.2963 -0.8973 -0.8973 -0.8648 -0.8648 -0.5987 -0.5987 -0.5376 -0.5376 -0.4920 -0.4920 1.2540 1.2540 1.4247 1.4247 1.9426 1.9426 2.1635 2.1635 2.1828 2.1828 2.9578 2.9578 3.0807 3.0807 3.1119 3.1119 3.2861 3.2861 3.9427 3.9427 4.0902 4.0902 4.2691 4.2691 4.6335 4.6335 4.6937 4.6937 4.8017 4.8017 4.9361 4.9361 4.9385 4.9385 5.1766 5.1766 5.2459 5.2459 5.8403 5.8403 5.9145 5.9145 7.8209 7.8209 8.4475 8.4475 8.6138 8.6138 8.6300 8.6300 9.1909 9.1909 10.0876 10.0876 k = 0.4655 0.3343 0.0000 ( 6214 PWs) bands (ev): -7.9433 -7.9433 -7.1993 -7.1993 -6.7194 -6.7194 -6.7163 -6.7163 -2.2944 -2.2944 -0.8980 -0.8980 -0.8649 -0.8649 -0.5992 -0.5992 -0.5381 -0.5381 -0.4920 -0.4920 1.2725 1.2725 1.4204 1.4204 1.9333 1.9333 2.1656 2.1656 2.1851 2.1851 2.9596 2.9596 3.0821 3.0821 3.1121 3.1121 3.2925 3.2925 3.9475 3.9475 4.0971 4.0971 4.2561 4.2561 4.6334 4.6334 4.6952 4.6952 4.8059 4.8059 4.9396 4.9396 4.9412 4.9412 5.1710 5.1710 5.2519 5.2519 5.8288 5.8288 5.9043 5.9043 7.8208 7.8208 8.4541 8.4541 8.5921 8.5921 8.6078 8.6078 9.1852 9.1852 10.0613 10.0613 k = 0.4828 0.3466 0.0000 ( 6198 PWs) bands (ev): -7.9387 -7.9387 -7.2055 -7.2055 -6.7194 -6.7194 -6.7164 -6.7164 -2.2932 -2.2932 -0.8984 -0.8984 -0.8650 -0.8650 -0.5996 -0.5996 -0.5383 -0.5383 -0.4920 -0.4920 1.2843 1.2843 1.4177 1.4177 1.9268 1.9268 2.1668 2.1668 2.1866 2.1866 2.9609 2.9609 3.0829 3.0829 3.1124 3.1124 3.2964 3.2964 3.9504 3.9504 4.1013 4.1013 4.2480 4.2480 4.6334 4.6334 4.6961 4.6961 4.8085 4.8085 4.9418 4.9418 4.9428 4.9428 5.1676 5.1676 5.2557 5.2557 5.8219 5.8219 5.8981 5.8981 7.8207 7.8207 8.4582 8.4582 8.5791 8.5791 8.5944 8.5944 9.1816 9.1816 10.0454 10.0454 k = 0.5000 0.3590 0.0000 ( 6182 PWs) bands (ev): -7.9371 -7.9371 -7.2076 -7.2076 -6.7194 -6.7194 -6.7164 -6.7164 -2.2928 -2.2928 -0.8985 -0.8985 -0.8650 -0.8650 -0.5997 -0.5997 -0.5384 -0.5384 -0.4919 -0.4919 1.2884 1.2884 1.4168 1.4168 1.9245 1.9245 2.1673 2.1673 2.1871 2.1871 2.9615 2.9615 3.0832 3.0832 3.1124 3.1124 3.2978 3.2978 3.9514 3.9514 4.1027 4.1027 4.2454 4.2454 4.6334 4.6334 4.6964 4.6964 4.8094 4.8094 4.9426 4.9426 4.9434 4.9434 5.1664 5.1664 5.2571 5.2571 5.8195 5.8195 5.8960 5.8960 7.8206 7.8206 8.4596 8.4596 8.5748 8.5748 8.5899 8.5899 9.1803 9.1803 10.0401 10.0401 k = 0.5000 0.3590 0.0000 ( 6182 PWs) bands (ev): -7.9371 -7.9371 -7.2076 -7.2076 -6.7194 -6.7194 -6.7164 -6.7164 -2.2928 -2.2928 -0.8985 -0.8985 -0.8650 -0.8650 -0.5997 -0.5997 -0.5384 -0.5384 -0.4919 -0.4919 1.2884 1.2884 1.4168 1.4168 1.9245 1.9245 2.1673 2.1673 2.1871 2.1871 2.9615 2.9615 3.0832 3.0832 3.1124 3.1124 3.2978 3.2978 3.9514 3.9514 4.1027 4.1027 4.2454 4.2454 4.6334 4.6334 4.6964 4.6964 4.8094 4.8094 4.9426 4.9426 4.9434 4.9434 5.1664 5.1664 5.2571 5.2571 5.8195 5.8195 5.8960 5.8960 7.8206 7.8206 8.4596 8.4596 8.5748 8.5748 8.5899 8.5899 9.1803 9.1803 10.0401 10.0401 k = 0.4912 0.3713 0.0151 ( 6200 PWs) bands (ev): -7.9366 -7.9366 -7.2073 -7.2071 -6.7203 -6.7201 -6.7170 -6.7168 -2.2926 -2.2915 -0.8993 -0.8978 -0.8674 -0.8618 -0.6027 -0.5964 -0.5407 -0.5359 -0.4948 -0.4889 1.2843 1.2902 1.4175 1.4182 1.9208 1.9209 2.1662 2.1693 2.1872 2.1893 2.9450 2.9652 3.0839 3.0862 3.1060 3.1248 3.2935 3.3019 3.9476 3.9525 4.0958 4.1052 4.2444 4.2481 4.6316 4.6366 4.6797 4.7117 4.8023 4.8153 4.9241 4.9426 4.9444 4.9633 5.1666 5.1697 5.2539 5.2587 5.8165 5.8217 5.8955 5.8956 7.8190 7.8248 8.4618 8.4656 8.5773 8.5781 8.5922 8.5941 9.1838 9.1839 10.0424 10.0435 k = 0.4823 0.3836 0.0303 ( 6204 PWs) bands (ev): -7.9351 -7.9351 -7.2062 -7.2058 -6.7234 -6.7233 -6.7177 -6.7170 -2.2911 -2.2888 -0.9002 -0.8973 -0.8691 -0.8580 -0.6055 -0.5929 -0.5427 -0.5332 -0.4974 -0.4856 1.2780 1.2899 1.4201 1.4216 1.9099 1.9104 2.1634 2.1724 2.1892 2.1959 2.9216 2.9543 3.0864 3.0914 3.1045 3.1438 3.2892 3.3058 3.9411 3.9509 4.0848 4.1032 4.2453 4.2526 4.6313 4.6412 4.6623 4.7250 4.7944 4.8201 4.9066 4.9440 4.9474 4.9838 5.1703 5.1767 5.2495 5.2590 5.8126 5.8219 5.8945 5.8953 7.8202 7.8316 8.4724 8.4798 8.5830 8.5863 8.6035 8.6057 9.1943 9.1945 10.0505 10.0528 k = 0.4735 0.3959 0.0454 ( 6192 PWs) bands (ev): -7.9326 -7.9326 -7.2043 -7.2037 -6.7293 -6.7292 -6.7178 -6.7168 -2.2881 -2.2847 -0.9010 -0.8968 -0.8701 -0.8536 -0.6079 -0.5891 -0.5444 -0.5305 -0.4998 -0.4821 1.2698 1.2875 1.4249 1.4271 1.8931 1.8942 2.1579 2.1734 2.1951 2.2066 2.8954 2.9335 3.0833 3.0912 3.1176 3.1662 3.2850 3.3095 3.9321 3.9466 4.0701 4.0967 4.2481 4.2587 4.6322 4.6446 4.6467 4.7354 4.7857 4.8236 4.8920 4.9470 4.9518 5.0044 5.1770 5.1873 5.2443 5.2580 5.8068 5.8180 5.8938 5.8975 7.8240 7.8409 8.4912 8.5023 8.5901 8.5969 8.6253 8.6268 9.2117 9.2118 10.0644 10.0678 k = 0.4647 0.4082 0.0606 ( 6196 PWs) bands (ev): -7.9292 -7.9291 -7.2017 -7.2008 -6.7378 -6.7377 -6.7178 -6.7163 -2.2839 -2.2794 -0.9019 -0.8964 -0.8703 -0.8487 -0.6100 -0.5852 -0.5457 -0.5277 -0.5021 -0.4783 1.2596 1.2829 1.4316 1.4346 1.8716 1.8738 2.1501 2.1709 2.2050 2.2197 2.8682 2.9083 3.0775 3.0850 3.1385 3.1894 3.2809 3.3129 3.9208 3.9398 4.0523 4.0861 4.2525 4.2662 4.6258 4.6355 4.6531 4.7418 4.7764 4.8255 4.8816 4.9515 4.9573 5.0249 5.1855 5.2009 5.2394 5.2561 5.7976 5.8083 5.8952 5.9039 7.8304 7.8523 8.5182 8.5330 8.5994 8.6095 8.6565 8.6574 9.2356 9.2357 10.0841 10.0888 k = 0.4558 0.4206 0.0757 ( 6196 PWs) bands (ev): -7.9248 -7.9246 -7.1983 -7.1972 -6.7486 -6.7485 -6.7176 -6.7158 -2.2784 -2.2728 -0.9026 -0.8960 -0.8700 -0.8434 -0.6119 -0.5810 -0.5466 -0.5249 -0.5043 -0.4742 1.2477 1.2763 1.4403 1.4441 1.8467 1.8501 2.1403 2.1656 2.2168 2.2336 2.8414 2.8816 3.0693 3.0765 3.1607 3.2118 3.2771 3.3157 3.9073 3.9306 4.0318 4.0716 4.2584 4.2751 4.6088 4.6385 4.6601 4.7434 4.7667 4.8257 4.8767 4.9577 4.9637 5.0449 5.1932 5.2170 5.2375 5.2540 5.7839 5.7926 5.8999 5.9146 7.8391 7.8658 8.5532 8.5717 8.6117 8.6248 8.6961 8.6966 9.2653 9.2657 10.1096 10.1159 k = 0.4470 0.4329 0.0909 ( 6188 PWs) bands (ev): -7.9195 -7.9193 -7.1941 -7.1928 -6.7617 -6.7615 -6.7173 -6.7151 -2.2718 -2.2652 -0.9032 -0.8955 -0.8692 -0.8378 -0.6133 -0.5767 -0.5470 -0.5221 -0.5064 -0.4698 1.2342 1.2679 1.4509 1.4556 1.8192 1.8240 2.1289 2.1582 2.2287 2.2469 2.8159 2.8550 3.0588 3.0660 3.1826 3.2324 3.2741 3.3181 3.8919 3.9193 4.0091 4.0537 4.2657 4.2852 4.5923 4.6424 4.6675 4.7402 4.7570 4.8246 4.8774 4.9655 4.9708 5.0644 5.1958 5.2332 5.2431 5.2544 5.7655 5.7718 5.9084 5.9289 7.8499 7.8810 8.5945 8.6167 8.6282 8.6444 8.7434 8.7434 9.3005 9.3014 10.1412 10.1491 k = 0.4381 0.4452 0.1060 ( 6190 PWs) bands (ev): -7.9133 -7.9131 -7.1892 -7.1877 -6.7768 -6.7765 -6.7169 -6.7143 -2.2642 -2.2566 -0.9038 -0.8947 -0.8680 -0.8320 -0.6144 -0.5722 -0.5469 -0.5194 -0.5084 -0.4652 1.2194 1.2578 1.4633 1.4691 1.7898 1.7961 2.1160 2.1490 2.2397 2.2586 2.7924 2.8297 3.0461 3.0535 3.2034 3.2491 3.2732 3.3197 3.8749 3.9060 3.9847 4.0330 4.2744 4.2963 4.5766 4.6466 4.6751 4.7330 4.7476 4.8227 4.8826 4.9749 4.9784 5.0830 5.1924 5.2405 5.2571 5.2663 5.7427 5.7470 5.9203 5.9458 7.8626 7.8976 8.6317 8.6538 8.6594 8.6825 8.7970 8.7978 9.3404 9.3421 10.1788 10.1886 k = 0.4293 0.4575 0.1212 ( 6190 PWs) bands (ev): -7.9063 -7.9061 -7.1835 -7.1819 -6.7938 -6.7935 -6.7164 -6.7135 -2.2557 -2.2472 -0.9041 -0.8937 -0.8666 -0.8261 -0.6151 -0.5676 -0.5463 -0.5167 -0.5104 -0.4605 1.2036 1.2464 1.4775 1.4845 1.7591 1.7670 2.1017 2.1381 2.2489 2.2680 2.7715 2.8065 3.0312 3.0390 3.2226 3.2567 3.2796 3.3205 3.8567 3.8913 3.9590 4.0098 4.2844 4.3084 4.5622 4.6504 4.6826 4.7238 4.7388 4.8201 4.8910 4.9859 4.9863 5.1006 5.1863 5.2403 5.2763 5.2883 5.7164 5.7191 5.9349 5.9647 7.8770 7.9154 8.6552 8.6780 8.7142 8.7437 8.8566 8.8586 9.3845 9.3871 10.2227 10.2346 k = 0.4205 0.4698 0.1363 ( 6198 PWs) bands (ev): -7.8985 -7.8983 -7.1772 -7.1753 -6.8125 -6.8122 -6.7158 -6.7126 -2.2466 -2.2372 -0.9043 -0.8923 -0.8651 -0.8202 -0.6155 -0.5629 -0.5450 -0.5143 -0.5124 -0.4556 1.1869 1.2337 1.4930 1.5017 1.7274 1.7373 2.0863 2.1257 2.2557 2.2745 2.7539 2.7860 3.0141 3.0224 3.2399 3.2562 3.2918 3.3205 3.8375 3.8753 3.9325 3.9847 4.2956 4.3213 4.5490 4.6531 4.6896 4.7139 4.7313 4.8170 4.9016 4.9942 4.9987 5.1167 5.1801 5.2396 5.2984 5.3134 5.6873 5.6890 5.9517 5.9851 7.8928 7.9342 8.6772 8.7019 8.7796 8.8148 8.9215 8.9256 9.4320 9.4358 10.2728 10.2872 k = 0.4116 0.4821 0.1515 ( 6202 PWs) bands (ev): -7.8901 -7.8899 -7.1701 -7.1680 -6.8327 -6.8324 -6.7152 -6.7116 -2.2369 -2.2268 -0.9044 -0.8905 -0.8634 -0.8145 -0.6155 -0.5581 -0.5431 -0.5143 -0.5119 -0.4506 1.1699 1.2201 1.5095 1.5204 1.6951 1.7077 2.0698 2.1118 2.2596 2.2775 2.7398 2.7688 2.9947 3.0038 3.2535 3.2547 3.3038 3.3199 3.8180 3.8585 3.9056 3.9582 4.3080 4.3348 4.5374 4.6541 4.6952 4.7054 4.7255 4.8133 4.9136 5.0022 5.0132 5.1306 5.1756 5.2400 5.3222 5.3401 5.6560 5.6573 5.9700 6.0063 7.9097 7.9537 8.7005 8.7271 8.8521 8.8937 8.9910 8.9981 9.4822 9.4874 10.3292 10.3464 k = 0.4028 0.4944 0.1666 ( 6210 PWs) bands (ev): -7.8811 -7.8808 -7.1624 -7.1601 -6.8543 -6.8539 -6.7145 -6.7106 -2.2269 -2.2161 -0.9042 -0.8884 -0.8617 -0.8090 -0.6151 -0.5533 -0.5404 -0.5163 -0.5096 -0.4457 1.1527 1.2059 1.5255 1.5403 1.6630 1.6796 2.0525 2.0967 2.2603 2.2771 2.7292 2.7551 2.9732 2.9832 3.2503 3.2658 3.3138 3.3197 3.7982 3.8413 3.8787 3.9307 4.3216 4.3488 4.5272 4.6529 4.6929 4.7052 4.7218 4.8091 4.9268 5.0103 5.0294 5.1405 5.1752 5.2420 5.3465 5.3678 5.6231 5.6248 5.9893 6.0279 7.9275 7.9738 8.7253 8.7534 8.9302 8.9795 9.0644 9.0760 9.5345 9.5411 10.3921 10.4122 k = 0.3940 0.5067 0.1818 ( 6202 PWs) bands (ev): -7.8717 -7.8714 -7.1540 -7.1516 -6.8769 -6.8765 -6.7137 -6.7095 -2.2167 -2.2053 -0.9038 -0.8858 -0.8599 -0.8039 -0.6143 -0.5485 -0.5369 -0.5182 -0.5074 -0.4409 1.1357 1.1915 1.5381 1.5592 1.6333 1.6564 2.0343 2.0804 2.2578 2.2732 2.7220 2.7452 2.9496 2.9607 3.2467 3.2714 3.3215 3.3216 3.7788 3.8241 3.8521 3.9027 4.3363 4.3631 4.5186 4.6495 4.6865 4.7100 4.7203 4.8047 4.9410 5.0184 5.0475 5.1452 5.1806 5.2460 5.3704 5.3958 5.5892 5.5927 6.0091 6.0495 7.9459 7.9942 8.7514 8.7808 9.0125 9.0709 9.1414 9.1592 9.5882 9.5964 10.4611 10.4847 k = 0.3851 0.5190 0.1969 ( 6206 PWs) bands (ev): -7.8619 -7.8616 -7.1450 -7.1424 -6.9003 -6.8999 -6.7129 -6.7084 -2.2065 -2.1947 -0.9032 -0.8830 -0.8582 -0.7993 -0.6131 -0.5438 -0.5326 -0.5201 -0.5054 -0.4364 1.1193 1.1770 1.5402 1.5662 1.6169 1.6451 2.0155 2.0632 2.2522 2.2663 2.7174 2.7387 2.9240 2.9363 3.2427 3.2699 3.3268 3.3268 3.7600 3.8072 3.8263 3.8745 4.3519 4.3775 4.5115 4.6442 4.6813 4.7145 4.7206 4.8001 4.9560 5.0267 5.0670 5.1470 5.1901 5.2522 5.3919 5.4235 5.5548 5.5627 6.0288 6.0707 7.9648 8.0148 8.7788 8.8088 9.0972 9.1655 9.2230 9.2480 9.6427 9.6525 10.5363 10.5637 k = 0.3763 0.5313 0.2121 ( 6206 PWs) bands (ev): -7.8519 -7.8516 -7.1354 -7.1326 -6.9243 -6.9239 -6.7120 -6.7073 -2.1966 -2.1843 -0.9025 -0.8799 -0.8564 -0.7953 -0.6115 -0.5394 -0.5275 -0.5220 -0.5035 -0.4322 1.1039 1.1629 1.5265 1.5458 1.6293 1.6514 1.9961 2.0453 2.2438 2.2569 2.7148 2.7352 2.8968 2.9103 3.2383 3.2623 3.3299 3.3346 3.7421 3.7910 3.8016 3.8466 4.3683 4.3917 4.5060 4.6376 4.6781 4.7181 4.7219 4.7956 4.9715 5.0356 5.0878 5.1494 5.2007 5.2606 5.4076 5.4495 5.5216 5.5382 6.0479 6.0909 7.9839 8.0354 8.8071 8.8373 9.1821 9.2575 9.3132 9.3425 9.6975 9.7088 10.6172 10.6487 k = 0.3675 0.5436 0.2272 ( 6208 PWs) bands (ev): -7.8420 -7.8416 -7.1253 -7.1223 -6.9486 -6.9481 -6.7111 -6.7061 -2.1870 -2.1745 -0.9015 -0.8765 -0.8546 -0.7920 -0.6096 -0.5352 -0.5241 -0.5214 -0.5017 -0.4285 1.0898 1.1494 1.5015 1.5150 1.6536 1.6706 1.9764 2.0269 2.2333 2.2457 2.7131 2.7339 2.8683 2.8829 3.2331 3.2501 3.3312 3.3435 3.7252 3.7757 3.7782 3.8192 4.3853 4.4054 4.5019 4.6304 4.6771 4.7208 4.7237 4.7913 4.9875 5.0453 5.1089 5.1548 5.2112 5.2713 5.4112 5.4631 5.4998 5.5256 6.0660 6.1097 8.0031 8.0558 8.8361 8.8660 9.2651 9.3406 9.4161 9.4434 9.7521 9.7646 10.7031 10.7394 k = 0.3586 0.5559 0.2424 ( 6202 PWs) bands (ev): -7.8322 -7.8318 -7.1146 -7.1115 -6.9727 -6.9722 -6.7102 -6.7049 -2.1779 -2.1654 -0.9003 -0.8731 -0.8526 -0.7894 -0.6073 -0.5316 -0.5254 -0.5149 -0.5000 -0.4254 1.0773 1.1369 1.4716 1.4821 1.6812 1.6967 1.9563 2.0085 2.2211 2.2331 2.7111 2.7341 2.8390 2.8544 3.2272 3.2347 3.3313 3.3526 3.7094 3.7565 3.7613 3.7926 4.4029 4.4186 4.4993 4.6229 4.6785 4.7224 4.7259 4.7874 5.0035 5.0563 5.1281 5.1659 5.2209 5.2844 5.3991 5.4404 5.5137 5.5285 6.0824 6.1267 8.0221 8.0758 8.8658 8.8946 9.3438 9.4150 9.5295 9.5504 9.8061 9.8195 10.7930 10.8351 k = 0.3498 0.5682 0.2575 ( 6184 PWs) bands (ev): -7.8229 -7.8225 -7.1035 -7.1001 -6.9964 -6.9958 -6.7092 -6.7037 -2.1695 -2.1570 -0.8990 -0.8697 -0.8504 -0.7877 -0.6047 -0.5307 -0.5244 -0.5078 -0.4984 -0.4230 1.0668 1.1256 1.4398 1.4489 1.7100 1.7268 1.9362 1.9908 2.2079 2.2199 2.7073 2.7344 2.8097 2.8254 3.2169 3.2205 3.3307 3.3615 3.6942 3.7368 3.7479 3.7671 4.4206 4.4308 4.4984 4.6154 4.6822 4.7231 4.7282 4.7841 5.0189 5.0692 5.1433 5.1852 5.2293 5.2999 5.3771 5.4078 5.5367 5.5416 6.0967 6.1415 8.0408 8.0953 8.8959 8.9231 9.4164 9.4818 9.6498 9.6630 9.8595 9.8728 10.8815 10.9345 k = 0.3410 0.5805 0.2727 ( 6194 PWs) bands (ev): -7.8142 -7.8138 -7.0919 -7.0884 -7.0193 -7.0187 -6.7082 -6.7025 -2.1619 -2.1497 -0.8975 -0.8666 -0.8480 -0.7868 -0.6018 -0.5323 -0.5210 -0.5003 -0.4971 -0.4214 1.0585 1.1157 1.4073 1.4159 1.7385 1.7597 1.9160 1.9746 2.1943 2.2064 2.6999 2.7333 2.7818 2.7968 3.1976 3.2130 3.3300 3.3700 3.6793 3.7195 3.7339 3.7441 4.4379 4.4420 4.4993 4.6079 4.6879 4.7230 4.7303 4.7814 5.0332 5.0845 5.1560 5.2109 5.2352 5.3176 5.3525 5.3746 5.5582 5.5593 6.1085 6.1535 8.0591 8.1140 8.9264 8.9514 9.4812 9.5404 9.7750 9.7792 9.9126 9.9241 10.9245 10.9911 k = 0.3321 0.5928 0.2878 ( 6198 PWs) bands (ev): -7.8066 -7.8062 -7.0799 -7.0762 -7.0409 -7.0402 -6.7073 -6.7014 -2.1552 -2.1434 -0.8958 -0.8639 -0.8450 -0.7867 -0.5986 -0.5345 -0.5172 -0.4959 -0.4926 -0.4207 1.0527 1.1076 1.3748 1.3834 1.7649 1.7947 1.8958 1.9618 2.1807 2.1931 2.6866 2.7274 2.7572 2.7715 3.1778 3.2052 3.3297 3.3780 3.6642 3.7048 3.7144 3.7286 4.4522 4.4538 4.5030 4.6007 4.6951 4.7226 4.7324 4.7794 5.0458 5.1025 5.1688 5.2340 5.2431 5.3309 5.3356 5.3444 5.5751 5.5803 6.1172 6.1623 8.0767 8.1318 8.9572 8.9795 9.5370 9.5898 9.8927 9.9038 9.9705 9.9726 10.9306 10.9857 k = 0.3233 0.6051 0.3030 ( 6198 PWs) bands (ev): -7.8003 -7.7999 -7.0679 -7.0637 -7.0609 -7.0597 -6.7063 -6.7002 -2.1496 -2.1383 -0.8941 -0.8618 -0.8415 -0.7874 -0.5953 -0.5370 -0.5134 -0.4948 -0.4847 -0.4210 1.0496 1.1012 1.3429 1.3517 1.7860 1.8316 1.8760 1.9555 2.1675 2.1803 2.6660 2.7112 2.7371 2.7542 3.1586 3.1975 3.3301 3.3856 3.6486 3.6919 3.6927 3.7178 4.4614 4.4669 4.5107 4.5938 4.7020 4.7238 4.7345 4.7781 5.0567 5.1231 5.1827 5.2288 5.2737 5.3107 5.3177 5.3611 5.5906 5.5989 6.1225 6.1677 8.0937 8.1485 8.9883 9.0074 9.5829 9.6291 9.9773 10.0179 10.0348 10.0573 10.9432 10.9899 k = 0.3144 0.6174 0.3181 ( 6206 PWs) bands (ev): -7.7957 -7.7953 -7.0789 -7.0784 -7.0544 -7.0507 -6.7053 -6.6991 -2.1452 -2.1345 -0.8922 -0.8603 -0.8374 -0.7889 -0.5918 -0.5397 -0.5097 -0.4940 -0.4769 -0.4223 1.0492 1.0967 1.3118 1.3210 1.7977 1.8561 1.8703 1.9596 2.1553 2.1681 2.6398 2.6857 2.7201 2.7435 3.1408 3.1904 3.3312 3.3927 3.6327 3.6695 3.6828 3.7085 4.4697 4.4763 4.5231 4.5872 4.7052 4.7295 4.7366 4.7773 5.0657 5.1457 5.1949 5.2164 5.2825 5.3028 5.3192 5.3858 5.6039 5.6149 6.1239 6.1691 8.1099 8.1640 9.0197 9.0353 9.6185 9.6582 10.0284 10.0591 10.1663 10.1753 10.9663 11.0049 k = 0.3144 0.6174 0.3181 ( 6206 PWs) bands (ev): -7.7957 -7.7953 -7.0789 -7.0784 -7.0544 -7.0507 -6.7053 -6.6991 -2.1452 -2.1345 -0.8922 -0.8603 -0.8374 -0.7889 -0.5918 -0.5397 -0.5097 -0.4940 -0.4769 -0.4223 1.0492 1.0967 1.3118 1.3210 1.7977 1.8561 1.8703 1.9596 2.1553 2.1681 2.6398 2.6857 2.7201 2.7435 3.1408 3.1904 3.3312 3.3927 3.6327 3.6695 3.6828 3.7085 4.4697 4.4763 4.5231 4.5872 4.7052 4.7295 4.7366 4.7773 5.0657 5.1457 5.1949 5.2164 5.2825 5.3028 5.3192 5.3858 5.6039 5.6149 6.1239 6.1691 8.1099 8.1640 9.0197 9.0353 9.6185 9.6582 10.0284 10.0591 10.1663 10.1753 10.9663 11.0049 k = 0.2948 0.6118 0.3250 ( 6198 PWs) bands (ev): -7.7947 -7.7944 -7.0887 -7.0877 -7.0454 -7.0416 -6.7051 -6.6988 -2.1437 -2.1334 -0.8914 -0.8598 -0.8354 -0.7898 -0.5902 -0.5409 -0.5080 -0.4936 -0.4733 -0.4232 1.0489 1.0944 1.2989 1.3105 1.7982 1.8448 1.8875 1.9632 2.1487 2.1680 2.6195 2.6591 2.7275 2.7469 3.1337 3.1874 3.3319 3.3952 3.6241 3.6561 3.6815 3.7047 4.4700 4.4827 4.5305 4.5844 4.7042 4.7322 4.7389 4.7771 5.0695 5.1554 5.1947 5.2174 5.2723 5.3092 5.3299 5.3978 5.6067 5.6192 6.1250 6.1699 8.1176 8.1713 9.0353 9.0506 9.6304 9.6674 10.0495 10.0788 10.2243 10.2298 10.9773 11.0120 k = 0.2751 0.6062 0.3319 ( 6203 PWs) bands (ev): -7.7951 -7.7947 -7.0997 -7.0984 -7.0327 -7.0287 -6.7055 -6.6991 -2.1429 -2.1330 -0.8906 -0.8595 -0.8332 -0.7908 -0.5887 -0.5422 -0.5063 -0.4932 -0.4700 -0.4243 1.0473 1.0910 1.2888 1.3049 1.7935 1.8283 1.9035 1.9657 2.1430 2.1745 2.5887 2.6231 2.7460 2.7618 3.1274 3.1845 3.3326 3.3964 3.6133 3.6408 3.6817 3.7016 4.4685 4.4900 4.5391 4.5818 4.7006 4.7313 4.7445 4.7766 5.0737 5.1629 5.1921 5.2257 5.2660 5.3139 5.3428 5.4101 5.6046 5.6194 6.1277 6.1722 8.1263 8.1798 9.0537 9.0712 9.6392 9.6745 10.0728 10.1017 10.2790 10.2811 10.9845 11.0153 k = 0.2555 0.6006 0.3388 ( 6198 PWs) bands (ev): -7.7965 -7.7962 -7.1105 -7.1092 -7.0180 -7.0138 -6.7064 -6.6999 -2.1427 -2.1333 -0.8898 -0.8592 -0.8310 -0.7919 -0.5872 -0.5435 -0.5046 -0.4927 -0.4670 -0.4256 1.0453 1.0874 1.2819 1.3025 1.7832 1.8075 1.9180 1.9685 2.1405 2.1843 2.5530 2.5858 2.7682 2.7832 3.1221 3.1818 3.3332 3.3964 3.6003 3.6253 3.6815 3.6988 4.4673 4.4963 4.5482 4.5795 4.6951 4.7288 4.7509 4.7758 5.0787 5.1669 5.1931 5.2361 5.2646 5.3191 5.3554 5.4227 5.5982 5.6159 6.1305 6.1745 8.1366 8.1895 9.0757 9.0975 9.6466 9.6812 10.0977 10.1267 10.3292 10.3306 10.9889 11.0162 k = 0.2358 0.5950 0.3458 ( 6194 PWs) bands (ev): -7.7988 -7.7985 -7.1208 -7.1195 -7.0018 -6.9974 -6.7080 -6.7014 -2.1430 -2.1340 -0.8890 -0.8592 -0.8287 -0.7931 -0.5858 -0.5448 -0.5030 -0.4921 -0.4641 -0.4270 1.0435 1.0843 1.2777 1.3023 1.7674 1.7835 1.9308 1.9723 2.1414 2.1957 2.5152 2.5487 2.7926 2.8087 3.1179 3.1794 3.3339 3.3954 3.5854 3.6100 3.6810 3.6961 4.4662 4.5017 4.5567 4.5779 4.6880 4.7253 4.7570 4.7748 5.0846 5.1675 5.1992 5.2443 5.2700 5.3247 5.3673 5.4362 5.5886 5.6094 6.1317 6.1751 8.1486 8.2007 9.1022 9.1293 9.6537 9.6886 10.1238 10.1529 10.3746 10.3791 10.9912 11.0159 k = 0.2162 0.5894 0.3527 ( 6189 PWs) bands (ev): -7.8018 -7.8014 -7.1305 -7.1293 -6.9846 -6.9800 -6.7103 -6.7037 -2.1436 -2.1353 -0.8881 -0.8594 -0.8263 -0.7943 -0.5844 -0.5462 -0.5017 -0.4913 -0.4615 -0.4285 1.0426 1.0822 1.2754 1.3032 1.7472 1.7575 1.9421 1.9770 2.1447 2.2077 2.4768 2.5124 2.8188 2.8372 3.1149 3.1776 3.3345 3.3933 3.5689 3.5945 3.6799 3.6935 4.4656 4.5066 4.5626 4.5784 4.6795 4.7213 4.7621 4.7736 5.0912 5.1673 5.2085 5.2499 5.2815 5.3306 5.3790 5.4506 5.5766 5.6009 6.1295 6.1726 8.1626 8.2135 9.1341 9.1667 9.6615 9.6971 10.1504 10.1795 10.4174 10.4246 10.9925 11.0151 k = 0.1965 0.5838 0.3596 ( 6183 PWs) bands (ev): -7.8051 -7.8048 -7.1395 -7.1384 -6.9667 -6.9619 -6.7134 -6.7067 -2.1446 -2.1368 -0.8873 -0.8598 -0.8240 -0.7955 -0.5831 -0.5477 -0.5005 -0.4905 -0.4592 -0.4301 1.0431 1.0817 1.2744 1.3046 1.7240 1.7305 1.9521 1.9822 2.1497 2.2194 2.4389 2.4777 2.8461 2.8678 3.1131 3.1764 3.3353 3.3904 3.5511 3.5784 3.6786 3.6908 4.4655 4.5111 4.5636 4.5825 4.6702 4.7169 4.7661 4.7724 5.0986 5.1676 5.2189 5.2554 5.2952 5.3363 5.3917 5.4664 5.5637 5.5912 6.1227 6.1658 8.1789 8.2279 9.1715 9.2094 9.6700 9.7067 10.1773 10.2061 10.4579 10.4670 10.9931 11.0146 k = 0.1769 0.5782 0.3665 ( 6186 PWs) bands (ev): -7.8087 -7.8084 -7.1478 -7.1468 -6.9483 -6.9434 -6.7173 -6.7106 -2.1458 -2.1387 -0.8863 -0.8604 -0.8218 -0.7967 -0.5817 -0.5493 -0.4995 -0.4897 -0.4571 -0.4316 1.0453 1.0829 1.2739 1.3059 1.6991 1.7037 1.9611 1.9875 2.1554 2.2302 2.4024 2.4452 2.8740 2.8997 3.1129 3.1763 3.3361 3.3867 3.5321 3.5616 3.6770 3.6881 4.4658 4.5154 4.5615 4.5880 4.6607 4.7121 4.7684 4.7717 5.1064 5.1689 5.2292 5.2623 5.3078 5.3418 5.4068 5.4836 5.5512 5.5811 6.1102 6.1537 8.1974 8.2439 9.2142 9.2571 9.6792 9.7173 10.2040 10.2323 10.4958 10.5063 10.9934 11.0149 k = 0.1572 0.5726 0.3734 ( 6178 PWs) bands (ev): -7.8123 -7.8121 -7.1553 -7.1544 -6.9298 -6.9247 -6.7221 -6.7154 -2.1471 -2.1407 -0.8852 -0.8612 -0.8196 -0.7979 -0.5804 -0.5509 -0.4986 -0.4890 -0.4553 -0.4331 1.0495 1.0860 1.2733 1.3065 1.6739 1.6778 1.9691 1.9925 2.1609 2.2395 2.3682 2.4155 2.9019 2.9321 3.1144 3.1777 3.3370 3.3824 3.5120 3.5437 3.6754 3.6854 4.4668 4.5196 4.5581 4.5926 4.6519 4.7070 4.7684 4.7723 5.1146 5.1711 5.2388 5.2709 5.3171 5.3469 5.4256 5.4997 5.5429 5.5721 6.0918 6.1360 8.2179 8.2612 9.2617 9.3089 9.6888 9.7283 10.2301 10.2575 10.5310 10.5420 10.9934 11.0161 k = 0.1376 0.5669 0.3803 ( 6179 PWs) bands (ev): -7.8159 -7.8156 -7.1620 -7.1612 -6.9113 -6.9060 -6.7278 -6.7211 -2.1485 -2.1428 -0.8841 -0.8623 -0.8176 -0.7991 -0.5789 -0.5527 -0.4978 -0.4885 -0.4536 -0.4345 1.0556 1.0909 1.2722 1.3061 1.6495 1.6535 1.9764 1.9969 2.1655 2.2465 2.3375 2.3893 2.9289 2.9634 3.1183 3.1812 3.3378 3.3775 3.4909 3.5249 3.6738 3.6827 4.4684 4.5236 4.5539 4.5949 4.6450 4.7016 4.7675 4.7730 5.1229 5.1737 5.2474 5.2804 5.3223 5.3512 5.4478 5.5057 5.5465 5.5678 6.0672 6.1125 8.2398 8.2794 9.3129 9.3637 9.6983 9.7391 10.2553 10.2816 10.5630 10.5740 10.9928 11.0179 k = 0.1179 0.5613 0.3872 ( 6177 PWs) bands (ev): -7.8192 -7.8190 -7.1679 -7.1672 -6.8931 -6.8877 -6.7345 -6.7278 -2.1498 -2.1449 -0.8829 -0.8635 -0.8156 -0.8002 -0.5774 -0.5545 -0.4970 -0.4883 -0.4520 -0.4359 1.0635 1.0972 1.2704 1.3044 1.6268 1.6313 1.9829 2.0007 2.1688 2.2494 2.3126 2.3670 2.9542 2.9920 3.1258 3.1875 3.3383 3.3723 3.4688 3.5051 3.6723 3.6801 4.4707 4.5272 4.5493 4.5941 4.6412 4.6960 4.7667 4.7731 5.1312 5.1764 5.2552 5.2901 5.3240 5.3545 5.4696 5.5020 5.5533 5.5821 6.0367 6.0835 8.2625 8.2977 9.3665 9.4200 9.7069 9.7489 10.2793 10.3039 10.5916 10.6020 10.9909 11.0195 k = 0.0983 0.5557 0.3941 ( 6179 PWs) bands (ev): -7.8221 -7.8220 -7.1728 -7.1723 -6.8753 -6.8697 -6.7422 -6.7355 -2.1510 -2.1469 -0.8815 -0.8649 -0.8139 -0.8013 -0.5759 -0.5565 -0.4962 -0.4883 -0.4505 -0.4372 1.0728 1.1044 1.2680 1.3010 1.6068 1.6117 1.9888 2.0038 2.1708 2.2444 2.2976 2.3488 2.9767 3.0152 3.1384 3.1973 3.3375 3.3673 3.4460 3.4846 3.6710 3.6777 4.4739 4.5296 4.5451 4.5902 4.6408 4.6902 4.7660 4.7726 5.1394 5.1786 5.2627 5.2991 5.3230 5.3561 5.4802 5.5006 5.5643 5.6125 6.0012 6.0494 8.2848 8.3151 9.4208 9.4759 9.7139 9.7570 10.3015 10.3241 10.6162 10.6256 10.9867 11.0185 k = 0.0786 0.5501 0.4010 ( 6180 PWs) bands (ev): -7.8247 -7.8245 -7.1769 -7.1765 -6.8581 -6.8523 -6.7509 -6.7442 -2.1520 -2.1487 -0.8801 -0.8665 -0.8122 -0.8024 -0.5742 -0.5585 -0.4954 -0.4886 -0.4490 -0.4384 1.0831 1.1117 1.2652 1.2959 1.5900 1.5951 1.9940 2.0062 2.1716 2.2312 2.2934 2.3347 2.9960 3.0313 3.1572 3.2108 3.3342 3.3629 3.4235 3.4640 3.6700 3.6754 4.4778 4.5285 4.5438 4.5845 4.6429 4.6843 4.7657 4.7718 5.1473 5.1801 5.2698 5.3070 5.3206 5.3558 5.4787 5.4999 5.5912 5.6490 5.9613 6.0111 8.3058 8.3307 9.4737 9.5288 9.7188 9.7624 10.3217 10.3415 10.6367 10.6448 10.9789 11.0121 k = 0.0590 0.5445 0.4079 ( 6184 PWs) bands (ev): -7.8267 -7.8266 -7.1801 -7.1798 -6.8416 -6.8357 -6.7606 -6.7540 -2.1528 -2.1503 -0.8785 -0.8681 -0.8107 -0.8034 -0.5725 -0.5605 -0.4945 -0.4891 -0.4476 -0.4397 1.0938 1.1180 1.2629 1.2893 1.5770 1.5816 1.9984 2.0078 2.1720 2.2153 2.2947 2.3242 3.0117 3.0403 3.1813 3.2277 3.3269 3.3582 3.4036 3.4441 3.6693 3.6735 4.4826 4.5233 4.5462 4.5781 4.6465 4.6783 4.7657 4.7706 5.1548 5.1804 5.2768 5.3115 5.3198 5.3537 5.4760 5.4956 5.6291 5.6890 5.9183 5.9695 8.3243 8.3434 9.5230 9.5755 9.7217 9.7641 10.3393 10.3555 10.6531 10.6596 10.9675 10.9984 k = 0.0393 0.5389 0.4148 ( 6185 PWs) bands (ev): -7.8282 -7.8282 -7.1824 -7.1822 -6.8260 -6.8200 -6.7712 -6.7648 -2.1533 -2.1516 -0.8769 -0.8699 -0.8092 -0.8045 -0.5706 -0.5626 -0.4936 -0.4898 -0.4462 -0.4409 1.1041 1.1220 1.2620 1.2818 1.5681 1.5716 2.0022 2.0085 2.1730 2.2008 2.2977 2.3164 3.0239 3.0436 3.2082 3.2464 3.3160 3.3477 3.3923 3.4260 3.6690 3.6718 4.4882 4.5163 4.5503 4.5719 4.6509 4.6724 4.7659 4.7695 5.1617 5.1793 5.2837 5.3085 5.3251 5.3498 5.4751 5.4898 5.6722 5.7306 5.8739 5.9257 8.3394 8.3523 9.5664 9.6110 9.7241 9.7612 10.3537 10.3654 10.6653 10.6700 10.9553 10.9792 k = 0.0197 0.5333 0.4217 ( 6191 PWs) bands (ev): -7.8291 -7.8291 -7.1837 -7.1836 -6.8115 -6.8057 -6.7824 -6.7764 -2.1534 -2.1525 -0.8752 -0.8716 -0.8080 -0.8056 -0.5687 -0.5647 -0.4926 -0.4907 -0.4449 -0.4422 1.1131 1.1227 1.2636 1.2743 1.5632 1.5651 2.0051 2.0083 2.1756 2.1892 2.3015 2.3104 3.0330 3.0430 3.2348 3.2611 3.3058 3.3297 3.3922 3.4107 3.6691 3.6705 4.4945 4.5088 4.5551 4.5659 4.6558 4.6666 4.7665 4.7683 5.1678 5.1768 5.2904 5.3031 5.3318 5.3446 5.4763 5.4842 5.7174 5.7671 5.8350 5.8812 8.3501 8.3566 9.6010 9.6282 9.7300 9.7532 10.3642 10.3703 10.6734 10.6758 10.9476 10.9606 k = 0.0000 0.5277 0.4286 ( 6188 PWs) bands (ev): -7.8294 -7.8294 -7.1841 -7.1841 -6.7997 -6.7997 -6.7873 -6.7873 -2.1531 -2.1531 -0.8734 -0.8734 -0.8067 -0.8067 -0.5667 -0.5667 -0.4916 -0.4916 -0.4435 -0.4435 1.1196 1.1196 1.2678 1.2678 1.5622 1.5622 2.0072 2.0072 2.1809 2.1809 2.3056 2.3056 3.0394 3.0394 3.2564 3.2564 3.3113 3.3113 3.3992 3.3992 3.6696 3.6696 4.5015 4.5015 4.5603 4.5603 4.6611 4.6611 4.7673 4.7673 5.1729 5.1729 5.2969 5.2969 5.3385 5.3385 5.4795 5.4795 5.7594 5.7594 5.8407 5.8407 8.3559 8.3559 9.6234 9.6234 9.7414 9.7414 10.3699 10.3699 10.6770 10.6770 10.9490 10.9490 k = 0.0000 0.5277 0.4286 ( 6188 PWs) bands (ev): -7.8294 -7.8294 -7.1841 -7.1841 -6.7997 -6.7997 -6.7873 -6.7873 -2.1531 -2.1531 -0.8734 -0.8734 -0.8067 -0.8067 -0.5667 -0.5667 -0.4916 -0.4916 -0.4435 -0.4435 1.1196 1.1196 1.2678 1.2678 1.5622 1.5622 2.0072 2.0072 2.1809 2.1809 2.3056 2.3056 3.0394 3.0394 3.2564 3.2564 3.3113 3.3113 3.3992 3.3992 3.6696 3.6696 4.5015 4.5015 4.5603 4.5603 4.6611 4.6611 4.7673 4.7673 5.1729 5.1729 5.2969 5.2969 5.3385 5.3385 5.4795 5.4795 5.7594 5.7594 5.8407 5.8407 8.3559 8.3559 9.6234 9.6234 9.7414 9.7414 10.3699 10.3699 10.6770 10.6770 10.9490 10.9490 k = 0.0089 0.5152 0.4439 ( 6194 PWs) bands (ev): -7.8290 -7.8290 -7.1839 -7.1837 -6.8002 -6.8001 -6.7876 -6.7874 -2.1536 -2.1530 -0.8740 -0.8729 -0.8090 -0.8046 -0.5675 -0.5660 -0.4920 -0.4913 -0.4441 -0.4439 1.1069 1.1154 1.2644 1.2697 1.5601 1.5713 2.0024 2.0108 2.1809 2.1872 2.3090 2.3108 3.0392 3.0408 3.2558 3.2571 3.3106 3.3125 3.3976 3.4014 3.6683 3.6711 4.5007 4.5021 4.5591 4.5624 4.6607 4.6621 4.7673 4.7677 5.1676 5.1740 5.2759 5.3024 5.3379 5.3590 5.4813 5.4840 5.7575 5.7609 5.8392 5.8411 8.3484 8.3532 9.6153 9.6259 9.7429 9.7433 10.3397 10.3671 10.6837 10.6986 10.9513 10.9525 k = 0.0179 0.5028 0.4592 ( 6190 PWs) bands (ev): -7.8279 -7.8279 -7.1829 -7.1826 -6.8015 -6.8014 -6.7885 -6.7882 -2.1545 -2.1533 -0.8745 -0.8723 -0.8115 -0.8027 -0.5681 -0.5652 -0.4923 -0.4911 -0.4454 -0.4450 1.0796 1.0950 1.2597 1.2702 1.5635 1.5838 1.9991 2.0143 2.1873 2.1978 2.3204 2.3246 3.0404 3.0436 3.2553 3.2580 3.3105 3.3143 3.3968 3.4043 3.6671 3.6726 4.4998 4.5025 4.5588 4.5656 4.6610 4.6640 4.7678 4.7685 5.1586 5.1711 5.2546 5.2876 5.3617 5.3841 5.4888 5.4944 5.7551 5.7621 5.8367 5.8404 8.3310 8.3406 9.6012 9.6221 9.7477 9.7489 10.2880 10.3341 10.7158 10.7373 10.9592 10.9617 k = 0.0268 0.4904 0.4745 ( 6194 PWs) bands (ev): -7.8260 -7.8259 -7.1813 -7.1807 -6.8036 -6.8035 -6.7899 -6.7894 -2.1558 -2.1540 -0.8749 -0.8717 -0.8140 -0.8010 -0.5687 -0.5643 -0.4927 -0.4910 -0.4475 -0.4468 1.0415 1.0615 1.2540 1.2694 1.5673 1.5937 2.0024 2.0220 2.1982 2.2105 2.3388 2.3466 3.0429 3.0477 3.2551 3.2588 3.3107 3.3165 3.3966 3.4078 3.6661 3.6742 4.4990 4.5027 4.5593 4.5697 4.6617 4.6668 4.7689 4.7696 5.1466 5.1651 5.2352 5.2710 5.3911 5.4117 5.5013 5.5098 5.7526 5.7631 5.8333 5.8388 8.3044 8.3185 9.5806 9.6111 9.7560 9.7580 10.2269 10.2839 10.7606 10.7825 10.9717 10.9755 k = 0.0357 0.4779 0.4899 ( 6194 PWs) bands (ev): -7.8233 -7.8232 -7.1789 -7.1782 -6.8066 -6.8065 -6.7919 -6.7912 -2.1574 -2.1551 -0.8754 -0.8711 -0.8167 -0.7996 -0.5692 -0.5635 -0.4931 -0.4911 -0.4503 -0.4493 0.9961 1.0190 1.2474 1.2675 1.5662 1.5952 2.0166 2.0382 2.2121 2.2242 2.3629 2.3752 3.0466 3.0530 3.2551 3.2597 3.3113 3.3193 3.3972 3.4119 3.6653 3.6758 4.4984 4.5029 4.5604 4.5747 4.6629 4.6705 4.7706 4.7709 5.1327 5.1568 5.2179 5.2555 5.4226 5.4410 5.5173 5.5289 5.7504 5.7642 5.8293 5.8364 8.2696 8.2879 9.5528 9.5913 9.7673 9.7704 10.1638 10.2268 10.8086 10.8280 10.9872 10.9923 k = 0.0446 0.4655 0.5052 ( 6192 PWs) bands (ev): -7.8199 -7.8198 -7.1759 -7.1750 -6.8103 -6.8103 -6.7943 -6.7934 -2.1594 -2.1565 -0.8758 -0.8705 -0.8194 -0.7983 -0.5697 -0.5626 -0.4936 -0.4915 -0.4536 -0.4521 0.9464 0.9708 1.2399 1.2642 1.5567 1.5858 2.0429 2.0651 2.2283 2.2390 2.3913 2.4088 3.0516 3.0595 3.2555 3.2605 3.3123 3.3225 3.3987 3.4166 3.6646 3.6772 4.4983 4.5032 4.5620 4.5805 4.6645 4.6751 4.7722 4.7730 5.1179 5.1474 5.2026 5.2414 5.4553 5.4715 5.5353 5.5498 5.7493 5.7660 5.8253 5.8335 8.2277 8.2498 9.5172 9.5611 9.7813 9.7853 10.1036 10.1686 10.8549 10.8710 11.0029 11.0095 k = 0.0536 0.4531 0.5205 ( 6188 PWs) bands (ev): -7.8158 -7.8157 -7.1721 -7.1711 -6.8149 -6.8149 -6.7973 -6.7962 -2.1616 -2.1583 -0.8761 -0.8700 -0.8221 -0.7974 -0.5700 -0.5618 -0.4942 -0.4924 -0.4572 -0.4549 0.8943 0.9195 1.2314 1.2592 1.5385 1.5662 2.0799 2.1021 2.2469 2.2555 2.4225 2.4456 3.0576 3.0670 3.2562 3.2614 3.3136 3.3262 3.4009 3.4220 3.6642 3.6786 4.4987 4.5038 4.5640 4.5870 4.6663 4.6807 4.7736 4.7760 5.1029 5.1376 5.1891 5.2284 5.4884 5.5026 5.5539 5.5705 5.7508 5.7686 5.8223 5.8305 8.1799 8.2056 9.4733 9.5194 9.7971 9.8022 10.0500 10.1132 10.8970 10.9097 11.0154 11.0235 k = 0.0625 0.4406 0.5358 ( 6182 PWs) bands (ev): -7.8110 -7.8109 -7.1678 -7.1665 -6.8203 -6.8202 -6.8008 -6.7994 -2.1642 -2.1604 -0.8764 -0.8696 -0.8247 -0.7967 -0.5703 -0.5610 -0.4950 -0.4939 -0.4609 -0.4576 0.8412 0.8667 1.2218 1.2525 1.5130 1.5387 2.1243 2.1469 2.2682 2.2742 2.4552 2.4846 3.0646 3.0755 3.2573 3.2624 3.3152 3.3302 3.4040 3.4280 3.6639 3.6797 4.5000 4.5046 4.5663 4.5941 4.6685 4.6872 4.7749 4.7797 5.0883 5.1282 5.1774 5.2167 5.5206 5.5334 5.5719 5.5885 5.7567 5.7718 5.8223 5.8281 8.1275 8.1563 9.4209 9.4659 9.8137 9.8202 10.0052 10.0629 10.9334 10.9426 11.0214 11.0304 k = 0.0714 0.4282 0.5511 ( 6176 PWs) bands (ev): -7.8056 -7.8055 -7.1628 -7.1614 -6.8263 -6.8263 -6.8047 -6.8032 -2.1670 -2.1628 -0.8767 -0.8693 -0.8272 -0.7964 -0.5705 -0.5603 -0.4963 -0.4961 -0.4643 -0.4598 0.7881 0.8135 1.2110 1.2438 1.4821 1.5057 2.1728 2.1965 2.2930 2.2958 2.4887 2.5249 3.0725 3.0848 3.2587 3.2634 3.3170 3.3346 3.4080 3.4346 3.6637 3.6805 4.5021 4.5059 4.5690 4.6018 4.6708 4.6944 4.7762 4.7839 5.0744 5.1196 5.1672 5.2060 5.5488 5.5627 5.5897 5.6014 5.7686 5.7743 5.8278 5.8284 8.0716 8.1031 9.3601 9.4012 9.8300 9.8388 9.9705 10.0194 10.9627 10.9667 11.0200 11.0278 k = 0.0804 0.4158 0.5664 ( 6176 PWs) bands (ev): -7.7996 -7.7994 -7.1571 -7.1556 -6.8331 -6.8331 -6.8092 -6.8074 -2.1700 -2.1655 -0.8770 -0.8693 -0.8296 -0.7964 -0.5707 -0.5596 -0.4992 -0.4981 -0.4672 -0.4614 0.7356 0.7607 1.1989 1.2333 1.4476 1.4694 2.2223 2.2474 2.3208 2.3224 2.5224 2.5660 3.0811 3.0949 3.2605 3.2646 3.3190 3.3392 3.4130 3.4418 3.6636 3.6810 4.5050 4.5076 4.5721 4.6099 4.6734 4.7022 4.7773 4.7886 5.0614 5.1119 5.1585 5.1961 5.5681 5.5872 5.6097 5.6099 5.7761 5.7858 5.8320 5.8427 8.0132 8.0470 9.2917 9.3272 9.8447 9.8572 9.9463 9.9835 10.9732 10.9801 11.0197 11.0200 k = 0.0893 0.4033 0.5817 ( 6164 PWs) bands (ev): -7.7930 -7.7929 -7.1509 -7.1492 -6.8404 -6.8404 -6.8141 -6.8122 -2.1731 -2.1684 -0.8772 -0.8694 -0.8317 -0.7966 -0.5708 -0.5590 -0.5028 -0.5005 -0.4694 -0.4623 0.6844 0.7090 1.1857 1.2209 1.4109 1.4310 2.2701 2.2959 2.3502 2.3582 2.5559 2.6074 3.0905 3.1056 3.2627 3.2661 3.3213 3.3440 3.4189 3.4496 3.6635 3.6810 4.5090 4.5099 4.5756 4.6185 4.6763 4.7105 4.7785 4.7939 5.0497 5.1051 5.1512 5.1869 5.5769 5.5981 5.6217 5.6309 5.7797 5.8044 5.8454 5.8648 7.9532 7.9890 9.2170 9.2462 9.8554 9.8742 9.9333 9.9560 10.9571 10.9722 11.0224 11.0286 k = 0.0982 0.3909 0.5970 ( 6170 PWs) bands (ev): -7.7860 -7.7858 -7.1441 -7.1422 -6.8483 -6.8483 -6.8195 -6.8174 -2.1764 -2.1714 -0.8775 -0.8699 -0.8335 -0.7973 -0.5709 -0.5586 -0.5069 -0.5035 -0.4708 -0.4627 0.6347 0.6587 1.1714 1.2069 1.3732 1.3918 2.3139 2.3389 2.3847 2.4018 2.5892 2.6488 3.1004 3.1168 3.2652 3.2678 3.3237 3.3489 3.4257 3.4580 3.6634 3.6805 4.5126 4.5139 4.5795 4.6275 4.6793 4.7191 4.7799 4.7996 5.0393 5.0993 5.1453 5.1783 5.5787 5.5959 5.6360 5.6472 5.7894 5.8218 5.8704 5.8926 7.8926 7.9299 9.1374 9.1605 9.8605 9.8871 9.9316 9.9388 10.9311 10.9471 11.0317 11.0373 k = 0.1071 0.3785 0.6123 ( 6166 PWs) bands (ev): -7.7785 -7.7784 -7.1368 -7.1347 -6.8567 -6.8566 -6.8254 -6.8231 -2.1797 -2.1746 -0.8778 -0.8708 -0.8348 -0.7982 -0.5709 -0.5584 -0.5111 -0.5070 -0.4714 -0.4626 0.5869 0.6102 1.1562 1.1914 1.3352 1.3524 2.3528 2.3769 2.4239 2.4508 2.6222 2.6899 3.1108 3.1284 3.2680 3.2699 3.3263 3.3540 3.4336 3.4670 3.6632 3.6794 4.5159 4.5196 4.5840 4.6369 4.6827 4.7276 4.7817 4.8056 5.0305 5.0942 5.1406 5.1700 5.5763 5.5890 5.6449 5.6547 5.8076 5.8411 5.9031 5.9245 7.8319 7.8704 9.0544 9.0718 9.8614 9.8909 9.9362 9.9385 10.9029 10.9182 11.0381 11.0417 k = 0.1161 0.3660 0.6276 ( 6172 PWs) bands (ev): -7.7708 -7.7706 -7.1289 -7.1267 -6.8654 -6.8653 -6.8317 -6.8293 -2.1831 -2.1779 -0.8781 -0.8719 -0.8358 -0.7994 -0.5709 -0.5582 -0.5153 -0.5106 -0.4714 -0.4622 0.5413 0.5638 1.1403 1.1747 1.2975 1.3135 2.3883 2.4127 2.4654 2.5008 2.6551 2.7301 3.1215 3.1403 3.2711 3.2724 3.3291 3.3592 3.4424 3.4766 3.6628 3.6776 4.5197 4.5261 4.5890 4.6463 4.6865 4.7357 4.7842 4.8118 5.0233 5.0896 5.1372 5.1619 5.5713 5.5801 5.6475 5.6540 5.8333 5.8643 5.9393 5.9588 7.7720 7.8111 8.9694 8.9820 9.8615 9.8872 9.9456 9.9495 10.8763 10.8903 11.0398 11.0412 k = 0.1250 0.3536 0.6429 ( 6178 PWs) bands (ev): -7.7627 -7.7625 -7.1205 -7.1182 -6.8744 -6.8743 -6.8385 -6.8359 -2.1865 -2.1813 -0.8785 -0.8734 -0.8363 -0.8009 -0.5710 -0.5583 -0.5192 -0.5142 -0.4709 -0.4615 0.4980 0.5196 1.1239 1.1572 1.2606 1.2755 2.4217 2.4474 2.5068 2.5490 2.6882 2.7692 3.1326 3.1523 3.2746 3.2755 3.3322 3.3646 3.4522 3.4866 3.6621 3.6751 4.5241 4.5333 4.5944 4.6556 4.6911 4.7430 4.7881 4.8182 5.0176 5.0851 5.1348 5.1536 5.5649 5.5705 5.6449 5.6480 5.8634 5.8909 5.9769 5.9944 7.7134 7.7527 8.8838 8.8922 9.8631 9.8838 9.9585 9.9617 10.8533 10.8656 11.0363 11.0369 k = 0.1339 0.3412 0.6582 ( 6182 PWs) bands (ev): -7.7545 -7.7543 -7.1117 -7.1092 -6.8836 -6.8835 -6.8458 -6.8430 -2.1898 -2.1847 -0.8789 -0.8751 -0.8365 -0.8026 -0.5710 -0.5586 -0.5228 -0.5176 -0.4701 -0.4607 0.4572 0.4778 1.1072 1.1390 1.2250 1.2387 2.4540 2.4815 2.5466 2.5934 2.7220 2.8065 3.1439 3.1643 3.2784 3.2792 3.3356 3.3703 3.4629 3.4971 3.6610 3.6717 4.5291 4.5409 4.6002 4.6640 4.6971 4.7491 4.7937 4.8246 5.0135 5.0806 5.1333 5.1451 5.5579 5.5609 5.6389 5.6390 5.8953 5.9194 6.0146 6.0302 7.6566 7.6958 8.7987 8.8036 9.8670 9.8834 9.9714 9.9734 10.8353 10.8456 11.0278 11.0299 k = 0.1429 0.3287 0.6736 ( 6180 PWs) bands (ev): -7.7462 -7.7460 -7.1025 -7.0999 -6.8929 -6.8928 -6.8534 -6.8506 -2.1930 -2.1880 -0.8793 -0.8770 -0.8363 -0.8045 -0.5711 -0.5592 -0.5259 -0.5206 -0.4690 -0.4598 0.4190 0.4386 1.0906 1.1206 1.1909 1.2036 2.4856 2.5146 2.5839 2.6329 2.7565 2.8415 3.1554 3.1761 3.2824 3.2834 3.3393 3.3761 3.4745 3.5079 3.6594 3.6676 4.5346 4.5489 4.6062 4.6705 4.7054 4.7542 4.8010 4.8311 5.0109 5.0757 5.1323 5.1362 5.5510 5.5521 5.6287 5.6307 5.9274 5.9485 6.0516 6.0655 7.6023 7.6408 8.7151 8.7172 9.8734 9.8864 9.9832 9.9841 10.8231 10.8312 11.0168 11.0199 k = 0.1518 0.3163 0.6889 ( 6172 PWs) bands (ev): -7.7379 -7.7377 -7.0929 -7.0901 -6.9021 -6.9020 -6.8615 -6.8586 -2.1961 -2.1913 -0.8799 -0.8788 -0.8358 -0.8065 -0.5712 -0.5598 -0.5285 -0.5233 -0.4677 -0.4589 0.3837 0.4021 1.0742 1.1023 1.1587 1.1703 2.5161 2.5464 2.6185 2.6674 2.7912 2.8737 3.1670 3.1877 3.2867 3.2882 3.3435 3.3823 3.4868 3.5190 3.6573 3.6626 4.5406 4.5570 4.6123 4.6747 4.7165 4.7588 4.8097 4.8375 5.0094 5.0703 5.1268 5.1314 5.5446 5.5448 5.6180 5.6214 5.9586 5.9770 6.0871 6.0995 7.5508 7.5881 8.6339 8.6340 9.8823 9.8928 9.9934 9.9934 10.8171 10.8229 11.0044 11.0078 k = 0.1607 0.3039 0.7042 ( 6170 PWs) bands (ev): -7.7298 -7.7296 -7.0829 -7.0800 -6.9111 -6.9110 -6.8700 -6.8669 -2.1991 -2.1945 -0.8807 -0.8805 -0.8352 -0.8086 -0.5712 -0.5607 -0.5306 -0.5255 -0.4664 -0.4580 0.3512 0.3684 1.0584 1.0843 1.1286 1.1391 2.5455 2.5763 2.6502 2.6972 2.8254 2.9026 3.1785 3.1987 3.2913 3.2935 3.3481 3.3888 3.4996 3.5300 3.6545 3.6568 4.5472 4.5651 4.6182 4.6767 4.7301 4.7634 4.8193 4.8439 5.0087 5.0641 5.1167 5.1302 5.5388 5.5398 5.6075 5.6118 5.9881 6.0043 6.1206 6.1317 7.5027 7.5384 8.5545 8.5564 9.8935 9.9021 10.0012 10.0020 10.8175 10.8209 10.9916 10.9948 k = 0.1696 0.2914 0.7195 ( 6164 PWs) bands (ev): -7.7219 -7.7217 -7.0727 -7.0697 -6.9199 -6.9198 -6.8789 -6.8757 -2.2018 -2.1975 -0.8825 -0.8812 -0.8345 -0.8107 -0.5713 -0.5617 -0.5322 -0.5274 -0.4649 -0.4572 0.3217 0.3375 1.0434 1.0669 1.1008 1.1102 2.5733 2.6039 2.6791 2.7231 2.8579 2.9281 3.1900 3.2091 3.2962 3.2991 3.3532 3.3955 3.5128 3.5409 3.6503 3.6511 4.5542 4.5730 4.6237 4.6770 4.7458 4.7689 4.8293 4.8503 5.0081 5.0570 5.1062 5.1282 5.5352 5.5365 5.5978 5.6024 6.0155 6.0297 6.1516 6.1615 7.4583 7.4919 8.4799 8.4830 9.9065 9.9138 10.0075 10.0089 10.8241 10.8253 10.9795 10.9819 k = 0.1786 0.2790 0.7348 ( 6168 PWs) bands (ev): -7.7144 -7.7142 -7.0621 -7.0590 -6.9282 -6.9281 -6.8881 -6.8849 -2.2042 -2.2003 -0.8842 -0.8820 -0.8336 -0.8128 -0.5714 -0.5628 -0.5333 -0.5288 -0.4635 -0.4564 0.2952 0.3096 1.0295 1.0505 1.0756 1.0838 2.5992 2.6287 2.7053 2.7455 2.8880 2.9499 3.2011 3.2187 3.3013 3.3049 3.3591 3.4024 3.5260 3.5514 3.6430 3.6469 4.5616 4.5806 4.6283 4.6757 4.7630 4.7758 4.8394 4.8567 5.0069 5.0489 5.0956 5.1251 5.5337 5.5349 5.5890 5.5936 6.0404 6.0527 6.1797 6.1885 7.4180 7.4491 8.4108 8.4147 9.9209 9.9274 10.0125 10.0142 10.8355 10.8365 10.9689 10.9701 k = 0.1875 0.2666 0.7501 ( 6160 PWs) bands (ev): -7.7074 -7.7072 -7.0514 -7.0482 -6.9359 -6.9359 -6.8976 -6.8943 -2.2065 -2.2029 -0.8856 -0.8828 -0.8327 -0.8148 -0.5714 -0.5639 -0.5341 -0.5300 -0.4620 -0.4557 0.2719 0.2847 1.0168 1.0352 1.0530 1.0600 2.6230 2.6504 2.7289 2.7651 2.9149 2.9682 3.2117 3.2272 3.3066 3.3108 3.3656 3.4094 3.5389 3.5613 3.6354 3.6420 4.5695 4.5878 4.6318 4.6732 4.7814 4.7844 4.8493 4.8632 5.0042 5.0396 5.0854 5.1207 5.5343 5.5352 5.5814 5.5857 6.0626 6.0731 6.2047 6.2124 7.3822 7.4103 8.3480 8.3523 9.9361 9.9422 10.0165 10.0182 10.8512 10.8541 10.9605 10.9605 k = 0.1964 0.2541 0.7654 ( 6156 PWs) bands (ev): -7.7010 -7.7008 -7.0405 -7.0371 -6.9430 -6.9430 -6.9075 -6.9042 -2.2084 -2.2053 -0.8868 -0.8838 -0.8317 -0.8167 -0.5713 -0.5649 -0.5346 -0.5310 -0.4607 -0.4551 0.2517 0.2629 1.0056 1.0212 1.0333 1.0391 2.6442 2.6688 2.7498 2.7818 2.9384 2.9830 3.2216 3.2347 3.3119 3.3164 3.3730 3.4161 3.5511 3.5703 3.6277 3.6366 4.5776 4.5946 4.6342 4.6694 4.7949 4.8008 4.8587 4.8695 4.9989 5.0290 5.0767 5.1151 5.5366 5.5372 5.5750 5.5790 6.0818 6.0907 6.2262 6.2330 7.3510 7.3758 8.2921 8.2965 9.9515 9.9572 10.0197 10.0212 10.8714 10.8759 10.9539 10.9552 k = 0.2054 0.2417 0.7807 ( 6152 PWs) bands (ev): -7.6953 -7.6952 -7.0294 -7.0260 -6.9493 -6.9492 -6.9176 -6.9143 -2.2100 -2.2073 -0.8878 -0.8847 -0.8307 -0.8184 -0.5712 -0.5659 -0.5349 -0.5318 -0.4594 -0.4547 0.2347 0.2442 0.9960 1.0086 1.0166 1.0210 2.6627 2.6839 2.7682 2.7957 2.9584 2.9946 3.2303 3.2409 3.3172 3.3215 3.3811 3.4222 3.5621 3.5781 3.6203 3.6307 4.5860 4.6010 4.6353 4.6646 4.8075 4.8206 4.8673 4.8755 4.9905 5.0172 5.0702 5.1083 5.5400 5.5404 5.5698 5.5737 6.0980 6.1054 6.2443 6.2500 7.3248 7.3460 8.2437 8.2479 9.9661 9.9715 10.0224 10.0236 10.8948 10.9007 10.9512 10.9536 k = 0.2143 0.2293 0.7960 ( 6152 PWs) bands (ev): -7.6905 -7.6904 -7.0183 -7.0148 -6.9546 -6.9544 -6.9279 -6.9246 -2.2113 -2.2091 -0.8885 -0.8857 -0.8297 -0.8201 -0.5711 -0.5669 -0.5350 -0.5324 -0.4582 -0.4544 0.2209 0.2286 0.9882 0.9978 1.0031 1.0059 2.6783 2.6956 2.7841 2.8067 2.9750 3.0031 3.2378 3.2459 3.3222 3.3259 3.3900 3.4272 3.5715 3.5844 3.6139 3.6247 4.5946 4.6069 4.6353 4.6589 4.8217 4.8404 4.8750 4.8810 4.9790 5.0041 5.0663 5.1008 5.5437 5.5443 5.5660 5.5698 6.1112 6.1172 6.2589 6.2636 7.3036 7.3209 8.2035 8.2072 9.9791 9.9841 10.0251 10.0258 10.9195 10.9264 10.9535 10.9565 k = 0.2232 0.2168 0.8113 ( 6150 PWs) bands (ev): -7.6866 -7.6866 -7.0071 -7.0036 -6.9589 -6.9586 -6.9384 -6.9351 -2.2123 -2.2106 -0.8889 -0.8866 -0.8287 -0.8216 -0.5708 -0.5677 -0.5349 -0.5329 -0.4572 -0.4543 0.2104 0.2163 0.9824 0.9887 0.9927 0.9940 2.6910 2.7041 2.7972 2.8146 2.9883 3.0089 3.2437 3.2495 3.3265 3.3295 3.3994 3.4304 3.5788 3.5888 3.6093 3.6190 4.6033 4.6123 4.6342 4.6524 4.8373 4.8593 4.8814 4.8856 4.9656 4.9899 5.0649 5.0930 5.5470 5.5479 5.5637 5.5673 6.1215 6.1260 6.2702 6.2738 7.2876 7.3007 8.1718 8.1748 9.9896 9.9939 10.0278 10.0281 10.9417 10.9495 10.9628 10.9656 k = 0.2321 0.2044 0.8266 ( 6152 PWs) bands (ev): -7.6838 -7.6838 -6.9961 -6.9926 -6.9622 -6.9616 -6.9488 -6.9457 -2.2129 -2.2118 -0.8891 -0.8874 -0.8276 -0.8230 -0.5705 -0.5684 -0.5347 -0.5334 -0.4563 -0.4544 0.2032 0.2071 0.9786 0.9820 0.9852 0.9852 2.7007 2.7095 2.8076 2.8195 2.9985 3.0120 3.2482 3.2519 3.3300 3.3320 3.4087 3.4312 3.5838 3.5910 3.6072 3.6143 4.6120 4.6173 4.6322 4.6451 4.8536 4.8757 4.8864 4.8888 4.9527 4.9750 5.0656 5.0853 5.5493 5.5504 5.5631 5.5662 6.1290 6.1320 6.2783 6.2807 7.2768 7.2856 8.1491 8.1512 9.9971 10.0003 10.0306 10.0307 10.9585 10.9659 10.9796 10.9816 k = 0.2411 0.1919 0.8419 ( 6164 PWs) bands (ev): -7.6821 -7.6821 -6.9856 -6.9823 -6.9645 -6.9634 -6.9583 -6.9561 -2.2131 -2.2126 -0.8890 -0.8881 -0.8266 -0.8243 -0.5702 -0.5691 -0.5345 -0.5339 -0.4556 -0.4546 0.1993 0.2012 0.9769 0.9781 0.9796 0.9801 2.7074 2.7118 2.8152 2.8212 3.0058 3.0125 3.2512 3.2530 3.3323 3.3333 3.4173 3.4291 3.5869 3.5908 3.6074 3.6110 4.6205 4.6217 4.6296 4.6374 4.8694 4.8857 4.8896 4.8901 4.9450 4.9603 5.0682 5.0783 5.5505 5.5512 5.5639 5.5656 6.1337 6.1352 6.2833 6.2845 7.2712 7.2756 8.1356 8.1367 10.0017 10.0033 10.0328 10.0329 10.9730 10.9789 10.9964 10.9967 k = 0.2500 0.1795 0.8572 ( 6168 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9652 -6.9652 -6.9627 -6.9627 -2.2130 -2.2130 -0.8887 -0.8887 -0.8255 -0.8255 -0.5697 -0.5697 -0.5342 -0.5342 -0.4550 -0.4550 0.1986 0.1986 0.9772 0.9772 0.9775 0.9775 2.7111 2.7111 2.8197 2.8197 3.0105 3.0105 3.2527 3.2527 3.3334 3.3334 3.4244 3.4244 3.5892 3.5892 3.6088 3.6088 4.6254 4.6254 4.6297 4.6297 4.8822 4.8822 4.8908 4.8908 4.9485 4.9485 5.0725 5.0725 5.5511 5.5511 5.5649 5.5649 6.1358 6.1358 6.2854 6.2854 7.2708 7.2708 8.1315 8.1315 10.0037 10.0037 10.0337 10.0337 10.9831 10.9831 11.0070 11.0070 k = 0.2500 0.1795 0.8572 ( 6168 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9652 -6.9652 -6.9627 -6.9627 -2.2130 -2.2130 -0.8887 -0.8887 -0.8255 -0.8255 -0.5697 -0.5697 -0.5342 -0.5342 -0.4550 -0.4550 0.1986 0.1986 0.9772 0.9772 0.9775 0.9775 2.7111 2.7111 2.8197 2.8197 3.0105 3.0105 3.2527 3.2527 3.3334 3.3334 3.4244 3.4244 3.5892 3.5892 3.6088 3.6088 4.6254 4.6254 4.6297 4.6297 4.8822 4.8822 4.8908 4.8908 4.9485 4.9485 5.0725 5.0725 5.5511 5.5511 5.5649 5.5649 6.1358 6.1358 6.2854 6.2854 7.2708 7.2708 8.1315 8.1315 10.0037 10.0037 10.0337 10.0337 10.9831 10.9831 11.0070 11.0070 k = 0.2639 0.1895 0.8450 ( 6157 PWs) bands (ev): -7.6817 -7.6817 -6.9810 -6.9786 -6.9661 -6.9650 -6.9608 -6.9593 -2.2132 -2.2128 -0.8889 -0.8883 -0.8262 -0.8248 -0.5700 -0.5693 -0.5344 -0.5339 -0.4554 -0.4548 0.1990 0.2001 0.9394 0.9410 1.0168 1.0172 2.7006 2.7027 2.8240 2.8265 3.0059 3.0100 3.2520 3.2530 3.3335 3.3339 3.4224 3.4297 3.5875 3.5904 3.6084 3.6104 4.6238 4.6245 4.6260 4.6355 4.8738 4.8810 4.8908 4.8954 4.9433 4.9552 5.0714 5.0786 5.5205 5.5208 5.5962 5.5973 6.1347 6.1356 6.2848 6.2855 7.2671 7.2693 8.1349 8.1356 9.9400 9.9404 10.0953 10.0956 10.9783 10.9835 10.9998 11.0031 k = 0.2778 0.1995 0.8327 ( 6144 PWs) bands (ev): -7.6822 -7.6821 -6.9852 -6.9823 -6.9666 -6.9658 -6.9563 -6.9539 -2.2133 -2.2126 -0.8891 -0.8878 -0.8270 -0.8240 -0.5705 -0.5688 -0.5347 -0.5334 -0.4558 -0.4546 0.2013 0.2033 0.9044 0.9075 1.0584 1.0592 2.6763 2.6797 2.8357 2.8390 2.9965 3.0049 3.2507 3.2527 3.3343 3.3345 3.4231 3.4387 3.5846 3.5916 3.6094 3.6132 4.6206 4.6225 4.6235 4.6422 4.8635 4.8749 4.8883 4.8999 4.9389 4.9641 5.0741 5.0903 5.4849 5.4854 5.6355 5.6373 6.1320 6.1339 6.2840 6.2852 7.2582 7.2621 8.1459 8.1479 9.8628 9.8634 10.1673 10.1680 10.9692 10.9772 10.9932 10.9990 k = 0.2917 0.2094 0.8204 ( 6148 PWs) bands (ev): -7.6829 -7.6828 -6.9892 -6.9862 -6.9671 -6.9664 -6.9514 -6.9487 -2.2132 -2.2122 -0.8893 -0.8872 -0.8279 -0.8232 -0.5711 -0.5682 -0.5350 -0.5328 -0.4565 -0.4545 0.2054 0.2081 0.8726 0.8770 1.1020 1.1032 2.6440 2.6484 2.8476 2.8512 2.9844 2.9962 3.2489 3.2518 3.3347 3.3353 3.4261 3.4504 3.5808 3.5926 3.6121 3.6171 4.6161 4.6199 4.6219 4.6486 4.8527 4.8677 4.8838 4.8994 4.9374 4.9729 5.0807 5.1068 5.4504 5.4510 5.6766 5.6789 6.1274 6.1304 6.2829 6.2845 7.2444 7.2490 8.1649 8.1686 9.7862 9.7868 10.2359 10.2368 10.9536 10.9578 11.0013 11.0030 k = 0.3056 0.2194 0.8081 ( 6146 PWs) bands (ev): -7.6837 -7.6837 -6.9928 -6.9899 -6.9674 -6.9667 -6.9470 -6.9442 -2.2130 -2.2116 -0.8895 -0.8864 -0.8289 -0.8224 -0.5717 -0.5674 -0.5352 -0.5321 -0.4573 -0.4544 0.2111 0.2145 0.8439 0.8496 1.1473 1.1489 2.6068 2.6121 2.8549 2.8592 2.9728 2.9862 3.2468 3.2505 3.3345 3.3362 3.4304 3.4632 3.5770 3.5936 3.6165 3.6221 4.6112 4.6170 4.6204 4.6546 4.8417 4.8598 4.8782 4.8939 4.9387 4.9802 5.0915 5.1270 5.4174 5.4180 5.7190 5.7214 6.1206 6.1249 6.2817 6.2836 7.2263 7.2306 8.1915 8.1973 9.7120 9.7124 10.2988 10.2998 10.9322 10.9335 11.0168 11.0187 k = 0.3194 0.2294 0.7959 ( 6148 PWs) bands (ev): -7.6847 -7.6847 -6.9959 -6.9931 -6.9674 -6.9667 -6.9433 -6.9405 -2.2126 -2.2108 -0.8897 -0.8856 -0.8300 -0.8215 -0.5724 -0.5665 -0.5355 -0.5312 -0.4582 -0.4544 0.2183 0.2224 0.8185 0.8253 1.1944 1.1962 2.5661 2.5725 2.8540 2.8607 2.9655 2.9782 3.2443 3.2489 3.3337 3.3364 3.4346 3.4749 3.5742 3.5954 3.6222 3.6281 4.6060 4.6138 4.6188 4.6600 4.8308 4.8515 4.8721 4.8860 4.9410 4.9853 5.1060 5.1500 5.3863 5.3869 5.7618 5.7639 6.1114 6.1173 6.2805 6.2824 7.2051 7.2082 8.2251 8.2336 9.6412 9.6415 10.3545 10.3554 10.9063 10.9069 11.0403 11.0453 k = 0.3333 0.2394 0.7836 ( 6149 PWs) bands (ev): -7.6857 -7.6857 -6.9984 -6.9958 -6.9671 -6.9664 -6.9406 -6.9378 -2.2119 -2.2097 -0.8898 -0.8846 -0.8312 -0.8205 -0.5732 -0.5654 -0.5357 -0.5302 -0.4593 -0.4543 0.2269 0.2315 0.7964 0.8042 1.2428 1.2449 2.5227 2.5303 2.8440 2.8543 2.9642 2.9742 3.2414 3.2468 3.3323 3.3359 3.4375 3.4831 3.5739 3.5982 3.6290 3.6349 4.6003 4.6101 4.6172 4.6647 4.8201 4.8427 4.8659 4.8771 4.9432 4.9884 5.1237 5.1748 5.3572 5.3578 5.8040 5.8054 6.1000 6.1077 6.2791 6.2809 7.1825 7.1834 8.2651 8.2767 9.5748 9.5750 10.4022 10.4028 10.8769 10.8788 11.0733 11.0814 k = 0.3472 0.2493 0.7713 ( 6155 PWs) bands (ev): -7.6868 -7.6868 -7.0004 -6.9979 -6.9666 -6.9658 -6.9389 -6.9361 -2.2109 -2.2082 -0.8899 -0.8835 -0.8324 -0.8195 -0.5740 -0.5642 -0.5359 -0.5292 -0.4605 -0.4543 0.2366 0.2417 0.7775 0.7863 1.2926 1.2947 2.4771 2.4861 2.8271 2.8414 2.9674 2.9739 3.2383 3.2444 3.3305 3.3348 3.4381 3.4860 3.5774 3.6023 3.6367 3.6426 4.5942 4.6061 4.6156 4.6688 4.8099 4.8335 4.8597 4.8681 4.9448 4.9897 5.1437 5.2008 5.3303 5.3310 5.8443 5.8444 6.0863 6.0960 6.2774 6.2789 7.1580 7.1603 8.3106 8.3255 9.5136 9.5136 10.4416 10.4417 10.8458 10.8486 11.1147 11.1266 k = 0.3611 0.2593 0.7590 ( 6157 PWs) bands (ev): -7.6879 -7.6878 -7.0018 -6.9994 -6.9658 -6.9649 -6.9382 -6.9356 -2.2096 -2.2065 -0.8900 -0.8823 -0.8337 -0.8183 -0.5748 -0.5628 -0.5359 -0.5281 -0.4618 -0.4542 0.2473 0.2528 0.7619 0.7716 1.3433 1.3454 2.4299 2.4404 2.8069 2.8245 2.9723 2.9756 3.2349 3.2416 3.3282 3.3331 3.4361 3.4832 3.5845 3.6076 3.6451 3.6510 4.5876 4.6016 4.6140 4.6721 4.8001 4.8240 4.8537 4.8596 4.9458 4.9898 5.1653 5.2268 5.3057 5.3072 5.8791 5.8813 6.0705 6.0824 6.2753 6.2765 7.1341 7.1405 8.3606 8.3792 9.4580 9.4581 10.4728 10.4734 10.8132 10.8165 11.1608 11.1784 k = 0.3750 0.2693 0.7468 ( 6161 PWs) bands (ev): -7.6889 -7.6889 -7.0025 -7.0004 -6.9646 -6.9638 -6.9387 -6.9362 -2.2079 -2.2043 -0.8900 -0.8811 -0.8349 -0.8171 -0.5755 -0.5612 -0.5358 -0.5270 -0.4631 -0.4541 0.2588 0.2647 0.7497 0.7602 1.3947 1.3967 2.3814 2.3936 2.7857 2.8063 2.9770 2.9773 3.2311 3.2384 3.3256 3.3310 3.4317 3.4762 3.5939 3.6137 3.6538 3.6599 4.5807 4.5968 4.6125 4.6747 4.7908 4.8141 4.8479 4.8515 4.9463 4.9888 5.1876 5.2492 5.2839 5.2897 5.9080 5.9130 6.0528 6.0670 6.2727 6.2734 7.1141 7.1254 8.4145 8.4370 9.4085 9.4088 10.4972 10.4986 10.7791 10.7827 11.2026 11.2274 k = 0.3889 0.2792 0.7345 ( 6167 PWs) bands (ev): -7.6899 -7.6899 -7.0028 -7.0007 -6.9632 -6.9623 -6.9403 -6.9379 -2.2059 -2.2018 -0.8900 -0.8798 -0.8362 -0.8157 -0.5762 -0.5596 -0.5354 -0.5259 -0.4646 -0.4539 0.2708 0.2773 0.7408 0.7520 1.4466 1.4482 2.3321 2.3462 2.7651 2.7884 2.9778 2.9805 3.2271 3.2348 3.3226 3.3287 3.4253 3.4663 3.6042 3.6201 3.6627 3.6690 4.5734 4.5915 4.6109 4.6768 4.7821 4.8039 4.8425 4.8442 4.9462 4.9872 5.2090 5.2507 5.2659 5.2955 5.9295 5.9377 6.0334 6.0500 6.2693 6.2695 7.0999 7.1167 8.4713 8.4979 9.3656 9.3660 10.5160 10.5184 10.7435 10.7473 11.2316 11.2561 k = 0.4028 0.2892 0.7222 ( 6173 PWs) bands (ev): -7.6909 -7.6908 -7.0024 -7.0005 -6.9615 -6.9605 -6.9429 -6.9408 -2.2036 -2.1990 -0.8899 -0.8785 -0.8375 -0.8142 -0.5769 -0.5579 -0.5347 -0.5248 -0.4661 -0.4537 0.2834 0.2904 0.7351 0.7470 1.4985 1.4995 2.2824 2.2988 2.7460 2.7719 2.9761 2.9820 3.2228 3.2308 3.3194 3.3261 3.4175 3.4548 3.6145 3.6264 3.6717 3.6780 4.5657 4.5859 4.6092 4.6783 4.7739 4.7935 4.8374 4.8377 4.9457 4.9852 5.2225 5.2361 5.2582 5.3196 5.9422 5.9540 6.0125 6.0316 6.2648 6.2652 7.0931 7.1159 8.5304 8.5613 9.3294 9.3301 10.5304 10.5339 10.7062 10.7103 11.2520 11.2760 k = 0.4167 0.2992 0.7099 ( 6177 PWs) bands (ev): -7.6919 -7.6918 -7.0014 -6.9998 -6.9596 -6.9584 -6.9466 -6.9446 -2.2009 -2.1959 -0.8899 -0.8772 -0.8387 -0.8126 -0.5775 -0.5564 -0.5335 -0.5239 -0.4676 -0.4533 0.2964 0.3039 0.7327 0.7453 1.5499 1.5500 2.2329 2.2519 2.7288 2.7575 2.9717 2.9812 3.2182 3.2265 3.3159 3.3235 3.4087 3.4424 3.6244 3.6322 3.6805 3.6867 4.5578 4.5800 4.6075 4.6793 4.7664 4.7829 4.8320 4.8328 4.9450 4.9828 5.2175 5.2205 5.2710 5.3464 5.9455 5.9607 5.9907 6.0121 6.2592 6.2602 7.0949 7.1235 8.5910 8.6263 9.3001 9.3013 10.5409 10.5457 10.6673 10.6717 11.2672 11.2916 k = 0.4306 0.3092 0.6976 ( 6183 PWs) bands (ev): -7.6930 -7.6929 -6.9999 -6.9984 -6.9576 -6.9562 -6.9509 -6.9493 -2.1980 -2.1925 -0.8898 -0.8759 -0.8399 -0.8109 -0.5780 -0.5551 -0.5319 -0.5230 -0.4692 -0.4529 0.3096 0.3178 0.7336 0.7469 1.5988 1.6004 2.1842 2.2064 2.7139 2.7457 2.9641 2.9779 3.2135 3.2218 3.3122 3.3208 3.3996 3.4295 3.6338 3.6372 3.6891 3.6948 4.5498 4.5737 4.6057 4.6800 4.7594 4.7722 4.8270 4.8287 4.9440 4.9803 5.2059 5.2063 5.2918 5.3733 5.9399 5.9571 5.9688 5.9916 6.2527 6.2544 7.1052 7.1393 8.6522 8.6923 9.2780 9.2799 10.5472 10.5535 10.6273 10.6323 11.2776 11.3030 k = 0.4444 0.3191 0.6854 ( 6180 PWs) bands (ev): -7.6942 -7.6940 -6.9978 -6.9965 -6.9584 -6.9562 -6.9530 -6.9523 -2.1949 -2.1889 -0.8897 -0.8748 -0.8411 -0.8091 -0.5786 -0.5541 -0.5296 -0.5223 -0.4707 -0.4524 0.3230 0.3320 0.7377 0.7516 1.6449 1.6489 2.1371 2.1634 2.7011 2.7365 2.9532 2.9720 3.2085 3.2169 3.3084 3.3181 3.3904 3.4166 3.6412 3.6425 3.6975 3.7021 4.5418 4.5674 4.6037 4.6804 4.7531 4.7616 4.8229 4.8249 4.9429 4.9777 5.1938 5.1944 5.3134 5.3993 5.9262 5.9401 5.9513 5.9705 6.2454 6.2479 7.1234 7.1623 8.7134 8.7585 9.2628 9.2658 10.5458 10.5543 10.5893 10.5955 11.2830 11.3095 k = 0.4583 0.3291 0.6731 ( 6186 PWs) bands (ev): -7.6955 -7.6954 -6.9952 -6.9942 -6.9639 -6.9621 -6.9507 -6.9498 -2.1917 -2.1851 -0.8896 -0.8737 -0.8422 -0.8072 -0.5790 -0.5534 -0.5268 -0.5216 -0.4723 -0.4519 0.3366 0.3466 0.7451 0.7597 1.6865 1.6941 2.0931 2.1244 2.6904 2.7300 2.9388 2.9638 3.2035 3.2118 3.3045 3.3155 3.3815 3.4039 3.6440 3.6504 3.7056 3.7086 4.5339 4.5608 4.6015 4.6805 4.7474 4.7509 4.8195 4.8216 4.9417 4.9752 5.1831 5.1842 5.3338 5.4238 5.9065 5.9164 5.9333 5.9488 6.2375 6.2409 7.1479 7.1909 8.7737 8.8242 9.2544 9.2589 10.5244 10.5299 10.5715 10.5736 11.2828 11.3104 k = 0.4722 0.3391 0.6608 ( 6185 PWs) bands (ev): -7.6971 -7.6970 -6.9921 -6.9914 -6.9704 -6.9690 -6.9476 -6.9466 -2.1884 -2.1814 -0.8894 -0.8727 -0.8433 -0.8052 -0.5795 -0.5531 -0.5235 -0.5212 -0.4738 -0.4514 0.3505 0.3616 0.7557 0.7710 1.7210 1.7333 2.0547 2.0923 2.6811 2.7259 2.9212 2.9536 3.1982 3.2064 3.3005 3.3130 3.3731 3.3915 3.6455 3.6574 3.7134 3.7143 4.5263 4.5543 4.5993 4.6805 4.7402 4.7424 4.8170 4.8187 4.9405 4.9729 5.1742 5.1754 5.3519 5.4458 5.8832 5.8915 5.9120 5.9268 6.2292 6.2333 7.1768 7.2229 8.8322 8.8883 9.2526 9.2592 10.4851 10.4881 10.5650 10.5663 11.2765 11.3052 k = 0.4861 0.3491 0.6485 ( 6188 PWs) bands (ev): -7.6991 -7.6989 -6.9889 -6.9887 -6.9766 -6.9761 -6.9441 -6.9430 -2.1852 -2.1777 -0.8893 -0.8719 -0.8443 -0.8031 -0.5800 -0.5530 -0.5208 -0.5198 -0.4753 -0.4509 0.3646 0.3769 0.7695 0.7857 1.7446 1.7621 2.0264 2.0706 2.6727 2.7236 2.9006 2.9419 3.1929 3.2008 3.2964 3.3105 3.3652 3.3794 3.6458 3.6632 3.7192 3.7209 4.5191 4.5478 4.5968 4.6804 4.7297 4.7379 4.8153 4.8162 4.9393 4.9707 5.1671 5.1682 5.3665 5.4641 5.8591 5.8664 5.8893 5.9046 6.2206 6.2254 7.2083 7.2567 8.8878 8.9497 9.2570 9.2659 10.4418 10.4446 10.5557 10.5584 11.2644 11.2939 k = 0.5000 0.3590 0.6363 ( 6188 PWs) bands (ev): -7.7015 -7.7013 -6.9897 -6.9874 -6.9809 -6.9794 -6.9403 -6.9391 -2.1821 -2.1741 -0.8891 -0.8712 -0.8452 -0.8010 -0.5804 -0.5531 -0.5207 -0.5159 -0.4768 -0.4505 0.3790 0.3928 0.7866 0.8036 1.7535 1.7741 2.0143 2.0632 2.6640 2.7223 2.8779 2.9295 3.1875 3.1950 3.2924 3.3081 3.3578 3.3677 3.6447 3.6677 3.7236 3.7280 4.5125 4.5416 4.5943 4.6803 4.7192 4.7340 4.8140 4.8144 4.9382 4.9688 5.1615 5.1624 5.3763 5.4770 5.8372 5.8413 5.8680 5.8825 6.2120 6.2174 7.2404 7.2903 8.9393 9.0068 9.2670 9.2784 10.3998 10.4032 10.5414 10.5444 11.2474 11.2775 k = 0.5000 0.3590 0.6363 ( 6188 PWs) bands (ev): -7.7015 -7.7013 -6.9897 -6.9874 -6.9809 -6.9794 -6.9403 -6.9391 -2.1821 -2.1741 -0.8891 -0.8712 -0.8452 -0.8010 -0.5804 -0.5531 -0.5207 -0.5159 -0.4768 -0.4505 0.3790 0.3928 0.7866 0.8036 1.7535 1.7741 2.0143 2.0632 2.6640 2.7223 2.8779 2.9295 3.1875 3.1950 3.2924 3.3081 3.3578 3.3677 3.6447 3.6677 3.7236 3.7280 4.5125 4.5416 4.5943 4.6803 4.7192 4.7340 4.8140 4.8144 4.9382 4.9688 5.1615 5.1624 5.3763 5.4770 5.8372 5.8413 5.8680 5.8825 6.2120 6.2174 7.2404 7.2903 8.9393 9.0068 9.2670 9.2784 10.3998 10.4032 10.5414 10.5444 11.2474 11.2775 k = 0.5000 0.3590 0.6150 ( 6188 PWs) bands (ev): -7.7066 -7.7064 -6.9969 -6.9937 -6.9801 -6.9776 -6.9331 -6.9319 -2.1772 -2.1684 -0.8889 -0.8704 -0.8467 -0.7974 -0.5812 -0.5536 -0.5206 -0.5087 -0.4793 -0.4500 0.4055 0.4221 0.8200 0.8386 1.7543 1.7768 2.0110 2.0639 2.6464 2.7197 2.8356 2.9082 3.1780 3.1847 3.2857 3.3044 3.3474 3.3493 3.6415 3.6734 3.7313 3.7403 4.5026 4.5309 4.5894 4.6805 4.7010 4.7280 4.8106 4.8136 4.9362 4.9656 5.1531 5.1534 5.3886 5.4932 5.7976 5.8035 5.8341 5.8442 6.1972 6.2033 7.2960 7.3479 9.0209 9.0987 9.2868 9.3035 10.3341 10.3391 10.5061 10.5090 11.2122 11.2433 k = 0.5000 0.3590 0.5938 ( 6190 PWs) bands (ev): -7.7124 -7.7121 -7.0048 -7.0013 -6.9777 -6.9749 -6.9254 -6.9241 -2.1726 -2.1630 -0.8887 -0.8701 -0.8482 -0.7939 -0.5821 -0.5542 -0.5207 -0.5012 -0.4817 -0.4496 0.4347 0.4544 0.8556 0.8757 1.7541 1.7781 2.0085 2.0650 2.6247 2.7159 2.7909 2.8877 3.1686 3.1741 3.2793 3.3015 3.3340 3.3402 3.6375 3.6776 3.7402 3.7532 4.4941 4.5199 4.5838 4.6809 4.6833 4.7224 4.8076 4.8132 4.9337 4.9624 5.1443 5.1446 5.4008 5.5088 5.7532 5.7702 5.8006 5.8055 6.1821 6.1888 7.3522 7.4057 9.0935 9.1844 9.3006 9.3261 10.2787 10.2854 10.4603 10.4626 11.1733 11.2058 k = 0.5000 0.3590 0.5726 ( 6178 PWs) bands (ev): -7.7189 -7.7187 -7.0132 -7.0096 -6.9741 -6.9711 -6.9173 -6.9159 -2.1686 -2.1583 -0.8885 -0.8701 -0.8495 -0.7904 -0.5830 -0.5549 -0.5211 -0.4943 -0.4835 -0.4494 0.4665 0.4896 0.8930 0.9147 1.7527 1.7777 2.0072 2.0666 2.5989 2.7089 2.7469 2.8688 3.1592 3.1633 3.2732 3.2994 3.3219 3.3358 3.6332 3.6802 3.7503 3.7666 4.4874 4.5086 4.5775 4.6662 4.6820 4.7172 4.8047 4.8131 4.9308 4.9591 5.1351 5.1363 5.4127 5.5237 5.7086 5.7377 5.7669 5.7680 6.1666 6.1739 7.4081 7.4631 9.1515 9.2600 9.3072 9.3469 10.2366 10.2443 10.4037 10.4052 11.1316 11.1661 k = 0.5000 0.3590 0.5514 ( 6190 PWs) bands (ev): -7.7263 -7.7260 -7.0221 -7.0184 -6.9693 -6.9663 -6.9087 -6.9072 -2.1654 -2.1544 -0.8885 -0.8707 -0.8508 -0.7872 -0.5841 -0.5558 -0.5215 -0.4912 -0.4816 -0.4496 0.5008 0.5276 0.9321 0.9554 1.7497 1.7751 2.0074 2.0688 2.5693 2.6842 2.7192 2.8520 3.1501 3.1524 3.2676 3.2982 3.3128 3.3338 3.6288 3.6816 3.7614 3.7803 4.4824 4.4970 4.5703 4.6499 4.6838 4.7124 4.8018 4.8130 4.9272 4.9557 5.1260 5.1285 5.4242 5.5379 5.6643 5.7058 5.7289 5.7364 6.1510 6.1587 7.4631 7.5193 9.1889 9.2945 9.3326 9.3678 10.2095 10.2174 10.3367 10.3374 11.0878 11.1248 k = 0.5000 0.3590 0.5302 ( 6194 PWs) bands (ev): -7.7343 -7.7340 -7.0313 -7.0276 -6.9634 -6.9604 -6.8998 -6.8982 -2.1630 -2.1513 -0.8886 -0.8717 -0.8519 -0.7843 -0.5853 -0.5566 -0.5222 -0.4928 -0.4753 -0.4500 0.5376 0.5682 0.9727 0.9975 1.7451 1.7701 2.0093 2.0717 2.5370 2.6404 2.7104 2.8373 3.1414 3.1417 3.2625 3.2977 3.3062 3.3337 3.6246 3.6822 3.7734 3.7942 4.4790 4.4851 4.5625 4.6347 4.6863 4.7081 4.7988 4.8128 4.9230 4.9522 5.1174 5.1213 5.4351 5.5512 5.6207 5.6746 5.6923 5.7062 6.1353 6.1433 7.5167 7.5738 9.2021 9.2799 9.3823 9.3893 10.1982 10.2046 10.2607 10.2613 11.0419 11.0819 k = 0.5000 0.3590 0.5090 ( 6196 PWs) bands (ev): -7.7431 -7.7428 -7.0409 -7.0372 -6.9564 -6.9533 -6.8905 -6.8889 -2.1615 -2.1493 -0.8888 -0.8731 -0.8530 -0.7818 -0.5865 -0.5574 -0.5228 -0.4955 -0.4685 -0.4509 0.5766 0.6111 1.0146 1.0408 1.7386 1.7626 2.0130 2.0753 2.5031 2.5945 2.7044 2.8244 3.1312 3.1331 3.2579 3.2978 3.3019 3.3353 3.6210 3.6823 3.7861 3.8084 4.4731 4.4769 4.5543 4.6206 4.6895 4.7045 4.7954 4.8124 4.9182 4.9486 5.1096 5.1151 5.4451 5.5631 5.5780 5.6432 5.6586 5.6778 6.1195 6.1278 7.5682 7.6260 9.1940 9.2526 9.4081 9.4190 10.1723 10.1769 10.2018 10.2113 10.9934 11.0370 k = 0.5000 0.3590 0.4878 ( 6192 PWs) bands (ev): -7.7525 -7.7521 -7.0507 -7.0470 -6.9483 -6.9452 -6.8809 -6.8793 -2.1610 -2.1483 -0.8890 -0.8748 -0.8540 -0.7798 -0.5879 -0.5583 -0.5235 -0.4985 -0.4620 -0.4522 0.6176 0.6562 1.0576 1.0852 1.7302 1.7527 2.0183 2.0797 2.4685 2.5500 2.6987 2.8131 3.1210 3.1253 3.2541 3.2983 3.2994 3.3380 3.6184 3.6825 3.7992 3.8228 4.4609 4.4757 4.5461 4.6079 4.6924 4.7026 4.7916 4.8117 4.9130 4.9450 5.1028 5.1102 5.4538 5.5366 5.5716 5.6107 5.6311 5.6516 6.1037 6.1122 7.6170 7.6752 9.1706 9.2163 9.4192 9.4403 10.0842 10.0879 10.2169 10.2228 10.9414 10.9890 k = 0.5000 0.3590 0.4666 ( 6188 PWs) bands (ev): -7.7624 -7.7621 -7.0607 -7.0571 -6.9391 -6.9361 -6.8711 -6.8695 -2.1616 -2.1485 -0.8893 -0.8768 -0.8550 -0.7783 -0.5895 -0.5591 -0.5242 -0.5017 -0.4562 -0.4539 0.6602 0.7030 1.1016 1.1304 1.7199 1.7406 2.0251 2.0848 2.4345 2.5078 2.6930 2.8031 3.1113 3.1182 3.2509 3.2982 3.2991 3.3414 3.6173 3.6832 3.8127 3.8373 4.4484 4.4743 4.5391 4.5964 4.6928 4.7045 4.7871 4.8105 4.9073 4.9413 5.0973 5.1066 5.4600 5.4969 5.5695 5.5778 5.6165 5.6284 6.0880 6.0967 7.6626 7.7210 9.1374 9.1739 9.4198 9.4466 9.9904 9.9947 10.2406 10.2441 10.8849 10.9366 k = 0.5000 0.3590 0.4454 ( 6200 PWs) bands (ev): -7.7729 -7.7725 -7.0709 -7.0673 -6.9289 -6.9259 -6.8612 -6.8595 -2.1633 -2.1498 -0.8896 -0.8790 -0.8560 -0.7774 -0.5913 -0.5599 -0.5248 -0.5051 -0.4561 -0.4513 0.7042 0.7510 1.1464 1.1763 1.7078 1.7265 2.0332 2.0906 2.4019 2.4689 2.6872 2.7941 3.1021 3.1117 3.2485 3.2977 3.3001 3.3449 3.6182 3.6848 3.8263 3.8518 4.4357 4.4712 4.5346 4.5862 4.6910 4.7100 4.7817 4.8087 4.9015 4.9375 5.0934 5.1045 5.4526 5.4690 5.5435 5.5538 5.6094 5.6188 6.0725 6.0812 7.7044 7.7627 9.0985 9.1280 9.4091 9.4388 9.8939 9.8989 10.2682 10.2693 10.8239 10.8793 k = 0.5000 0.3590 0.4242 ( 6208 PWs) bands (ev): -7.7837 -7.7834 -7.0810 -7.0776 -6.9179 -6.9149 -6.8511 -6.8495 -2.1661 -2.1524 -0.8901 -0.8813 -0.8570 -0.7771 -0.5932 -0.5607 -0.5253 -0.5085 -0.4587 -0.4473 0.7491 0.7996 1.1920 1.2224 1.6941 1.7108 2.0422 2.0969 2.3715 2.4335 2.6816 2.7862 3.0936 3.1060 3.2468 3.2975 3.3014 3.3478 3.6215 3.6877 3.8401 3.8664 4.4229 4.4651 4.5340 4.5775 4.6889 4.7170 4.7757 4.8059 4.8958 4.9337 5.0912 5.1040 5.4175 5.4654 5.5113 5.5308 5.5963 5.6282 6.0571 6.0658 7.7421 7.8000 9.0568 9.0806 9.3875 9.4183 9.7961 9.8018 10.2926 10.2938 10.7605 10.8183 k = 0.5000 0.3590 0.4030 ( 6208 PWs) bands (ev): -7.7948 -7.7945 -7.0912 -7.0878 -6.9061 -6.9031 -6.8410 -6.8394 -2.1700 -2.1562 -0.8905 -0.8837 -0.8580 -0.7775 -0.5954 -0.5614 -0.5257 -0.5120 -0.4617 -0.4444 0.7943 0.8484 1.2381 1.2688 1.6789 1.6940 2.0519 2.1036 2.3437 2.4021 2.6763 2.7791 3.0859 3.1011 3.2458 3.2972 3.3028 3.3496 3.6277 3.6924 3.8540 3.8811 4.4099 4.4558 4.5372 4.5706 4.6873 4.7251 4.7689 4.8022 4.8906 4.9299 5.0908 5.1049 5.3814 5.4585 5.4798 5.5070 5.5903 5.6396 6.0420 6.0507 7.7752 7.8324 9.0146 9.0337 9.3562 9.3870 9.6982 9.7046 10.3057 10.3079 10.7017 10.7594 k = 0.5000 0.3590 0.3818 ( 6202 PWs) bands (ev): -7.8061 -7.8058 -7.1013 -7.0980 -6.8936 -6.8907 -6.8310 -6.8293 -2.1750 -2.1611 -0.8909 -0.8862 -0.8591 -0.7786 -0.5976 -0.5621 -0.5258 -0.5156 -0.4650 -0.4424 0.8395 0.8966 1.2848 1.3149 1.6624 1.6763 2.0620 2.1104 2.3190 2.3748 2.6716 2.7730 3.0790 3.0970 3.2455 3.2964 3.3044 3.3500 3.6370 3.6991 3.8678 3.8957 4.3968 4.4441 4.5422 4.5668 4.6861 4.7335 4.7617 4.7974 4.8861 4.9261 5.0923 5.1071 5.3462 5.4465 5.4492 5.4835 5.5910 5.6520 6.0271 6.0358 7.8035 7.8597 8.9733 8.9884 9.3166 9.3465 9.6011 9.6081 10.2965 10.2966 10.6607 10.7131 k = 0.5000 0.3590 0.3605 ( 6198 PWs) bands (ev): -7.8175 -7.8172 -7.1112 -7.1081 -6.8805 -6.8777 -6.8209 -6.8193 -2.1809 -2.1671 -0.8914 -0.8886 -0.8602 -0.7805 -0.5999 -0.5628 -0.5258 -0.5192 -0.4687 -0.4415 0.8840 0.9436 1.3318 1.3604 1.6450 1.6583 2.0723 2.1174 2.2977 2.3516 2.6678 2.7681 3.0729 3.0938 3.2458 3.2946 3.3059 3.3488 3.6494 3.7081 3.8816 3.9103 4.3836 4.4309 4.5450 4.5690 4.6856 4.7405 4.7557 4.7913 4.8827 4.9224 5.0955 5.1104 5.3122 5.4197 5.4307 5.4604 5.5970 5.6648 6.0126 6.0212 7.8268 7.8818 8.9340 8.9457 9.2701 9.2985 9.5056 9.5131 10.2488 10.2549 10.6486 10.6906 k = 0.5000 0.3590 0.3393 ( 6188 PWs) bands (ev): -7.8288 -7.8285 -7.1209 -7.1179 -6.8671 -6.8644 -6.8111 -6.8094 -2.1877 -2.1741 -0.8919 -0.8909 -0.8613 -0.7831 -0.6023 -0.5634 -0.5256 -0.5228 -0.4725 -0.4415 0.9275 0.9887 1.3791 1.4048 1.6270 1.6408 2.0826 2.1243 2.2798 2.3325 2.6653 2.7645 3.0679 3.0914 3.2467 3.2917 3.3072 3.3459 3.6648 3.7195 3.8952 3.9248 4.3705 4.4168 4.5444 4.5781 4.6858 4.7396 4.7577 4.7841 4.8805 4.9187 5.1004 5.1146 5.2793 5.3911 5.4127 5.4379 5.6068 5.6780 5.9985 6.0070 7.8451 7.8987 8.8972 8.9060 9.2180 9.2444 9.4124 9.4203 10.1698 10.1816 10.6607 10.6918 k = 0.5000 0.3590 0.3181 ( 6198 PWs) bands (ev): -7.8400 -7.8397 -7.1304 -7.1275 -6.8535 -6.8508 -6.8014 -6.7998 -2.1952 -2.1819 -0.8931 -0.8924 -0.8625 -0.7864 -0.6046 -0.5640 -0.5265 -0.5252 -0.4765 -0.4424 0.9693 1.0314 1.4261 1.4468 1.6087 1.6248 2.0927 2.1310 2.2652 2.3170 2.6644 2.7625 3.0638 3.0898 3.2480 3.2873 3.3080 3.3416 3.6829 3.7333 3.9087 3.9393 4.3574 4.4023 4.5428 4.5907 4.6865 4.7323 4.7659 4.7761 4.8793 4.9150 5.1068 5.1194 5.2474 5.3636 5.3935 5.4158 5.6192 5.6917 5.9847 5.9932 7.8586 7.9106 8.8632 8.8696 9.1615 9.1856 9.3220 9.3304 10.0731 10.0878 10.6310 10.6502 k = 0.5000 0.3590 0.2969 ( 6202 PWs) bands (ev): -7.8510 -7.8507 -7.1395 -7.1368 -6.8397 -6.8372 -6.7920 -6.7904 -2.2034 -2.1906 -0.8952 -0.8929 -0.8637 -0.7904 -0.6068 -0.5647 -0.5302 -0.5247 -0.4806 -0.4440 1.0091 1.0712 1.4724 1.4840 1.5910 1.6129 2.1024 2.1374 2.2536 2.3048 2.6658 2.7624 3.0608 3.0891 3.2497 3.2815 3.3078 3.3364 3.7034 3.7495 3.9218 3.9536 4.3446 4.3876 4.5421 4.6051 4.6874 4.7244 4.7674 4.7751 4.8791 4.9113 5.1144 5.1242 5.2167 5.3375 5.3739 5.3941 5.6336 5.7058 5.9715 5.9798 7.8676 7.9178 8.8318 8.8365 9.1016 9.1230 9.2351 9.2436 9.9689 9.9840 10.5591 10.5762 k = 0.5000 0.3590 0.2757 ( 6206 PWs) bands (ev): -7.8616 -7.8613 -7.1482 -7.1457 -6.8260 -6.8236 -6.7829 -6.7814 -2.2121 -2.1998 -0.8971 -0.8933 -0.8649 -0.7951 -0.6088 -0.5654 -0.5338 -0.5240 -0.4847 -0.4463 1.0466 1.1077 1.5101 1.5150 1.5765 1.6113 2.1117 2.1435 2.2447 2.2952 2.6699 2.7647 3.0587 3.0890 3.2516 3.2742 3.3058 3.3312 3.7256 3.7677 3.9348 3.9679 4.3321 4.3729 4.5428 4.6202 4.6878 4.7178 4.7585 4.7842 4.8799 4.9076 5.1228 5.1285 5.1874 5.3131 5.3542 5.3728 5.6495 5.7202 5.9587 5.9670 7.8726 7.9209 8.8027 8.8063 9.0393 9.0578 9.1521 9.1606 9.8635 9.8776 10.4904 10.5059 k = 0.5000 0.3590 0.2545 ( 6210 PWs) bands (ev): -7.8718 -7.8715 -7.1565 -7.1541 -6.8126 -6.8103 -6.7742 -6.7727 -2.2212 -2.2095 -0.8988 -0.8937 -0.8660 -0.8003 -0.6105 -0.5662 -0.5372 -0.5232 -0.4887 -0.4491 1.0814 1.1407 1.5179 1.5360 1.5831 1.6273 2.1204 2.1491 2.2378 2.2873 2.6774 2.7696 3.0576 3.0896 3.2534 3.2657 3.3007 3.3273 3.7493 3.7877 3.9474 3.9821 4.3201 4.3585 4.5452 4.6353 4.6858 4.7145 4.7499 4.7928 4.8815 4.9039 5.1305 5.1315 5.1608 5.2910 5.3347 5.3519 5.6665 5.7348 5.9464 5.9548 7.8740 7.9203 8.7755 8.7787 8.9756 8.9909 9.0734 9.0815 9.7612 9.7734 10.4258 10.4399 k = 0.5000 0.3590 0.2333 ( 6214 PWs) bands (ev): -7.8815 -7.8812 -7.1643 -7.1621 -6.7995 -6.7973 -6.7659 -6.7645 -2.2304 -2.2194 -0.9002 -0.8942 -0.8671 -0.8059 -0.6119 -0.5672 -0.5404 -0.5224 -0.4926 -0.4524 1.1134 1.1700 1.5116 1.5259 1.6201 1.6565 2.1286 2.1543 2.2325 2.2804 2.6885 2.7776 3.0575 3.0908 3.2515 3.2595 3.2922 3.3250 3.7737 3.8090 3.9599 3.9962 4.3086 4.3444 4.5494 4.6495 4.6807 4.7154 4.7421 4.8007 4.8840 4.9002 5.1242 5.1318 5.1501 5.2723 5.3155 5.3312 5.6844 5.7496 5.9349 5.9432 7.8726 7.9167 8.7493 8.7533 8.9118 8.9235 8.9994 9.0069 9.6647 9.6747 10.3656 10.3784 k = 0.5000 0.3590 0.2121 ( 6214 PWs) bands (ev): -7.8906 -7.8903 -7.1715 -7.1695 -6.7870 -6.7849 -6.7582 -6.7568 -2.2396 -2.2293 -0.9013 -0.8945 -0.8682 -0.8120 -0.6129 -0.5685 -0.5431 -0.5216 -0.4962 -0.4559 1.1426 1.1958 1.4997 1.5104 1.6617 1.6905 2.1360 2.1589 2.2280 2.2736 2.7037 2.7889 3.0583 3.0923 3.2408 3.2608 3.2810 3.3237 3.7984 3.8311 3.9723 4.0102 4.2978 4.3309 4.5554 4.6617 4.6735 4.7195 4.7363 4.8077 4.8871 4.8964 5.1007 5.1281 5.1580 5.2581 5.2969 5.3110 5.7028 5.7642 5.9241 5.9325 7.8688 7.9107 8.7234 8.7295 8.8493 8.8565 8.9305 8.9370 9.5759 9.5835 10.3101 10.3216 k = 0.5000 0.3590 0.1909 ( 6202 PWs) bands (ev): -7.8990 -7.8988 -7.1782 -7.1764 -6.7751 -6.7732 -6.7510 -6.7497 -2.2486 -2.2391 -0.9021 -0.8949 -0.8691 -0.8182 -0.6134 -0.5703 -0.5452 -0.5211 -0.4993 -0.4597 1.1688 1.2180 1.4863 1.4948 1.7026 1.7252 2.1428 2.1629 2.2237 2.2662 2.7229 2.8035 3.0598 3.0941 3.2273 3.2636 3.2678 3.3227 3.8227 3.8535 3.9848 4.0243 4.2878 4.3180 4.5635 4.6658 4.6700 4.7251 4.7342 4.8137 4.8909 4.8928 5.0764 5.1193 5.1683 5.2491 5.2791 5.2912 5.7213 5.7784 5.9143 5.9227 7.8634 7.9028 8.6961 8.7071 8.7904 8.7910 8.8670 8.8724 9.4959 9.5014 10.2593 10.2696 k = 0.5000 0.3590 0.1697 ( 6204 PWs) bands (ev): -7.9067 -7.9065 -7.1843 -7.1827 -6.7641 -6.7623 -6.7444 -6.7432 -2.2572 -2.2486 -0.9026 -0.8952 -0.8699 -0.8245 -0.6136 -0.5726 -0.5466 -0.5210 -0.5017 -0.4636 1.1922 1.2369 1.4730 1.4799 1.7416 1.7591 2.1489 2.1663 2.2191 2.2579 2.7459 2.8214 3.0620 3.0960 3.2120 3.2529 3.2667 3.3214 3.8461 3.8751 3.9976 4.0382 4.2786 4.3057 4.5733 4.6581 4.6727 4.7312 4.7372 4.8186 4.8894 4.8952 5.0532 5.1056 5.1783 5.2445 5.2627 5.2724 5.7396 5.7916 5.9058 5.9140 7.8568 7.8935 8.6654 8.6856 8.7285 8.7384 8.8093 8.8135 9.4255 9.4291 10.2136 10.2226 k = 0.5000 0.3590 0.1485 ( 6204 PWs) bands (ev): -7.9137 -7.9135 -7.1897 -7.1883 -6.7540 -6.7524 -6.7384 -6.7373 -2.2652 -2.2576 -0.9028 -0.8955 -0.8706 -0.8309 -0.6133 -0.5754 -0.5473 -0.5217 -0.5031 -0.4675 1.2128 1.2526 1.4605 1.4662 1.7783 1.7914 2.1543 2.1689 2.2140 2.2484 2.7721 2.8422 3.0648 3.0978 3.1953 3.2365 3.2700 3.3199 3.8680 3.8952 4.0112 4.0520 4.2703 4.2942 4.5849 4.6510 4.6706 4.7369 4.7447 4.8223 4.8867 4.9001 5.0317 5.0881 5.1867 5.2406 5.2485 5.2572 5.7568 5.8034 5.8988 5.9066 7.8495 7.8831 8.6288 8.6651 8.6701 8.6970 8.7577 8.7608 9.3647 9.3668 10.1729 10.1808 k = 0.5000 0.3590 0.1273 ( 6194 PWs) bands (ev): -7.9198 -7.9196 -7.1945 -7.1932 -6.7450 -6.7436 -6.7331 -6.7321 -2.2724 -2.2659 -0.9027 -0.8957 -0.8710 -0.8370 -0.6125 -0.5786 -0.5473 -0.5231 -0.5034 -0.4713 1.2308 1.2653 1.4491 1.4538 1.8123 1.8216 2.1590 2.1707 2.2082 2.2378 2.8007 2.8654 3.0679 3.0994 3.1772 3.2188 3.2735 3.3179 3.8879 3.9129 4.0256 4.0654 4.2630 4.2837 4.5982 4.6448 4.6656 4.7411 4.7546 4.8249 4.8854 4.9054 5.0124 5.0682 5.1915 5.2293 5.2388 5.2524 5.7727 5.8129 5.8939 5.9007 7.8420 7.8721 8.5885 8.6172 8.6457 8.6656 8.7127 8.7145 9.3134 9.3145 10.1375 10.1442 k = 0.5000 0.3590 0.1060 ( 6200 PWs) bands (ev): -7.9250 -7.9249 -7.1985 -7.1975 -6.7372 -6.7359 -6.7285 -6.7276 -2.2788 -2.2733 -0.9023 -0.8961 -0.8712 -0.8430 -0.6113 -0.5821 -0.5468 -0.5253 -0.5028 -0.4751 1.2462 1.2752 1.4393 1.4431 1.8430 1.8492 2.1630 2.1715 2.2022 2.2263 2.8310 2.8899 3.0712 3.1008 3.1579 3.2000 3.2772 3.3155 3.9053 3.9275 4.0410 4.0779 4.2567 4.2741 4.6128 4.6395 4.6594 4.7426 4.7652 4.8261 4.8865 4.9111 4.9954 5.0471 5.1900 5.2139 5.2360 5.2538 5.7864 5.8196 5.8914 5.8966 7.8348 7.8609 8.5498 8.5710 8.6277 8.6403 8.6747 8.6750 9.2712 9.2716 10.1075 10.1130 k = 0.5000 0.3590 0.0848 ( 6198 PWs) bands (ev): -7.9293 -7.9292 -7.2018 -7.2010 -6.7308 -6.7296 -6.7246 -6.7238 -2.2841 -2.2797 -0.9018 -0.8964 -0.8710 -0.8485 -0.6097 -0.5858 -0.5458 -0.5278 -0.5014 -0.4788 1.2591 1.2826 1.4310 1.4341 1.8701 1.8737 2.1662 2.1712 2.1965 2.2147 2.8619 2.9146 3.0745 3.1018 3.1380 3.1803 3.2811 3.3127 3.9201 3.9386 4.0567 4.0890 4.2516 4.2656 4.6285 4.6354 4.6531 4.7405 4.7757 4.8257 4.8909 4.9171 4.9809 5.0254 5.1836 5.1992 5.2390 5.2560 5.7975 5.8232 5.8912 5.8944 7.8284 7.8500 8.5165 8.5324 8.6114 8.6188 8.6426 8.6439 9.2377 9.2377 10.0829 10.0873 k = 0.5000 0.3590 0.0636 ( 6196 PWs) bands (ev): -7.9327 -7.9326 -7.2044 -7.2038 -6.7257 -6.7248 -6.7214 -6.7208 -2.2883 -2.2849 -0.9010 -0.8968 -0.8704 -0.8535 -0.6077 -0.5894 -0.5444 -0.5306 -0.4995 -0.4824 1.2698 1.2874 1.4246 1.4268 1.8927 1.8945 2.1684 2.1699 2.1919 2.2037 2.8922 2.9377 3.0775 3.1027 3.1184 3.1603 3.2852 3.3094 3.9320 3.9463 4.0719 4.0978 4.2477 4.2584 4.6327 4.6433 4.6488 4.7344 4.7855 4.8237 4.8992 4.9232 4.9687 5.0037 5.1762 5.1866 5.2442 5.2580 5.8060 5.8243 5.8925 5.8939 7.8233 7.8399 8.4904 8.5018 8.5974 8.6006 8.6177 8.6205 9.2121 9.2123 10.0638 10.0671 k = 0.5000 0.3590 0.0424 ( 6200 PWs) bands (ev): -7.9352 -7.9351 -7.2062 -7.2058 -6.7222 -6.7216 -6.7188 -6.7184 -2.2911 -2.2889 -0.9001 -0.8972 -0.8692 -0.8580 -0.6054 -0.5930 -0.5427 -0.5333 -0.4973 -0.4858 1.2781 1.2900 1.4201 1.4215 1.9100 1.9106 2.1680 2.1694 2.1889 2.1947 2.9207 2.9562 3.0799 3.1005 3.1042 3.1410 3.2893 3.3057 3.9412 3.9509 4.0853 4.1034 4.2453 4.2525 4.6313 4.6408 4.6630 4.7245 4.7944 4.8201 4.9111 4.9295 4.9586 4.9825 5.1701 5.1765 5.2495 5.2590 5.8121 5.8236 5.8943 5.8945 7.8200 7.8313 8.4720 8.4795 8.5860 8.5865 8.6008 8.6041 9.1943 9.1944 10.0503 10.0525 k = 0.5000 0.3590 0.0212 ( 6206 PWs) bands (ev): -7.9366 -7.9366 -7.2073 -7.2071 -6.7202 -6.7199 -6.7171 -6.7169 -2.2927 -2.2915 -0.8993 -0.8978 -0.8674 -0.8619 -0.6027 -0.5965 -0.5407 -0.5359 -0.4947 -0.4890 1.2843 1.2902 1.4174 1.4182 1.9208 1.9209 2.1668 2.1687 2.1872 2.1891 2.9449 2.9655 3.0815 3.0885 3.1064 3.1242 3.2935 3.3018 3.9476 3.9525 4.0959 4.1052 4.2444 4.2480 4.6316 4.6365 4.6799 4.7115 4.8024 4.8153 4.9260 4.9359 4.9501 4.9622 5.1666 5.1697 5.2539 5.2587 5.8164 5.8219 5.8955 5.8956 7.8190 7.8247 8.4618 8.4655 8.5776 8.5779 8.5919 8.5940 9.1838 9.1839 10.0424 10.0435 k = 0.5000 0.3590 0.0000 ( 6182 PWs) bands (ev): -7.9371 -7.9371 -7.2076 -7.2076 -6.7194 -6.7194 -6.7164 -6.7164 -2.2928 -2.2928 -0.8985 -0.8985 -0.8650 -0.8650 -0.5997 -0.5997 -0.5384 -0.5384 -0.4919 -0.4919 1.2884 1.2884 1.4168 1.4168 1.9245 1.9245 2.1673 2.1673 2.1871 2.1871 2.9615 2.9615 3.0832 3.0832 3.1124 3.1124 3.2978 3.2978 3.9514 3.9514 4.1027 4.1027 4.2454 4.2454 4.6334 4.6334 4.6964 4.6964 4.8094 4.8094 4.9426 4.9426 4.9434 4.9434 5.1664 5.1664 5.2571 5.2571 5.8195 5.8195 5.8960 5.8960 7.8206 7.8206 8.4596 8.4596 8.5748 8.5748 8.5899 8.5899 9.1803 9.1803 10.0401 10.0401 k = 0.0000 0.0000 0.8572 ( 6164 PWs) bands (ev): -7.6818 -7.6818 -6.9799 -6.9799 -6.9747 -6.9747 -6.9503 -6.9503 -2.2192 -2.2192 -0.8882 -0.8882 -0.8292 -0.8292 -0.5715 -0.5715 -0.5316 -0.5316 -0.4578 -0.4578 0.2529 0.2529 0.6098 0.6098 1.7389 1.7389 2.0522 2.0522 2.7219 2.7219 3.0552 3.0552 3.2502 3.2502 3.3450 3.3450 3.5746 3.5746 3.6051 3.6051 3.6604 3.6604 4.6072 4.6072 4.6480 4.6480 4.7909 4.7909 4.8738 4.8738 4.9718 4.9718 5.2160 5.2160 5.3105 5.3105 6.0993 6.0993 6.1161 6.1161 6.3101 6.3101 6.8911 6.8911 8.3317 8.3317 9.0860 9.0860 10.5841 10.5841 11.1554 11.1554 11.2339 11.2339 k = 0.0167 0.0120 0.8572 ( 6176 PWs) bands (ev): -7.6818 -7.6818 -6.9798 -6.9798 -6.9747 -6.9747 -6.9504 -6.9504 -2.2191 -2.2191 -0.8882 -0.8882 -0.8292 -0.8292 -0.5715 -0.5715 -0.5316 -0.5316 -0.4577 -0.4577 0.2523 0.2523 0.6115 0.6115 1.7250 1.7250 2.0659 2.0659 2.7240 2.7240 3.0543 3.0543 3.2502 3.2502 3.3449 3.3449 3.5742 3.5742 3.6045 3.6045 3.6596 3.6596 4.6072 4.6072 4.6479 4.6479 4.7914 4.7914 4.8740 4.8740 4.9715 4.9715 5.2174 5.2174 5.3080 5.3080 6.0958 6.0958 6.1159 6.1159 6.3098 6.3098 6.8950 6.8950 8.3301 8.3301 9.0917 9.0917 10.5836 10.5836 11.1542 11.1542 11.2308 11.2308 k = 0.0333 0.0239 0.8572 ( 6168 PWs) bands (ev): -7.6818 -7.6818 -6.9797 -6.9797 -6.9746 -6.9746 -6.9506 -6.9506 -2.2189 -2.2189 -0.8882 -0.8882 -0.8291 -0.8291 -0.5714 -0.5714 -0.5317 -0.5317 -0.4577 -0.4577 0.2505 0.2505 0.6167 0.6167 1.6891 1.6891 2.1015 2.1015 2.7302 2.7302 3.0518 3.0518 3.2503 3.2503 3.3449 3.3449 3.5727 3.5727 3.6029 3.6029 3.6573 3.6573 4.6075 4.6075 4.6476 4.6476 4.7933 4.7933 4.8750 4.8750 4.9707 4.9707 5.2215 5.2215 5.3005 5.3005 6.0851 6.0851 6.1159 6.1159 6.3091 6.3091 6.9066 6.9066 8.3252 8.3252 9.1084 9.1084 10.5820 10.5820 11.1505 11.1505 11.2220 11.2220 k = 0.0500 0.0359 0.8572 ( 6172 PWs) bands (ev): -7.6818 -7.6818 -6.9795 -6.9795 -6.9745 -6.9745 -6.9510 -6.9510 -2.2186 -2.2186 -0.8882 -0.8882 -0.8289 -0.8289 -0.5713 -0.5713 -0.5318 -0.5318 -0.4575 -0.4575 0.2477 0.2477 0.6253 0.6253 1.6406 1.6406 2.1493 2.1493 2.7403 2.7403 3.0476 3.0476 3.2503 3.2503 3.3447 3.3447 3.5700 3.5700 3.6003 3.6003 3.6538 3.6538 4.6079 4.6079 4.6472 4.6472 4.7962 4.7962 4.8766 4.8766 4.9693 4.9693 5.2283 5.2283 5.2887 5.2887 6.0669 6.0669 6.1166 6.1166 6.3078 6.3078 6.9253 6.9253 8.3171 8.3171 9.1359 9.1359 10.5789 10.5789 11.1444 11.1444 11.2079 11.2079 k = 0.0667 0.0479 0.8572 ( 6172 PWs) bands (ev): -7.6817 -7.6817 -6.9792 -6.9792 -6.9743 -6.9743 -6.9515 -6.9515 -2.2182 -2.2182 -0.8883 -0.8883 -0.8286 -0.8286 -0.5712 -0.5712 -0.5320 -0.5320 -0.4574 -0.4574 0.2438 0.2438 0.6374 0.6374 1.5857 1.5857 2.2032 2.2032 2.7540 2.7540 3.0416 3.0416 3.2504 3.2504 3.3445 3.3445 3.5655 3.5655 3.5973 3.5973 3.6493 3.6493 4.6086 4.6086 4.6465 4.6465 4.8002 4.8002 4.8788 4.8788 4.9673 4.9673 5.2371 5.2371 5.2739 5.2739 6.0420 6.0420 6.1177 6.1177 6.3062 6.3062 6.9504 6.9504 8.3061 8.3061 9.1736 9.1736 10.5737 10.5737 11.1361 11.1361 11.1895 11.1895 k = 0.0833 0.0598 0.8572 ( 6166 PWs) bands (ev): -7.6817 -7.6817 -6.9789 -6.9789 -6.9740 -6.9740 -6.9521 -6.9521 -2.2176 -2.2176 -0.8883 -0.8883 -0.8283 -0.8283 -0.5711 -0.5711 -0.5322 -0.5322 -0.4572 -0.4572 0.2392 0.2392 0.6528 0.6528 1.5278 1.5278 2.2597 2.2597 2.7709 2.7709 3.0340 3.0340 3.2505 3.2505 3.3442 3.3442 3.5584 3.5584 3.5942 3.5942 3.6443 3.6443 4.6094 4.6094 4.6457 4.6457 4.8053 4.8053 4.8817 4.8817 4.9647 4.9647 5.2420 5.2420 5.2628 5.2628 6.0109 6.0109 6.1193 6.1193 6.3042 6.3042 6.9809 6.9809 8.2921 8.2921 9.2208 9.2208 10.5653 10.5653 11.1254 11.1254 11.1678 11.1678 k = 0.1000 0.0718 0.8572 ( 6166 PWs) bands (ev): -7.6817 -7.6817 -6.9787 -6.9787 -6.9736 -6.9736 -6.9529 -6.9529 -2.2171 -2.2171 -0.8883 -0.8883 -0.8279 -0.8279 -0.5709 -0.5709 -0.5324 -0.5324 -0.4569 -0.4569 0.2340 0.2340 0.6715 0.6715 1.4686 1.4686 2.3169 2.3169 2.7903 2.7903 3.0247 3.0247 3.2506 3.2506 3.3439 3.3439 3.5482 3.5482 3.5917 3.5917 3.6392 3.6392 4.6104 4.6104 4.6446 4.6446 4.8114 4.8114 4.8851 4.8851 4.9617 4.9617 5.2271 5.2271 5.2724 5.2724 5.9747 5.9747 6.1212 6.1212 6.3020 6.3020 7.0154 7.0154 8.2756 8.2756 9.2768 9.2768 10.5522 10.5522 11.1124 11.1124 11.1440 11.1440 k = 0.1167 0.0838 0.8572 ( 6158 PWs) bands (ev): -7.6817 -7.6817 -6.9784 -6.9784 -6.9730 -6.9730 -6.9538 -6.9538 -2.2164 -2.2164 -0.8884 -0.8884 -0.8275 -0.8275 -0.5707 -0.5707 -0.5327 -0.5327 -0.4566 -0.4566 0.2284 0.2284 0.6935 0.6935 1.4092 1.4092 2.3737 2.3737 2.8113 2.8113 3.0141 3.0141 3.2508 3.2508 3.3434 3.3434 3.5349 3.5349 3.5898 3.5898 3.6341 3.6341 4.6116 4.6116 4.6434 4.6434 4.8182 4.8182 4.8890 4.8890 4.9582 4.9582 5.2052 5.2052 5.2907 5.2907 5.9343 5.9343 6.1233 6.1233 6.2995 6.2995 7.0528 7.0528 8.2570 8.2570 9.3405 9.3405 10.5325 10.5325 11.0961 11.0961 11.1191 11.1191 k = 0.1333 0.0957 0.8572 ( 6158 PWs) bands (ev): -7.6816 -7.6816 -6.9782 -6.9782 -6.9723 -6.9723 -6.9548 -6.9548 -2.2158 -2.2158 -0.8884 -0.8884 -0.8271 -0.8271 -0.5706 -0.5706 -0.5330 -0.5330 -0.4563 -0.4563 0.2227 0.2227 0.7187 0.7187 1.3502 1.3502 2.4294 2.4294 2.8327 2.8327 3.0028 3.0028 3.2509 3.2509 3.3428 3.3428 3.5191 3.5191 3.5885 3.5885 3.6293 3.6293 4.6130 4.6130 4.6420 4.6420 4.8258 4.8258 4.8933 4.8933 4.9543 4.9543 5.1820 5.1820 5.3129 5.3129 5.8905 5.8905 6.1255 6.1255 6.2970 6.2970 7.0916 7.0916 8.2368 8.2368 9.4112 9.4112 10.5039 10.5039 11.0735 11.0735 11.0956 11.0956 k = 0.1500 0.1077 0.8572 ( 6156 PWs) bands (ev): -7.6816 -7.6816 -6.9780 -6.9780 -6.9714 -6.9714 -6.9559 -6.9559 -2.2152 -2.2152 -0.8885 -0.8885 -0.8267 -0.8267 -0.5704 -0.5704 -0.5332 -0.5332 -0.4561 -0.4561 0.2172 0.2172 0.7470 0.7470 1.2921 1.2921 2.4833 2.4833 2.8521 2.8521 2.9920 2.9920 3.2512 3.2512 3.3420 3.3420 3.5015 3.5015 3.5878 3.5878 3.6248 3.6248 4.6146 4.6146 4.6404 4.6404 4.8339 4.8339 4.8976 4.8976 4.9504 4.9504 5.1589 5.1589 5.3387 5.3387 5.8442 5.8442 6.1277 6.1277 6.2945 6.2945 7.1304 7.1304 8.2157 8.2157 9.4878 9.4878 10.4645 10.4645 11.0449 11.0449 11.0759 11.0759 k = 0.1667 0.1197 0.8572 ( 6146 PWs) bands (ev): -7.6816 -7.6816 -6.9779 -6.9779 -6.9704 -6.9704 -6.9571 -6.9571 -2.2146 -2.2146 -0.8885 -0.8885 -0.8264 -0.8264 -0.5702 -0.5702 -0.5335 -0.5335 -0.4558 -0.4558 0.2121 0.2121 0.7784 0.7784 1.2353 1.2353 2.5348 2.5348 2.8660 2.8660 2.9845 2.9845 3.2514 3.2514 3.3409 3.3409 3.4830 3.4830 3.5876 3.5876 3.6206 3.6206 4.6164 4.6164 4.6386 4.6386 4.8425 4.8425 4.9013 4.9013 4.9470 4.9470 5.1367 5.1367 5.3677 5.3677 5.7964 5.7964 6.1299 6.1299 6.2920 6.2920 7.1675 7.1675 8.1946 8.1946 9.5694 9.5694 10.4130 10.4130 11.0186 11.0186 11.0585 11.0585 k = 0.1833 0.1316 0.8572 ( 6150 PWs) bands (ev): -7.6816 -7.6816 -6.9779 -6.9779 -6.9693 -6.9693 -6.9583 -6.9583 -2.2140 -2.2140 -0.8885 -0.8885 -0.8261 -0.8261 -0.5700 -0.5700 -0.5337 -0.5337 -0.4555 -0.4555 0.2075 0.2075 0.8127 0.8127 1.1799 1.1799 2.5834 2.5834 2.8697 2.8697 2.9837 2.9837 3.2517 3.2517 3.3394 3.3394 3.4649 3.4649 3.5877 3.5877 3.6169 3.6169 4.6183 4.6183 4.6367 4.6367 4.8514 4.8514 4.9034 4.9034 4.9447 4.9447 5.1164 5.1164 5.3999 5.3999 5.7477 5.7477 6.1319 6.1319 6.2898 6.2898 7.2013 7.2013 8.1747 8.1747 9.6550 9.6550 10.3499 10.3499 10.9994 10.9994 11.0430 11.0430 k = 0.2000 0.1436 0.8572 ( 6146 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9681 -6.9681 -6.9596 -6.9596 -2.2136 -2.2136 -0.8886 -0.8886 -0.8258 -0.8258 -0.5698 -0.5698 -0.5339 -0.5339 -0.4553 -0.4553 0.2037 0.2037 0.8498 0.8498 1.1262 1.1262 2.6283 2.6283 2.8617 2.8617 2.9902 2.9902 3.2521 3.2521 3.3376 3.3376 3.4486 3.4486 3.5881 3.5881 3.6137 3.6137 4.6204 4.6204 4.6347 4.6347 4.8603 4.8603 4.9031 4.9031 4.9444 4.9444 5.0988 5.0988 5.4352 5.4352 5.6990 5.6990 6.1335 6.1335 6.2880 6.2880 7.2301 7.2301 8.1572 8.1572 9.7437 9.7437 10.2767 10.2767 10.9879 10.9879 11.0298 11.0298 k = 0.2167 0.1556 0.8572 ( 6140 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9669 -6.9669 -6.9609 -6.9609 -2.2133 -2.2133 -0.8886 -0.8886 -0.8256 -0.8256 -0.5697 -0.5697 -0.5341 -0.5341 -0.4551 -0.4551 0.2009 0.2009 0.8898 0.8898 1.0744 1.0744 2.6678 2.6678 2.8457 2.8457 2.9998 2.9998 3.2524 3.2524 3.3357 3.3357 3.4356 3.4356 3.5886 3.5886 3.6111 3.6111 4.6225 4.6225 4.6326 4.6326 4.8691 4.8691 4.8999 4.8999 4.9459 4.9459 5.0849 5.0849 5.4734 5.4734 5.6508 5.6508 6.1348 6.1348 6.2866 6.2866 7.2521 7.2521 8.1434 8.1434 9.8345 9.8345 10.1959 10.1959 10.9830 10.9830 11.0189 11.0189 k = 0.2333 0.1675 0.8572 ( 6148 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9658 -6.9658 -6.9621 -6.9621 -2.2131 -2.2131 -0.8886 -0.8886 -0.8255 -0.8255 -0.5697 -0.5697 -0.5342 -0.5342 -0.4550 -0.4550 0.1992 0.1992 0.9323 0.9323 1.0248 1.0248 2.6983 2.6983 2.8282 2.8282 3.0076 3.0076 3.2527 3.2527 3.3341 3.3341 3.4273 3.4273 3.5890 3.5890 3.6094 3.6094 4.6243 4.6243 4.6308 4.6308 4.8773 4.8773 4.8948 4.8948 4.9477 4.9477 5.0758 5.0758 5.5141 5.5141 5.6040 5.6040 6.1356 6.1356 6.2857 6.2857 7.2661 7.2661 8.1345 8.1345 9.9258 9.9258 10.1099 10.1099 10.9825 10.9825 11.0106 11.0106 k = 0.2500 0.1795 0.8572 ( 6168 PWs) bands (ev): -7.6815 -7.6815 -6.9778 -6.9778 -6.9652 -6.9652 -6.9627 -6.9627 -2.2130 -2.2130 -0.8887 -0.8887 -0.8255 -0.8255 -0.5697 -0.5697 -0.5342 -0.5342 -0.4550 -0.4550 0.1986 0.1986 0.9772 0.9772 0.9775 0.9775 2.7111 2.7111 2.8197 2.8197 3.0105 3.0105 3.2527 3.2527 3.3334 3.3334 3.4244 3.4244 3.5892 3.5892 3.6088 3.6088 4.6254 4.6254 4.6297 4.6297 4.8822 4.8822 4.8908 4.8908 4.9485 4.9485 5.0725 5.0725 5.5511 5.5511 5.5649 5.5649 6.1358 6.1358 6.2854 6.2854 7.2708 7.2708 8.1315 8.1315 10.0037 10.0037 10.0337 10.0337 10.9831 10.9831 11.0070 11.0070 Writing output data file ZnCu2GeSe4.save init_run : 1.33s CPU 0.84s WALL ( 1 calls) electrons : 436.35s CPU 315.41s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.02s WALL ( 1 calls) potinit : 0.06s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 436.34s CPU 315.39s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.31s CPU 0.17s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.54s CPU 0.57s WALL ( 276 calls) cegterg : 364.45s CPU 274.90s WALL ( 353 calls) Called by sum_band: Called by *egterg: h_psi : 304.37s CPU 192.86s WALL ( 5991 calls) s_psi : 10.87s CPU 8.41s WALL ( 5991 calls) g_psi : 0.37s CPU 0.38s WALL ( 5362 calls) cdiaghg : 77.79s CPU 75.55s WALL ( 5638 calls) cegterg:over : 12.28s CPU 11.90s WALL ( 5362 calls) cegterg:upda : 10.95s CPU 10.14s WALL ( 5362 calls) cegterg:last : 5.03s CPU 5.01s WALL ( 905 calls) cdiaghg:chol : 4.65s CPU 4.40s WALL ( 5638 calls) cdiaghg:inve : 3.09s CPU 3.09s WALL ( 5638 calls) cdiaghg:para : 5.08s CPU 5.24s WALL ( 11276 calls) Called by h_psi: h_psi:vloc : 278.87s CPU 173.08s WALL ( 5991 calls) h_psi:vnl : 25.01s CPU 19.38s WALL ( 5991 calls) add_vuspsi : 13.42s CPU 10.23s WALL ( 5991 calls) General routines calbec : 11.54s CPU 9.13s WALL ( 5991 calls) fft : 0.07s CPU 0.05s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 265.57s CPU 162.76s WALL ( 875664 calls) interpolate : 0.02s CPU 0.02s WALL ( 4 calls) davcio : 0.38s CPU 1.66s WALL ( 552 calls) Parallel routines fft_scatter : 85.76s CPU 65.06s WALL ( 875687 calls) PWSCF : 7m42.44s CPU 5m58.53s WALL This run was terminated on: 15:52: 7 10Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=