Program PWSCF v.5.4.0 starts on 10Feb2017 at 15:46:34 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: ./Cu2HgGeSe4.save/ file Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S renormalized file Cu.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 147 65 18 4912 1431 216 Max 148 66 19 4915 1452 218 Sum 5315 2353 661 176887 52009 7801 bravais-lattice index = 14 lattice parameter (alat) = 12.9851 a.u. unit-cell volume = 1234.5546 (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 = 416.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.985099 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.650419 celldm(5)= -0.650419 celldm(6)= 0.300838 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.300838 0.953675 0.000000 ) a(3) = ( -0.650419 -0.476838 0.591254 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.315451 0.845660 ) b(2) = ( 0.000000 1.048575 0.845660 ) b(3) = ( 0.000000 0.000000 1.691321 ) 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 Hg read from file: /users/gautes/Pseudo/Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: a7fd98bfb2640362c6e2ed76594f1960 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 1279 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. # 3 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. # 4 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 atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Hg 12.00 200.59000 Hg( 1.00) Se 6.00 78.96000 Se( 1.00) Cu 11.00 63.54600 Cu( 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= 271 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0216836), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0433672), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0650508), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.0867344), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.1084180), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.1301016), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.1517852), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.1734688), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.1951524), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.2168360), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.2385196), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.2602032), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.2818868), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.3035704), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.3252540), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.3469376), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.3686212), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.3903048), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.4119884), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.4336721), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.4553557), wk = 0.0036900 k( 23) = ( 0.0000000 0.0000000 0.4770393), wk = 0.0036900 k( 24) = ( 0.0000000 0.0000000 0.4987228), wk = 0.0036900 k( 25) = ( 0.0000000 0.0000000 0.5204065), wk = 0.0036900 k( 26) = ( 0.0000000 0.0000000 0.5420901), wk = 0.0036900 k( 27) = ( 0.0000000 0.0000000 0.5637737), wk = 0.0036900 k( 28) = ( 0.0000000 0.0000000 0.5854573), wk = 0.0036900 k( 29) = ( 0.0000000 0.0000000 0.6071409), wk = 0.0036900 k( 30) = ( 0.0000000 0.0000000 0.6288245), wk = 0.0036900 k( 31) = ( 0.0000000 0.0000000 0.6505081), wk = 0.0036900 k( 32) = ( 0.0000000 0.0000000 0.6721917), wk = 0.0036900 k( 33) = ( 0.0000000 0.0000000 0.6938753), wk = 0.0036900 k( 34) = ( 0.0000000 0.0000000 0.7155589), wk = 0.0036900 k( 35) = ( 0.0000000 0.0000000 0.7372425), wk = 0.0036900 k( 36) = ( 0.0000000 0.0000000 0.7589261), wk = 0.0036900 k( 37) = ( 0.0000000 0.0000000 0.7806097), wk = 0.0036900 k( 38) = ( 0.0000000 0.0000000 0.8022933), wk = 0.0036900 k( 39) = ( 0.0000000 0.0000000 0.8239769), wk = 0.0036900 k( 40) = ( 0.0000000 0.0000000 0.8456605), wk = 0.0036900 k( 41) = ( 0.0000000 0.0000000 0.8456605), wk = 0.0036900 k( 42) = ( -0.0122152 0.0166619 0.8456605), wk = 0.0036900 k( 43) = ( -0.0244305 0.0333238 0.8456605), wk = 0.0036900 k( 44) = ( -0.0366457 0.0499857 0.8456605), wk = 0.0036900 k( 45) = ( -0.0488610 0.0666476 0.8456605), wk = 0.0036900 k( 46) = ( -0.0610762 0.0833095 0.8456605), wk = 0.0036900 k( 47) = ( -0.0732914 0.0999714 0.8456605), wk = 0.0036900 k( 48) = ( -0.0855067 0.1166333 0.8456605), wk = 0.0036900 k( 49) = ( -0.0977219 0.1332953 0.8456605), wk = 0.0036900 k( 50) = ( -0.1099372 0.1499572 0.8456605), wk = 0.0036900 k( 51) = ( -0.1221524 0.1666191 0.8456605), wk = 0.0036900 k( 52) = ( -0.1343677 0.1832810 0.8456605), wk = 0.0036900 k( 53) = ( -0.1343677 0.1832810 0.8456605), wk = 0.0036900 k( 54) = ( -0.1435085 0.1957493 0.8302005), wk = 0.0036900 k( 55) = ( -0.1526493 0.2082176 0.8147404), wk = 0.0036900 k( 56) = ( -0.1617901 0.2206859 0.7992804), wk = 0.0036900 k( 57) = ( -0.1709309 0.2331542 0.7838203), wk = 0.0036900 k( 58) = ( -0.1800717 0.2456225 0.7683603), wk = 0.0036900 k( 59) = ( -0.1892125 0.2580908 0.7529002), wk = 0.0036900 k( 60) = ( -0.1983533 0.2705591 0.7374402), wk = 0.0036900 k( 61) = ( -0.2074941 0.2830274 0.7219802), wk = 0.0036900 k( 62) = ( -0.2166349 0.2954957 0.7065201), wk = 0.0036900 k( 63) = ( -0.2257757 0.3079640 0.6910601), wk = 0.0036900 k( 64) = ( -0.2349166 0.3204323 0.6756000), wk = 0.0036900 k( 65) = ( -0.2440574 0.3329006 0.6601400), wk = 0.0036900 k( 66) = ( -0.2531982 0.3453689 0.6446800), wk = 0.0036900 k( 67) = ( -0.2623390 0.3578372 0.6292199), wk = 0.0036900 k( 68) = ( -0.2714798 0.3703055 0.6137599), wk = 0.0036900 k( 69) = ( -0.2806206 0.3827738 0.5982998), wk = 0.0036900 k( 70) = ( -0.2897614 0.3952421 0.5828398), wk = 0.0036900 k( 71) = ( -0.2989022 0.4077104 0.5673798), wk = 0.0036900 k( 72) = ( -0.3080430 0.4201787 0.5519197), wk = 0.0036900 k( 73) = ( -0.3171838 0.4326470 0.5364597), wk = 0.0036900 k( 74) = ( -0.3171838 0.4326470 0.5364597), wk = 0.0036900 k( 75) = ( -0.3081214 0.4202856 0.5211323), wk = 0.0036900 k( 76) = ( -0.2990590 0.4079243 0.5058048), wk = 0.0036900 k( 77) = ( -0.2899967 0.3955629 0.4904774), wk = 0.0036900 k( 78) = ( -0.2809342 0.3832016 0.4751500), wk = 0.0036900 k( 79) = ( -0.2718719 0.3708403 0.4598226), wk = 0.0036900 k( 80) = ( -0.2628095 0.3584789 0.4444952), wk = 0.0036900 k( 81) = ( -0.2537471 0.3461176 0.4291677), wk = 0.0036900 k( 82) = ( -0.2446847 0.3337562 0.4138403), wk = 0.0036900 k( 83) = ( -0.2356223 0.3213949 0.3985129), wk = 0.0036900 k( 84) = ( -0.2265599 0.3090335 0.3831855), wk = 0.0036900 k( 85) = ( -0.2174975 0.2966722 0.3678581), wk = 0.0036900 k( 86) = ( -0.2084351 0.2843109 0.3525306), wk = 0.0036900 k( 87) = ( -0.1993727 0.2719495 0.3372032), wk = 0.0036900 k( 88) = ( -0.1903103 0.2595882 0.3218758), wk = 0.0036900 k( 89) = ( -0.1812479 0.2472268 0.3065484), wk = 0.0036900 k( 90) = ( -0.1721855 0.2348655 0.2912210), wk = 0.0036900 k( 91) = ( -0.1631231 0.2225041 0.2758935), wk = 0.0036900 k( 92) = ( -0.1540607 0.2101428 0.2605661), wk = 0.0036900 k( 93) = ( -0.1449983 0.1977815 0.2452387), wk = 0.0036900 k( 94) = ( -0.1359359 0.1854201 0.2299113), wk = 0.0036900 k( 95) = ( -0.1268735 0.1730588 0.2145839), wk = 0.0036900 k( 96) = ( -0.1178111 0.1606974 0.1992565), wk = 0.0036900 k( 97) = ( -0.1087487 0.1483361 0.1839290), wk = 0.0036900 k( 98) = ( -0.0996864 0.1359748 0.1686016), wk = 0.0036900 k( 99) = ( -0.0906239 0.1236134 0.1532742), wk = 0.0036900 k( 100) = ( -0.0815616 0.1112521 0.1379468), wk = 0.0036900 k( 101) = ( -0.0724992 0.0988907 0.1226194), wk = 0.0036900 k( 102) = ( -0.0634368 0.0865294 0.1072919), wk = 0.0036900 k( 103) = ( -0.0543744 0.0741680 0.0919645), wk = 0.0036900 k( 104) = ( -0.0453120 0.0618067 0.0766371), wk = 0.0036900 k( 105) = ( -0.0362496 0.0494454 0.0613097), wk = 0.0036900 k( 106) = ( -0.0271872 0.0370840 0.0459823), wk = 0.0036900 k( 107) = ( -0.0181248 0.0247227 0.0306548), wk = 0.0036900 k( 108) = ( -0.0090624 0.0123613 0.0153274), wk = 0.0036900 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 111) = ( 0.0172414 0.0126401 0.0000000), wk = 0.0036900 k( 112) = ( 0.0344828 0.0252801 0.0000000), wk = 0.0036900 k( 113) = ( 0.0517241 0.0379202 0.0000000), wk = 0.0036900 k( 114) = ( 0.0689655 0.0505603 0.0000000), wk = 0.0036900 k( 115) = ( 0.0862069 0.0632003 0.0000000), wk = 0.0036900 k( 116) = ( 0.1034483 0.0758404 0.0000000), wk = 0.0036900 k( 117) = ( 0.1206897 0.0884805 0.0000000), wk = 0.0036900 k( 118) = ( 0.1379310 0.1011205 0.0000000), wk = 0.0036900 k( 119) = ( 0.1551724 0.1137606 0.0000000), wk = 0.0036900 k( 120) = ( 0.1724138 0.1264007 0.0000000), wk = 0.0036900 k( 121) = ( 0.1896552 0.1390407 0.0000000), wk = 0.0036900 k( 122) = ( 0.2068966 0.1516808 0.0000000), wk = 0.0036900 k( 123) = ( 0.2241379 0.1643209 0.0000000), wk = 0.0036900 k( 124) = ( 0.2413793 0.1769609 0.0000000), wk = 0.0036900 k( 125) = ( 0.2586207 0.1896010 0.0000000), wk = 0.0036900 k( 126) = ( 0.2758621 0.2022411 0.0000000), wk = 0.0036900 k( 127) = ( 0.2931034 0.2148811 0.0000000), wk = 0.0036900 k( 128) = ( 0.3103448 0.2275212 0.0000000), wk = 0.0036900 k( 129) = ( 0.3275862 0.2401613 0.0000000), wk = 0.0036900 k( 130) = ( 0.3448276 0.2528013 0.0000000), wk = 0.0036900 k( 131) = ( 0.3620690 0.2654414 0.0000000), wk = 0.0036900 k( 132) = ( 0.3793103 0.2780815 0.0000000), wk = 0.0036900 k( 133) = ( 0.3965517 0.2907215 0.0000000), wk = 0.0036900 k( 134) = ( 0.4137931 0.3033616 0.0000000), wk = 0.0036900 k( 135) = ( 0.4310345 0.3160017 0.0000000), wk = 0.0036900 k( 136) = ( 0.4482759 0.3286417 0.0000000), wk = 0.0036900 k( 137) = ( 0.4655172 0.3412818 0.0000000), wk = 0.0036900 k( 138) = ( 0.4827586 0.3539219 0.0000000), wk = 0.0036900 k( 139) = ( 0.5000000 0.3665620 0.0000000), wk = 0.0036900 k( 140) = ( 0.5000000 0.3665620 0.0000000), wk = 0.0036900 k( 141) = ( 0.4908592 0.3790303 0.0154600), wk = 0.0036900 k( 142) = ( 0.4817184 0.3914986 0.0309201), wk = 0.0036900 k( 143) = ( 0.4725776 0.4039669 0.0463801), wk = 0.0036900 k( 144) = ( 0.4634368 0.4164351 0.0618402), wk = 0.0036900 k( 145) = ( 0.4542960 0.4289034 0.0773002), wk = 0.0036900 k( 146) = ( 0.4451551 0.4413717 0.0927602), wk = 0.0036900 k( 147) = ( 0.4360143 0.4538400 0.1082203), wk = 0.0036900 k( 148) = ( 0.4268735 0.4663084 0.1236803), wk = 0.0036900 k( 149) = ( 0.4177327 0.4787767 0.1391404), wk = 0.0036900 k( 150) = ( 0.4085919 0.4912449 0.1546004), wk = 0.0036900 k( 151) = ( 0.3994511 0.5037132 0.1700604), wk = 0.0036900 k( 152) = ( 0.3903103 0.5161815 0.1855205), wk = 0.0036900 k( 153) = ( 0.3811695 0.5286498 0.2009805), wk = 0.0036900 k( 154) = ( 0.3720287 0.5411181 0.2164406), wk = 0.0036900 k( 155) = ( 0.3628879 0.5535864 0.2319006), wk = 0.0036900 k( 156) = ( 0.3537471 0.5660547 0.2473607), wk = 0.0036900 k( 157) = ( 0.3446063 0.5785230 0.2628207), wk = 0.0036900 k( 158) = ( 0.3354654 0.5909913 0.2782807), wk = 0.0036900 k( 159) = ( 0.3263246 0.6034596 0.2937408), wk = 0.0036900 k( 160) = ( 0.3171838 0.6159279 0.3092008), wk = 0.0036900 k( 161) = ( 0.3171838 0.6159279 0.3092008), wk = 0.0036900 k( 162) = ( 0.2973598 0.6102004 0.3163027), wk = 0.0036900 k( 163) = ( 0.2775358 0.6044729 0.3234045), wk = 0.0036900 k( 164) = ( 0.2577119 0.5987454 0.3305063), wk = 0.0036900 k( 165) = ( 0.2378879 0.5930178 0.3376082), wk = 0.0036900 k( 166) = ( 0.2180639 0.5872903 0.3447100), wk = 0.0036900 k( 167) = ( 0.1982399 0.5815628 0.3518119), wk = 0.0036900 k( 168) = ( 0.1784159 0.5758352 0.3589137), wk = 0.0036900 k( 169) = ( 0.1585919 0.5701077 0.3660155), wk = 0.0036900 k( 170) = ( 0.1387679 0.5643802 0.3731174), wk = 0.0036900 k( 171) = ( 0.1189439 0.5586526 0.3802192), wk = 0.0036900 k( 172) = ( 0.0991199 0.5529251 0.3873210), wk = 0.0036900 k( 173) = ( 0.0792960 0.5471976 0.3944229), wk = 0.0036900 k( 174) = ( 0.0594720 0.5414700 0.4015247), wk = 0.0036900 k( 175) = ( 0.0396480 0.5357425 0.4086266), wk = 0.0036900 k( 176) = ( 0.0198240 0.5300150 0.4157284), wk = 0.0036900 k( 177) = ( 0.0000000 0.5242875 0.4228302), wk = 0.0036900 k( 178) = ( 0.0000000 0.5242875 0.4228302), wk = 0.0036900 k( 179) = ( 0.0089286 0.5121087 0.4379313), wk = 0.0036900 k( 180) = ( 0.0178571 0.4999299 0.4530324), wk = 0.0036900 k( 181) = ( 0.0267857 0.4877511 0.4681335), wk = 0.0036900 k( 182) = ( 0.0357143 0.4755722 0.4832346), wk = 0.0036900 k( 183) = ( 0.0446429 0.4633934 0.4983357), wk = 0.0036900 k( 184) = ( 0.0535714 0.4512146 0.5134367), wk = 0.0036900 k( 185) = ( 0.0625000 0.4390358 0.5285378), wk = 0.0036900 k( 186) = ( 0.0714286 0.4268570 0.5436389), wk = 0.0036900 k( 187) = ( 0.0803571 0.4146782 0.5587400), wk = 0.0036900 k( 188) = ( 0.0892857 0.4024994 0.5738410), wk = 0.0036900 k( 189) = ( 0.0982143 0.3903206 0.5889421), wk = 0.0036900 k( 190) = ( 0.1071429 0.3781418 0.6040432), wk = 0.0036900 k( 191) = ( 0.1160714 0.3659630 0.6191443), wk = 0.0036900 k( 192) = ( 0.1250000 0.3537842 0.6342454), wk = 0.0036900 k( 193) = ( 0.1339286 0.3416054 0.6493464), wk = 0.0036900 k( 194) = ( 0.1428571 0.3294266 0.6644475), wk = 0.0036900 k( 195) = ( 0.1517857 0.3172478 0.6795486), wk = 0.0036900 k( 196) = ( 0.1607143 0.3050690 0.6946497), wk = 0.0036900 k( 197) = ( 0.1696429 0.2928902 0.7097508), wk = 0.0036900 k( 198) = ( 0.1785714 0.2807114 0.7248519), wk = 0.0036900 k( 199) = ( 0.1875000 0.2685326 0.7399529), wk = 0.0036900 k( 200) = ( 0.1964286 0.2563538 0.7550540), wk = 0.0036900 k( 201) = ( 0.2053571 0.2441750 0.7701551), wk = 0.0036900 k( 202) = ( 0.2142857 0.2319962 0.7852562), wk = 0.0036900 k( 203) = ( 0.2232143 0.2198174 0.8003573), wk = 0.0036900 k( 204) = ( 0.2321429 0.2076386 0.8154583), wk = 0.0036900 k( 205) = ( 0.2410714 0.1954598 0.8305594), wk = 0.0036900 k( 206) = ( 0.2500000 0.1832810 0.8456605), wk = 0.0036900 k( 207) = ( 0.2500000 0.1832810 0.8456605), wk = 0.0036900 k( 208) = ( 0.2638889 0.1934633 0.8330350), wk = 0.0036900 k( 209) = ( 0.2777778 0.2036455 0.8204095), wk = 0.0036900 k( 210) = ( 0.2916667 0.2138278 0.8077840), wk = 0.0036900 k( 211) = ( 0.3055556 0.2240101 0.7951585), wk = 0.0036900 k( 212) = ( 0.3194444 0.2341924 0.7825330), wk = 0.0036900 k( 213) = ( 0.3333333 0.2443746 0.7699075), wk = 0.0036900 k( 214) = ( 0.3472222 0.2545569 0.7572821), wk = 0.0036900 k( 215) = ( 0.3611111 0.2647392 0.7446566), wk = 0.0036900 k( 216) = ( 0.3750000 0.2749215 0.7320311), wk = 0.0036900 k( 217) = ( 0.3888889 0.2851037 0.7194056), wk = 0.0036900 k( 218) = ( 0.4027778 0.2952860 0.7067801), wk = 0.0036900 k( 219) = ( 0.4166667 0.3054683 0.6941546), wk = 0.0036900 k( 220) = ( 0.4305556 0.3156506 0.6815291), wk = 0.0036900 k( 221) = ( 0.4444444 0.3258328 0.6689036), wk = 0.0036900 k( 222) = ( 0.4583333 0.3360151 0.6562781), wk = 0.0036900 k( 223) = ( 0.4722222 0.3461974 0.6436526), wk = 0.0036900 k( 224) = ( 0.4861111 0.3563797 0.6310271), wk = 0.0036900 k( 225) = ( 0.5000000 0.3665620 0.6184017), wk = 0.0036900 k( 226) = ( 0.5000000 0.3665620 0.6184017), wk = 0.0036900 k( 227) = ( 0.5000000 0.3665620 0.5970774), wk = 0.0036900 k( 228) = ( 0.5000000 0.3665620 0.5757533), wk = 0.0036900 k( 229) = ( 0.5000000 0.3665620 0.5544291), wk = 0.0036900 k( 230) = ( 0.5000000 0.3665620 0.5331049), wk = 0.0036900 k( 231) = ( 0.5000000 0.3665620 0.5117807), wk = 0.0036900 k( 232) = ( 0.5000000 0.3665620 0.4904565), wk = 0.0036900 k( 233) = ( 0.5000000 0.3665620 0.4691323), wk = 0.0036900 k( 234) = ( 0.5000000 0.3665620 0.4478081), wk = 0.0036900 k( 235) = ( 0.5000000 0.3665620 0.4264839), wk = 0.0036900 k( 236) = ( 0.5000000 0.3665620 0.4051597), wk = 0.0036900 k( 237) = ( 0.5000000 0.3665620 0.3838355), wk = 0.0036900 k( 238) = ( 0.5000000 0.3665620 0.3625113), wk = 0.0036900 k( 239) = ( 0.5000000 0.3665620 0.3411871), wk = 0.0036900 k( 240) = ( 0.5000000 0.3665620 0.3198629), wk = 0.0036900 k( 241) = ( 0.5000000 0.3665620 0.2985387), wk = 0.0036900 k( 242) = ( 0.5000000 0.3665620 0.2772145), wk = 0.0036900 k( 243) = ( 0.5000000 0.3665620 0.2558903), wk = 0.0036900 k( 244) = ( 0.5000000 0.3665620 0.2345661), wk = 0.0036900 k( 245) = ( 0.5000000 0.3665620 0.2132420), wk = 0.0036900 k( 246) = ( 0.5000000 0.3665620 0.1919177), wk = 0.0036900 k( 247) = ( 0.5000000 0.3665620 0.1705936), wk = 0.0036900 k( 248) = ( 0.5000000 0.3665620 0.1492694), wk = 0.0036900 k( 249) = ( 0.5000000 0.3665620 0.1279452), wk = 0.0036900 k( 250) = ( 0.5000000 0.3665620 0.1066210), wk = 0.0036900 k( 251) = ( 0.5000000 0.3665620 0.0852968), wk = 0.0036900 k( 252) = ( 0.5000000 0.3665620 0.0639726), wk = 0.0036900 k( 253) = ( 0.5000000 0.3665620 0.0426484), wk = 0.0036900 k( 254) = ( 0.5000000 0.3665620 0.0213242), wk = 0.0036900 k( 255) = ( 0.5000000 0.3665620 0.0000000), wk = 0.0036900 k( 256) = ( 0.0000000 0.0000000 0.8456605), wk = 0.0036900 k( 257) = ( 0.0166667 0.0122187 0.8456605), wk = 0.0036900 k( 258) = ( 0.0333333 0.0244375 0.8456605), wk = 0.0036900 k( 259) = ( 0.0500000 0.0366562 0.8456605), wk = 0.0036900 k( 260) = ( 0.0666667 0.0488749 0.8456605), wk = 0.0036900 k( 261) = ( 0.0833333 0.0610937 0.8456605), wk = 0.0036900 k( 262) = ( 0.1000000 0.0733124 0.8456605), wk = 0.0036900 k( 263) = ( 0.1166667 0.0855311 0.8456605), wk = 0.0036900 k( 264) = ( 0.1333333 0.0977499 0.8456605), wk = 0.0036900 k( 265) = ( 0.1500000 0.1099686 0.8456605), wk = 0.0036900 k( 266) = ( 0.1666667 0.1221873 0.8456605), wk = 0.0036900 k( 267) = ( 0.1833333 0.1344060 0.8456605), wk = 0.0036900 k( 268) = ( 0.2000000 0.1466248 0.8456605), wk = 0.0036900 k( 269) = ( 0.2166667 0.1588435 0.8456605), wk = 0.0036900 k( 270) = ( 0.2333333 0.1710622 0.8456605), wk = 0.0036900 k( 271) = ( 0.2500000 0.1832810 0.8456605), wk = 0.0036900 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.1538462), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0036900 k( 23) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0036900 k( 24) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0036900 k( 25) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0036900 k( 26) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0036900 k( 27) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0036900 k( 28) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0036900 k( 29) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0036900 k( 30) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0036900 k( 31) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0036900 k( 32) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0036900 k( 33) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0036900 k( 34) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0036900 k( 35) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0036900 k( 36) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0036900 k( 37) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0036900 k( 38) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0036900 k( 39) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0036900 k( 40) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 42) = ( -0.0122152 0.0122152 0.5000000), wk = 0.0036900 k( 43) = ( -0.0244305 0.0244305 0.5000000), wk = 0.0036900 k( 44) = ( -0.0366457 0.0366457 0.5000000), wk = 0.0036900 k( 45) = ( -0.0488610 0.0488610 0.5000000), wk = 0.0036900 k( 46) = ( -0.0610762 0.0610762 0.5000000), wk = 0.0036900 k( 47) = ( -0.0732914 0.0732915 0.5000000), wk = 0.0036900 k( 48) = ( -0.0855067 0.0855067 0.5000000), wk = 0.0036900 k( 49) = ( -0.0977219 0.0977219 0.5000000), wk = 0.0036900 k( 50) = ( -0.1099372 0.1099372 0.5000000), wk = 0.0036900 k( 51) = ( -0.1221524 0.1221524 0.5000000), wk = 0.0036900 k( 52) = ( -0.1343677 0.1343677 0.5000000), wk = 0.0036900 k( 53) = ( -0.1343677 0.1343677 0.5000000), wk = 0.0036900 k( 54) = ( -0.1435085 0.1435085 0.4908592), wk = 0.0036900 k( 55) = ( -0.1526493 0.1526493 0.4817184), wk = 0.0036900 k( 56) = ( -0.1617901 0.1617901 0.4725776), wk = 0.0036900 k( 57) = ( -0.1709309 0.1709309 0.4634368), wk = 0.0036900 k( 58) = ( -0.1800717 0.1800717 0.4542960), wk = 0.0036900 k( 59) = ( -0.1892125 0.1892125 0.4451551), wk = 0.0036900 k( 60) = ( -0.1983533 0.1983533 0.4360143), wk = 0.0036900 k( 61) = ( -0.2074941 0.2074941 0.4268735), wk = 0.0036900 k( 62) = ( -0.2166349 0.2166349 0.4177327), wk = 0.0036900 k( 63) = ( -0.2257757 0.2257758 0.4085919), wk = 0.0036900 k( 64) = ( -0.2349166 0.2349166 0.3994511), wk = 0.0036900 k( 65) = ( -0.2440574 0.2440574 0.3903103), wk = 0.0036900 k( 66) = ( -0.2531982 0.2531982 0.3811695), wk = 0.0036900 k( 67) = ( -0.2623390 0.2623390 0.3720287), wk = 0.0036900 k( 68) = ( -0.2714798 0.2714798 0.3628879), wk = 0.0036900 k( 69) = ( -0.2806206 0.2806206 0.3537471), wk = 0.0036900 k( 70) = ( -0.2897614 0.2897614 0.3446063), wk = 0.0036900 k( 71) = ( -0.2989022 0.2989022 0.3354654), wk = 0.0036900 k( 72) = ( -0.3080430 0.3080430 0.3263246), wk = 0.0036900 k( 73) = ( -0.3171838 0.3171838 0.3171838), wk = 0.0036900 k( 74) = ( -0.3171838 0.3171838 0.3171838), wk = 0.0036900 k( 75) = ( -0.3081214 0.3081214 0.3081214), wk = 0.0036900 k( 76) = ( -0.2990590 0.2990590 0.2990590), wk = 0.0036900 k( 77) = ( -0.2899967 0.2899967 0.2899967), wk = 0.0036900 k( 78) = ( -0.2809342 0.2809343 0.2809342), wk = 0.0036900 k( 79) = ( -0.2718719 0.2718719 0.2718719), wk = 0.0036900 k( 80) = ( -0.2628095 0.2628095 0.2628095), wk = 0.0036900 k( 81) = ( -0.2537471 0.2537471 0.2537471), wk = 0.0036900 k( 82) = ( -0.2446847 0.2446847 0.2446847), wk = 0.0036900 k( 83) = ( -0.2356223 0.2356223 0.2356223), wk = 0.0036900 k( 84) = ( -0.2265599 0.2265599 0.2265599), wk = 0.0036900 k( 85) = ( -0.2174975 0.2174975 0.2174975), wk = 0.0036900 k( 86) = ( -0.2084351 0.2084351 0.2084351), wk = 0.0036900 k( 87) = ( -0.1993727 0.1993727 0.1993727), wk = 0.0036900 k( 88) = ( -0.1903103 0.1903103 0.1903103), wk = 0.0036900 k( 89) = ( -0.1812479 0.1812479 0.1812479), wk = 0.0036900 k( 90) = ( -0.1721855 0.1721855 0.1721855), wk = 0.0036900 k( 91) = ( -0.1631231 0.1631231 0.1631231), wk = 0.0036900 k( 92) = ( -0.1540607 0.1540607 0.1540607), wk = 0.0036900 k( 93) = ( -0.1449983 0.1449983 0.1449983), wk = 0.0036900 k( 94) = ( -0.1359359 0.1359359 0.1359359), wk = 0.0036900 k( 95) = ( -0.1268735 0.1268735 0.1268735), wk = 0.0036900 k( 96) = ( -0.1178111 0.1178111 0.1178111), wk = 0.0036900 k( 97) = ( -0.1087487 0.1087487 0.1087487), wk = 0.0036900 k( 98) = ( -0.0996864 0.0996864 0.0996863), wk = 0.0036900 k( 99) = ( -0.0906239 0.0906239 0.0906240), wk = 0.0036900 k( 100) = ( -0.0815616 0.0815616 0.0815616), wk = 0.0036900 k( 101) = ( -0.0724992 0.0724992 0.0724992), wk = 0.0036900 k( 102) = ( -0.0634368 0.0634368 0.0634368), wk = 0.0036900 k( 103) = ( -0.0543744 0.0543744 0.0543744), wk = 0.0036900 k( 104) = ( -0.0453120 0.0453120 0.0453120), wk = 0.0036900 k( 105) = ( -0.0362496 0.0362496 0.0362496), wk = 0.0036900 k( 106) = ( -0.0271872 0.0271872 0.0271872), wk = 0.0036900 k( 107) = ( -0.0181248 0.0181248 0.0181248), wk = 0.0036900 k( 108) = ( -0.0090624 0.0090624 0.0090624), wk = 0.0036900 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 111) = ( 0.0172414 0.0172414 -0.0172414), wk = 0.0036900 k( 112) = ( 0.0344828 0.0344828 -0.0344828), wk = 0.0036900 k( 113) = ( 0.0517241 0.0517241 -0.0517241), wk = 0.0036900 k( 114) = ( 0.0689655 0.0689655 -0.0689655), wk = 0.0036900 k( 115) = ( 0.0862069 0.0862069 -0.0862069), wk = 0.0036900 k( 116) = ( 0.1034483 0.1034483 -0.1034483), wk = 0.0036900 k( 117) = ( 0.1206897 0.1206897 -0.1206897), wk = 0.0036900 k( 118) = ( 0.1379310 0.1379310 -0.1379310), wk = 0.0036900 k( 119) = ( 0.1551724 0.1551724 -0.1551724), wk = 0.0036900 k( 120) = ( 0.1724138 0.1724138 -0.1724138), wk = 0.0036900 k( 121) = ( 0.1896552 0.1896552 -0.1896552), wk = 0.0036900 k( 122) = ( 0.2068966 0.2068966 -0.2068966), wk = 0.0036900 k( 123) = ( 0.2241379 0.2241379 -0.2241379), wk = 0.0036900 k( 124) = ( 0.2413793 0.2413793 -0.2413793), wk = 0.0036900 k( 125) = ( 0.2586207 0.2586207 -0.2586207), wk = 0.0036900 k( 126) = ( 0.2758621 0.2758621 -0.2758621), wk = 0.0036900 k( 127) = ( 0.2931034 0.2931034 -0.2931034), wk = 0.0036900 k( 128) = ( 0.3103448 0.3103448 -0.3103448), wk = 0.0036900 k( 129) = ( 0.3275862 0.3275862 -0.3275862), wk = 0.0036900 k( 130) = ( 0.3448276 0.3448276 -0.3448276), wk = 0.0036900 k( 131) = ( 0.3620690 0.3620690 -0.3620690), wk = 0.0036900 k( 132) = ( 0.3793103 0.3793103 -0.3793103), wk = 0.0036900 k( 133) = ( 0.3965517 0.3965517 -0.3965517), wk = 0.0036900 k( 134) = ( 0.4137931 0.4137931 -0.4137931), wk = 0.0036900 k( 135) = ( 0.4310345 0.4310345 -0.4310345), wk = 0.0036900 k( 136) = ( 0.4482759 0.4482759 -0.4482759), wk = 0.0036900 k( 137) = ( 0.4655172 0.4655172 -0.4655172), wk = 0.0036900 k( 138) = ( 0.4827586 0.4827586 -0.4827586), wk = 0.0036900 k( 139) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 140) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 141) = ( 0.4908592 0.5091408 -0.4908592), wk = 0.0036900 k( 142) = ( 0.4817184 0.5182816 -0.4817184), wk = 0.0036900 k( 143) = ( 0.4725776 0.5274224 -0.4725776), wk = 0.0036900 k( 144) = ( 0.4634368 0.5365632 -0.4634368), wk = 0.0036900 k( 145) = ( 0.4542960 0.5457040 -0.4542960), wk = 0.0036900 k( 146) = ( 0.4451551 0.5548449 -0.4451552), wk = 0.0036900 k( 147) = ( 0.4360143 0.5639857 -0.4360143), wk = 0.0036900 k( 148) = ( 0.4268735 0.5731265 -0.4268735), wk = 0.0036900 k( 149) = ( 0.4177327 0.5822673 -0.4177327), wk = 0.0036900 k( 150) = ( 0.4085919 0.5914081 -0.4085919), wk = 0.0036900 k( 151) = ( 0.3994511 0.6005489 -0.3994511), wk = 0.0036900 k( 152) = ( 0.3903103 0.6096897 -0.3903103), wk = 0.0036900 k( 153) = ( 0.3811695 0.6188305 -0.3811695), wk = 0.0036900 k( 154) = ( 0.3720287 0.6279713 -0.3720287), wk = 0.0036900 k( 155) = ( 0.3628879 0.6371121 -0.3628879), wk = 0.0036900 k( 156) = ( 0.3537471 0.6462529 -0.3537471), wk = 0.0036900 k( 157) = ( 0.3446063 0.6553937 -0.3446063), wk = 0.0036900 k( 158) = ( 0.3354654 0.6645346 -0.3354654), wk = 0.0036900 k( 159) = ( 0.3263246 0.6736754 -0.3263246), wk = 0.0036900 k( 160) = ( 0.3171838 0.6828162 -0.3171838), wk = 0.0036900 k( 161) = ( 0.3171838 0.6828162 -0.3171838), wk = 0.0036900 k( 162) = ( 0.2973598 0.6713902 -0.2973598), wk = 0.0036900 k( 163) = ( 0.2775358 0.6599641 -0.2775359), wk = 0.0036900 k( 164) = ( 0.2577119 0.6485381 -0.2577119), wk = 0.0036900 k( 165) = ( 0.2378879 0.6371121 -0.2378879), wk = 0.0036900 k( 166) = ( 0.2180639 0.6256861 -0.2180639), wk = 0.0036900 k( 167) = ( 0.1982399 0.6142601 -0.1982399), wk = 0.0036900 k( 168) = ( 0.1784159 0.6028341 -0.1784159), wk = 0.0036900 k( 169) = ( 0.1585919 0.5914081 -0.1585919), wk = 0.0036900 k( 170) = ( 0.1387679 0.5799821 -0.1387679), wk = 0.0036900 k( 171) = ( 0.1189439 0.5685561 -0.1189439), wk = 0.0036900 k( 172) = ( 0.0991199 0.5571301 -0.0991199), wk = 0.0036900 k( 173) = ( 0.0792960 0.5457040 -0.0792960), wk = 0.0036900 k( 174) = ( 0.0594720 0.5342780 -0.0594720), wk = 0.0036900 k( 175) = ( 0.0396480 0.5228520 -0.0396480), wk = 0.0036900 k( 176) = ( 0.0198240 0.5114260 -0.0198240), wk = 0.0036900 k( 177) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0036900 k( 178) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0036900 k( 179) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0036900 k( 180) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0036900 k( 181) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0036900 k( 182) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0036900 k( 183) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0036900 k( 184) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0036900 k( 185) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0036900 k( 186) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0036900 k( 187) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0036900 k( 188) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0036900 k( 189) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0036900 k( 190) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0036900 k( 191) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0036900 k( 192) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0036900 k( 193) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0036900 k( 194) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0036900 k( 195) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0036900 k( 196) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0036900 k( 197) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0036900 k( 198) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0036900 k( 199) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0036900 k( 200) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0036900 k( 201) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0036900 k( 202) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0036900 k( 203) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0036900 k( 204) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0036900 k( 205) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0036900 k( 206) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 k( 207) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 k( 208) = ( 0.2638889 0.2638889 0.2286462), wk = 0.0036900 k( 209) = ( 0.2777778 0.2777778 0.2072925), wk = 0.0036900 k( 210) = ( 0.2916667 0.2916667 0.1859387), wk = 0.0036900 k( 211) = ( 0.3055556 0.3055556 0.1645850), wk = 0.0036900 k( 212) = ( 0.3194444 0.3194444 0.1432312), wk = 0.0036900 k( 213) = ( 0.3333333 0.3333333 0.1218775), wk = 0.0036900 k( 214) = ( 0.3472222 0.3472222 0.1005237), wk = 0.0036900 k( 215) = ( 0.3611111 0.3611111 0.0791699), wk = 0.0036900 k( 216) = ( 0.3750000 0.3750000 0.0578162), wk = 0.0036900 k( 217) = ( 0.3888889 0.3888889 0.0364624), wk = 0.0036900 k( 218) = ( 0.4027778 0.4027778 0.0151086), wk = 0.0036900 k( 219) = ( 0.4166667 0.4166667 -0.0062451), wk = 0.0036900 k( 220) = ( 0.4305556 0.4305556 -0.0275989), wk = 0.0036900 k( 221) = ( 0.4444444 0.4444444 -0.0489526), wk = 0.0036900 k( 222) = ( 0.4583333 0.4583333 -0.0703064), wk = 0.0036900 k( 223) = ( 0.4722222 0.4722222 -0.0916602), wk = 0.0036900 k( 224) = ( 0.4861111 0.4861111 -0.1130139), wk = 0.0036900 k( 225) = ( 0.5000000 0.5000000 -0.1343677), wk = 0.0036900 k( 226) = ( 0.5000000 0.5000000 -0.1343677), wk = 0.0036900 k( 227) = ( 0.5000000 0.5000000 -0.1469757), wk = 0.0036900 k( 228) = ( 0.5000000 0.5000000 -0.1595837), wk = 0.0036900 k( 229) = ( 0.5000000 0.5000000 -0.1721917), wk = 0.0036900 k( 230) = ( 0.5000000 0.5000000 -0.1847997), wk = 0.0036900 k( 231) = ( 0.5000000 0.5000000 -0.1974077), wk = 0.0036900 k( 232) = ( 0.5000000 0.5000000 -0.2100157), wk = 0.0036900 k( 233) = ( 0.5000000 0.5000000 -0.2226237), wk = 0.0036900 k( 234) = ( 0.5000000 0.5000000 -0.2352318), wk = 0.0036900 k( 235) = ( 0.5000000 0.5000000 -0.2478398), wk = 0.0036900 k( 236) = ( 0.5000000 0.5000000 -0.2604478), wk = 0.0036900 k( 237) = ( 0.5000000 0.5000000 -0.2730558), wk = 0.0036900 k( 238) = ( 0.5000000 0.5000000 -0.2856638), wk = 0.0036900 k( 239) = ( 0.5000000 0.5000000 -0.2982718), wk = 0.0036900 k( 240) = ( 0.5000000 0.5000000 -0.3108798), wk = 0.0036900 k( 241) = ( 0.5000000 0.5000000 -0.3234878), wk = 0.0036900 k( 242) = ( 0.5000000 0.5000000 -0.3360958), wk = 0.0036900 k( 243) = ( 0.5000000 0.5000000 -0.3487039), wk = 0.0036900 k( 244) = ( 0.5000000 0.5000000 -0.3613119), wk = 0.0036900 k( 245) = ( 0.5000000 0.5000000 -0.3739199), wk = 0.0036900 k( 246) = ( 0.5000000 0.5000000 -0.3865279), wk = 0.0036900 k( 247) = ( 0.5000000 0.5000000 -0.3991359), wk = 0.0036900 k( 248) = ( 0.5000000 0.5000000 -0.4117439), wk = 0.0036900 k( 249) = ( 0.5000000 0.5000000 -0.4243519), wk = 0.0036900 k( 250) = ( 0.5000000 0.5000000 -0.4369599), wk = 0.0036900 k( 251) = ( 0.5000000 0.5000000 -0.4495679), wk = 0.0036900 k( 252) = ( 0.5000000 0.5000000 -0.4621760), wk = 0.0036900 k( 253) = ( 0.5000000 0.5000000 -0.4747840), wk = 0.0036900 k( 254) = ( 0.5000000 0.5000000 -0.4873920), wk = 0.0036900 k( 255) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 256) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 257) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0036900 k( 258) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0036900 k( 259) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0036900 k( 260) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0036900 k( 261) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0036900 k( 262) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0036900 k( 263) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0036900 k( 264) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0036900 k( 265) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0036900 k( 266) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0036900 k( 267) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0036900 k( 268) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0036900 k( 269) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0036900 k( 270) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0036900 k( 271) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 Dense grid: 176887 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 52009 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.43 Mb ( 384, 74) NL pseudopotentials 0.50 Mb ( 192, 172) Each V/rho on FFT grid 0.37 Mb ( 24300) Each G-vector array 0.04 Mb ( 4915) G-vector shells 0.02 Mb ( 2127) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.73 Mb ( 384, 296) Each subspace H/S matrix 0.08 Mb ( 74, 74) Each matrix 0.39 Mb ( 172, 2, 74) The potential is recalculated from file : ./Cu2HgGeSe4.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 5.1 secs Computing kpt #: 2 total cpu time spent up to now is 6.5 secs Computing kpt #: 3 total cpu time spent up to now is 7.9 secs Computing kpt #: 4 total cpu time spent up to now is 9.3 secs Computing kpt #: 5 total cpu time spent up to now is 10.8 secs Computing kpt #: 6 total cpu time spent up to now is 12.2 secs Computing kpt #: 7 total cpu time spent up to now is 13.5 secs Computing kpt #: 8 total cpu time spent up to now is 14.9 secs Computing kpt #: 9 total cpu time spent up to now is 16.4 secs Computing kpt #: 10 total cpu time spent up to now is 17.8 secs Computing kpt #: 11 total cpu time spent up to now is 19.3 secs Computing kpt #: 12 total cpu time spent up to now is 20.7 secs Computing kpt #: 13 total cpu time spent up to now is 22.2 secs Computing kpt #: 14 total cpu time spent up to now is 23.6 secs Computing kpt #: 15 total cpu time spent up to now is 25.1 secs Computing kpt #: 16 total cpu time spent up to now is 26.6 secs Computing kpt #: 17 total cpu time spent up to now is 28.0 secs Computing kpt #: 18 total cpu time spent up to now is 29.5 secs Computing kpt #: 19 total cpu time spent up to now is 31.0 secs Computing kpt #: 20 total cpu time spent up to now is 32.5 secs Computing kpt #: 21 total cpu time spent up to now is 33.9 secs Computing kpt #: 22 total cpu time spent up to now is 35.7 secs Computing kpt #: 23 total cpu time spent up to now is 37.2 secs Computing kpt #: 24 total cpu time spent up to now is 38.6 secs Computing kpt #: 25 total cpu time spent up to now is 40.1 secs Computing kpt #: 26 total cpu time spent up to now is 41.6 secs Computing kpt #: 27 total cpu time spent up to now is 43.1 secs Computing kpt #: 28 total cpu time spent up to now is 44.6 secs Computing kpt #: 29 total cpu time spent up to now is 46.1 secs Computing kpt #: 30 total cpu time spent up to now is 47.7 secs Computing kpt #: 31 total cpu time spent up to now is 49.2 secs Computing kpt #: 32 total cpu time spent up to now is 51.0 secs Computing kpt #: 33 total cpu time spent up to now is 52.7 secs Computing kpt #: 34 total cpu time spent up to now is 54.5 secs Computing kpt #: 35 total cpu time spent up to now is 56.2 secs Computing kpt #: 36 total cpu time spent up to now is 58.0 secs Computing kpt #: 37 total cpu time spent up to now is 59.7 secs Computing kpt #: 38 total cpu time spent up to now is 61.5 secs Computing kpt #: 39 total cpu time spent up to now is 63.2 secs Computing kpt #: 40 total cpu time spent up to now is 64.9 secs Computing kpt #: 41 total cpu time spent up to now is 66.6 secs Computing kpt #: 42 total cpu time spent up to now is 68.3 secs Computing kpt #: 43 total cpu time spent up to now is 70.0 secs Computing kpt #: 44 total cpu time spent up to now is 71.7 secs Computing kpt #: 45 total cpu time spent up to now is 73.5 secs Computing kpt #: 46 total cpu time spent up to now is 75.2 secs Computing kpt #: 47 total cpu time spent up to now is 76.9 secs Computing kpt #: 48 total cpu time spent up to now is 78.6 secs Computing kpt #: 49 total cpu time spent up to now is 80.3 secs Computing kpt #: 50 total cpu time spent up to now is 82.0 secs Computing kpt #: 51 total cpu time spent up to now is 83.8 secs Computing kpt #: 52 total cpu time spent up to now is 85.5 secs Computing kpt #: 53 total cpu time spent up to now is 87.3 secs Computing kpt #: 54 total cpu time spent up to now is 89.0 secs Computing kpt #: 55 total cpu time spent up to now is 90.7 secs Computing kpt #: 56 total cpu time spent up to now is 92.5 secs Computing kpt #: 57 total cpu time spent up to now is 94.3 secs Computing kpt #: 58 total cpu time spent up to now is 96.1 secs Computing kpt #: 59 total cpu time spent up to now is 97.8 secs Computing kpt #: 60 total cpu time spent up to now is 99.4 secs Computing kpt #: 61 total cpu time spent up to now is 101.1 secs Computing kpt #: 62 total cpu time spent up to now is 102.8 secs Computing kpt #: 63 total cpu time spent up to now is 104.5 secs Computing kpt #: 64 total cpu time spent up to now is 106.3 secs Computing kpt #: 65 total cpu time spent up to now is 108.0 secs Computing kpt #: 66 total cpu time spent up to now is 109.7 secs Computing kpt #: 67 total cpu time spent up to now is 111.5 secs Computing kpt #: 68 total cpu time spent up to now is 113.2 secs Computing kpt #: 69 total cpu time spent up to now is 114.9 secs Computing kpt #: 70 total cpu time spent up to now is 116.7 secs Computing kpt #: 71 total cpu time spent up to now is 118.5 secs Computing kpt #: 72 total cpu time spent up to now is 120.3 secs Computing kpt #: 73 total cpu time spent up to now is 121.9 secs Computing kpt #: 74 total cpu time spent up to now is 123.6 secs Computing kpt #: 75 total cpu time spent up to now is 125.3 secs Computing kpt #: 76 total cpu time spent up to now is 127.0 secs Computing kpt #: 77 total cpu time spent up to now is 128.7 secs Computing kpt #: 78 total cpu time spent up to now is 130.4 secs Computing kpt #: 79 total cpu time spent up to now is 132.1 secs Computing kpt #: 80 total cpu time spent up to now is 133.9 secs Computing kpt #: 81 total cpu time spent up to now is 135.6 secs Computing kpt #: 82 total cpu time spent up to now is 137.3 secs Computing kpt #: 83 total cpu time spent up to now is 138.9 secs Computing kpt #: 84 total cpu time spent up to now is 140.7 secs Computing kpt #: 85 total cpu time spent up to now is 142.3 secs Computing kpt #: 86 total cpu time spent up to now is 143.9 secs Computing kpt #: 87 total cpu time spent up to now is 145.4 secs Computing kpt #: 88 total cpu time spent up to now is 146.9 secs Computing kpt #: 89 total cpu time spent up to now is 148.4 secs Computing kpt #: 90 total cpu time spent up to now is 149.9 secs Computing kpt #: 91 total cpu time spent up to now is 151.3 secs Computing kpt #: 92 total cpu time spent up to now is 152.8 secs Computing kpt #: 93 total cpu time spent up to now is 154.2 secs Computing kpt #: 94 total cpu time spent up to now is 155.7 secs Computing kpt #: 95 total cpu time spent up to now is 157.2 secs Computing kpt #: 96 total cpu time spent up to now is 158.6 secs Computing kpt #: 97 total cpu time spent up to now is 160.1 secs Computing kpt #: 98 total cpu time spent up to now is 161.5 secs Computing kpt #: 99 total cpu time spent up to now is 163.0 secs Computing kpt #: 100 total cpu time spent up to now is 164.4 secs Computing kpt #: 101 total cpu time spent up to now is 166.4 secs Computing kpt #: 102 total cpu time spent up to now is 167.9 secs Computing kpt #: 103 total cpu time spent up to now is 169.3 secs Computing kpt #: 104 total cpu time spent up to now is 170.7 secs Computing kpt #: 105 total cpu time spent up to now is 172.1 secs Computing kpt #: 106 total cpu time spent up to now is 173.5 secs Computing kpt #: 107 total cpu time spent up to now is 174.9 secs Computing kpt #: 108 total cpu time spent up to now is 176.3 secs Computing kpt #: 109 total cpu time spent up to now is 177.7 secs Computing kpt #: 110 total cpu time spent up to now is 179.0 secs Computing kpt #: 111 total cpu time spent up to now is 180.3 secs Computing kpt #: 112 total cpu time spent up to now is 181.8 secs Computing kpt #: 113 total cpu time spent up to now is 183.2 secs Computing kpt #: 114 total cpu time spent up to now is 184.6 secs Computing kpt #: 115 total cpu time spent up to now is 186.0 secs Computing kpt #: 116 total cpu time spent up to now is 187.4 secs Computing kpt #: 117 total cpu time spent up to now is 188.9 secs Computing kpt #: 118 total cpu time spent up to now is 190.4 secs Computing kpt #: 119 total cpu time spent up to now is 191.8 secs Computing kpt #: 120 total cpu time spent up to now is 193.2 secs Computing kpt #: 121 total cpu time spent up to now is 194.7 secs Computing kpt #: 122 total cpu time spent up to now is 196.1 secs Computing kpt #: 123 total cpu time spent up to now is 197.5 secs Computing kpt #: 124 total cpu time spent up to now is 198.9 secs Computing kpt #: 125 total cpu time spent up to now is 200.3 secs Computing kpt #: 126 total cpu time spent up to now is 201.7 secs Computing kpt #: 127 total cpu time spent up to now is 203.1 secs Computing kpt #: 128 total cpu time spent up to now is 204.5 secs Computing kpt #: 129 total cpu time spent up to now is 206.0 secs Computing kpt #: 130 total cpu time spent up to now is 207.5 secs Computing kpt #: 131 total cpu time spent up to now is 208.9 secs Computing kpt #: 132 total cpu time spent up to now is 210.4 secs Computing kpt #: 133 total cpu time spent up to now is 211.9 secs Computing kpt #: 134 total cpu time spent up to now is 213.4 secs Computing kpt #: 135 total cpu time spent up to now is 215.0 secs Computing kpt #: 136 total cpu time spent up to now is 216.7 secs Computing kpt #: 137 total cpu time spent up to now is 218.5 secs Computing kpt #: 138 total cpu time spent up to now is 220.2 secs Computing kpt #: 139 total cpu time spent up to now is 221.9 secs Computing kpt #: 140 total cpu time spent up to now is 223.5 secs Computing kpt #: 141 total cpu time spent up to now is 225.3 secs Computing kpt #: 142 total cpu time spent up to now is 227.0 secs Computing kpt #: 143 total cpu time spent up to now is 228.7 secs Computing kpt #: 144 total cpu time spent up to now is 230.4 secs Computing kpt #: 145 total cpu time spent up to now is 232.2 secs Computing kpt #: 146 total cpu time spent up to now is 233.9 secs Computing kpt #: 147 total cpu time spent up to now is 235.6 secs Computing kpt #: 148 total cpu time spent up to now is 237.3 secs Computing kpt #: 149 total cpu time spent up to now is 239.1 secs Computing kpt #: 150 total cpu time spent up to now is 240.8 secs Computing kpt #: 151 total cpu time spent up to now is 242.5 secs Computing kpt #: 152 total cpu time spent up to now is 244.3 secs Computing kpt #: 153 total cpu time spent up to now is 246.1 secs Computing kpt #: 154 total cpu time spent up to now is 247.9 secs Computing kpt #: 155 total cpu time spent up to now is 249.6 secs Computing kpt #: 156 total cpu time spent up to now is 251.4 secs Computing kpt #: 157 total cpu time spent up to now is 253.3 secs Computing kpt #: 158 total cpu time spent up to now is 255.0 secs Computing kpt #: 159 total cpu time spent up to now is 257.1 secs Computing kpt #: 160 total cpu time spent up to now is 258.8 secs Computing kpt #: 161 total cpu time spent up to now is 260.5 secs Computing kpt #: 162 total cpu time spent up to now is 262.2 secs Computing kpt #: 163 total cpu time spent up to now is 263.9 secs Computing kpt #: 164 total cpu time spent up to now is 265.6 secs Computing kpt #: 165 total cpu time spent up to now is 267.3 secs Computing kpt #: 166 total cpu time spent up to now is 269.1 secs Computing kpt #: 167 total cpu time spent up to now is 271.0 secs Computing kpt #: 168 total cpu time spent up to now is 272.7 secs Computing kpt #: 169 total cpu time spent up to now is 274.5 secs Computing kpt #: 170 total cpu time spent up to now is 276.3 secs Computing kpt #: 171 total cpu time spent up to now is 278.1 secs Computing kpt #: 172 total cpu time spent up to now is 279.8 secs Computing kpt #: 173 total cpu time spent up to now is 281.6 secs Computing kpt #: 174 total cpu time spent up to now is 283.2 secs Computing kpt #: 175 total cpu time spent up to now is 284.9 secs Computing kpt #: 176 total cpu time spent up to now is 286.6 secs Computing kpt #: 177 total cpu time spent up to now is 288.3 secs Computing kpt #: 178 total cpu time spent up to now is 290.1 secs Computing kpt #: 179 total cpu time spent up to now is 291.8 secs Computing kpt #: 180 total cpu time spent up to now is 293.5 secs Computing kpt #: 181 total cpu time spent up to now is 295.0 secs Computing kpt #: 182 total cpu time spent up to now is 296.6 secs Computing kpt #: 183 total cpu time spent up to now is 298.1 secs Computing kpt #: 184 total cpu time spent up to now is 299.8 secs Computing kpt #: 185 total cpu time spent up to now is 301.4 secs Computing kpt #: 186 total cpu time spent up to now is 303.0 secs Computing kpt #: 187 total cpu time spent up to now is 304.7 secs Computing kpt #: 188 total cpu time spent up to now is 306.4 secs Computing kpt #: 189 total cpu time spent up to now is 308.1 secs Computing kpt #: 190 total cpu time spent up to now is 309.8 secs Computing kpt #: 191 total cpu time spent up to now is 311.5 secs Computing kpt #: 192 total cpu time spent up to now is 313.2 secs Computing kpt #: 193 total cpu time spent up to now is 314.9 secs Computing kpt #: 194 total cpu time spent up to now is 316.6 secs Computing kpt #: 195 total cpu time spent up to now is 318.2 secs Computing kpt #: 196 total cpu time spent up to now is 319.8 secs Computing kpt #: 197 total cpu time spent up to now is 321.4 secs Computing kpt #: 198 total cpu time spent up to now is 323.0 secs Computing kpt #: 199 total cpu time spent up to now is 324.6 secs Computing kpt #: 200 total cpu time spent up to now is 326.2 secs Computing kpt #: 201 total cpu time spent up to now is 327.8 secs Computing kpt #: 202 total cpu time spent up to now is 329.3 secs Computing kpt #: 203 total cpu time spent up to now is 330.9 secs Computing kpt #: 204 total cpu time spent up to now is 332.4 secs Computing kpt #: 205 total cpu time spent up to now is 333.9 secs Computing kpt #: 206 total cpu time spent up to now is 335.4 secs Computing kpt #: 207 total cpu time spent up to now is 336.9 secs Computing kpt #: 208 total cpu time spent up to now is 338.5 secs Computing kpt #: 209 total cpu time spent up to now is 340.1 secs Computing kpt #: 210 total cpu time spent up to now is 341.6 secs Computing kpt #: 211 total cpu time spent up to now is 343.2 secs Computing kpt #: 212 total cpu time spent up to now is 344.8 secs Computing kpt #: 213 total cpu time spent up to now is 346.3 secs Computing kpt #: 214 total cpu time spent up to now is 347.9 secs Computing kpt #: 215 total cpu time spent up to now is 349.5 secs Computing kpt #: 216 total cpu time spent up to now is 351.2 secs Computing kpt #: 217 total cpu time spent up to now is 352.9 secs Computing kpt #: 218 total cpu time spent up to now is 354.6 secs Computing kpt #: 219 total cpu time spent up to now is 356.3 secs Computing kpt #: 220 total cpu time spent up to now is 358.0 secs Computing kpt #: 221 total cpu time spent up to now is 359.8 secs Computing kpt #: 222 total cpu time spent up to now is 361.4 secs Computing kpt #: 223 total cpu time spent up to now is 363.2 secs Computing kpt #: 224 total cpu time spent up to now is 365.0 secs Computing kpt #: 225 total cpu time spent up to now is 366.7 secs Computing kpt #: 226 total cpu time spent up to now is 368.5 secs Computing kpt #: 227 total cpu time spent up to now is 370.2 secs Computing kpt #: 228 total cpu time spent up to now is 371.9 secs Computing kpt #: 229 total cpu time spent up to now is 373.5 secs Computing kpt #: 230 total cpu time spent up to now is 375.1 secs Computing kpt #: 231 total cpu time spent up to now is 376.6 secs Computing kpt #: 232 total cpu time spent up to now is 378.1 secs Computing kpt #: 233 total cpu time spent up to now is 379.5 secs Computing kpt #: 234 total cpu time spent up to now is 381.0 secs Computing kpt #: 235 total cpu time spent up to now is 382.5 secs Computing kpt #: 236 total cpu time spent up to now is 383.9 secs Computing kpt #: 237 total cpu time spent up to now is 385.4 secs Computing kpt #: 238 total cpu time spent up to now is 386.9 secs Computing kpt #: 239 total cpu time spent up to now is 388.3 secs Computing kpt #: 240 total cpu time spent up to now is 389.8 secs Computing kpt #: 241 total cpu time spent up to now is 391.3 secs Computing kpt #: 242 total cpu time spent up to now is 392.7 secs Computing kpt #: 243 total cpu time spent up to now is 394.2 secs Computing kpt #: 244 total cpu time spent up to now is 395.8 secs Computing kpt #: 245 total cpu time spent up to now is 397.2 secs Computing kpt #: 246 total cpu time spent up to now is 398.9 secs Computing kpt #: 247 total cpu time spent up to now is 400.6 secs Computing kpt #: 248 total cpu time spent up to now is 402.4 secs Computing kpt #: 249 total cpu time spent up to now is 404.6 secs Computing kpt #: 250 total cpu time spent up to now is 406.4 secs Computing kpt #: 251 total cpu time spent up to now is 408.1 secs Computing kpt #: 252 total cpu time spent up to now is 409.8 secs Computing kpt #: 253 total cpu time spent up to now is 411.6 secs Computing kpt #: 254 total cpu time spent up to now is 413.3 secs Computing kpt #: 255 total cpu time spent up to now is 415.0 secs Computing kpt #: 256 total cpu time spent up to now is 416.8 secs Computing kpt #: 257 total cpu time spent up to now is 418.4 secs Computing kpt #: 258 total cpu time spent up to now is 420.2 secs Computing kpt #: 259 total cpu time spent up to now is 422.0 secs Computing kpt #: 260 total cpu time spent up to now is 423.8 secs Computing kpt #: 261 total cpu time spent up to now is 425.4 secs Computing kpt #: 262 total cpu time spent up to now is 427.2 secs Computing kpt #: 263 total cpu time spent up to now is 428.9 secs Computing kpt #: 264 total cpu time spent up to now is 430.6 secs Computing kpt #: 265 total cpu time spent up to now is 432.3 secs Computing kpt #: 266 total cpu time spent up to now is 433.9 secs Computing kpt #: 267 total cpu time spent up to now is 435.4 secs Computing kpt #: 268 total cpu time spent up to now is 436.9 secs Computing kpt #: 269 total cpu time spent up to now is 438.5 secs Computing kpt #: 270 total cpu time spent up to now is 440.0 secs Computing kpt #: 271 total cpu time spent up to now is 441.6 secs ethr = 1.61E-08, avg # of iterations = 20.6 total cpu time spent up to now is 441.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6491 PWs) bands (ev): -7.9572 -7.9572 -6.5092 -6.5092 -6.4824 -6.4824 -6.4715 -6.4715 -2.2011 -2.2011 -1.2254 -1.2254 -1.1643 -1.1643 0.2986 0.2986 0.4501 0.4501 0.5051 0.5051 1.2835 1.2835 1.7273 1.7273 1.9297 1.9297 2.2038 2.2038 2.2065 2.2065 3.0907 3.0907 3.3581 3.3581 3.3622 3.3622 3.6105 3.6105 4.2371 4.2371 4.2934 4.2934 4.6873 4.6873 4.7404 4.7404 4.7710 4.7710 4.8603 4.8603 4.9662 4.9662 5.1005 5.1005 5.2522 5.2522 6.5133 6.5133 6.7232 6.7232 6.8708 6.8708 6.8795 6.8795 8.7016 8.7016 9.0844 9.0844 9.9549 9.9549 10.2502 10.2502 10.3723 10.3723 k = 0.0000 0.0000 0.0217 ( 6481 PWs) bands (ev): -7.9566 -7.9565 -6.5098 -6.5094 -6.4828 -6.4826 -6.4720 -6.4719 -2.2037 -2.1977 -1.2270 -1.2240 -1.1723 -1.1554 0.2894 0.3077 0.4446 0.4540 0.4948 0.5175 1.2813 1.2866 1.7240 1.7290 1.9120 1.9376 2.1954 2.2025 2.2105 2.2262 3.0889 3.0917 3.3569 3.3582 3.3591 3.3648 3.6100 3.6121 4.2280 4.2359 4.2820 4.2965 4.6853 4.6918 4.7377 4.7477 4.7705 4.7745 4.8581 4.8633 4.9620 4.9721 5.0965 5.1063 5.2530 5.2551 6.4941 6.4952 6.7274 6.7317 6.8740 6.8751 6.8817 6.8897 8.7023 8.7097 9.0821 9.0868 9.9541 9.9561 10.2515 10.2520 10.3724 10.3743 k = 0.0000 0.0000 0.0434 ( 6469 PWs) bands (ev): -7.9546 -7.9546 -6.5110 -6.5104 -6.4838 -6.4835 -6.4732 -6.4730 -2.2055 -2.1935 -1.2291 -1.2229 -1.1794 -1.1459 0.2803 0.3166 0.4383 0.4541 0.4890 0.5308 1.2803 1.2904 1.7193 1.7294 1.8877 1.9337 2.1971 2.2043 2.2204 2.2538 3.0864 3.0917 3.3524 3.3560 3.3578 3.3681 3.6108 3.6148 4.2091 4.2193 4.2696 4.2913 4.6841 4.6997 4.7397 4.7563 4.7756 4.7799 4.8567 4.8669 4.9592 4.9795 5.0942 5.1137 5.2572 5.2616 6.4477 6.4500 6.7353 6.7416 6.8667 6.8726 6.9152 6.9252 8.7120 8.7263 9.0795 9.0894 9.9541 9.9586 10.2549 10.2566 10.3747 10.3788 k = 0.0000 0.0000 0.0651 ( 6473 PWs) bands (ev): -7.9514 -7.9513 -6.5131 -6.5124 -6.4852 -6.4850 -6.4752 -6.4748 -2.2065 -2.1886 -1.2316 -1.2219 -1.1853 -1.1361 0.2714 0.3252 0.4317 0.4494 0.4887 0.5441 1.2803 1.2944 1.7140 1.7292 1.8594 1.9186 2.2089 2.2090 2.2347 2.2860 3.0833 3.0909 3.3443 3.3512 3.3586 3.3724 3.6127 3.6185 4.1790 4.1855 4.2614 4.2813 4.6827 4.7100 4.7461 4.7617 4.7867 4.7890 4.8563 4.8712 4.9578 4.9882 5.0936 5.1226 5.2651 5.2716 6.3885 6.3920 6.7369 6.7428 6.8561 6.8657 6.9687 6.9795 8.7303 8.7506 9.0763 9.0920 9.9558 9.9640 10.2587 10.2626 10.3797 10.3862 k = 0.0000 0.0000 0.0867 ( 6479 PWs) bands (ev): -7.9469 -7.9467 -6.5160 -6.5155 -6.4870 -6.4870 -6.4778 -6.4773 -2.2067 -2.1830 -1.2346 -1.2211 -1.1899 -1.1262 0.2628 0.3336 0.4252 0.4417 0.4922 0.5568 1.2812 1.2980 1.7092 1.7296 1.8287 1.8954 2.2156 2.2261 2.2545 2.3213 3.0800 3.0893 3.3336 3.3438 3.3605 3.3775 3.6156 3.6229 4.1383 4.1404 4.2548 4.2697 4.6807 4.7210 4.7561 4.7656 4.7948 4.8064 4.8571 4.8761 4.9579 4.9984 5.0949 5.1331 5.2769 5.2854 6.3236 6.3281 6.7305 6.7352 6.8432 6.8562 7.0337 7.0447 8.7566 8.7815 9.0722 9.0947 9.9611 9.9744 10.2610 10.2680 10.3880 10.3967 k = 0.0000 0.0000 0.1084 ( 6483 PWs) bands (ev): -7.9411 -7.9409 -6.5200 -6.5198 -6.4894 -6.4891 -6.4810 -6.4803 -2.2060 -2.1768 -1.2379 -1.2204 -1.1934 -1.1162 0.2547 0.3417 0.4187 0.4333 0.4972 0.5683 1.2826 1.3007 1.7063 1.7317 1.7967 1.8668 2.2234 2.2433 2.2810 2.3585 3.0766 3.0872 3.3206 3.3343 3.3632 3.3831 3.6196 3.6278 4.0889 4.0893 4.2478 4.2576 4.6782 4.7313 4.7686 4.7696 4.8040 4.8242 4.8591 4.8816 4.9594 5.0100 5.0981 5.1448 5.2928 5.3030 6.2563 6.2616 6.7168 6.7198 6.8293 6.8452 7.1048 7.1160 8.7897 8.8172 9.0672 9.0975 9.9719 9.9913 10.2609 10.2712 10.3998 10.4101 k = 0.0000 0.0000 0.1301 ( 6495 PWs) bands (ev): -7.9341 -7.9338 -6.5254 -6.5251 -6.4923 -6.4915 -6.4845 -6.4834 -2.2044 -2.1699 -1.2414 -1.2197 -1.1958 -1.1065 0.2473 0.3494 0.4125 0.4253 0.5026 0.5780 1.2839 1.3017 1.7066 1.7368 1.7641 1.8352 2.2310 2.2583 2.3132 2.3972 3.0733 3.0848 3.3054 3.3228 3.3667 3.3889 3.6243 3.6328 4.0344 4.0352 4.2400 4.2454 4.6755 4.7404 4.7736 4.7821 4.8141 4.8405 4.8628 4.8876 4.9627 5.0230 5.1032 5.1577 5.3128 5.3245 6.1881 6.1941 6.6960 6.6970 6.8156 6.8337 7.1788 7.1904 8.8278 8.8554 9.0618 9.1013 9.9898 10.0164 10.2577 10.2712 10.4147 10.4255 k = 0.0000 0.0000 0.1518 ( 6507 PWs) bands (ev): -7.9259 -7.9255 -6.5324 -6.5315 -6.4958 -6.4947 -6.4881 -6.4864 -2.2021 -2.1624 -1.2447 -1.2191 -1.1973 -1.0971 0.2406 0.3566 0.4066 0.4178 0.5079 0.5855 1.2842 1.3004 1.7099 1.7333 1.7453 1.8026 2.2375 2.2705 2.3492 2.4369 3.0705 3.0824 3.2880 3.3095 3.3707 3.3948 3.6297 3.6375 3.9787 3.9794 4.2315 4.2330 4.6726 4.7483 4.7776 4.7954 4.8249 4.8536 4.8688 4.8937 4.9681 5.0376 5.1101 5.1713 5.3374 5.3499 6.1198 6.1264 6.6670 6.6681 6.8024 6.8222 7.2538 7.2658 8.8676 8.8925 9.0584 9.1083 10.0159 10.0503 10.2518 10.2681 10.4315 10.4418 k = 0.0000 0.0000 0.1735 ( 6513 PWs) bands (ev): -7.9165 -7.9161 -6.5406 -6.5391 -6.5002 -6.4989 -6.4915 -6.4890 -2.1988 -2.1544 -1.2478 -1.2185 -1.1981 -1.0883 0.2349 0.3633 0.4013 0.4110 0.5131 0.5906 1.2829 1.2962 1.6927 1.7293 1.7496 1.7784 2.2420 2.2796 2.3876 2.4773 3.0682 3.0800 3.2687 3.2945 3.3751 3.4006 3.6355 3.6409 3.9226 3.9268 4.2204 4.2225 4.6697 4.7549 4.7814 4.8082 4.8359 4.8627 4.8779 4.8996 4.9765 5.0537 5.1187 5.1853 5.3662 5.3791 6.0522 6.0593 6.6305 6.6338 6.7899 6.8110 7.3286 7.3410 8.9021 8.9230 9.0631 9.1227 10.0506 10.0933 10.2432 10.2623 10.4491 10.4581 k = 0.0000 0.0000 0.1952 ( 6505 PWs) bands (ev): -7.9059 -7.9054 -6.5500 -6.5478 -6.5054 -6.5041 -6.4945 -6.4911 -2.1948 -2.1458 -1.2504 -1.2179 -1.1984 -1.0802 0.2302 0.3688 0.3970 0.4051 0.5180 0.5930 1.2791 1.2890 1.6602 1.7235 1.7480 1.7899 2.2437 2.2847 2.4277 2.5182 3.0667 3.0780 3.2473 3.2775 3.3797 3.4062 3.6409 3.6416 3.8694 3.8797 4.2078 4.2130 4.6668 4.7601 4.7852 4.8207 4.8462 4.8695 4.8880 4.9049 4.9888 5.0718 5.1285 5.1997 5.3994 5.4119 5.9857 5.9933 6.5883 6.5936 6.7776 6.7998 7.4023 7.4149 8.9206 8.9411 9.0857 9.1494 10.0936 10.1451 10.2323 10.2542 10.4665 10.4734 k = 0.0000 0.0000 0.2168 ( 6505 PWs) bands (ev): -7.8943 -7.8937 -6.5603 -6.5576 -6.5113 -6.5100 -6.4972 -6.4931 -2.1900 -2.1369 -1.2525 -1.2174 -1.1983 -1.0729 0.2265 0.3721 0.3948 0.3998 0.5224 0.5927 1.2725 1.2788 1.6267 1.6882 1.7759 1.8162 2.2421 2.2855 2.4690 2.5594 3.0659 3.0764 3.2239 3.2584 3.3843 3.4115 3.6375 3.6448 3.8222 3.8420 4.1952 4.2032 4.6640 4.7640 4.7888 4.8329 4.8551 4.8757 4.8973 4.9096 5.0054 5.0917 5.1395 5.2142 5.4364 5.4481 5.9207 5.9288 6.5412 6.5482 6.7652 6.7885 7.4740 7.4864 8.9193 8.9448 9.1297 9.1898 10.1431 10.2040 10.2202 10.2450 10.4830 10.4874 k = 0.0000 0.0000 0.2385 ( 6503 PWs) bands (ev): -7.8816 -7.8809 -6.5715 -6.5683 -6.5179 -6.5165 -6.5000 -6.4951 -2.1843 -2.1275 -1.2540 -1.2169 -1.1978 -1.0666 0.2238 0.3720 0.3953 0.3961 0.5264 0.5898 1.2627 1.2657 1.5931 1.6515 1.8120 1.8497 2.2369 2.2815 2.5112 2.6006 3.0658 3.0749 3.1984 3.2367 3.3888 3.4164 3.6268 3.6447 3.7848 3.8171 4.1828 4.1933 4.6613 4.7666 4.7922 4.8448 4.8620 4.8819 4.9054 4.9144 5.0263 5.1136 5.1513 5.2289 5.4768 5.4873 5.8577 5.8662 6.4900 6.4984 6.7524 6.7768 7.5432 7.5551 8.9046 8.9369 9.1878 9.2407 10.1916 10.2035 10.2409 10.2722 10.4982 10.4994 k = 0.0000 0.0000 0.2602 ( 6505 PWs) bands (ev): -7.8679 -7.8671 -6.5833 -6.5798 -6.5249 -6.5235 -6.5028 -6.4973 -2.1779 -2.1177 -1.2550 -1.2165 -1.1971 -1.0612 0.2223 0.3690 0.3915 0.4000 0.5300 0.5847 1.2499 1.2500 1.5596 1.6144 1.8559 1.8892 2.2280 2.2726 2.5539 2.6418 3.0663 3.0729 3.1714 3.2118 3.3931 3.4209 3.6102 3.6375 3.7617 3.8059 4.1704 4.1832 4.6587 4.7681 4.7957 4.8557 4.8674 4.8884 4.9122 4.9201 5.0512 5.1376 5.1636 5.2437 5.5202 5.5288 5.7970 5.8062 6.4353 6.4448 6.7390 6.7646 7.6093 7.6202 8.8822 8.9208 9.2538 9.2983 10.1863 10.2033 10.2760 10.3440 10.5095 10.5119 k = 0.0000 0.0000 0.2819 ( 6497 PWs) bands (ev): -7.8533 -7.8524 -6.5957 -6.5919 -6.5323 -6.5308 -6.5057 -6.4996 -2.1708 -2.1076 -1.2553 -1.2160 -1.1961 -1.0570 0.2217 0.3647 0.3882 0.4052 0.5332 0.5777 1.2321 1.2340 1.5264 1.5772 1.9066 1.9339 2.2160 2.2593 2.5969 2.6826 3.0668 3.0682 3.1449 3.1839 3.3972 3.4251 3.5913 3.6225 3.7543 3.8058 4.1583 4.1732 4.6562 4.7688 4.7990 4.8620 4.8745 4.8953 4.9178 4.9271 5.0799 5.1634 5.1764 5.2589 5.5660 5.5718 5.7391 5.7496 6.3779 6.3882 6.7249 6.7516 7.6719 7.6815 8.8548 8.8990 9.3243 9.3601 10.1671 10.1899 10.3365 10.4193 10.5175 10.5242 k = 0.0000 0.0000 0.3036 ( 6485 PWs) bands (ev): -7.8378 -7.8368 -6.6086 -6.6044 -6.5401 -6.5386 -6.5089 -6.5023 -2.1630 -2.0973 -1.2551 -1.2156 -1.1949 -1.0538 0.2222 0.3597 0.3855 0.4107 0.5360 0.5691 1.2121 1.2153 1.4935 1.5400 1.9633 1.9832 2.2014 2.2421 2.6401 2.7229 3.0554 3.0658 3.1244 3.1542 3.4010 3.4288 3.5740 3.6044 3.7583 3.8134 4.1464 4.1632 4.6539 4.7688 4.8023 4.8626 4.8849 4.9029 4.9222 4.9354 5.1121 5.1895 5.1907 5.2749 5.6123 5.6131 5.6849 5.7002 6.3184 6.3293 6.7101 6.7379 7.7308 7.7386 8.8237 8.8727 9.3973 9.4244 10.1457 10.1714 10.4000 10.4959 10.5238 10.5355 k = 0.0000 0.0000 0.3253 ( 6477 PWs) bands (ev): -7.8215 -7.8204 -6.6216 -6.6173 -6.5481 -6.5466 -6.5124 -6.5053 -2.1546 -2.0867 -1.2544 -1.2152 -1.1936 -1.0518 0.2237 0.3544 0.3834 0.4164 0.5385 0.5596 1.1903 1.1937 1.4610 1.5030 2.0244 2.0357 2.1854 2.2224 2.6831 2.7623 3.0293 3.0587 3.1155 3.1277 3.4045 3.4322 3.5606 3.5877 3.7691 3.8262 4.1348 4.1533 4.6518 4.7683 4.8055 4.8605 4.8958 4.9113 4.9255 4.9451 5.1474 5.2028 5.2184 5.2925 5.6200 5.6279 5.6677 5.6882 6.2573 6.2686 6.6944 6.7233 7.7857 7.7915 8.7891 8.8424 9.4716 9.4902 10.1222 10.1500 10.4607 10.5278 10.5476 10.5726 k = 0.0000 0.0000 0.3469 ( 6477 PWs) bands (ev): -7.8046 -7.8032 -6.6349 -6.6304 -6.5563 -6.5548 -6.5162 -6.5086 -2.1455 -2.0759 -1.2533 -1.2148 -1.1921 -1.0509 0.2260 0.3487 0.3816 0.4219 0.5407 0.5495 1.1668 1.1693 1.4291 1.4663 2.0867 2.0887 2.1715 2.2029 2.7258 2.8001 2.9935 3.0370 3.1137 3.1153 3.4079 3.4352 3.5519 3.5745 3.7838 3.8425 4.1236 4.1435 4.6500 4.7674 4.8084 4.8571 4.9061 4.9206 4.9277 4.9561 5.1847 5.2168 5.2447 5.3134 5.5813 5.5820 5.7160 5.7272 6.1954 6.2069 6.6778 6.7077 7.8365 7.8400 8.7513 8.8086 9.5464 9.5568 10.0964 10.1260 10.5101 10.5310 10.5679 10.6463 k = 0.0000 0.0000 0.3686 ( 6473 PWs) bands (ev): -7.7870 -7.7855 -6.6481 -6.6435 -6.5647 -6.5632 -6.5204 -6.5125 -2.1358 -2.0650 -1.2518 -1.2145 -1.1905 -1.0510 0.2291 0.3427 0.3803 0.4273 0.5393 0.5426 1.1415 1.1423 1.3976 1.4299 2.1265 2.1297 2.1832 2.1963 2.7680 2.8344 2.9547 3.0016 3.1123 3.1195 3.4110 3.4379 3.5474 3.5654 3.8011 3.8612 4.1127 4.1338 4.6486 4.7662 4.8112 4.8529 4.9155 4.9290 4.9310 4.9684 5.2169 5.2384 5.2670 5.3397 5.5383 5.5385 5.7669 5.7748 6.1333 6.1449 6.6604 6.6913 7.8829 7.8840 8.7100 8.7710 9.6210 9.6236 10.0682 10.0994 10.5334 10.5348 10.6088 10.7163 k = 0.0000 0.0000 0.3903 ( 6475 PWs) bands (ev): -7.7689 -7.7672 -6.6611 -6.6565 -6.5732 -6.5717 -6.5250 -6.5167 -2.1257 -2.0540 -1.2501 -1.2142 -1.1888 -1.0523 0.2329 0.3363 0.3792 0.4324 0.5296 0.5443 1.1126 1.1147 1.3666 1.3941 2.1199 2.1290 2.2325 2.2442 2.8093 2.8553 2.9252 2.9606 3.1168 3.1264 3.4141 3.4403 3.5468 3.5602 3.8202 3.8819 4.1023 4.1243 4.6477 4.7649 4.8136 4.8483 4.9237 4.9293 4.9426 4.9820 5.2325 5.2782 5.2835 5.3719 5.4987 5.4998 5.8182 5.8243 6.0716 6.0833 6.6422 6.6740 7.9235 7.9248 8.6653 8.7297 9.6904 9.6951 10.0376 10.0700 10.5354 10.5452 10.6603 10.7819 k = 0.0000 0.0000 0.4120 ( 6475 PWs) bands (ev): -7.7503 -7.7485 -6.6739 -6.6693 -6.5817 -6.5802 -6.5300 -6.5215 -2.1150 -2.0430 -1.2481 -1.2139 -1.1870 -1.0545 0.2373 0.3294 0.3784 0.4371 0.5207 0.5459 1.0805 1.0864 1.3363 1.3588 2.1057 2.1094 2.2878 2.3153 2.8364 2.8495 2.9186 2.9328 3.1242 3.1349 3.4171 3.4425 3.5494 3.5587 3.8405 3.9037 4.0923 4.1151 4.6476 4.7635 4.8158 4.8435 4.9287 4.9306 4.9554 4.9968 5.2419 5.2939 5.3248 5.4061 5.4640 5.4711 5.8694 5.8741 6.0110 6.0228 6.6232 6.6558 7.9584 7.9620 8.6170 8.6846 9.7567 9.7682 10.0044 10.0376 10.5378 10.5519 10.7125 10.8431 k = 0.0000 0.0000 0.4337 ( 6483 PWs) bands (ev): -7.7315 -7.7295 -6.6863 -6.6817 -6.5902 -6.5887 -6.5355 -6.5268 -2.1040 -2.0319 -1.2461 -1.2137 -1.1852 -1.0576 0.2423 0.3221 0.3777 0.4414 0.5131 0.5475 1.0463 1.0565 1.3066 1.3243 2.0879 2.0921 2.3443 2.3871 2.7958 2.8750 2.8921 2.9607 3.1333 3.1449 3.4203 3.4445 3.5548 3.5605 3.8616 3.9263 4.0828 4.1061 4.6482 4.7622 4.8177 4.8385 4.9273 4.9365 4.9693 5.0125 5.2473 5.2974 5.3728 5.4199 5.4374 5.4747 5.9192 5.9238 5.9522 5.9650 6.6034 6.6368 7.9882 7.9940 8.5655 8.6357 9.8225 9.8398 9.9688 10.0022 10.5408 10.5579 10.7635 10.9006 k = 0.0000 0.0000 0.4554 ( 6489 PWs) bands (ev): -7.7125 -7.7103 -6.6981 -6.6937 -6.5986 -6.5972 -6.5416 -6.5327 -2.0926 -2.0210 -1.2439 -1.2135 -1.1833 -1.0615 0.2476 0.3143 0.3769 0.4451 0.5071 0.5489 1.0103 1.0253 1.2776 1.2907 2.0676 2.0806 2.3962 2.4561 2.7529 2.8417 2.9278 2.9911 3.1436 3.1559 3.4235 3.4464 3.5628 3.5656 3.8830 3.9491 4.0740 4.0974 4.6499 4.7611 4.8194 4.8336 4.9250 4.9414 4.9845 5.0288 5.2479 5.2928 5.4007 5.4102 5.4415 5.5151 5.8958 5.9061 5.9716 5.9729 6.5830 6.6171 8.0122 8.0201 8.5113 8.5835 9.8872 9.9030 9.9375 9.9638 10.5450 10.5641 10.8134 10.9552 k = 0.0000 0.0000 0.4770 ( 6483 PWs) bands (ev): -7.6934 -7.6910 -6.7093 -6.7050 -6.6069 -6.6055 -6.5481 -6.5392 -2.0809 -2.0102 -1.2418 -1.2133 -1.1813 -1.0660 0.2533 0.3061 0.3761 0.4482 0.5028 0.5504 0.9729 0.9929 1.2494 1.2581 2.0499 2.0718 2.4383 2.5165 2.7158 2.8155 2.9640 3.0209 3.1549 3.1680 3.4269 3.4481 3.5734 3.5742 3.9045 3.9716 4.0659 4.0892 4.6529 4.7603 4.8211 4.8290 4.9220 4.9453 5.0007 5.0454 5.2429 5.2802 5.3936 5.4040 5.4917 5.5647 5.8425 5.8535 6.0198 6.0209 6.5621 6.5968 8.0289 8.0389 8.4561 8.5292 9.8819 9.9180 9.9551 9.9864 10.5505 10.5713 10.8629 11.0080 k = 0.0000 0.0000 0.4987 ( 6484 PWs) bands (ev): -7.6743 -7.6718 -6.7197 -6.7155 -6.6151 -6.6137 -6.5552 -6.5462 -2.0690 -1.9996 -1.2398 -1.2132 -1.1794 -1.0712 0.2593 0.2976 0.3750 0.4506 0.5002 0.5518 0.9347 0.9596 1.2220 1.2267 2.0353 2.0659 2.4647 2.5528 2.6994 2.8033 2.9987 3.0490 3.1669 3.1808 3.4305 3.4499 3.5865 3.5869 3.9254 3.9931 4.0588 4.0817 4.6573 4.7600 4.8228 4.8245 4.9186 4.9486 5.0179 5.0617 5.2331 5.2621 5.3891 5.4034 5.5494 5.6182 5.7931 5.8044 6.0669 6.0677 6.5408 6.5759 8.0354 8.0481 8.4028 8.4751 9.8370 9.8734 10.0177 10.0552 10.5574 10.5795 10.9124 11.0598 k = 0.0000 0.0000 0.5204 ( 6476 PWs) bands (ev): -7.6554 -7.6528 -6.7292 -6.7251 -6.6230 -6.6217 -6.5629 -6.5538 -2.0569 -1.9893 -1.2379 -1.2131 -1.1774 -1.0768 0.2656 0.2891 0.3735 0.4525 0.4993 0.5532 0.8962 0.9258 1.1956 1.1967 2.0242 2.0628 2.4713 2.5466 2.7213 2.8079 3.0316 3.0751 3.1795 3.1942 3.4343 3.4516 3.6030 3.6035 3.9451 4.0127 4.0531 4.0757 4.6633 4.7603 4.8202 4.8244 4.9151 4.9513 5.0358 5.0771 5.2210 5.2418 5.3894 5.4056 5.6098 5.6745 5.7486 5.7601 6.1123 6.1128 6.5192 6.5547 8.0272 8.0441 8.3564 8.4251 9.7877 9.8237 10.0816 10.1245 10.5656 10.5890 10.9625 11.1108 k = 0.0000 0.0000 0.5421 ( 6496 PWs) bands (ev): -7.6369 -7.6341 -6.7376 -6.7337 -6.6306 -6.6293 -6.5711 -6.5620 -2.0448 -1.9793 -1.2362 -1.2132 -1.1754 -1.0827 0.2720 0.2806 0.3715 0.4541 0.4996 0.5546 0.8579 0.8918 1.1681 1.1702 2.0167 2.0624 2.4598 2.5145 2.7637 2.8266 3.0625 3.0990 3.1925 3.2080 3.4384 3.4534 3.6237 3.6241 3.9627 4.0281 4.0496 4.0727 4.6708 4.7611 4.8163 4.8260 4.9119 4.9535 5.0543 5.0905 5.2095 5.2211 5.3925 5.4087 5.6691 5.7123 5.7188 5.7350 6.1555 6.1560 6.4977 6.5335 7.9992 8.0220 8.3225 8.3843 9.7349 9.7701 10.1458 10.1938 10.5751 10.5996 11.0132 11.1613 k = 0.0000 0.0000 0.5638 ( 6492 PWs) bands (ev): -7.6189 -7.6160 -6.7450 -6.7412 -6.6379 -6.6367 -6.5798 -6.5708 -2.0327 -1.9697 -1.2347 -1.2133 -1.1734 -1.0889 0.2724 0.2786 0.3688 0.4556 0.5006 0.5558 0.8205 0.8581 1.1411 1.1459 2.0128 2.0646 2.4364 2.4750 2.8073 2.8524 3.0915 3.1208 3.2057 3.2220 3.4426 3.4553 3.6479 3.6501 3.9766 4.0356 4.0497 4.0765 4.6797 4.7625 4.8127 4.8274 4.9100 4.9558 5.0733 5.1004 5.2009 5.2018 5.3967 5.4116 5.6705 5.6869 5.7413 5.7936 6.1963 6.1970 6.4765 6.5124 7.9494 7.9787 8.3035 8.3567 9.6789 9.7131 10.2103 10.2633 10.5856 10.6112 11.0642 11.2108 k = 0.0000 0.0000 0.5855 ( 6492 PWs) bands (ev): -7.6014 -7.5984 -6.7511 -6.7475 -6.6448 -6.6437 -6.5890 -6.5802 -2.0207 -1.9606 -1.2334 -1.2135 -1.1715 -1.0952 0.2647 0.2853 0.3652 0.4572 0.5019 0.5570 0.7846 0.8252 1.1159 1.1228 2.0124 2.0689 2.4065 2.4343 2.8455 2.8790 3.1182 3.1405 3.2188 3.2358 3.4471 3.4573 3.6761 3.6808 3.9855 4.0350 4.0547 4.0870 4.6896 4.7642 4.8096 4.8282 4.9104 4.9585 5.0924 5.1048 5.1820 5.2001 5.4009 5.4137 5.6447 5.6600 5.8048 5.8545 6.2343 6.2353 6.4561 6.4920 7.8814 7.9152 8.2968 8.3419 9.6202 9.6530 10.2756 10.3332 10.5969 10.6235 11.1150 11.2587 k = 0.0000 0.0000 0.6071 ( 6492 PWs) bands (ev): -7.5847 -7.5817 -6.7560 -6.7525 -6.6514 -6.6504 -6.5987 -6.5901 -2.0089 -1.9521 -1.2323 -1.2139 -1.1695 -1.1014 0.2577 0.2921 0.3608 0.4591 0.5030 0.5578 0.7508 0.7938 1.0924 1.1010 2.0152 2.0751 2.3740 2.3944 2.8761 2.9027 3.1426 3.1582 3.2318 3.2492 3.4517 3.4594 3.7079 3.7154 3.9892 4.0308 4.0647 4.0995 4.7001 4.7660 4.8069 4.8279 4.9146 4.9622 5.1037 5.1110 5.1650 5.2051 5.4044 5.4148 5.6247 5.6394 5.8696 5.9156 6.2690 6.2706 6.4371 6.4729 7.8007 7.8362 8.2977 8.3364 9.5592 9.5905 10.3416 10.4036 10.6089 10.6363 11.1646 11.3038 k = 0.0000 0.0000 0.6288 ( 6484 PWs) bands (ev): -7.5690 -7.5660 -6.7595 -6.7561 -6.6575 -6.6565 -6.6089 -6.6005 -1.9974 -1.9443 -1.2313 -1.2143 -1.1676 -1.1075 0.2515 0.2992 0.3552 0.4612 0.5033 0.5583 0.7198 0.7642 1.0709 1.0807 2.0209 2.0827 2.3410 2.3563 2.8989 2.9215 3.1644 3.1741 3.2443 3.2617 3.4564 3.4618 3.7426 3.7526 3.9895 4.0255 4.0778 4.1117 4.7102 4.7674 4.8049 4.8262 4.9236 4.9676 5.0989 5.1255 5.1536 5.2147 5.4071 5.4154 5.6114 5.6248 5.9336 5.9757 6.2997 6.3020 6.4207 6.4561 7.7120 7.7468 8.3027 8.3364 9.4968 9.5263 10.4085 10.4742 10.6215 10.6495 11.2115 11.3449 k = 0.0000 0.0000 0.6505 ( 6488 PWs) bands (ev): -7.5542 -7.5513 -6.7616 -6.7583 -6.6631 -6.6622 -6.6195 -6.6113 -1.9862 -1.9372 -1.2306 -1.2150 -1.1657 -1.1134 0.2463 0.3063 0.3486 0.4634 0.5024 0.5583 0.6924 0.7370 1.0513 1.0618 2.0290 2.0913 2.3089 2.3205 2.9145 2.9349 3.1836 3.1882 3.2561 3.2731 3.4611 3.4644 3.7789 3.7908 3.9882 4.0202 4.0922 4.1226 4.7193 4.7679 4.8033 4.8230 4.9377 4.9752 5.0926 5.1228 5.1609 5.2269 5.4095 5.4159 5.6046 5.6157 5.9955 6.0336 6.3254 6.3278 6.4093 6.4433 7.6186 7.6510 8.3097 8.3393 9.4340 9.4615 10.4758 10.5442 10.6354 10.6633 11.2541 11.3803 k = 0.0000 0.0000 0.6722 ( 6482 PWs) bands (ev): -7.5407 -7.5379 -6.7622 -6.7589 -6.6682 -6.6675 -6.6304 -6.6224 -1.9756 -1.9309 -1.2300 -1.2157 -1.1639 -1.1189 0.2422 0.3136 0.3410 0.4654 0.5001 0.5575 0.6692 0.7127 1.0338 1.0444 2.0392 2.1004 2.2787 2.2875 2.9240 2.9432 3.2000 3.2008 3.2672 3.2833 3.4658 3.4672 3.8153 3.8280 3.9865 4.0152 4.1068 4.1320 4.7270 4.7673 4.8022 4.8189 4.9563 4.9850 5.0862 5.1109 5.1792 5.2399 5.4124 5.4172 5.6035 5.6113 6.0537 6.0875 6.3444 6.3446 6.4072 6.4368 7.5232 7.5520 8.3175 8.3434 9.3719 9.3972 10.5425 10.6083 10.6554 10.6784 11.2904 11.3948 k = 0.0000 0.0000 0.6939 ( 6494 PWs) bands (ev): -7.5284 -7.5258 -6.7614 -6.7581 -6.6727 -6.6721 -6.6415 -6.6339 -1.9654 -1.9256 -1.2295 -1.2167 -1.1621 -1.1241 0.2394 0.3204 0.3332 0.4661 0.4968 0.5559 0.6509 0.6914 1.0183 1.0287 2.0509 2.1095 2.2510 2.2575 2.9287 2.9470 3.2119 3.2137 3.2773 3.2920 3.4701 3.4702 3.8500 3.8624 3.9852 4.0108 4.1206 4.1399 4.7328 4.7656 4.8013 4.8143 4.9775 4.9965 5.0807 5.0988 5.1997 5.2530 5.4164 5.4199 5.6069 5.6107 6.1056 6.1351 6.3510 6.3569 6.4169 6.4388 7.4283 7.4529 8.3253 8.3479 9.3119 9.3347 10.6047 10.6434 10.6983 10.7045 11.3187 11.3698 k = 0.0000 0.0000 0.7156 ( 6498 PWs) bands (ev): -7.5175 -7.5151 -6.7592 -6.7559 -6.6767 -6.6763 -6.6528 -6.6455 -1.9560 -1.9212 -1.2291 -1.2177 -1.1603 -1.1289 0.2379 0.3196 0.3324 0.4638 0.4942 0.5532 0.6375 0.6735 1.0050 1.0148 2.0637 2.1180 2.2263 2.2310 2.9299 2.9473 3.2215 3.2248 3.2863 3.2993 3.4731 3.4743 3.8815 3.8924 3.9849 4.0074 4.1333 4.1466 4.7371 4.7632 4.8005 4.8099 4.9991 5.0085 5.0767 5.0881 5.2210 5.2658 5.4220 5.4243 5.6135 5.6139 6.1483 6.1732 6.3555 6.3659 6.4325 6.4475 7.3363 7.3564 8.3328 8.3521 9.2555 9.2757 10.6511 10.6584 10.7338 10.7728 11.3374 11.3488 k = 0.0000 0.0000 0.7372 ( 6508 PWs) bands (ev): -7.5081 -7.5060 -6.7557 -6.7522 -6.6801 -6.6798 -6.6642 -6.6572 -1.9473 -1.9179 -1.2286 -1.2189 -1.1586 -1.1333 0.2379 0.3104 0.3400 0.4567 0.4944 0.5494 0.6287 0.6590 0.9938 1.0026 2.0769 2.1256 2.2048 2.2080 2.9289 2.9449 3.2297 3.2337 3.2942 3.3052 3.4761 3.4779 3.9082 3.9167 3.9864 4.0054 4.1444 4.1523 4.7401 4.7602 4.7996 4.8059 5.0185 5.0193 5.0751 5.0797 5.2422 5.2779 5.4290 5.4305 5.6193 5.6237 6.1789 6.1991 6.3655 6.3776 6.4484 6.4588 7.2498 7.2653 8.3397 8.3558 9.2042 9.2215 10.6695 10.6751 10.7910 10.8437 11.3272 11.3317 k = 0.0000 0.0000 0.7589 ( 6494 PWs) bands (ev): -7.5003 -7.4985 -6.7508 -6.7472 -6.6829 -6.6829 -6.6754 -6.6687 -1.9395 -1.9156 -1.2281 -1.2201 -1.1568 -1.1371 0.2395 0.2999 0.3490 0.4459 0.4972 0.5446 0.6235 0.6475 0.9849 0.9923 2.0900 2.1315 2.1870 2.1888 2.9269 2.9410 3.2367 3.2406 3.3008 3.3098 3.4789 3.4810 3.9288 3.9342 3.9904 4.0054 4.1535 4.1571 4.7421 4.7570 4.7987 4.8026 5.0271 5.0330 5.0748 5.0760 5.2624 5.2890 5.4368 5.4379 5.6278 5.6350 6.1971 6.2128 6.3824 6.3939 6.4625 6.4700 7.1718 7.1831 8.3458 8.3587 9.1598 9.1740 10.6787 10.6873 10.8584 10.9139 11.3077 11.3183 k = 0.0000 0.0000 0.7806 ( 6490 PWs) bands (ev): -7.4941 -7.4927 -6.7448 -6.7411 -6.6864 -6.6857 -6.6851 -6.6797 -1.9327 -1.9145 -1.2275 -1.2214 -1.1550 -1.1406 0.2425 0.2892 0.3588 0.4330 0.5016 0.5388 0.6211 0.6387 0.9782 0.9840 2.1023 2.1354 2.1729 2.1734 2.9248 2.9362 3.2422 3.2456 3.3063 3.3130 3.4815 3.4834 3.9426 3.9449 3.9968 4.0073 4.1605 4.1611 4.7434 4.7539 4.7979 4.8001 5.0318 5.0401 5.0749 5.0789 5.2801 5.2984 5.4444 5.4453 5.6381 5.6465 6.2060 6.2177 6.4028 6.4121 6.4739 6.4793 7.1056 7.1132 8.3510 8.3607 9.1237 9.1346 10.6865 10.6946 10.9280 10.9812 11.2893 11.3078 k = 0.0000 0.0000 0.8023 ( 6490 PWs) bands (ev): -7.4896 -7.4886 -6.7379 -6.7341 -6.6967 -6.6922 -6.6867 -6.6858 -1.9268 -1.9146 -1.2268 -1.2227 -1.1531 -1.1437 0.2471 0.2789 0.3695 0.4195 0.5070 0.5325 0.6206 0.6322 0.9737 0.9777 2.1134 2.1369 2.1623 2.1627 2.9235 2.9315 3.2464 3.2488 3.3104 3.3149 3.4836 3.4850 3.9502 3.9506 4.0039 4.0103 4.1645 4.1651 4.7444 4.7511 4.7972 4.7983 5.0342 5.0410 5.0787 5.0823 5.2940 5.3052 5.4509 5.4517 5.6489 5.6562 6.2100 6.2178 6.4216 6.4279 6.4823 6.4859 7.0549 7.0594 8.3552 8.3617 9.0973 9.1047 10.6927 10.6987 10.9959 11.0423 11.2695 11.2944 k = 0.0000 0.0000 0.8240 ( 6506 PWs) bands (ev): -7.4867 -7.4862 -6.7305 -6.7271 -6.7056 -6.7017 -6.6875 -6.6873 -1.9220 -1.9159 -1.2260 -1.2239 -1.1510 -1.1464 0.2532 0.2693 0.3809 0.4060 0.5129 0.5259 0.6217 0.6274 0.9714 0.9734 2.1228 2.1352 2.1557 2.1564 2.9233 2.9275 3.2491 3.2504 3.3133 3.3155 3.4850 3.4858 3.9534 3.9536 4.0094 4.0125 4.1668 4.1675 4.7455 4.7488 4.7968 4.7973 5.0359 5.0394 5.0826 5.0844 5.3034 5.3087 5.4553 5.4558 5.6578 5.6620 6.2121 6.2160 6.4350 6.4381 6.4877 6.4895 7.0231 7.0251 8.3584 8.3617 9.0818 9.0855 10.6971 10.7003 11.0568 11.0885 11.2482 11.2676 k = 0.0000 0.0000 0.8457 ( 6504 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7083 -6.7083 -6.6878 -6.6878 -1.9184 -1.9184 -1.2250 -1.2250 -1.1488 -1.1488 0.2606 0.2606 0.3931 0.3931 0.5193 0.5193 0.6239 0.6239 0.9713 0.9713 2.1302 2.1302 2.1540 2.1540 2.9247 2.9247 3.2505 3.2505 3.3150 3.3150 3.4858 3.4858 3.9544 3.9544 4.0124 4.0124 4.1680 4.1680 4.7469 4.7469 4.7968 4.7968 5.0375 5.0375 5.0846 5.0846 5.3083 5.3083 5.4570 5.4570 5.6626 5.6626 6.2140 6.2140 6.4407 6.4407 6.4901 6.4901 7.0127 7.0127 8.3606 8.3606 9.0778 9.0778 10.6997 10.6997 11.0962 11.0962 11.2438 11.2438 k = 0.0000 0.0000 0.8457 ( 6504 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7083 -6.7083 -6.6878 -6.6878 -1.9184 -1.9184 -1.2250 -1.2250 -1.1488 -1.1488 0.2606 0.2606 0.3931 0.3931 0.5193 0.5193 0.6239 0.6239 0.9713 0.9713 2.1302 2.1302 2.1540 2.1540 2.9247 2.9247 3.2505 3.2505 3.3150 3.3150 3.4858 3.4858 3.9544 3.9544 4.0124 4.0124 4.1680 4.1680 4.7469 4.7469 4.7968 4.7968 5.0375 5.0375 5.0846 5.0846 5.3083 5.3083 5.4570 5.4570 5.6626 5.6626 6.2140 6.2140 6.4407 6.4407 6.4901 6.4901 7.0127 7.0127 8.3606 8.3606 9.0778 9.0778 10.6997 10.6997 11.0962 11.0962 11.2438 11.2438 k =-0.0122 0.0167 0.8457 ( 6502 PWs) bands (ev): -7.4857 -7.4854 -6.7265 -6.7254 -6.7082 -6.7079 -6.6876 -6.6867 -1.9221 -1.9150 -1.2268 -1.2227 -1.1531 -1.1439 0.2602 0.2613 0.3900 0.3965 0.5131 0.5258 0.6223 0.6273 0.9670 0.9788 2.1299 2.1314 2.1534 2.1545 2.9210 2.9274 3.2498 3.2509 3.3134 3.3162 3.4848 3.4860 3.9291 3.9747 3.9906 4.0350 4.1682 4.1686 4.7445 4.7485 4.7903 4.8031 5.0334 5.0409 5.0844 5.0846 5.3019 5.3046 5.4595 5.4635 5.6607 5.6632 6.2110 6.2129 6.4386 6.4401 6.4769 6.4889 7.0153 7.0261 8.3630 8.3673 9.0795 9.0796 10.6987 10.7020 11.0761 11.1132 11.2313 11.2546 k =-0.0244 0.0333 0.8457 ( 6494 PWs) bands (ev): -7.4858 -7.4851 -6.7303 -6.7282 -6.7075 -6.7069 -6.6862 -6.6846 -1.9261 -1.9120 -1.2282 -1.2200 -1.1568 -1.1383 0.2600 0.2625 0.3873 0.4000 0.5077 0.5320 0.6220 0.6328 0.9660 0.9894 2.1302 2.1335 2.1527 2.1550 2.9164 2.9292 3.2489 3.2510 3.3113 3.3169 3.4831 3.4853 3.9020 3.9566 4.0034 4.0553 4.1693 4.1702 4.7411 4.7494 4.7839 4.8089 5.0285 5.0434 5.0837 5.0843 5.2873 5.2924 5.4695 5.4773 5.6573 5.6625 6.2036 6.2076 6.4340 6.4369 6.4515 6.4737 7.0333 7.0533 8.3741 8.3832 9.0849 9.0851 10.6987 10.7051 11.0518 11.1258 11.2080 11.2700 k =-0.0366 0.0500 0.8457 ( 6504 PWs) bands (ev): -7.4858 -7.4848 -6.7357 -6.7329 -6.7061 -6.7054 -6.6839 -6.6820 -1.9304 -1.9094 -1.2293 -1.2170 -1.1599 -1.1320 0.2599 0.2641 0.3848 0.4038 0.5032 0.5375 0.6228 0.6410 0.9685 1.0030 2.1308 2.1363 2.1518 2.1559 2.9109 2.9299 3.2478 3.2507 3.3087 3.3171 3.4805 3.4839 3.8736 3.9267 4.0240 4.0732 4.1712 4.1725 4.7365 4.7496 4.7780 4.8141 5.0225 5.0450 5.0822 5.0839 5.2678 5.2754 5.4838 5.4951 5.6524 5.6605 6.1918 6.1981 6.4170 6.4267 6.4315 6.4476 7.0641 7.0913 8.3932 8.4077 9.0936 9.0939 10.6995 10.7084 11.0211 11.1193 11.1875 11.2867 k =-0.0489 0.0666 0.8457 ( 6510 PWs) bands (ev): -7.4857 -7.4845 -6.7424 -6.7389 -6.7040 -6.7033 -6.6813 -6.6792 -1.9348 -1.9071 -1.2301 -1.2138 -1.1623 -1.1249 0.2597 0.2664 0.3825 0.4077 0.4997 0.5418 0.6249 0.6520 0.9744 1.0194 2.1312 2.1395 2.1513 2.1577 2.9043 2.9294 3.2465 3.2499 3.3058 3.3170 3.4773 3.4817 3.8439 3.8943 4.0436 4.0888 4.1740 4.1758 4.7307 4.7492 4.7729 4.8185 5.0155 5.0453 5.0798 5.0835 5.2463 5.2563 5.4998 5.5143 5.6461 5.6577 6.1754 6.1843 6.3769 6.4092 6.4221 6.4241 7.1047 7.1370 8.4192 8.4403 9.1057 9.1061 10.7002 10.7108 10.9822 11.0762 11.1945 11.2801 k =-0.0611 0.0833 0.8457 ( 6514 PWs) bands (ev): -7.4856 -7.4841 -6.7502 -6.7462 -6.7013 -6.7006 -6.6784 -6.6763 -1.9394 -1.9051 -1.2308 -1.2106 -1.1641 -1.1171 0.2595 0.2695 0.3805 0.4117 0.4973 0.5447 0.6282 0.6659 0.9841 1.0387 2.1310 2.1415 2.1525 2.1607 2.8966 2.9276 3.2449 3.2485 3.3025 3.3164 3.4733 3.4787 3.8134 3.8600 4.0620 4.1022 4.1776 4.1800 4.7240 4.7482 4.7685 4.8222 5.0072 5.0436 5.0765 5.0833 5.2252 5.2370 5.5161 5.5331 5.6384 5.6545 6.1543 6.1662 6.3335 6.3711 6.4109 6.4154 7.1520 7.1882 8.4509 8.4796 9.1208 9.1212 10.6999 10.7110 10.9341 11.0158 11.2149 11.2681 k =-0.0733 0.1000 0.8457 ( 6510 PWs) bands (ev): -7.4855 -7.4837 -6.7588 -6.7543 -6.6981 -6.6974 -6.6755 -6.6734 -1.9441 -1.9034 -1.2313 -1.2077 -1.1651 -1.1086 0.2591 0.2735 0.3786 0.4157 0.4957 0.5465 0.6330 0.6823 0.9976 1.0606 2.1299 2.1409 2.1569 2.1653 2.8875 2.9240 3.2430 3.2464 3.2989 3.3156 3.4688 3.4750 3.7825 3.8244 4.0792 4.1135 4.1820 4.1849 4.7168 4.7465 4.7647 4.8253 4.9975 5.0386 5.0729 5.0832 5.2061 5.2188 5.5319 5.5496 5.6293 5.6520 6.1286 6.1439 6.2885 6.3287 6.4007 6.4058 7.2042 7.2435 8.4867 8.5244 9.1386 9.1391 10.6974 10.7078 10.8776 10.9489 11.2414 11.2618 k =-0.0855 0.1166 0.8457 ( 6530 PWs) bands (ev): -7.4854 -7.4834 -6.7682 -6.7633 -6.6942 -6.6935 -6.6726 -6.6705 -1.9488 -1.9021 -1.2317 -1.2053 -1.1653 -1.0995 0.2584 0.2783 0.3768 0.4197 0.4948 0.5473 0.6396 0.7006 1.0152 1.0851 2.1277 2.1384 2.1637 2.1714 2.8769 2.9186 3.2408 3.2433 3.2949 3.3145 3.4636 3.4706 3.7518 3.7881 4.0953 4.1230 4.1871 4.1906 4.7094 4.7441 4.7613 4.8278 4.9865 5.0287 5.0698 5.0834 5.1905 5.2022 5.5468 5.5614 5.6188 5.6519 6.0985 6.1175 6.2431 6.2847 6.3903 6.3958 7.2598 7.3016 8.5251 8.5727 9.1587 9.1592 10.6912 10.6993 10.8145 10.8790 11.2633 11.2728 k =-0.0977 0.1333 0.8457 ( 6518 PWs) bands (ev): -7.4854 -7.4832 -6.7782 -6.7730 -6.6898 -6.6891 -6.6697 -6.6676 -1.9534 -1.9009 -1.2322 -1.2038 -1.1644 -1.0899 0.2574 0.2839 0.3750 0.4236 0.4943 0.5474 0.6482 0.7204 1.0368 1.1121 2.1246 2.1349 2.1719 2.1789 2.8645 2.9110 3.2383 3.2391 3.2908 3.3132 3.4580 3.4656 3.7219 3.7518 4.1103 4.1309 4.1931 4.1970 4.7023 4.7409 4.7582 4.8301 4.9743 5.0135 5.0678 5.0839 5.1790 5.1878 5.5607 5.5665 5.6070 5.6563 6.0644 6.0874 6.1981 6.2406 6.3800 6.3857 7.3180 7.3621 8.5646 8.6229 9.1806 9.1811 10.6800 10.6834 10.7472 10.8089 11.2733 11.3094 k =-0.1099 0.1500 0.8457 ( 6514 PWs) bands (ev): -7.4855 -7.4831 -6.7889 -6.7834 -6.6849 -6.6842 -6.6666 -6.6646 -1.9579 -1.8999 -1.2328 -1.2033 -1.1628 -1.0799 0.2561 0.2904 0.3732 0.4275 0.4940 0.5470 0.6590 0.7412 1.0625 1.1414 2.1206 2.1307 2.1812 2.1877 2.8501 2.9008 3.2337 3.2353 3.2864 3.3118 3.4519 3.4601 3.6937 3.7164 4.1242 4.1375 4.1999 4.2041 4.6958 4.7368 4.7551 4.8323 4.9613 4.9938 5.0665 5.0847 5.1712 5.1754 5.5642 5.5732 5.5942 5.6655 6.0270 6.0542 6.1541 6.1968 6.3698 6.3756 7.3781 7.4243 8.6034 8.6727 9.2039 9.2043 10.6570 10.6615 10.6785 10.7420 11.2924 11.3515 k =-0.1222 0.1666 0.8457 ( 6502 PWs) bands (ev): -7.4857 -7.4832 -6.8001 -6.7943 -6.6795 -6.6789 -6.6635 -6.6615 -1.9622 -1.8991 -1.2335 -1.2035 -1.1606 -1.0696 0.2544 0.2976 0.3715 0.4314 0.4938 0.5463 0.6723 0.7626 1.0923 1.1729 2.1159 2.1257 2.1914 2.1975 2.8334 2.8878 3.2268 3.2318 3.2820 3.3103 3.4455 3.4541 3.6677 3.6826 4.1371 4.1429 4.2074 4.2117 4.6904 4.7317 4.7519 4.8347 4.9479 4.9711 5.0656 5.0859 5.1650 5.1664 5.5559 5.5777 5.5869 5.6780 5.9868 6.0184 6.1116 6.1542 6.3597 6.3655 7.4397 7.4880 8.6401 8.7204 9.2279 9.2282 10.6071 10.6152 10.6379 10.6832 11.3212 11.3987 k =-0.1344 0.1833 0.8457 ( 6510 PWs) bands (ev): -7.4862 -7.4834 -6.8118 -6.8058 -6.6737 -6.6731 -6.6601 -6.6582 -1.9662 -1.8984 -1.2343 -1.2045 -1.1582 -1.0593 0.2523 0.3052 0.3699 0.4351 0.4936 0.5452 0.6880 0.7846 1.1259 1.2066 2.1104 2.1202 2.2025 2.2082 2.8144 2.8717 3.2186 3.2278 3.2774 3.3087 3.4389 3.4477 3.6447 3.6512 4.1474 4.1490 4.2157 4.2198 4.6860 4.7254 4.7486 4.8374 4.9345 4.9467 5.0647 5.0872 5.1563 5.1639 5.5434 5.5633 5.5961 5.6919 5.9445 5.9807 6.0706 6.1129 6.3498 6.3556 7.5025 7.5526 8.6733 8.7639 9.2518 9.2521 10.5395 10.5589 10.6039 10.6323 11.3601 11.4501 k =-0.1344 0.1833 0.8457 ( 6510 PWs) bands (ev): -7.4862 -7.4834 -6.8118 -6.8058 -6.6737 -6.6731 -6.6601 -6.6582 -1.9662 -1.8984 -1.2343 -1.2045 -1.1582 -1.0593 0.2523 0.3052 0.3699 0.4351 0.4936 0.5452 0.6880 0.7846 1.1259 1.2066 2.1104 2.1202 2.2025 2.2082 2.8144 2.8717 3.2186 3.2278 3.2774 3.3087 3.4389 3.4477 3.6447 3.6512 4.1474 4.1490 4.2157 4.2198 4.6860 4.7254 4.7486 4.8374 4.9345 4.9467 5.0647 5.0872 5.1563 5.1639 5.5434 5.5633 5.5961 5.6919 5.9445 5.9807 6.0706 6.1129 6.3498 6.3556 7.5025 7.5526 8.6733 8.7639 9.2518 9.2521 10.5395 10.5589 10.6039 10.6323 11.3601 11.4501 k =-0.1435 0.1957 0.8302 ( 6505 PWs) bands (ev): -7.4869 -7.4841 -6.8206 -6.8145 -6.6738 -6.6702 -6.6552 -6.6508 -1.9693 -1.8982 -1.2350 -1.2053 -1.1563 -1.0517 0.2505 0.3112 0.3687 0.4381 0.4935 0.5442 0.7023 0.8019 1.1538 1.2333 2.1067 2.1165 2.2096 2.2175 2.7986 2.8573 3.2110 3.2239 3.2738 3.3069 3.4335 3.4424 3.6286 3.6317 4.1498 4.1567 4.2209 4.2256 4.6836 4.7197 4.7466 4.8396 4.9203 4.9325 5.0636 5.0882 5.1510 5.1625 5.5299 5.5486 5.6027 5.7016 5.9123 5.9519 6.0436 6.0851 6.3396 6.3488 7.5526 7.6041 8.6954 8.7929 9.2699 9.2722 10.4755 10.5118 10.5743 10.6104 11.3917 11.4769 k =-0.1526 0.2082 0.8147 ( 6506 PWs) bands (ev): -7.4883 -7.4854 -6.8294 -6.8232 -6.6766 -6.6723 -6.6450 -6.6395 -1.9724 -1.8988 -1.2358 -1.2059 -1.1545 -1.0445 0.2486 0.3175 0.3675 0.4412 0.4936 0.5429 0.7199 0.8206 1.1843 1.2616 2.1042 2.1140 2.2152 2.2275 2.7816 2.8406 3.2016 3.2188 3.2699 3.3038 3.4274 3.4362 3.6108 3.6196 4.1515 4.1626 4.2231 4.2298 4.6816 4.7126 4.7456 4.8418 4.8997 4.9255 5.0617 5.0887 5.1465 5.1605 5.5122 5.5291 5.6069 5.7089 5.8800 5.9229 6.0221 6.0620 6.3261 6.3425 7.6079 7.6608 8.7151 8.8184 9.2899 9.2947 10.4017 10.4468 10.5584 10.6020 11.4199 11.4667 k =-0.1618 0.2207 0.7993 ( 6507 PWs) bands (ev): -7.4902 -7.4873 -6.8381 -6.8317 -6.6798 -6.6756 -6.6332 -6.6272 -1.9756 -1.9000 -1.2367 -1.2063 -1.1525 -1.0377 0.2469 0.3236 0.3669 0.4442 0.4937 0.5415 0.7407 0.8409 1.2170 1.2911 2.1029 2.1127 2.2202 2.2370 2.7630 2.8212 3.1904 3.2126 3.2658 3.2994 3.4206 3.4291 3.5958 3.6110 4.1528 4.1672 4.2218 4.2320 4.6802 4.7044 4.7454 4.8430 4.8789 4.9210 5.0591 5.0884 5.1427 5.1577 5.4926 5.5071 5.6081 5.7132 5.8480 5.8937 6.0055 6.0424 6.3114 6.3368 7.6674 7.7218 8.7323 8.8405 9.3102 9.3181 10.3254 10.3727 10.5528 10.5989 11.4400 11.4532 k =-0.1709 0.2332 0.7838 ( 6512 PWs) bands (ev): -7.4926 -7.4897 -6.8464 -6.8400 -6.6832 -6.6791 -6.6207 -6.6143 -1.9788 -1.9018 -1.2377 -1.2063 -1.1505 -1.0315 0.2453 0.3290 0.3672 0.4470 0.4937 0.5399 0.7645 0.8629 1.2516 1.3217 2.1027 2.1126 2.2250 2.2459 2.7428 2.7990 3.1778 3.2052 3.2615 3.2937 3.4130 3.4209 3.5844 3.6054 4.1539 4.1709 4.2172 4.2317 4.6790 4.6958 4.7456 4.8390 4.8634 4.9181 5.0557 5.0868 5.1390 5.1547 5.4729 5.4855 5.6063 5.7139 5.8165 5.8642 5.9921 6.0247 6.2973 6.3327 7.7304 7.7864 8.7473 8.8591 9.3291 9.3409 10.2490 10.2958 10.5540 10.6005 11.4280 11.4681 k =-0.1801 0.2456 0.7684 ( 6514 PWs) bands (ev): -7.4954 -7.4925 -6.8545 -6.8480 -6.6867 -6.6827 -6.6079 -6.6012 -1.9819 -1.9042 -1.2389 -1.2061 -1.1484 -1.0260 0.2438 0.3335 0.3685 0.4496 0.4934 0.5384 0.7913 0.8865 1.2877 1.3531 2.1035 2.1134 2.2298 2.2540 2.7209 2.7739 3.1641 3.1968 3.2569 3.2867 3.4046 3.4117 3.5766 3.6026 4.1545 4.1738 4.2094 4.2288 4.6760 4.6895 4.7459 4.8236 4.8601 4.9166 5.0510 5.0835 5.1339 5.1535 5.4545 5.4670 5.6015 5.7102 5.7861 5.8346 5.9804 6.0077 6.2849 6.3308 7.7960 7.8537 8.7603 8.8744 9.3449 9.3617 10.1746 10.2190 10.5609 10.6071 11.4120 11.4834 k =-0.1892 0.2581 0.7529 ( 6514 PWs) bands (ev): -7.4984 -7.4955 -6.8622 -6.8556 -6.6900 -6.6862 -6.5950 -6.5880 -1.9849 -1.9072 -1.2402 -1.2057 -1.1461 -1.0212 0.2425 0.3369 0.3709 0.4521 0.4928 0.5369 0.8206 0.9116 1.3249 1.3851 2.1053 2.1151 2.2347 2.2614 2.6973 2.7460 3.1497 3.1877 3.2520 3.2786 3.3953 3.4014 3.5722 3.6024 4.1538 4.1759 4.1989 4.2239 4.6679 4.6892 4.7459 4.8037 4.8626 4.9164 5.0440 5.0789 5.1264 5.1558 5.4386 5.4533 5.5938 5.7009 5.7582 5.8048 5.9688 5.9905 6.2753 6.3312 7.8631 7.9230 8.7718 8.8869 9.3560 9.3789 10.1040 10.1445 10.5720 10.6191 11.3977 11.4895 k =-0.1984 0.2706 0.7374 ( 6512 PWs) bands (ev): -7.5017 -7.4988 -6.8695 -6.8629 -6.6932 -6.6896 -6.5823 -6.5751 -1.9876 -1.9106 -1.2416 -1.2051 -1.1436 -1.0171 0.2415 0.3395 0.3739 0.4547 0.4918 0.5356 0.8521 0.9383 1.3627 1.4175 2.1077 2.1176 2.2398 2.2680 2.6721 2.7156 3.1352 3.1778 3.2465 3.2694 3.3849 3.3905 3.5709 3.6045 4.1497 4.1771 4.1867 4.2187 4.6571 4.6926 4.7448 4.7847 4.8670 4.9171 5.0339 5.0733 5.1180 5.1615 5.4266 5.4448 5.5833 5.6838 5.7346 5.7749 5.9567 5.9733 6.2691 6.3338 7.9309 7.9931 8.7824 8.8970 9.3610 9.3911 10.0391 10.0743 10.5852 10.6369 11.3861 11.4829 k =-0.2075 0.2830 0.7220 ( 6520 PWs) bands (ev): -7.5050 -7.5022 -6.8764 -6.8698 -6.6963 -6.6929 -6.5699 -6.5624 -1.9902 -1.9144 -1.2430 -1.2045 -1.1408 -1.0138 0.2406 0.3414 0.3772 0.4574 0.4903 0.5345 0.8855 0.9664 1.4006 1.4498 2.1109 2.1206 2.2452 2.2739 2.6457 2.6832 3.1207 3.1675 3.2402 3.2591 3.3734 3.3793 3.5722 3.6086 4.1397 4.1714 4.1801 4.2153 4.6457 4.6980 4.7403 4.7698 4.8725 4.9184 5.0207 5.0657 5.1118 5.1698 5.4190 5.4408 5.5698 5.6593 5.7150 5.7451 5.9438 5.9565 6.2663 6.3381 7.9980 8.0629 8.7927 8.9052 9.3592 9.3971 9.9811 10.0103 10.5978 10.6602 11.3781 11.4751 k =-0.2166 0.2955 0.7065 ( 6526 PWs) bands (ev): -7.5083 -7.5056 -6.8829 -6.8762 -6.6993 -6.6961 -6.5579 -6.5502 -1.9925 -1.9185 -1.2444 -1.2039 -1.1378 -1.0113 0.2398 0.3430 0.3803 0.4603 0.4883 0.5337 0.9203 0.9956 1.4380 1.4817 2.1146 2.1242 2.2509 2.2792 2.6185 2.6493 3.1067 3.1569 3.2329 3.2478 3.3610 3.3682 3.5755 3.6144 4.1237 4.1554 4.1825 4.2148 4.6344 4.7035 4.7305 4.7627 4.8789 4.9198 5.0059 5.0554 5.1099 5.1802 5.4154 5.4406 5.5537 5.6307 5.6965 5.7154 5.9305 5.9407 6.2666 6.3437 8.0631 8.1310 8.8038 8.9124 9.3508 9.3961 9.9309 9.9542 10.6073 10.6876 11.3745 11.4712 k =-0.2258 0.3080 0.6911 ( 6526 PWs) bands (ev): -7.5115 -7.5090 -6.8889 -6.8822 -6.7021 -6.6991 -6.5464 -6.5386 -1.9945 -1.9228 -1.2457 -1.2034 -1.1345 -1.0094 0.2392 0.3445 0.3831 0.4635 0.4859 0.5331 0.9560 1.0257 1.4743 1.5129 2.1187 2.1280 2.2568 2.2838 2.5909 2.6147 3.0935 3.1461 3.2244 3.2353 3.3483 3.3572 3.5803 3.6214 4.1035 4.1365 4.1864 4.2167 4.6234 4.7023 4.7242 4.7614 4.8862 4.9212 4.9907 5.0432 5.1122 5.1925 5.4148 5.4432 5.5353 5.6004 5.6770 5.6859 5.9172 5.9267 6.2695 6.3499 8.1249 8.1957 8.8169 8.9194 9.3364 9.3880 9.8884 9.9071 10.6113 10.7166 11.3755 11.4739 k =-0.2349 0.3204 0.6756 ( 6520 PWs) bands (ev): -7.5146 -7.5123 -6.8943 -6.8876 -6.7046 -6.7018 -6.5357 -6.5277 -1.9961 -1.9272 -1.2470 -1.2031 -1.1309 -1.0083 0.2388 0.3459 0.3854 0.4669 0.4833 0.5326 0.9921 1.0561 1.5089 1.5428 2.1233 2.1321 2.2628 2.2878 2.5635 2.5804 3.0812 3.1352 3.2143 3.2218 3.3360 3.3464 3.5863 3.6294 4.0814 4.1155 4.1911 4.2200 4.6133 4.6892 4.7294 4.7632 4.8940 4.9223 4.9766 5.0306 5.1175 5.2063 5.4158 5.4474 5.5157 5.5703 5.6553 5.6573 5.9048 5.9146 6.2741 6.3564 8.1817 8.2550 8.8333 8.9272 9.3178 9.3733 9.8530 9.8695 10.6081 10.7443 11.3807 11.4844 k =-0.2441 0.3329 0.6601 ( 6520 PWs) bands (ev): -7.5176 -7.5154 -6.8993 -6.8925 -6.7069 -6.7044 -6.5258 -6.5176 -1.9975 -1.9316 -1.2481 -1.2028 -1.1272 -1.0078 0.2384 0.3472 0.3871 0.4702 0.4809 0.5323 1.0281 1.0865 1.5410 1.5709 2.1282 2.1362 2.2688 2.2913 2.5361 2.5478 3.0701 3.1246 3.2015 3.2082 3.3247 3.3360 3.5930 3.6380 4.0586 4.0934 4.1963 4.2240 4.6040 4.6733 4.7365 4.7681 4.9019 4.9229 4.9648 5.0190 5.1244 5.2214 5.4158 5.4520 5.4968 5.5419 5.6279 5.6334 5.8938 5.9043 6.2799 6.3627 8.2320 8.3069 8.8542 8.9366 9.2968 9.3536 9.8241 9.8405 10.5967 10.7678 11.3888 11.4991 k =-0.2532 0.3454 0.6447 ( 6525 PWs) bands (ev): -7.5203 -7.5183 -6.9037 -6.8970 -6.7090 -6.7067 -6.5168 -6.5085 -1.9985 -1.9359 -1.2491 -1.2027 -1.1234 -1.0078 0.2382 0.3485 0.3884 0.4719 0.4799 0.5319 1.0632 1.1161 1.5699 1.5966 2.1333 2.1402 2.2747 2.2944 2.5078 2.5194 3.0606 3.1143 3.1853 3.1955 3.3148 3.3263 3.6002 3.6468 4.0362 4.0711 4.2018 4.2284 4.5959 4.6576 4.7416 4.7768 4.9083 4.9233 4.9567 5.0092 5.1320 5.2377 5.4116 5.4553 5.4805 5.5181 5.5999 5.6100 5.8845 5.8957 6.2863 6.3686 8.2748 8.3496 8.8807 8.9485 9.2756 9.3308 9.8013 9.8180 10.5775 10.7848 11.3982 11.5080 k =-0.2623 0.3578 0.6292 ( 6536 PWs) bands (ev): -7.5227 -7.5209 -6.9075 -6.9008 -6.7109 -6.7087 -6.5088 -6.5004 -1.9993 -1.9400 -1.2500 -1.2027 -1.1197 -1.0082 0.2381 0.3498 0.3894 0.4708 0.4819 0.5315 1.0969 1.1444 1.5952 1.6194 2.1382 2.1443 2.2803 2.2972 2.4792 2.4958 3.0528 3.1046 3.1668 3.1833 3.3065 3.3174 3.6074 3.6555 4.0151 4.0495 4.2073 4.2327 4.5892 4.6428 4.7444 4.7885 4.9100 4.9256 4.9530 5.0018 5.1394 5.2551 5.4014 5.4503 5.4712 5.5033 5.5726 5.5870 5.8769 5.8885 6.2928 6.3739 8.3093 8.3823 8.9125 8.9630 9.2557 9.3069 9.7839 9.8005 10.5518 10.7944 11.4069 11.5110 k =-0.2715 0.3703 0.6138 ( 6533 PWs) bands (ev): -7.5247 -7.5233 -6.9108 -6.9041 -6.7124 -6.7105 -6.5019 -6.4934 -1.9998 -1.9438 -1.2507 -1.2028 -1.1161 -1.0089 0.2380 0.3510 0.3900 0.4684 0.4852 0.5310 1.1282 1.1704 1.6165 1.6386 2.1423 2.1488 2.2855 2.2999 2.4527 2.4759 3.0472 3.0957 3.1473 3.1714 3.2999 3.3097 3.6143 3.6638 3.9961 4.0294 4.2125 4.2368 4.5840 4.6292 4.7459 4.8015 4.9071 4.9301 4.9528 4.9976 5.1454 5.2734 5.3876 5.4324 5.4719 5.4972 5.5469 5.5660 5.8712 5.8826 6.2990 6.3784 8.3357 8.4053 8.9480 8.9798 9.2384 9.2839 9.7708 9.7866 10.5221 10.7971 11.4137 11.5119 k =-0.2806 0.3828 0.5983 ( 6524 PWs) bands (ev): -7.5265 -7.5252 -6.9135 -6.9068 -6.7137 -6.7119 -6.4962 -6.4876 -2.0001 -1.9471 -1.2513 -1.2029 -1.1129 -1.0098 0.2379 0.3520 0.3904 0.4659 0.4886 0.5304 1.1562 1.1933 1.6338 1.6537 2.1451 2.1539 2.2905 2.3024 2.4297 2.4592 3.0441 3.0880 3.1277 3.1603 3.2949 3.3031 3.6208 3.6713 3.9799 4.0115 4.2172 4.2404 4.5804 4.6170 4.7466 4.8141 4.9029 4.9350 4.9539 4.9970 5.1492 5.2923 5.3739 5.4121 5.4730 5.4931 5.5245 5.5492 5.8670 5.8777 6.3046 6.3822 8.3546 8.4202 8.9840 8.9979 9.2245 9.2632 9.7614 9.7755 10.4915 10.7945 11.4178 11.5123 k =-0.2898 0.3952 0.5828 ( 6524 PWs) bands (ev): -7.5278 -7.5268 -6.9156 -6.9089 -6.7147 -6.7131 -6.4917 -6.4830 -2.0002 -1.9498 -1.2518 -1.2030 -1.1101 -1.0107 0.2379 0.3529 0.3907 0.4637 0.4916 0.5297 1.1800 1.2121 1.6471 1.6647 2.1467 2.1590 2.2950 2.3046 2.4112 2.4456 3.0436 3.0817 3.1090 3.1507 3.2913 3.2979 3.6263 3.6776 3.9669 3.9965 4.2211 4.2434 4.5785 4.6062 4.7469 4.8249 4.8993 4.9398 4.9544 4.9993 5.1503 5.3114 5.3625 5.3952 5.4678 5.4858 5.5103 5.5387 5.8641 5.8737 6.3093 6.3851 8.3673 8.4289 9.0111 9.0214 9.2142 9.2457 9.7549 9.7667 10.4630 10.7890 11.4196 11.5126 k =-0.2989 0.4077 0.5674 ( 6514 PWs) bands (ev): -7.5287 -7.5280 -6.9171 -6.9104 -6.7155 -6.7139 -6.4884 -6.4797 -2.0002 -1.9519 -1.2521 -1.2031 -1.1081 -1.0115 0.2379 0.3536 0.3909 0.4620 0.4941 0.5291 1.1982 1.2260 1.6566 1.6718 2.1475 2.1633 2.2990 2.3062 2.3976 2.4354 3.0460 3.0769 3.0922 3.1433 3.2891 3.2939 3.6306 3.6823 3.9575 3.9851 4.2240 4.2456 4.5785 4.5971 4.7471 4.8330 4.8967 4.9444 4.9540 5.0030 5.1493 5.3294 5.3535 5.3843 5.4548 5.4747 5.5067 5.5341 5.8624 5.8708 6.3129 6.3872 8.3753 8.4335 9.0257 9.0483 9.2078 9.2320 9.7510 9.7599 10.4399 10.7830 11.4202 11.5131 k =-0.3080 0.4202 0.5519 ( 6516 PWs) bands (ev): -7.5293 -7.5287 -6.9180 -6.9113 -6.7159 -6.7144 -6.4864 -6.4777 -2.0001 -1.9532 -1.2523 -1.2032 -1.1067 -1.0120 0.2379 0.3540 0.3910 0.4609 0.4956 0.5287 1.2099 1.2344 1.6624 1.6755 2.1479 2.1662 2.3019 2.3071 2.3893 2.4290 3.0508 3.0732 3.0789 3.1385 3.2879 3.2913 3.6333 3.6853 3.9519 3.9779 4.2259 4.2470 4.5804 4.5898 4.7472 4.8378 4.8953 4.9483 4.9532 5.0060 5.1476 5.3433 5.3478 5.3797 5.4407 5.4656 5.5070 5.5326 5.8616 5.8689 6.3151 6.3884 8.3795 8.4355 9.0346 9.0666 9.2049 9.2226 9.7493 9.7552 10.4248 10.7785 11.4202 11.5135 k =-0.3172 0.4326 0.5365 ( 6512 PWs) bands (ev): -7.5294 -7.5290 -6.9183 -6.9117 -6.7160 -6.7146 -6.4858 -6.4770 -2.0001 -1.9536 -1.2524 -1.2032 -1.1063 -1.0122 0.2380 0.3541 0.3911 0.4606 0.4962 0.5285 1.2139 1.2372 1.6644 1.6766 2.1480 2.1672 2.3031 2.3073 2.3866 2.4267 3.0548 3.0692 3.0748 3.1369 3.2876 3.2904 3.6342 3.6863 3.9500 3.9754 4.2265 4.2475 4.5834 4.5849 4.7472 4.8394 4.8949 4.9503 4.9524 5.0071 5.1469 5.3440 5.3508 5.3788 5.4344 5.4622 5.5074 5.5323 5.8614 5.8682 6.3158 6.3888 8.3808 8.4361 9.0377 9.0730 9.2043 9.2191 9.7490 9.7534 10.4196 10.7768 11.4201 11.5137 k =-0.3172 0.4326 0.5365 ( 6512 PWs) bands (ev): -7.5294 -7.5290 -6.9183 -6.9117 -6.7160 -6.7146 -6.4858 -6.4770 -2.0001 -1.9536 -1.2524 -1.2032 -1.1063 -1.0122 0.2380 0.3541 0.3911 0.4606 0.4962 0.5285 1.2139 1.2372 1.6644 1.6766 2.1480 2.1672 2.3031 2.3073 2.3866 2.4267 3.0548 3.0692 3.0748 3.1369 3.2876 3.2904 3.6342 3.6863 3.9500 3.9754 4.2265 4.2475 4.5834 4.5849 4.7472 4.8394 4.8949 4.9503 4.9524 5.0071 5.1469 5.3440 5.3508 5.3788 5.4344 5.4622 5.5074 5.5323 5.8614 5.8682 6.3158 6.3888 8.3808 8.4361 9.0377 9.0730 9.2043 9.2191 9.7490 9.7534 10.4196 10.7768 11.4201 11.5137 k =-0.3081 0.4203 0.5211 ( 6522 PWs) bands (ev): -7.5332 -7.5329 -6.9035 -6.8967 -6.7251 -6.7237 -6.4857 -6.4768 -2.0031 -1.9627 -1.2489 -1.2029 -1.0943 -1.0174 0.2466 0.3481 0.3982 0.4549 0.5057 0.5196 1.2304 1.2494 1.6423 1.6584 2.1692 2.1905 2.2997 2.3047 2.3675 2.4121 3.0366 3.0549 3.0579 3.1220 3.2790 3.2846 3.6407 3.6945 3.9175 3.9419 4.2073 4.2244 4.5916 4.5928 4.7658 4.8301 4.8962 4.9444 4.9645 5.0004 5.1565 5.3463 5.3810 5.3945 5.4126 5.4504 5.5237 5.5561 5.8835 5.8920 6.3112 6.3814 8.3656 8.4263 9.0848 9.1093 9.2260 9.2383 9.7706 9.7818 10.5585 10.9053 11.4177 11.4803 k =-0.2991 0.4079 0.5058 ( 6498 PWs) bands (ev): -7.5387 -7.5383 -6.8884 -6.8814 -6.7323 -6.7310 -6.4856 -6.4765 -2.0061 -1.9721 -1.2452 -1.2029 -1.0829 -1.0244 0.2559 0.3401 0.4065 0.4458 0.5127 0.5158 1.2484 1.2630 1.6199 1.6400 2.1859 2.2097 2.3020 2.3045 2.3494 2.4009 3.0183 3.0356 3.0449 3.1068 3.2693 3.2824 3.6483 3.7029 3.8865 3.9097 4.1889 4.2021 4.5996 4.6005 4.7847 4.8213 4.8953 4.9399 4.9788 4.9938 5.1663 5.3352 5.3820 5.4017 5.4160 5.4693 5.5430 5.5820 5.9022 5.9122 6.3029 6.3698 8.3507 8.4151 9.1283 9.1406 9.2521 9.2590 9.7894 9.8055 10.7020 11.0351 11.4113 11.4419 k =-0.2900 0.3956 0.4905 ( 6508 PWs) bands (ev): -7.5457 -7.5455 -6.8728 -6.8657 -6.7375 -6.7362 -6.4856 -6.4764 -2.0091 -1.9819 -1.2415 -1.2032 -1.0721 -1.0328 0.2659 0.3312 0.4153 0.4337 0.5078 0.5262 1.2675 1.2774 1.5973 1.6215 2.1952 2.2227 2.3040 2.3086 2.3367 2.3980 3.0001 3.0163 3.0305 3.0910 3.2616 3.2811 3.6567 3.7113 3.8569 3.8790 4.1713 4.1807 4.6072 4.6080 4.7997 4.8168 4.8929 4.9365 4.9875 4.9941 5.1758 5.3138 5.3592 5.4034 5.4511 5.5016 5.5646 5.6092 5.9171 5.9282 6.2910 6.3540 8.3366 8.4033 9.1643 9.1643 9.2842 9.2843 9.8064 9.8254 10.8492 11.1599 11.3963 11.4028 k =-0.2809 0.3832 0.4751 ( 6502 PWs) bands (ev): -7.5545 -7.5543 -6.8571 -6.8499 -6.7407 -6.7395 -6.4855 -6.4762 -2.0123 -1.9919 -1.2378 -1.2038 -1.0621 -1.0425 0.2765 0.3217 0.4197 0.4242 0.5043 0.5367 1.2872 1.2925 1.5747 1.6032 2.1969 2.2299 2.2981 2.3038 2.3457 2.4085 2.9825 2.9977 3.0144 3.0745 3.2562 3.2807 3.6658 3.7196 3.8289 3.8497 4.1548 4.1604 4.6146 4.6153 4.7975 4.8298 4.8896 4.9343 4.9817 5.0092 5.1846 5.2887 5.3370 5.4099 5.4884 5.5373 5.5881 5.6371 5.9277 5.9398 6.2762 6.3346 8.3242 8.3918 9.1789 9.1876 9.3185 9.3226 9.8224 9.8425 10.9991 11.2495 11.3420 11.4174 k =-0.2719 0.3708 0.4598 ( 6510 PWs) bands (ev): -7.5649 -7.5648 -6.8410 -6.8338 -6.7417 -6.7406 -6.4854 -6.4761 -2.0155 -2.0022 -1.2341 -1.2046 -1.0533 -1.0529 0.2876 0.3120 0.4047 0.4330 0.5015 0.5472 1.3071 1.3076 1.5524 1.5850 2.1930 2.2334 2.2856 2.2905 2.3716 2.4316 2.9661 2.9798 2.9967 3.0574 3.2531 3.2811 3.6751 3.7274 3.8024 3.8220 4.1396 4.1413 4.6217 4.6226 4.7892 4.8488 4.8858 4.9332 4.9764 5.0233 5.1911 5.2628 5.3189 5.4185 5.5272 5.5740 5.6134 5.6652 5.9339 5.9467 6.2588 6.3120 8.3138 8.3812 9.1848 9.1968 9.3620 9.3662 9.8382 9.8580 11.1501 11.2474 11.2778 11.5072 k =-0.2628 0.3585 0.4445 ( 6508 PWs) bands (ev): -7.5768 -7.5768 -6.8248 -6.8175 -6.7408 -6.7397 -6.4854 -6.4760 -2.0188 -2.0127 -1.2306 -1.2057 -1.0649 -1.0446 0.2991 0.3023 0.3896 0.4416 0.4990 0.5575 1.3223 1.3267 1.5307 1.5671 2.1856 2.2353 2.2691 2.2773 2.4034 2.4628 2.9514 2.9628 2.9779 3.0395 3.2520 3.2824 3.6844 3.7346 3.7776 3.7960 4.1237 4.1258 4.6286 4.6298 4.7805 4.8679 4.8816 4.9333 4.9716 5.0356 5.1929 5.2374 5.3086 5.4286 5.5677 5.6099 5.6409 5.6924 5.9355 5.9488 6.2399 6.2874 8.3061 8.3721 9.1826 9.1943 9.4119 9.4135 9.8546 9.8730 11.1896 11.2023 11.3016 11.6314 k =-0.2537 0.3461 0.4292 ( 6506 PWs) bands (ev): -7.5903 -7.5903 -6.8085 -6.8011 -6.7379 -6.7368 -6.4853 -6.4760 -2.0233 -2.0224 -1.2274 -1.2070 -1.0771 -1.0372 0.2926 0.3107 0.3749 0.4499 0.4964 0.5675 1.3360 1.3454 1.5100 1.5497 2.1758 2.2367 2.2510 2.2660 2.4383 2.4984 2.9390 2.9457 2.9598 3.0212 3.2528 3.2845 3.6932 3.7399 3.7547 3.7728 4.1077 4.1137 4.6354 4.6370 4.7720 4.8773 4.8860 4.9348 4.9674 5.0458 5.1875 5.2129 5.3088 5.4398 5.6094 5.6416 5.6725 5.7177 5.9327 5.9460 6.2207 6.2618 8.3013 8.3649 9.1727 9.1821 9.4632 9.4653 9.8719 9.8884 11.1074 11.1180 11.4479 11.7286 k =-0.2447 0.3338 0.4138 ( 6508 PWs) bands (ev): -7.6051 -7.6050 -6.7921 -6.7847 -6.7331 -6.7321 -6.4853 -6.4760 -2.0341 -2.0261 -1.2244 -1.2085 -1.0896 -1.0308 0.2831 0.3217 0.3619 0.4578 0.4937 0.5772 1.3481 1.3628 1.4908 1.5330 2.1643 2.2295 2.2410 2.2568 2.4747 2.5364 2.9260 2.9294 2.9458 3.0025 3.2551 3.2872 3.7004 3.7344 3.7365 3.7589 4.0933 4.1033 4.6420 4.6441 4.7638 4.8729 4.9020 4.9385 4.9637 5.0535 5.1754 5.1895 5.3193 5.4523 5.6519 5.6661 5.7094 5.7398 5.9258 5.9382 6.2031 6.2372 8.2995 8.3598 9.1556 9.1616 9.5145 9.5207 9.8906 9.9047 11.0097 11.0248 11.5804 11.7026 k =-0.2356 0.3214 0.3985 ( 6516 PWs) bands (ev): -7.6211 -7.6209 -6.7756 -6.7683 -6.7267 -6.7257 -6.4852 -6.4761 -2.0449 -2.0302 -1.2219 -1.2102 -1.1020 -1.0254 0.2740 0.3288 0.3538 0.4653 0.4907 0.5866 1.3578 1.3785 1.4737 1.5172 2.1515 2.2101 2.2436 2.2497 2.5119 2.5754 2.9037 2.9230 2.9371 2.9842 3.2586 3.2906 3.7002 3.7190 3.7223 3.7596 4.0805 4.0949 4.6485 4.6512 4.7559 4.8685 4.9142 4.9454 4.9604 5.0586 5.1593 5.1673 5.3375 5.4660 5.6830 5.6933 5.7501 5.7582 5.9151 5.9257 6.1891 6.2159 8.3005 8.3566 9.1317 9.1334 9.5667 9.5769 9.9109 9.9227 10.9016 10.9243 11.6475 11.6490 k =-0.2266 0.3090 0.3832 ( 6510 PWs) bands (ev): -7.6380 -7.6377 -6.7592 -6.7519 -6.7187 -6.7177 -6.4852 -6.4762 -2.0558 -2.0345 -1.2199 -1.2120 -1.1141 -1.0211 0.2653 0.3253 0.3576 0.4723 0.4874 0.5954 1.3645 1.3921 1.4593 1.5026 2.1378 2.1899 2.2444 2.2477 2.5489 2.6145 2.8801 2.9193 2.9335 2.9678 3.2631 3.2944 3.6868 3.6991 3.7240 3.7633 4.0697 4.0884 4.6549 4.6582 4.7485 4.8642 4.9221 4.9558 4.9573 5.0611 5.1415 5.1465 5.3609 5.4813 5.6918 5.7252 5.7785 5.7931 5.9011 5.9086 6.1812 6.2007 8.3040 8.3550 9.0984 9.1019 9.6190 9.6331 9.9327 9.9425 10.7868 10.8183 11.5844 11.6098 k =-0.2175 0.2967 0.3679 ( 6504 PWs) bands (ev): -7.6557 -7.6554 -6.7430 -6.7357 -6.7093 -6.7084 -6.4852 -6.4763 -2.0667 -2.0391 -1.2188 -1.2140 -1.1254 -1.0178 0.2570 0.3163 0.3682 0.4786 0.4839 0.6037 1.3675 1.4033 1.4482 1.4895 2.1233 2.1694 2.2404 2.2528 2.5850 2.6525 2.8558 2.9147 2.9357 2.9577 3.2684 3.2987 3.6704 3.6798 3.7290 3.7665 4.0607 4.0841 4.6612 4.6651 4.7415 4.8599 4.9272 4.9544 4.9679 5.0612 5.1236 5.1271 5.3881 5.4982 5.6912 5.7325 5.8140 5.8376 5.8839 5.8873 6.1814 6.1943 8.3091 8.3539 9.0576 9.0671 9.6707 9.6887 9.9558 9.9641 10.6680 10.7086 11.5114 11.5412 k =-0.2084 0.2843 0.3525 ( 6498 PWs) bands (ev): -7.6739 -7.6736 -6.7268 -6.7196 -6.6988 -6.6978 -6.4852 -6.4765 -2.0775 -2.0441 -1.2186 -1.2160 -1.1357 -1.0155 0.2493 0.3071 0.3802 0.4800 0.4844 0.6114 1.3669 1.4119 1.4407 1.4780 2.1082 2.1487 2.2373 2.2586 2.6196 2.6884 2.8313 2.9035 2.9443 2.9607 3.2743 3.3033 3.6548 3.6618 3.7337 3.7686 4.0538 4.0819 4.6673 4.6719 4.7349 4.8559 4.9310 4.9515 4.9798 5.0588 5.1062 5.1089 5.4181 5.5170 5.6808 5.7193 5.8587 5.8619 5.8645 5.8840 6.1907 6.1982 8.3147 8.3521 9.0126 9.0290 9.7212 9.7430 9.9794 9.9872 10.5478 10.5973 11.4316 11.4622 k =-0.1994 0.2719 0.3372 ( 6486 PWs) bands (ev): -7.6926 -7.6922 -6.7109 -6.7038 -6.6873 -6.6863 -6.4851 -6.4768 -2.0882 -2.0495 -1.2195 -1.2181 -1.1447 -1.0143 0.2422 0.2989 0.3923 0.4759 0.4893 0.6185 1.3635 1.4179 1.4361 1.4686 2.0925 2.1279 2.2348 2.2647 2.6520 2.7217 2.8068 2.8871 2.9600 2.9759 3.2807 3.3081 3.6406 3.6455 3.7372 3.7692 4.0491 4.0819 4.6733 4.6784 4.7287 4.8519 4.9341 4.9485 4.9905 5.0539 5.0901 5.0924 5.4503 5.5378 5.6612 5.6938 5.8340 5.8375 5.9110 5.9311 6.2088 6.2120 8.3189 8.3476 8.9654 8.9901 9.7696 9.7952 10.0021 10.0108 10.4289 10.4869 11.3464 11.3770 k =-0.1903 0.2596 0.3219 ( 6486 PWs) bands (ev): -7.7115 -7.7111 -6.6953 -6.6883 -6.6750 -6.6739 -6.4851 -6.4770 -2.0988 -2.0553 -1.2216 -1.2203 -1.1520 -1.0141 0.2358 0.2922 0.4040 0.4716 0.4936 0.6248 1.3587 1.4213 1.4334 1.4613 2.0764 2.1069 2.2323 2.2706 2.6817 2.7521 2.7824 2.8690 2.9826 3.0000 3.2874 3.3132 3.6281 3.6310 3.7392 3.7682 4.0467 4.0839 4.6791 4.6847 4.7231 4.8482 4.9368 4.9450 4.9994 5.0464 5.0759 5.0773 5.4841 5.5603 5.6341 5.6604 5.8033 5.8085 5.9635 5.9795 6.2341 6.2345 8.3189 8.3377 8.9192 8.9530 9.8145 9.8448 10.0203 10.0321 10.3158 10.3818 11.2572 11.2875 k =-0.1812 0.2472 0.3065 ( 6494 PWs) bands (ev): -7.7304 -7.7300 -6.6799 -6.6731 -6.6621 -6.6609 -6.4851 -6.4773 -2.1091 -2.0615 -1.2249 -1.2224 -1.1576 -1.0148 0.2301 0.2870 0.4148 0.4672 0.4969 0.6302 1.3538 1.4224 1.4318 1.4564 2.0597 2.0859 2.2296 2.2760 2.7080 2.7579 2.7803 2.8518 3.0113 3.0307 3.2943 3.3183 3.6180 3.6188 3.7397 3.7653 4.0466 4.0881 4.6847 4.6906 4.7181 4.8446 4.9389 4.9407 5.0063 5.0367 5.0633 5.0639 5.5184 5.5822 5.6025 5.6242 5.7707 5.7766 6.0175 6.0288 6.2623 6.2661 8.3112 8.3194 8.8776 8.9214 9.8531 9.8904 10.0254 10.0412 10.2209 10.2919 11.1653 11.1951 k =-0.1722 0.2349 0.2912 ( 6494 PWs) bands (ev): -7.7492 -7.7488 -6.6650 -6.6584 -6.6486 -6.6475 -6.4850 -6.4776 -2.1192 -2.0681 -1.2290 -1.2245 -1.1618 -1.0166 0.2253 0.2834 0.4244 0.4632 0.4994 0.6348 1.3492 1.4214 1.4311 1.4541 2.0426 2.0648 2.2265 2.2804 2.7288 2.7335 2.8070 2.8381 3.0445 3.0663 3.3014 3.3234 3.6094 3.6106 3.7386 3.7606 4.0488 4.0942 4.6902 4.6957 4.7141 4.8412 4.9354 4.9403 5.0111 5.0260 5.0518 5.0524 5.5425 5.5702 5.5784 5.6208 5.7372 5.7425 6.0726 6.0789 6.2948 6.3021 8.2897 8.2916 8.8452 8.8982 9.8752 9.9278 10.0017 10.0163 10.1762 10.2364 11.0721 11.1012 k =-0.1631 0.2225 0.2759 ( 6492 PWs) bands (ev): -7.7678 -7.7674 -6.6504 -6.6440 -6.6350 -6.6338 -6.4849 -6.4779 -2.1290 -2.0750 -1.2334 -1.2265 -1.1649 -1.0193 0.2213 0.2815 0.4316 0.4604 0.5011 0.6383 1.3453 1.4185 1.4316 1.4545 2.0252 2.0438 2.2230 2.2835 2.7089 2.7392 2.8332 2.8336 3.0801 3.1050 3.3087 3.3285 3.6036 3.6067 3.7360 3.7542 4.0535 4.1022 4.6954 4.6988 4.7122 4.8381 4.9289 4.9406 5.0137 5.0156 5.0405 5.0430 5.5179 5.5274 5.6006 5.6487 5.7044 5.7071 6.1284 6.1295 6.3302 6.3413 8.2471 8.2571 8.8254 8.8857 9.8447 9.9097 9.9877 9.9921 10.1825 10.2242 10.9791 11.0072 k =-0.1541 0.2101 0.2606 ( 6502 PWs) bands (ev): -7.7860 -7.7856 -6.6362 -6.6302 -6.6212 -6.6200 -6.4849 -6.4783 -2.1385 -2.0823 -1.2379 -1.2284 -1.1673 -1.0229 0.2182 0.2812 0.4348 0.4602 0.5018 0.6408 1.3416 1.4137 1.4340 1.4582 2.0074 2.0231 2.2190 2.2852 2.6839 2.7349 2.8426 2.8596 3.1163 3.1447 3.3160 3.3335 3.6023 3.6072 3.7321 3.7461 4.0602 4.1117 4.6986 4.7004 4.7139 4.8350 4.9208 4.9397 5.0062 5.0142 5.0287 5.0354 5.4798 5.4816 5.6261 5.6699 5.6819 5.6823 6.1803 6.1846 6.3674 6.3825 8.1915 8.2066 8.8193 8.8839 9.7585 9.8222 10.0047 10.0154 10.2061 10.2363 10.8878 10.9146 k =-0.1450 0.1978 0.2452 ( 6490 PWs) bands (ev): -7.8037 -7.8033 -6.6225 -6.6169 -6.6074 -6.6063 -6.4847 -6.4786 -2.1475 -2.0900 -1.2418 -1.2301 -1.1693 -1.0274 0.2160 0.2826 0.4334 0.4633 0.5017 0.6422 1.3377 1.4073 1.4392 1.4652 1.9894 2.0028 2.2146 2.2855 2.6584 2.7195 2.8617 2.8863 3.1510 3.1834 3.3232 3.3385 3.6066 3.6134 3.7270 3.7368 4.0690 4.1227 4.6963 4.7052 4.7178 4.8322 4.9112 4.9375 4.9982 5.0127 5.0162 5.0299 5.4356 5.4407 5.6132 5.6343 5.7005 5.7172 6.2312 6.2411 6.4056 6.4251 8.1243 8.1418 8.8256 8.8916 9.6571 9.7221 10.0256 10.0428 10.2340 10.2572 10.7996 10.8248 k =-0.1359 0.1854 0.2299 ( 6499 PWs) bands (ev): -7.8208 -7.8204 -6.6093 -6.6041 -6.5939 -6.5928 -6.4846 -6.4790 -2.1560 -2.0979 -1.2451 -1.2317 -1.1711 -1.0326 0.2148 0.2855 0.4291 0.4678 0.5007 0.6423 1.3333 1.3996 1.4477 1.4757 1.9714 1.9831 2.2100 2.2844 2.6322 2.6981 2.8852 2.9131 3.1828 3.2190 3.3302 3.3431 3.6176 3.6264 3.7213 3.7267 4.0796 4.1349 4.6935 4.7097 4.7224 4.8292 4.9003 4.9338 4.9913 5.0029 5.0091 5.0263 5.3904 5.4024 5.5810 5.5980 5.7404 5.7555 6.2818 6.2973 6.4442 6.4683 8.0479 8.0657 8.8414 8.9066 9.5539 9.6200 10.0444 10.0652 10.2622 10.2801 10.7164 10.7395 k =-0.1269 0.1731 0.2146 ( 6495 PWs) bands (ev): -7.8372 -7.8368 -6.5967 -6.5920 -6.5807 -6.5796 -6.4844 -6.4793 -2.1641 -2.1061 -1.2475 -1.2331 -1.1729 -1.0386 0.2146 0.2899 0.4236 0.4722 0.4991 0.6412 1.3282 1.3909 1.4601 1.4895 1.9535 1.9642 2.2054 2.2820 2.6049 2.6734 2.9101 2.9396 3.2103 3.2495 3.3367 3.3476 3.6358 3.6466 3.7160 3.7166 4.0917 4.1480 4.6908 4.7140 4.7270 4.8262 4.8886 4.9291 4.9849 4.9894 5.0032 5.0247 5.3467 5.3658 5.5460 5.5623 5.7851 5.7964 6.3317 6.3530 6.4827 6.5117 7.9644 7.9813 8.8637 8.9268 9.4530 9.5192 10.0580 10.0812 10.2884 10.3020 10.6399 10.6606 k =-0.1178 0.1607 0.1993 ( 6501 PWs) bands (ev): -7.8528 -7.8524 -6.5848 -6.5806 -6.5679 -6.5669 -6.4841 -6.4796 -2.1715 -2.1144 -1.2489 -1.2342 -1.1748 -1.0453 0.2154 0.2958 0.4175 0.4758 0.4967 0.6387 1.3225 1.3815 1.4763 1.5063 1.9359 1.9465 2.2009 2.2784 2.5764 2.6463 2.9350 2.9652 3.2332 3.2741 3.3423 3.3517 3.6596 3.6698 3.7089 3.7161 4.1051 4.1618 4.6884 4.7179 4.7314 4.8229 4.8766 4.9235 4.9725 4.9818 4.9949 5.0244 5.3050 5.3314 5.5108 5.5272 5.8324 5.8399 6.3806 6.4077 6.5205 6.5546 7.8758 7.8912 8.8899 8.9500 9.3561 9.4213 10.0649 10.0900 10.3110 10.3209 10.5722 10.5900 k =-0.1087 0.1483 0.1839 ( 6499 PWs) bands (ev): -7.8675 -7.8671 -6.5735 -6.5698 -6.5557 -6.5547 -6.4837 -6.4799 -2.1784 -2.1228 -1.2492 -1.2351 -1.1767 -1.0527 0.2172 0.3029 0.4111 0.4785 0.4938 0.6349 1.3164 1.3717 1.4961 1.5261 1.9188 1.9302 2.1966 2.2739 2.5465 2.6170 2.9590 2.9894 3.2518 3.2929 3.3470 3.3553 3.6750 3.6798 3.7177 3.7377 4.1195 4.1760 4.6863 4.7214 4.7356 4.8190 4.8648 4.9174 4.9567 4.9773 4.9845 5.0250 5.2658 5.2995 5.4764 5.4932 5.8817 5.8860 6.4282 6.4609 6.5576 6.5967 7.7839 7.7974 8.9180 8.9742 9.2641 9.3275 10.0646 10.0909 10.3282 10.3352 10.5154 10.5301 k =-0.0997 0.1360 0.1686 ( 6499 PWs) bands (ev): -7.8813 -7.8809 -6.5630 -6.5599 -6.5441 -6.5431 -6.4833 -6.4801 -2.1846 -2.1312 -1.2486 -1.2357 -1.1788 -1.0606 0.2199 0.3111 0.4047 0.4803 0.4905 0.6297 1.3101 1.3618 1.5193 1.5482 1.9025 1.9156 2.1928 2.2686 2.5151 2.5859 2.9816 3.0115 3.2671 3.3067 3.3507 3.3583 3.6706 3.6758 3.7534 3.7803 4.1346 4.1903 4.6846 4.7245 4.7395 4.8140 4.8541 4.9111 4.9400 4.9721 4.9734 5.0259 5.2296 5.2703 5.4432 5.4603 5.9329 5.9345 6.4739 6.5121 6.5935 6.6376 7.6899 7.7014 8.9462 8.9975 9.1784 9.2384 10.0569 10.0837 10.3381 10.3434 10.4716 10.4829 k =-0.0906 0.1236 0.1533 ( 6507 PWs) bands (ev): -7.8941 -7.8937 -6.5533 -6.5509 -6.5332 -6.5323 -6.4828 -6.4802 -2.1901 -2.1395 -1.2469 -1.2360 -1.1810 -1.0690 0.2237 0.3201 0.3985 0.4812 0.4868 0.6232 1.3040 1.3518 1.5453 1.5723 1.8872 1.9032 2.1896 2.2626 2.4822 2.5528 3.0022 3.0311 3.2800 3.3171 3.3536 3.3607 3.6612 3.6683 3.8003 3.8319 4.1502 4.2044 4.6833 4.7270 4.7432 4.8075 4.8446 4.9045 4.9229 4.9580 4.9698 5.0265 5.1968 5.2438 5.4116 5.4288 5.9853 5.9859 6.5175 6.5606 6.6282 6.6767 7.5949 7.6045 8.9728 9.0161 9.1017 9.1549 10.0431 10.0693 10.3393 10.3439 10.4419 10.4500 k =-0.0816 0.1113 0.1379 ( 6507 PWs) bands (ev): -7.9058 -7.9055 -6.5445 -6.5427 -6.5231 -6.5223 -6.4821 -6.4802 -2.1948 -2.1476 -1.2443 -1.2360 -1.1832 -1.0779 0.2283 0.3292 0.3930 0.4815 0.4830 0.6154 1.2983 1.3421 1.5737 1.5975 1.8733 1.8936 2.1871 2.2561 2.4479 2.5181 3.0206 3.0476 3.2915 3.3250 3.3558 3.3626 3.6514 3.6598 3.8524 3.8882 4.1661 4.2181 4.6823 4.7288 4.7464 4.7997 4.8364 4.8978 4.9058 4.9421 4.9665 5.0264 5.1677 5.2199 5.3819 5.3989 6.0385 6.0405 6.5585 6.6053 6.6619 6.7137 7.5000 7.5078 8.9959 9.0044 9.0593 9.0786 10.0253 10.0499 10.3322 10.3368 10.4244 10.4300 k =-0.0725 0.0989 0.1226 ( 6511 PWs) bands (ev): -7.9164 -7.9161 -6.5366 -6.5354 -6.5140 -6.5132 -6.4813 -6.4801 -2.1988 -2.1555 -1.2409 -1.2358 -1.1853 -1.0871 0.2338 0.3373 0.3892 0.4791 0.4812 0.6062 1.2931 1.3328 1.6036 1.6230 1.8612 1.8874 2.1853 2.2492 2.4124 2.4817 3.0366 3.0612 3.3022 3.3315 3.3573 3.3640 3.6421 3.6514 3.9074 3.9468 4.1818 4.2311 4.6817 4.7297 4.7494 4.7912 4.8281 4.8895 4.8908 4.9247 4.9635 5.0249 5.1430 5.1984 5.3547 5.3710 6.0939 6.0969 6.5965 6.6450 6.6950 6.7481 7.4059 7.4121 8.9468 8.9936 9.0307 9.0663 10.0064 10.0285 10.3205 10.3249 10.4141 10.4185 k =-0.0634 0.0865 0.1073 ( 6513 PWs) bands (ev): -7.9258 -7.9256 -6.5296 -6.5291 -6.5058 -6.5052 -6.4803 -6.4797 -2.2020 -2.1631 -1.2370 -1.2352 -1.1872 -1.0967 0.2401 0.3424 0.3889 0.4752 0.4807 0.5958 1.2887 1.3240 1.6341 1.6474 1.8517 1.8854 2.1844 2.2420 2.3761 2.4441 3.0500 3.0717 3.3124 3.3371 3.3585 3.3650 3.6338 3.6434 3.9638 4.0056 4.1972 4.2433 4.6815 4.7292 4.7518 4.7831 4.8178 4.8758 4.8824 4.9071 4.9609 5.0213 5.1233 5.1793 5.3301 5.3453 6.1513 6.1548 6.6311 6.6783 6.7280 6.7794 7.3135 7.3183 8.8887 8.9356 9.0415 9.0771 9.9890 10.0080 10.3076 10.3114 10.4062 10.4105 k =-0.0544 0.0742 0.0920 ( 6503 PWs) bands (ev): -7.9341 -7.9339 -6.5237 -6.5237 -6.4988 -6.4983 -6.4792 -6.4791 -2.2044 -2.1703 -1.2344 -1.2328 -1.1885 -1.1065 0.2471 0.3427 0.3938 0.4714 0.4802 0.5844 1.2851 1.3158 1.6636 1.6693 1.8460 1.8883 2.1844 2.2345 2.3396 2.4054 3.0611 3.0796 3.3223 3.3420 3.3593 3.3658 3.6266 3.6360 4.0200 4.0629 4.2120 4.2544 4.6816 4.7272 4.7539 4.7759 4.8044 4.8660 4.8697 4.8924 4.9589 5.0153 5.1091 5.1623 5.3087 5.3223 6.2105 6.2141 6.6619 6.7049 6.7603 6.8072 7.2236 7.2274 8.8371 8.8787 9.0545 9.0850 9.9748 9.9904 10.2949 10.2980 10.3987 10.4034 k =-0.0453 0.0618 0.0766 ( 6495 PWs) bands (ev): -7.9411 -7.9409 -6.5193 -6.5189 -6.4931 -6.4927 -6.4780 -6.4778 -2.2059 -2.1770 -1.2333 -1.2288 -1.1888 -1.1164 0.2547 0.3388 0.4030 0.4678 0.4800 0.5719 1.2824 1.3083 1.6876 1.6899 1.8457 1.8965 2.1853 2.2267 2.3040 2.3663 3.0700 3.0851 3.3315 3.3464 3.3598 3.3663 3.6207 3.6293 4.0746 4.1164 4.2261 4.2645 4.6820 4.7231 4.7555 4.7696 4.7889 4.8505 4.8602 4.8829 4.9575 5.0071 5.1000 5.1473 5.2906 5.3021 6.2711 6.2745 6.6882 6.7250 6.7906 6.8311 7.1373 7.1403 8.7933 8.8287 9.0645 9.0896 9.9646 9.9768 10.2830 10.2853 10.3914 10.3965 k =-0.0362 0.0494 0.0613 ( 6475 PWs) bands (ev): -7.9469 -7.9467 -6.5157 -6.5150 -6.4886 -6.4885 -6.4765 -6.4762 -2.2066 -2.1831 -1.2319 -1.2257 -1.1876 -1.1264 0.2629 0.3325 0.4142 0.4644 0.4806 0.5588 1.2806 1.3016 1.7017 1.7101 1.8530 1.9090 2.1871 2.2186 2.2711 2.3274 3.0769 3.0887 3.3400 3.3501 3.3600 3.3666 3.6161 3.6235 4.1256 4.1636 4.2396 4.2738 4.6826 4.7170 4.7565 4.7613 4.7766 4.8281 4.8573 4.8765 4.9570 4.9977 5.0952 5.1343 5.2760 5.2852 6.3323 6.3353 6.7095 6.7388 6.8176 6.8506 7.0561 7.0587 8.7576 8.7865 9.0715 9.0912 9.9583 9.9673 10.2722 10.2739 10.3846 10.3897 k =-0.0272 0.0371 0.0460 ( 6471 PWs) bands (ev): -7.9514 -7.9513 -6.5130 -6.5123 -6.4856 -6.4856 -6.4748 -6.4745 -2.2065 -2.1887 -1.2304 -1.2239 -1.1844 -1.1363 0.2715 0.3249 0.4256 0.4612 0.4828 0.5450 1.2799 1.2957 1.7119 1.7224 1.8686 1.9231 2.1899 2.2097 2.2435 2.2899 3.0822 3.0908 3.3474 3.3531 3.3600 3.3665 3.6128 3.6187 4.1705 4.2010 4.2529 4.2829 4.6834 4.7087 4.7498 4.7562 4.7716 4.8056 4.8563 4.8713 4.9575 4.9882 5.0935 5.1231 5.2648 5.2716 6.3927 6.3951 6.7242 6.7454 6.8403 6.8651 6.9829 6.9855 8.7304 8.7524 9.0763 9.0908 9.9551 9.9613 10.2631 10.2642 10.3788 10.3834 k =-0.0181 0.0247 0.0307 ( 6467 PWs) bands (ev): -7.9546 -7.9546 -6.5110 -6.5104 -6.4838 -6.4836 -6.4731 -6.4729 -2.2055 -2.1935 -1.2287 -1.2234 -1.1792 -1.1460 0.2804 0.3165 0.4360 0.4579 0.4872 0.5312 1.2801 1.2907 1.7190 1.7279 1.8900 1.9344 2.1936 2.2009 2.2242 2.2554 3.0861 3.0918 3.3535 3.3553 3.3598 3.3659 3.6108 3.6148 4.2056 4.2254 4.2669 4.2915 4.6843 4.6995 4.7412 4.7537 4.7700 4.7866 4.8567 4.8669 4.9591 4.9795 5.0941 5.1138 5.2571 5.2616 6.4492 6.4509 6.7302 6.7431 6.8581 6.8744 6.9231 6.9258 8.7119 8.7268 9.0796 9.0891 9.9540 9.9579 10.2560 10.2567 10.3746 10.3781 k =-0.0091 0.0124 0.0153 ( 6479 PWs) bands (ev): -7.9566 -7.9565 -6.5098 -6.5094 -6.4828 -6.4827 -6.4720 -6.4719 -2.2037 -2.1977 -1.2270 -1.2241 -1.1723 -1.1554 0.2895 0.3076 0.4442 0.4544 0.4947 0.5176 1.2813 1.2866 1.7240 1.7289 1.9122 1.9376 2.1976 2.1984 2.2124 2.2262 3.0889 3.0917 3.3570 3.3578 3.3597 3.3645 3.6100 3.6121 4.2275 4.2366 4.2818 4.2965 4.6853 4.6918 4.7379 4.7474 4.7698 4.7753 4.8581 4.8633 4.9619 4.9721 5.0965 5.1063 5.2530 5.2551 6.4943 6.4952 6.7266 6.7321 6.8702 6.8764 6.8868 6.8872 8.7023 8.7098 9.0821 9.0868 9.9542 9.9560 10.2516 10.2520 10.3724 10.3742 k = 0.0000 0.0000 0.0000 ( 6491 PWs) bands (ev): -7.9572 -7.9572 -6.5092 -6.5092 -6.4824 -6.4824 -6.4715 -6.4715 -2.2011 -2.2011 -1.2254 -1.2254 -1.1643 -1.1643 0.2986 0.2986 0.4501 0.4501 0.5051 0.5051 1.2835 1.2835 1.7273 1.7273 1.9297 1.9297 2.2038 2.2038 2.2065 2.2065 3.0907 3.0907 3.3581 3.3581 3.3622 3.3622 3.6105 3.6105 4.2371 4.2371 4.2934 4.2934 4.6873 4.6873 4.7404 4.7404 4.7710 4.7710 4.8603 4.8603 4.9662 4.9662 5.1005 5.1005 5.2522 5.2522 6.5133 6.5133 6.7232 6.7232 6.8708 6.8708 6.8795 6.8795 8.7016 8.7016 9.0844 9.0844 9.9549 9.9549 10.2502 10.2502 10.3723 10.3723 k = 0.0000 0.0000 0.0000 ( 6491 PWs) bands (ev): -7.9572 -7.9572 -6.5092 -6.5092 -6.4824 -6.4824 -6.4715 -6.4715 -2.2011 -2.2011 -1.2254 -1.2254 -1.1643 -1.1643 0.2986 0.2986 0.4501 0.4501 0.5051 0.5051 1.2835 1.2835 1.7273 1.7273 1.9297 1.9297 2.2038 2.2038 2.2065 2.2065 3.0907 3.0907 3.3581 3.3581 3.3622 3.3622 3.6105 3.6105 4.2371 4.2371 4.2934 4.2934 4.6873 4.6873 4.7404 4.7404 4.7710 4.7710 4.8603 4.8603 4.9662 4.9662 5.1005 5.1005 5.2522 5.2522 6.5133 6.5133 6.7232 6.7232 6.8708 6.8708 6.8795 6.8795 8.7016 8.7016 9.0844 9.0844 9.9549 9.9549 10.2502 10.2502 10.3723 10.3723 k = 0.0172 0.0126 0.0000 ( 6479 PWs) bands (ev): -7.9565 -7.9565 -6.5105 -6.5105 -6.4824 -6.4824 -6.4715 -6.4715 -2.2002 -2.2002 -1.2254 -1.2254 -1.1643 -1.1643 0.2986 0.2986 0.4498 0.4498 0.5052 0.5052 1.2803 1.2803 1.7313 1.7313 1.9295 1.9295 2.2041 2.2041 2.2076 2.2076 3.0915 3.0915 3.3578 3.3578 3.3623 3.3623 3.6100 3.6100 4.2379 4.2379 4.2944 4.2944 4.6877 4.6877 4.7406 4.7406 4.7715 4.7715 4.8604 4.8604 4.9663 4.9663 5.0999 5.0999 5.2525 5.2525 6.4915 6.4915 6.7293 6.7293 6.8678 6.8678 6.8943 6.8943 8.7028 8.7028 9.0828 9.0828 9.9529 9.9529 10.2494 10.2494 10.3699 10.3699 k = 0.0345 0.0253 0.0000 ( 6483 PWs) bands (ev): -7.9544 -7.9544 -6.5144 -6.5144 -6.4825 -6.4825 -6.4716 -6.4716 -2.1976 -2.1976 -1.2255 -1.2255 -1.1645 -1.1645 0.2986 0.2986 0.4489 0.4489 0.5054 0.5054 1.2710 1.2710 1.7429 1.7429 1.9289 1.9289 2.2052 2.2052 2.2105 2.2105 3.0941 3.0941 3.3570 3.3570 3.3623 3.3623 3.6084 3.6084 4.2405 4.2405 4.2975 4.2975 4.6889 4.6889 4.7411 4.7411 4.7727 4.7727 4.8609 4.8609 4.9665 4.9665 5.0980 5.0980 5.2533 5.2533 6.4396 6.4396 6.7357 6.7357 6.8591 6.8591 6.9372 6.9372 8.7064 8.7064 9.0778 9.0778 9.9475 9.9475 10.2466 10.2466 10.3625 10.3625 k = 0.0517 0.0379 0.0000 ( 6483 PWs) bands (ev): -7.9508 -7.9508 -6.5209 -6.5209 -6.4826 -6.4826 -6.4718 -6.4718 -2.1932 -2.1932 -1.2258 -1.2258 -1.1648 -1.1648 0.2987 0.2987 0.4474 0.4474 0.5059 0.5059 1.2570 1.2570 1.7609 1.7609 1.9280 1.9280 2.2075 2.2075 2.2148 2.2148 3.0983 3.0983 3.3558 3.3558 3.3622 3.3622 3.6060 3.6060 4.2448 4.2448 4.3027 4.3027 4.6909 4.6909 4.7419 4.7419 4.7749 4.7749 4.8616 4.8616 4.9669 4.9669 5.0947 5.0947 5.2547 5.2547 6.3749 6.3749 6.7327 6.7327 6.8447 6.8447 7.0002 7.0002 8.7123 8.7123 9.0692 9.0692 9.9396 9.9396 10.2410 10.2410 10.3496 10.3496 k = 0.0690 0.0506 0.0000 ( 6483 PWs) bands (ev): -7.9458 -7.9458 -6.5299 -6.5299 -6.4827 -6.4827 -6.4720 -6.4720 -2.1872 -2.1872 -1.2262 -1.2262 -1.1653 -1.1653 0.2987 0.2987 0.4452 0.4452 0.5065 0.5065 1.2394 1.2394 1.7838 1.7838 1.9267 1.9267 2.2111 2.2111 2.2205 2.2205 3.1040 3.1040 3.3541 3.3541 3.3621 3.3621 3.6027 3.6027 4.2506 4.2506 4.3098 4.3098 4.6938 4.6938 4.7428 4.7428 4.7782 4.7782 4.8625 4.8625 4.9674 4.9674 5.0898 5.0898 5.2571 5.2571 6.3059 6.3059 6.7215 6.7215 6.8249 6.8249 7.0742 7.0742 8.7203 8.7203 9.0570 9.0570 9.9308 9.9308 10.2313 10.2313 10.3306 10.3306 k = 0.0862 0.0632 0.0000 ( 6475 PWs) bands (ev): -7.9395 -7.9395 -6.5413 -6.5413 -6.4829 -6.4829 -6.4722 -6.4722 -2.1796 -2.1796 -1.2267 -1.2267 -1.1658 -1.1658 0.2986 0.2986 0.4426 0.4426 0.5074 0.5074 1.2198 1.2198 1.8102 1.8102 1.9252 1.9252 2.2160 2.2160 2.2273 2.2273 3.1113 3.1113 3.3522 3.3522 3.3618 3.3618 3.5986 3.5986 4.2580 4.2580 4.3188 4.3188 4.6973 4.6973 4.7437 4.7437 4.7827 4.7827 4.8634 4.8634 4.9683 4.9683 5.0832 5.0832 5.2606 5.2606 6.2361 6.2361 6.7040 6.7040 6.8001 6.8001 7.1536 7.1536 8.7302 8.7302 9.0412 9.0412 9.9229 9.9229 10.2158 10.2158 10.3048 10.3048 k = 0.1034 0.0758 0.0000 ( 6487 PWs) bands (ev): -7.9318 -7.9318 -6.5550 -6.5550 -6.4831 -6.4831 -6.4725 -6.4725 -2.1705 -2.1705 -1.2273 -1.2273 -1.1665 -1.1665 0.2983 0.2983 0.4394 0.4394 0.5085 0.5085 1.1993 1.1993 1.8387 1.8387 1.9234 1.9234 2.2221 2.2221 2.2354 2.2354 3.1198 3.1198 3.3498 3.3498 3.3614 3.3614 3.5940 3.5940 4.2668 4.2668 4.3295 4.3295 4.7014 4.7014 4.7444 4.7444 4.7885 4.7885 4.8643 4.8643 4.9692 4.9692 5.0748 5.0748 5.2654 5.2654 6.1673 6.1673 6.6818 6.6818 6.7708 6.7708 7.2354 7.2354 8.7415 8.7415 9.0220 9.0220 9.9178 9.9178 10.1927 10.1927 10.2714 10.2714 k = 0.1207 0.0885 0.0000 ( 6523 PWs) bands (ev): -7.9227 -7.9227 -6.5710 -6.5710 -6.4833 -6.4833 -6.4728 -6.4728 -2.1600 -2.1600 -1.2282 -1.2282 -1.1673 -1.1673 0.2978 0.2978 0.4357 0.4357 0.5099 0.5099 1.1790 1.1790 1.8680 1.8680 1.9215 1.9215 2.2294 2.2294 2.2445 2.2445 3.1295 3.1295 3.3473 3.3473 3.3610 3.3610 3.5889 3.5889 4.2768 4.2768 4.3418 4.3418 4.7061 4.7061 4.7449 4.7449 4.7957 4.7957 4.8647 4.8647 4.9704 4.9704 5.0647 5.0647 5.2716 5.2716 6.1003 6.1003 6.6556 6.6556 6.7374 6.7374 7.3179 7.3179 8.7530 8.7530 9.0003 9.0003 9.9167 9.9167 10.1608 10.1608 10.2302 10.2302 k = 0.1379 0.1011 0.0000 ( 6515 PWs) bands (ev): -7.9122 -7.9122 -6.5892 -6.5892 -6.4836 -6.4836 -6.4732 -6.4732 -2.1484 -2.1484 -1.2291 -1.2291 -1.1682 -1.1682 0.2969 0.2969 0.4316 0.4316 0.5116 0.5116 1.1596 1.1596 1.8964 1.8964 1.9205 1.9205 2.2379 2.2379 2.2546 2.2546 3.1403 3.1403 3.3445 3.3445 3.3607 3.3607 3.5838 3.5838 4.2879 4.2879 4.3557 4.3557 4.7114 4.7114 4.7453 4.7453 4.8044 4.8044 4.8643 4.8643 4.9720 4.9720 5.0534 5.0534 5.2794 5.2794 6.0358 6.0358 6.6261 6.6261 6.7004 6.7004 7.4001 7.4001 8.7630 8.7630 8.9783 8.9783 9.9210 9.9210 10.1193 10.1193 10.1812 10.1812 k = 0.1552 0.1138 0.0000 ( 6519 PWs) bands (ev): -7.9005 -7.9005 -6.6093 -6.6093 -6.4838 -6.4838 -6.4736 -6.4736 -2.1356 -2.1356 -1.2304 -1.2304 -1.1691 -1.1691 0.2957 0.2957 0.4271 0.4271 0.5136 0.5136 1.1418 1.1418 1.9120 1.9120 1.9314 1.9314 2.2473 2.2473 2.2656 2.2656 3.1518 3.1518 3.3416 3.3416 3.3605 3.3605 3.5789 3.5789 4.3000 4.3000 4.3708 4.3708 4.7171 4.7171 4.7456 4.7456 4.8144 4.8144 4.8626 4.8626 4.9738 4.9738 5.0413 5.0413 5.2887 5.2887 5.9741 5.9741 6.5940 6.5940 6.6606 6.6606 7.4811 7.4811 8.7682 8.7682 8.9596 8.9596 9.9309 9.9309 10.0685 10.0685 10.1249 10.1249 k = 0.1724 0.1264 0.0000 ( 6511 PWs) bands (ev): -7.8876 -7.8876 -6.6312 -6.6312 -6.4841 -6.4841 -6.4741 -6.4741 -2.1220 -2.1220 -1.2318 -1.2318 -1.1701 -1.1701 0.2940 0.2940 0.4224 0.4224 0.5160 0.5160 1.1260 1.1260 1.9114 1.9114 1.9569 1.9569 2.2577 2.2577 2.2774 2.2774 3.1640 3.1640 3.3385 3.3385 3.3604 3.3604 3.5744 3.5744 4.3129 4.3129 4.3871 4.3871 4.7229 4.7229 4.7458 4.7458 4.8257 4.8257 4.8588 4.8588 4.9761 4.9761 5.0294 5.0294 5.2994 5.2994 5.9155 5.9155 6.5596 6.5596 6.6184 6.6184 7.5603 7.5603 8.7639 8.7639 8.9493 8.9493 9.9454 9.9454 10.0108 10.0108 10.0622 10.0622 k = 0.1897 0.1390 0.0000 ( 6495 PWs) bands (ev): -7.8734 -7.8734 -6.6548 -6.6548 -6.4844 -6.4844 -6.4746 -6.4746 -2.1075 -2.1075 -1.2334 -1.2334 -1.1712 -1.1712 0.2918 0.2918 0.4173 0.4173 0.5186 0.5186 1.1128 1.1128 1.9090 1.9090 1.9821 1.9821 2.2689 2.2689 2.2899 2.2899 3.1765 3.1765 3.3354 3.3354 3.3606 3.3606 3.5707 3.5707 4.3264 4.3264 4.4042 4.4042 4.7286 4.7286 4.7462 4.7462 4.8374 4.8374 4.8528 4.8528 4.9788 4.9788 5.0187 5.0187 5.3115 5.3115 5.8600 5.8600 6.5236 6.5236 6.5745 6.5745 7.6373 7.6373 8.7471 8.7471 8.9511 8.9511 9.9324 9.9324 9.9781 9.9781 9.9957 9.9957 k = 0.2069 0.1517 0.0000 ( 6507 PWs) bands (ev): -7.8580 -7.8580 -6.6799 -6.6799 -6.4848 -6.4848 -6.4751 -6.4751 -2.0925 -2.0925 -1.2353 -1.2353 -1.1723 -1.1723 0.2890 0.2890 0.4122 0.4122 0.5215 0.5215 1.1023 1.1023 1.9061 1.9061 2.0050 2.0050 2.2808 2.2808 2.3030 2.3030 3.1893 3.1893 3.3321 3.3321 3.3611 3.3611 3.5681 3.5681 4.3402 4.3402 4.4221 4.4221 4.7329 4.7329 4.7476 4.7476 4.8382 4.8382 4.8550 4.8550 4.9819 4.9819 5.0104 5.0104 5.3248 5.3248 5.8076 5.8076 6.4864 6.4864 6.5294 6.5294 7.7115 7.7115 8.7196 8.7196 8.9636 8.9636 9.8642 9.8642 9.9211 9.9211 10.0056 10.0056 k = 0.2241 0.1643 0.0000 ( 6503 PWs) bands (ev): -7.8416 -7.8416 -6.7064 -6.7064 -6.4851 -6.4851 -6.4756 -6.4756 -2.0771 -2.0771 -1.2375 -1.2375 -1.1735 -1.1735 0.2856 0.2856 0.4069 0.4069 0.5245 0.5245 1.0948 1.0948 1.9032 1.9032 2.0249 2.0249 2.2932 2.2932 2.3165 2.3165 3.2020 3.2020 3.3289 3.3289 3.3619 3.3619 3.5672 3.5672 4.3543 4.3543 4.4405 4.4405 4.7341 4.7341 4.7513 4.7513 4.8245 4.8245 4.8691 4.8691 4.9855 4.9855 5.0051 5.0051 5.3391 5.3391 5.7583 5.7583 6.4484 6.4484 6.4838 6.4838 7.7827 7.7827 8.6854 8.6854 8.9833 8.9833 9.7884 9.7884 9.8464 9.8464 10.0403 10.0403 k = 0.2414 0.1770 0.0000 ( 6507 PWs) bands (ev): -7.8241 -7.8241 -6.7339 -6.7339 -6.4854 -6.4854 -6.4761 -6.4761 -2.0615 -2.0615 -1.2399 -1.2399 -1.1747 -1.1747 0.2818 0.2818 0.4015 0.4015 0.5276 0.5276 1.0905 1.0905 1.9001 1.9001 2.0415 2.0415 2.3061 2.3061 2.3303 2.3303 3.2143 3.2143 3.3257 3.3257 3.3632 3.3632 3.5681 3.5681 4.3684 4.3684 4.4592 4.4592 4.7317 4.7317 4.7569 4.7569 4.8068 4.8068 4.8850 4.8850 4.9896 4.9896 5.0029 5.0029 5.3542 5.3542 5.7119 5.7119 6.4099 6.4099 6.4386 6.4386 7.8505 7.8505 8.6481 8.6481 9.0068 9.0068 9.7102 9.7102 9.7700 9.7700 10.0812 10.0812 k = 0.2586 0.1896 0.0000 ( 6499 PWs) bands (ev): -7.8056 -7.8056 -6.7624 -6.7624 -6.4858 -6.4858 -6.4766 -6.4766 -2.0458 -2.0458 -1.2425 -1.2425 -1.1759 -1.1759 0.2775 0.2775 0.3963 0.3963 0.5307 0.5307 1.0894 1.0894 1.8970 1.8970 2.0544 2.0544 2.3192 2.3192 2.3443 2.3443 3.2261 3.2261 3.3226 3.3226 3.3651 3.3651 3.5712 3.5712 4.3823 4.3823 4.4780 4.4780 4.7248 4.7248 4.7635 4.7635 4.7884 4.7884 4.9020 4.9020 4.9942 4.9942 5.0034 5.0034 5.3699 5.3699 5.6684 5.6684 6.3710 6.3710 6.3944 6.3944 7.9146 7.9146 8.6103 8.6103 9.0318 9.0318 9.6316 9.6316 9.6933 9.6933 10.1274 10.1274 k = 0.2759 0.2022 0.0000 ( 6491 PWs) bands (ev): -7.7864 -7.7864 -6.7916 -6.7916 -6.4861 -6.4861 -6.4772 -6.4772 -2.0303 -2.0303 -1.2453 -1.2453 -1.1771 -1.1771 0.2728 0.2728 0.3911 0.3911 0.5336 0.5336 1.0916 1.0916 1.8938 1.8938 2.0634 2.0634 2.3324 2.3324 2.3583 2.3583 3.2371 3.2371 3.3197 3.3197 3.3676 3.3676 3.5767 3.5767 4.3959 4.3959 4.4966 4.4966 4.7108 4.7108 4.7698 4.7698 4.7738 4.7738 4.9199 4.9199 4.9994 4.9994 5.0059 5.0059 5.3859 5.3859 5.6275 5.6275 6.3317 6.3317 6.3525 6.3525 7.9745 7.9745 8.5738 8.5738 9.0563 9.0563 9.5540 9.5540 9.6174 9.6174 10.1783 10.1783 k = 0.2931 0.2149 0.0000 ( 6507 PWs) bands (ev): -7.7664 -7.7664 -6.8212 -6.8212 -6.4864 -6.4864 -6.4777 -6.4777 -2.0150 -2.0150 -1.2483 -1.2483 -1.1782 -1.1782 0.2679 0.2679 0.3860 0.3860 0.5364 0.5364 1.0969 1.0969 1.8905 1.8905 2.0685 2.0685 2.3455 2.3455 2.3721 2.3721 3.2470 3.2470 3.3170 3.3170 3.3707 3.3707 3.5847 3.5847 4.4090 4.4090 4.5147 4.5147 4.6888 4.6888 4.7636 4.7636 4.7770 4.7770 4.9385 4.9385 5.0051 5.0051 5.0098 5.0098 5.4019 5.4019 5.5892 5.5892 6.2919 6.2919 6.3138 6.3138 8.0296 8.0296 8.5403 8.5403 9.0789 9.0789 9.4791 9.4791 9.5434 9.5434 10.2331 10.2331 k = 0.3103 0.2275 0.0000 ( 6514 PWs) bands (ev): -7.7458 -7.7458 -6.8511 -6.8511 -6.4867 -6.4867 -6.4782 -6.4782 -2.0003 -2.0003 -1.2515 -1.2515 -1.1793 -1.1793 0.2627 0.2627 0.3812 0.3812 0.5389 0.5389 1.1051 1.1051 1.8872 1.8872 2.0699 2.0699 2.3585 2.3585 2.3856 2.3856 3.2557 3.2557 3.3146 3.3146 3.3745 3.3745 3.5953 3.5953 4.4215 4.4215 4.5319 4.5319 4.6611 4.6611 4.7584 4.7584 4.7831 4.7831 4.9576 4.9576 5.0115 5.0115 5.0146 5.0146 5.4173 5.4173 5.5535 5.5535 6.2523 6.2523 6.2783 6.2783 8.0791 8.0791 8.5115 8.5115 9.0978 9.0978 9.4082 9.4082 9.4723 9.4723 10.2912 10.2912 k = 0.3276 0.2402 0.0000 ( 6514 PWs) bands (ev): -7.7248 -7.7248 -6.8809 -6.8809 -6.4870 -6.4870 -6.4787 -6.4787 -1.9861 -1.9861 -1.2547 -1.2547 -1.1804 -1.1804 0.2576 0.2576 0.3766 0.3766 0.5412 0.5412 1.1159 1.1159 1.8837 1.8837 2.0677 2.0677 2.3710 2.3710 2.3986 2.3986 3.2630 3.2630 3.3125 3.3125 3.3789 3.3789 3.6083 3.6083 4.4333 4.4333 4.5472 4.5472 4.6317 4.6317 4.7553 4.7553 4.7887 4.7887 4.9770 4.9770 5.0184 5.0184 5.0202 5.0202 5.4312 5.4312 5.5211 5.5211 6.2140 6.2140 6.2458 6.2458 8.1214 8.1214 8.4892 8.4892 9.1110 9.1110 9.3435 9.3435 9.4050 9.4050 10.3516 10.3516 k = 0.3448 0.2528 0.0000 ( 6514 PWs) bands (ev): -7.7037 -7.7037 -6.9104 -6.9104 -6.4873 -6.4873 -6.4792 -6.4792 -1.9727 -1.9727 -1.2579 -1.2579 -1.1814 -1.1814 0.2525 0.2525 0.3723 0.3723 0.5431 0.5431 1.1289 1.1289 1.8802 1.8802 2.0625 2.0625 2.3831 2.3831 2.4110 2.4110 3.2689 3.2689 3.3108 3.3108 3.3837 3.3837 3.6236 3.6236 4.4443 4.4443 4.5559 4.5559 4.6066 4.6066 4.7532 4.7532 4.7936 4.7936 4.9956 4.9956 5.0254 5.0254 5.0273 5.0273 5.4399 5.4399 5.4949 5.4949 6.1779 6.1779 6.2163 6.2163 8.1548 8.1548 8.4757 8.4757 9.1150 9.1150 9.2878 9.2878 9.3429 9.3429 10.4136 10.4136 k = 0.3621 0.2654 0.0000 ( 6506 PWs) bands (ev): -7.6826 -7.6826 -6.9391 -6.9391 -6.4875 -6.4875 -6.4796 -6.4796 -1.9603 -1.9603 -1.2611 -1.2611 -1.1824 -1.1824 0.2476 0.2476 0.3684 0.3684 0.5447 0.5447 1.1436 1.1436 1.8764 1.8764 2.0549 2.0549 2.3944 2.3944 2.4226 2.4226 3.2734 3.2734 3.3096 3.3096 3.3889 3.3889 3.6408 3.6408 4.4542 4.4542 4.5443 4.5443 4.6006 4.6006 4.7517 4.7517 4.7977 4.7977 5.0116 5.0116 5.0317 5.0317 5.0380 5.0380 5.4329 5.4329 5.4851 5.4851 6.1445 6.1445 6.1896 6.1896 8.1776 8.1776 8.4728 8.4728 9.1054 9.1054 9.2439 9.2439 9.2886 9.2886 10.4760 10.4760 k = 0.3793 0.2781 0.0000 ( 6534 PWs) bands (ev): -7.6620 -7.6620 -6.9667 -6.9667 -6.4878 -6.4878 -6.4800 -6.4800 -1.9489 -1.9489 -1.2642 -1.2642 -1.1832 -1.1832 0.2430 0.2430 0.3649 0.3649 0.5461 0.5461 1.1593 1.1593 1.8724 1.8724 2.0455 2.0455 2.4049 2.4049 2.4333 2.4333 3.2766 3.2766 3.3088 3.3088 3.3940 3.3940 3.6592 3.6592 4.4627 4.4627 4.5174 4.5174 4.6099 4.6099 4.7505 4.7505 4.8008 4.8008 5.0223 5.0223 5.0378 5.0378 5.0539 5.0539 5.4103 5.4103 5.4911 5.4911 6.1143 6.1143 6.1659 6.1659 8.1895 8.1895 8.4808 8.4808 9.0806 9.0806 9.2073 9.2073 9.2495 9.2495 10.5377 10.5377 k = 0.3966 0.2907 0.0000 ( 6550 PWs) bands (ev): -7.6421 -7.6421 -6.9927 -6.9927 -6.4880 -6.4880 -6.4804 -6.4804 -1.9388 -1.9388 -1.2671 -1.2671 -1.1840 -1.1840 0.2388 0.2388 0.3617 0.3617 0.5471 0.5471 1.1755 1.1755 1.8683 1.8683 2.0352 2.0352 2.4143 2.4143 2.4428 2.4428 3.2787 3.2787 3.3084 3.3084 3.3991 3.3991 3.6783 3.6783 4.4678 4.4678 4.4901 4.4901 4.6220 4.6220 4.7495 4.7495 4.8032 4.8032 5.0288 5.0288 5.0437 5.0437 5.0736 5.0736 5.3836 5.3836 5.5012 5.5012 6.0877 6.0877 6.1453 6.1453 8.1925 8.1925 8.4973 8.4973 9.0469 9.0469 9.1681 9.1681 9.2302 9.2302 10.5977 10.5977 k = 0.4138 0.3034 0.0000 ( 6554 PWs) bands (ev): -7.6236 -7.6236 -7.0165 -7.0165 -6.4881 -6.4881 -6.4807 -6.4807 -1.9299 -1.9299 -1.2697 -1.2697 -1.1847 -1.1847 0.2351 0.2351 0.3591 0.3591 0.5480 0.5480 1.1913 1.1913 1.8639 1.8639 2.0249 2.0249 2.4226 2.4226 2.4512 2.4512 3.2800 3.2800 3.3084 3.3084 3.4037 3.4037 3.6973 3.6973 4.4535 4.4535 4.4824 4.4824 4.6338 4.6338 4.7488 4.7488 4.8047 4.8047 5.0332 5.0332 5.0491 5.0491 5.0952 5.0952 5.3567 5.3567 5.5112 5.5112 6.0648 6.0648 6.1278 6.1278 8.1899 8.1899 8.5186 8.5186 9.0120 9.0120 9.1304 9.1304 9.2206 9.2206 10.6545 10.6545 k = 0.4310 0.3160 0.0000 ( 6558 PWs) bands (ev): -7.6070 -7.6070 -7.0375 -7.0375 -6.4883 -6.4883 -6.4809 -6.4809 -1.9225 -1.9225 -1.2720 -1.2720 -1.1852 -1.1852 0.2320 0.2320 0.3568 0.3568 0.5486 0.5486 1.2059 1.2059 1.8596 1.8596 2.0153 2.0153 2.4296 2.4296 2.4582 2.4582 3.2807 3.2807 3.3085 3.3085 3.4078 3.4078 3.7151 3.7151 4.4289 4.4289 4.4865 4.4865 4.6444 4.6444 4.7481 4.7481 4.8056 4.8056 5.0363 5.0363 5.0537 5.0537 5.1175 5.1175 5.3302 5.3302 5.5200 5.5200 6.0459 6.0459 6.1136 6.1136 8.1847 8.1847 8.5411 8.5411 8.9804 8.9804 9.0979 9.0979 9.2139 9.2139 10.7069 10.7069 k = 0.4483 0.3286 0.0000 ( 6562 PWs) bands (ev): -7.5930 -7.5930 -7.0549 -7.0549 -6.4884 -6.4884 -6.4811 -6.4811 -1.9167 -1.9167 -1.2738 -1.2738 -1.1856 -1.1856 0.2295 0.2295 0.3551 0.3551 0.5491 0.5491 1.2184 1.2184 1.8556 1.8556 2.0072 2.0072 2.4351 2.4351 2.4637 2.4637 3.2810 3.2810 3.3088 3.3088 3.4111 3.4111 3.7306 3.7306 4.4071 4.4071 4.4906 4.4906 4.6532 4.6532 4.7477 4.7477 4.8060 4.8060 5.0385 5.0385 5.0574 5.0574 5.1399 5.1399 5.3048 5.3048 5.5273 5.5273 6.0311 6.0311 6.1025 6.1025 8.1790 8.1790 8.5618 8.5618 8.9541 8.9541 9.0722 9.0722 9.2083 9.2083 10.7531 10.7531 k = 0.4655 0.3413 0.0000 ( 6558 PWs) bands (ev): -7.5824 -7.5824 -7.0681 -7.0681 -6.4885 -6.4885 -6.4813 -6.4813 -1.9125 -1.9125 -1.2752 -1.2752 -1.1860 -1.1860 0.2277 0.2277 0.3538 0.3538 0.5494 0.5494 1.2281 1.2281 1.8523 1.8523 2.0010 2.0010 2.4392 2.4392 2.4678 2.4678 3.2811 3.2811 3.3090 3.3090 3.4136 3.4136 3.7428 3.7428 4.3904 4.3904 4.4937 4.4937 4.6598 4.6598 4.7474 4.7474 4.8060 4.8060 5.0399 5.0399 5.0600 5.0600 5.1616 5.1616 5.2811 5.2811 5.5326 5.5326 6.0205 6.0205 6.0947 6.0947 8.1742 8.1742 8.5784 8.5784 8.9346 8.9346 9.0536 9.0536 9.2037 9.2037 10.7425 10.7425 k = 0.4828 0.3539 0.0000 ( 6542 PWs) bands (ev): -7.5756 -7.5756 -7.0764 -7.0764 -6.4885 -6.4885 -6.4814 -6.4814 -1.9099 -1.9099 -1.2760 -1.2760 -1.1861 -1.1861 0.2266 0.2266 0.3530 0.3530 0.5496 0.5496 1.2342 1.2342 1.8501 1.8501 1.9972 1.9972 2.4416 2.4416 2.4702 2.4702 3.2812 3.2812 3.3091 3.3091 3.4151 3.4151 3.7506 3.7506 4.3799 4.3799 4.4957 4.4957 4.6640 4.6640 4.7472 4.7472 4.8059 4.8059 5.0408 5.0408 5.0617 5.0617 5.1803 5.1803 5.2612 5.2612 5.5358 5.5358 6.0141 6.0141 6.0900 6.0900 8.1711 8.1711 8.5891 8.5891 8.9225 8.9225 9.0424 9.0424 9.2006 9.2006 10.7288 10.7288 k = 0.5000 0.3666 0.0000 ( 6550 PWs) bands (ev): -7.5733 -7.5733 -7.0792 -7.0792 -6.4886 -6.4886 -6.4814 -6.4814 -1.9090 -1.9090 -1.2763 -1.2763 -1.1862 -1.1862 0.2262 0.2262 0.3528 0.3528 0.5496 0.5496 1.2363 1.2363 1.8494 1.8494 1.9959 1.9959 2.4425 2.4425 2.4710 2.4710 3.2812 3.2812 3.3092 3.3092 3.4156 3.4156 3.7533 3.7533 4.3763 4.3763 4.4963 4.4963 4.6654 4.6654 4.7471 4.7471 4.8059 4.8059 5.0411 5.0411 5.0623 5.0623 5.1890 5.1890 5.2520 5.2520 5.5369 5.5369 6.0119 6.0119 6.0884 6.0884 8.1700 8.1700 8.5928 8.5928 8.9184 8.9184 9.0387 9.0387 9.1995 9.1995 10.7242 10.7242 k = 0.5000 0.3666 0.0000 ( 6550 PWs) bands (ev): -7.5733 -7.5733 -7.0792 -7.0792 -6.4886 -6.4886 -6.4814 -6.4814 -1.9090 -1.9090 -1.2763 -1.2763 -1.1862 -1.1862 0.2262 0.2262 0.3528 0.3528 0.5496 0.5496 1.2363 1.2363 1.8494 1.8494 1.9959 1.9959 2.4425 2.4425 2.4710 2.4710 3.2812 3.2812 3.3092 3.3092 3.4156 3.4156 3.7533 3.7533 4.3763 4.3763 4.4963 4.4963 4.6654 4.6654 4.7471 4.7471 4.8059 4.8059 5.0411 5.0411 5.0623 5.0623 5.1890 5.1890 5.2520 5.2520 5.5369 5.5369 6.0119 6.0119 6.0884 6.0884 8.1700 8.1700 8.5928 8.5928 8.9184 8.9184 9.0387 9.0387 9.1995 9.1995 10.7242 10.7242 k = 0.4909 0.3790 0.0155 ( 6552 PWs) bands (ev): -7.5731 -7.5730 -7.0789 -7.0785 -6.4893 -6.4888 -6.4820 -6.4817 -1.9143 -1.9041 -1.2771 -1.2753 -1.1938 -1.1771 0.2205 0.2325 0.3480 0.3583 0.5447 0.5545 1.2346 1.2368 1.8492 1.8498 1.9950 1.9953 2.4410 2.4439 2.4703 2.4721 3.2797 3.2813 3.3079 3.3094 3.4126 3.4177 3.7494 3.7544 4.3761 4.3779 4.4883 4.5024 4.6545 4.6637 4.7476 4.7569 4.7924 4.8178 5.0258 5.0507 5.0625 5.0679 5.1811 5.1955 5.2556 5.2557 5.5348 5.5365 6.0067 6.0167 6.0879 6.0887 8.1712 8.1743 8.5904 8.5958 8.9112 8.9296 9.0361 9.0440 9.2014 9.2080 10.7263 10.7274 k = 0.4817 0.3915 0.0309 ( 6556 PWs) bands (ev): -7.5722 -7.5721 -7.0778 -7.0770 -6.4912 -6.4905 -6.4831 -6.4824 -1.9198 -1.8997 -1.2777 -1.2739 -1.2000 -1.1667 0.2152 0.2391 0.3441 0.3644 0.5398 0.5593 1.2316 1.2362 1.8493 1.8506 1.9926 1.9931 2.4394 2.4450 2.4701 2.4735 3.2769 3.2800 3.3052 3.3087 3.4088 3.4191 3.7431 3.7526 4.3775 4.3807 4.4787 4.5065 4.6362 4.6496 4.7569 4.7719 4.7788 4.8282 5.0095 5.0532 5.0643 5.0811 5.1722 5.2005 5.2662 5.2664 5.5302 5.5334 6.0012 6.0189 6.0889 6.0893 8.1776 8.1840 8.5885 8.5995 8.9090 8.9439 9.0364 9.0520 9.2125 9.2273 10.7337 10.7358 k = 0.4726 0.4040 0.0464 ( 6552 PWs) bands (ev): -7.5708 -7.5706 -7.0757 -7.0745 -6.4950 -6.4942 -6.4842 -6.4829 -1.9254 -1.8959 -1.2782 -1.2722 -1.2047 -1.1551 0.2104 0.2460 0.3411 0.3711 0.5348 0.5640 1.2275 1.2345 1.8496 1.8514 1.9888 1.9897 2.4371 2.4455 2.4709 2.4755 3.2728 3.2775 3.3011 3.3072 3.4039 3.4200 3.7346 3.7479 4.3802 4.3845 4.4680 4.5083 4.6143 4.6286 4.7557 4.7792 4.7883 4.8372 4.9938 5.0542 5.0669 5.0966 5.1624 5.2040 5.2825 5.2834 5.5235 5.5281 5.9938 6.0148 6.0904 6.0961 8.1891 8.1989 8.5872 8.6043 8.9126 8.9604 9.0399 9.0633 9.2316 9.2575 10.7462 10.7493 k = 0.4634 0.4164 0.0618 ( 6556 PWs) bands (ev): -7.5688 -7.5686 -7.0728 -7.0712 -6.5009 -6.5000 -6.4850 -6.4830 -1.9311 -1.8927 -1.2786 -1.2698 -1.2080 -1.1425 0.2062 0.2532 0.3391 0.3782 0.5297 0.5687 1.2223 1.2319 1.8499 1.8523 1.9841 1.9854 2.4338 2.4446 2.4729 2.4784 3.2673 3.2736 3.2953 3.3050 3.3981 3.4204 3.7245 3.7406 4.3842 4.3884 4.4568 4.5076 4.5901 4.6041 4.7402 4.7950 4.8048 4.8444 4.9804 5.0554 5.0701 5.1131 5.1520 5.2059 5.3033 5.3057 5.5151 5.5210 5.9826 6.0028 6.0951 6.1096 8.2051 8.2186 8.5867 8.6105 8.9224 8.9785 9.0470 9.0780 9.2573 9.2978 10.7637 10.7676 k = 0.4543 0.4289 0.0773 ( 6552 PWs) bands (ev): -7.5664 -7.5661 -7.0690 -7.0669 -6.5087 -6.5078 -6.4854 -6.4828 -1.9368 -1.8903 -1.2788 -1.2667 -1.2100 -1.1292 0.2026 0.2606 0.3382 0.3857 0.5245 0.5733 1.2161 1.2285 1.8501 1.8529 1.9789 1.9807 2.4293 2.4421 2.4761 2.4821 3.2605 3.2683 3.2877 3.3021 3.3912 3.4202 3.7134 3.7309 4.3890 4.3906 4.4470 4.5037 4.5646 4.5781 4.7235 4.8122 4.8209 4.8495 4.9704 5.0573 5.0740 5.1301 5.1416 5.2063 5.3274 5.3322 5.5055 5.5126 5.9664 5.9840 6.1041 6.1284 8.2250 8.2424 8.5873 8.6185 8.9379 8.9977 9.0583 9.0965 9.2886 9.3475 10.7859 10.7906 k = 0.4452 0.4414 0.0928 ( 6534 PWs) bands (ev): -7.5635 -7.5631 -7.0643 -7.0618 -6.5182 -6.5172 -6.4857 -6.4826 -1.9424 -1.8887 -1.2788 -1.2627 -1.2110 -1.1154 0.1997 0.2681 0.3385 0.3934 0.5192 0.5776 1.2091 1.2244 1.8498 1.8528 1.9741 1.9763 2.4236 2.4379 2.4804 2.4864 3.2525 3.2615 3.2786 3.2985 3.3834 3.4195 3.7017 3.7194 4.3876 4.3941 4.4414 4.4952 4.5382 4.5531 4.7076 4.8290 4.8361 4.8523 4.9651 5.0595 5.0786 5.1308 5.1487 5.2054 5.3539 5.3620 5.4956 5.5035 5.9452 5.9600 6.1172 6.1509 8.2480 8.2696 8.5894 8.6287 8.9582 9.0174 9.0750 9.1192 9.3246 9.4054 10.8127 10.8183 k = 0.4360 0.4538 0.1082 ( 6534 PWs) bands (ev): -7.5601 -7.5598 -7.0587 -7.0559 -6.5292 -6.5281 -6.4859 -6.4822 -1.9479 -1.8880 -1.2786 -1.2577 -1.2111 -1.1014 0.1974 0.2755 0.3400 0.4011 0.5136 0.5816 1.2015 1.2200 1.8484 1.8514 1.9705 1.9728 2.4169 2.4323 2.4852 2.4906 3.2432 3.2527 3.2683 3.2941 3.3749 3.4179 3.6902 3.7066 4.3766 4.3978 4.4424 4.4805 4.5118 4.5323 4.6935 4.8443 4.8463 4.8568 4.9644 5.0616 5.0838 5.1218 5.1670 5.2034 5.3815 5.3942 5.4865 5.4944 5.9196 5.9322 6.1335 6.1756 8.2732 8.2991 8.5936 8.6416 8.9810 9.0367 9.0992 9.1470 9.3644 9.4708 10.8439 10.8506 k = 0.4269 0.4663 0.1237 ( 6526 PWs) bands (ev): -7.5565 -7.5561 -7.0523 -7.0491 -6.5416 -6.5404 -6.4861 -6.4818 -1.9532 -1.8883 -1.2782 -1.2516 -1.2104 -1.0875 0.1959 0.2829 0.3428 0.4089 0.5080 0.5851 1.1937 1.2154 1.8453 1.8480 1.9691 1.9711 2.4094 2.4253 2.4901 2.4943 3.2328 3.2416 3.2575 3.2887 3.3658 3.4155 3.6794 3.6932 4.3585 4.3963 4.4473 4.4620 4.4870 4.5175 4.6817 4.8462 4.8578 4.8693 4.9676 5.0624 5.0897 5.1157 5.1855 5.2010 5.4082 5.4274 5.4803 5.4863 5.8905 5.9014 6.1523 6.2015 8.2996 8.3295 8.6006 8.6577 9.0036 9.0545 9.1330 9.1803 9.4075 9.5427 10.8796 10.8876 k = 0.4177 0.4788 0.1391 ( 6530 PWs) bands (ev): -7.5526 -7.5521 -7.0451 -7.0415 -6.5551 -6.5539 -6.4862 -6.4814 -1.9582 -1.8895 -1.2775 -1.2447 -1.2090 -1.0739 0.1950 0.2902 0.3469 0.4166 0.5021 0.5880 1.1860 1.2110 1.8402 1.8422 1.9707 1.9720 2.4011 2.4172 2.4946 2.4969 3.2214 3.2282 3.2464 3.2820 3.3565 3.4117 3.6699 3.6797 4.3350 4.3823 4.4470 4.4483 4.4715 4.5074 4.6725 4.8436 4.8688 4.8831 4.9735 5.0600 5.0959 5.1145 5.1986 5.2038 5.4283 5.4565 5.4828 5.4846 5.8587 5.8686 6.1724 6.2279 8.3263 8.3590 8.6115 8.6772 9.0241 9.0702 9.1778 9.2195 9.4536 9.6205 10.9198 10.9292 k = 0.4086 0.4912 0.1546 ( 6534 PWs) bands (ev): -7.5485 -7.5480 -7.0370 -7.0331 -6.5696 -6.5683 -6.4862 -6.4810 -1.9631 -1.8916 -1.2765 -1.2370 -1.2067 -1.0610 0.1949 0.2973 0.3520 0.4240 0.4963 0.5899 1.1788 1.2069 1.8326 1.8338 1.9756 1.9759 2.3924 2.4080 2.4980 2.4983 3.2090 3.2129 3.2350 3.2739 3.3474 3.4066 3.6622 3.6669 4.3072 4.3546 4.4296 4.4410 4.4759 4.5017 4.6661 4.8413 4.8771 4.8959 4.9812 5.0536 5.1017 5.1197 5.1975 5.2216 5.4354 5.4620 5.5004 5.5086 5.8250 5.8347 6.1933 6.2541 8.3520 8.3857 8.6274 8.7006 9.0424 9.0836 9.2328 9.2642 9.5025 9.7036 10.9644 10.9756 k = 0.3995 0.5037 0.1701 ( 6542 PWs) bands (ev): -7.5444 -7.5439 -7.0282 -7.0239 -6.5849 -6.5835 -6.4863 -6.4806 -1.9677 -1.8946 -1.2753 -1.2292 -1.2034 -1.0489 0.1956 0.3045 0.3579 0.4311 0.4904 0.5906 1.1725 1.2035 1.8227 1.8231 1.9828 1.9840 2.3832 2.3980 2.4972 2.5006 3.1957 3.1964 3.2229 3.2642 3.3388 3.3999 3.6552 3.6565 4.2758 4.3196 4.4083 4.4329 4.4864 4.5017 4.6626 4.8403 4.8824 4.9072 4.9900 5.0443 5.1065 5.1303 5.1990 5.2388 5.4351 5.4578 5.5272 5.5441 5.7901 5.8008 6.2141 6.2795 8.3760 8.4076 8.6496 8.7278 9.0591 9.0950 9.2959 9.3134 9.5547 9.7915 11.0135 11.0267 k = 0.3903 0.5162 0.1855 ( 6524 PWs) bands (ev): -7.5403 -7.5398 -7.0186 -7.0140 -6.6007 -6.5993 -6.4863 -6.4801 -1.9721 -1.8984 -1.2738 -1.2220 -1.1982 -1.0380 0.1971 0.3117 0.3643 0.4378 0.4848 0.5900 1.1677 1.2010 1.8104 1.8106 1.9928 1.9955 2.3737 2.3873 2.4941 2.5013 3.1795 3.1819 3.2100 3.2530 3.3309 3.3916 3.6450 3.6530 4.2417 4.2816 4.3874 4.4203 4.4982 4.5072 4.6620 4.8411 4.8850 4.9164 4.9994 5.0333 5.1094 5.1451 5.2044 5.2552 5.4343 5.4541 5.5552 5.5806 5.7551 5.7689 6.2343 6.3035 8.3973 8.4234 8.6785 8.7588 9.0751 9.1048 9.3642 9.3662 9.6112 9.8839 11.0668 11.0823 k = 0.3812 0.5286 0.2010 ( 6520 PWs) bands (ev): -7.5365 -7.5359 -7.0083 -7.0034 -6.6168 -6.6153 -6.4862 -6.4797 -1.9762 -1.9031 -1.2720 -1.2165 -1.1906 -1.0285 0.1993 0.3190 0.3707 0.4441 0.4797 0.5877 1.1646 1.1997 1.7963 1.7966 2.0055 2.0100 2.3641 2.3761 2.4886 2.4999 3.1627 3.1675 3.1962 3.2403 3.3238 3.3817 3.6366 3.6517 4.2057 4.2422 4.3669 4.4039 4.5102 4.5160 4.6640 4.8439 4.8849 4.9235 5.0087 5.0215 5.1106 5.1633 5.2143 5.2705 5.4354 5.4519 5.5784 5.6150 5.7222 5.7427 6.2533 6.3255 8.4154 8.4328 8.7136 8.7932 9.0911 9.1138 9.4213 9.4342 9.6742 9.9806 11.1242 11.1423 k = 0.3720 0.5411 0.2164 ( 6518 PWs) bands (ev): -7.5330 -7.5325 -6.9973 -6.9920 -6.6330 -6.6314 -6.4862 -6.4792 -1.9801 -1.9085 -1.2700 -1.2125 -1.1807 -1.0205 0.2024 0.3265 0.3766 0.4497 0.4756 0.5837 1.1638 1.1998 1.7810 1.7811 2.0207 2.0271 2.3544 2.3645 2.4804 2.4962 3.1465 3.1527 3.1814 3.2265 3.3172 3.3704 3.6302 3.6525 4.1686 4.2024 4.3468 4.3849 4.5220 4.5263 4.6687 4.8487 4.8825 4.9285 5.0095 5.0167 5.1110 5.1841 5.2289 5.2849 5.4393 5.4519 5.5892 5.6370 5.7013 5.7293 6.2705 6.3450 8.4299 8.4364 8.7537 8.8304 9.1075 9.1225 9.4771 9.5013 9.7466 10.0815 11.1853 11.2063 k = 0.3629 0.5536 0.2319 ( 6516 PWs) bands (ev): -7.5301 -7.5295 -6.9856 -6.9801 -6.6489 -6.6474 -6.4862 -6.4788 -1.9838 -1.9146 -1.2677 -1.2097 -1.1693 -1.0143 0.2063 0.3341 0.3812 0.4546 0.4731 0.5777 1.1654 1.2015 1.7642 1.7648 2.0381 2.0465 2.3449 2.3528 2.4697 2.4899 3.1312 3.1376 3.1656 3.2120 3.3112 3.3580 3.6259 3.6551 4.1309 4.1626 4.3267 4.3639 4.5336 4.5372 4.6761 4.8555 4.8783 4.9318 4.9976 5.0222 5.1121 5.2071 5.2475 5.2982 5.4464 5.4543 5.5810 5.6240 5.7149 5.7351 6.2857 6.3617 8.4351 8.4405 8.7974 8.8696 9.1247 9.1318 9.5322 9.5618 9.8312 10.1867 11.2495 11.2741 k = 0.3537 0.5661 0.2474 ( 6522 PWs) bands (ev): -7.5278 -7.5273 -6.9732 -6.9675 -6.6644 -6.6628 -6.4861 -6.4784 -1.9873 -1.9213 -1.2651 -1.2076 -1.1571 -1.0099 0.2110 0.3417 0.3840 0.4586 0.4729 0.5700 1.1698 1.2050 1.7461 1.7480 2.0576 2.0681 2.3357 2.3412 2.4566 2.4812 3.1171 3.1222 3.1489 3.1970 3.3056 3.3446 3.6237 3.6592 4.0933 4.1233 4.3066 4.3417 4.5447 4.5478 4.6861 4.8639 4.8725 4.9340 4.9861 5.0244 5.1153 5.2320 5.2695 5.3105 5.4567 5.4590 5.5584 5.5932 5.7457 5.7552 6.2982 6.3751 8.4296 8.4471 8.8435 8.9102 9.1424 9.1426 9.5853 9.6136 9.9287 10.2961 11.3159 11.3448 k = 0.3446 0.5785 0.2628 ( 6518 PWs) bands (ev): -7.5265 -7.5259 -6.9603 -6.9543 -6.6791 -6.6775 -6.4860 -6.4780 -1.9907 -1.9287 -1.2622 -1.2060 -1.1444 -1.0075 0.2165 0.3489 0.3848 0.4616 0.4754 0.5606 1.1769 1.2103 1.7270 1.7306 2.0788 2.0915 2.3270 2.3299 2.4413 2.4701 3.1041 3.1063 3.1314 3.1819 3.3004 3.3308 3.6236 3.6647 4.0561 4.0847 4.2864 4.3186 4.5552 4.5580 4.6984 4.8655 4.8732 4.9359 4.9755 5.0232 5.1210 5.2587 5.2946 5.3218 5.4662 5.4697 5.5297 5.5597 5.7788 5.7814 6.3078 6.3847 8.4207 8.4497 8.8912 8.9515 9.1546 9.1613 9.6348 9.6570 10.0381 10.4099 11.3805 11.4179 k = 0.3355 0.5910 0.2783 ( 6524 PWs) bands (ev): -7.5262 -7.5257 -6.9468 -6.9406 -6.6928 -6.6912 -6.4860 -6.4777 -1.9939 -1.9365 -1.2591 -1.2047 -1.1315 -1.0071 0.2229 0.3546 0.3848 0.4632 0.4804 0.5501 1.1868 1.2174 1.7069 1.7129 2.1014 2.1163 2.3191 2.3194 2.4241 2.4569 3.0898 3.0921 3.1131 3.1668 3.2956 3.3169 3.6254 3.6712 4.0196 4.0471 4.2663 4.2950 4.5651 4.5675 4.7130 4.8574 4.8826 4.9386 4.9659 5.0192 5.1285 5.2869 5.3219 5.3320 5.4753 5.4806 5.5041 5.5269 5.8092 5.8109 6.3140 6.3904 8.4091 8.4485 8.9399 8.9928 9.1689 9.1805 9.6797 9.6932 10.1575 10.5280 11.4141 11.4651 k = 0.3263 0.6035 0.2937 ( 6518 PWs) bands (ev): -7.5271 -7.5266 -6.9328 -6.9263 -6.7052 -6.7037 -6.4859 -6.4773 -1.9971 -1.9448 -1.2559 -1.2038 -1.1188 -1.0087 0.2300 0.3568 0.3863 0.4631 0.4875 0.5391 1.1992 1.2264 1.6860 1.6949 2.1248 2.1419 2.3101 2.3123 2.4057 2.4422 3.0726 3.0806 3.0941 3.1518 3.2913 3.3032 3.6290 3.6785 3.9842 4.0107 4.2463 4.2712 4.5745 4.5765 4.7294 4.8487 4.8902 4.9437 4.9574 5.0136 5.1374 5.3165 5.3409 5.3508 5.4618 5.4812 5.5014 5.5113 5.8363 5.8409 6.3168 6.3918 8.3956 8.4437 8.9889 9.0336 9.1854 9.1998 9.7194 9.7235 10.2851 10.6504 11.4194 11.5315 k = 0.3172 0.6159 0.3092 ( 6512 PWs) bands (ev): -7.5294 -7.5290 -6.9183 -6.9117 -6.7160 -6.7146 -6.4858 -6.4770 -2.0001 -1.9536 -1.2524 -1.2032 -1.1063 -1.0122 0.2380 0.3541 0.3911 0.4606 0.4962 0.5285 1.2139 1.2372 1.6644 1.6766 2.1480 2.1672 2.3031 2.3073 2.3866 2.4267 3.0548 3.0692 3.0748 3.1369 3.2876 3.2904 3.6342 3.6863 3.9500 3.9754 4.2265 4.2475 4.5834 4.5849 4.7472 4.8394 4.8949 4.9503 4.9524 5.0071 5.1469 5.3440 5.3508 5.3788 5.4344 5.4622 5.5074 5.5323 5.8614 5.8682 6.3158 6.3888 8.3808 8.4361 9.0377 9.0730 9.2043 9.2191 9.7490 9.7534 10.4196 10.7768 11.4201 11.5137 k = 0.3172 0.6159 0.3092 ( 6512 PWs) bands (ev): -7.5294 -7.5290 -6.9183 -6.9117 -6.7160 -6.7146 -6.4858 -6.4770 -2.0001 -1.9536 -1.2524 -1.2032 -1.1063 -1.0122 0.2380 0.3541 0.3911 0.4606 0.4962 0.5285 1.2139 1.2372 1.6644 1.6766 2.1480 2.1672 2.3031 2.3073 2.3866 2.4267 3.0548 3.0692 3.0748 3.1369 3.2876 3.2904 3.6342 3.6863 3.9500 3.9754 4.2265 4.2475 4.5834 4.5849 4.7472 4.8394 4.8949 4.9503 4.9524 5.0071 5.1469 5.3440 5.3508 5.3788 5.4344 5.4622 5.5074 5.5323 5.8614 5.8682 6.3158 6.3888 8.3808 8.4361 9.0377 9.0730 9.2043 9.2191 9.7490 9.7534 10.4196 10.7768 11.4201 11.5137 k = 0.2974 0.6102 0.3163 ( 6520 PWs) bands (ev): -7.5316 -7.5312 -6.9112 -6.9045 -6.7198 -6.7183 -6.4860 -6.4771 -2.0018 -1.9580 -1.2508 -1.2030 -1.1008 -1.0144 0.2415 0.3517 0.3944 0.4585 0.5001 0.5244 1.2213 1.2427 1.6558 1.6696 2.1570 2.1773 2.2889 2.3117 2.3807 2.4232 3.0246 3.0531 3.0853 3.1420 3.2849 3.2864 3.6367 3.6898 3.9321 3.9588 4.2186 4.2386 4.5823 4.5944 4.7555 4.8351 4.8952 4.9443 4.9597 5.0044 5.1518 5.3468 5.3627 5.3891 5.4248 5.4547 5.5142 5.5442 5.8694 5.8778 6.3162 6.3875 8.3736 8.4319 9.0594 9.0894 9.2153 9.2299 9.7609 9.7676 10.4832 10.8354 11.4168 11.4958 k = 0.2775 0.6045 0.3234 ( 6508 PWs) bands (ev): -7.5350 -7.5346 -6.9038 -6.8971 -6.7216 -6.7199 -6.4866 -6.4777 -2.0038 -1.9629 -1.2492 -1.2029 -1.0957 -1.0171 0.2445 0.3487 0.3985 0.4563 0.5028 0.5215 1.2293 1.2485 1.6502 1.6652 2.1624 2.1844 2.2697 2.3116 2.3822 2.4254 2.9865 3.0189 3.1065 3.1601 3.2803 3.2851 3.6389 3.6928 3.9098 3.9411 4.2127 4.2333 4.5818 4.6050 4.7633 4.8310 4.8933 4.9366 4.9678 5.0025 5.1580 5.3468 5.3732 5.3969 5.4201 5.4532 5.5223 5.5581 5.8720 5.8829 6.3191 6.3876 8.3661 8.4276 9.0803 9.1042 9.2300 9.2449 9.7745 9.7817 10.5473 10.8931 11.4086 11.4729 k = 0.2577 0.5987 0.3305 ( 6509 PWs) bands (ev): -7.5395 -7.5391 -6.8967 -6.8903 -6.7211 -6.7191 -6.4877 -6.4788 -2.0063 -1.9682 -1.2476 -1.2029 -1.0910 -1.0201 0.2469 0.3451 0.4032 0.4543 0.5034 0.5207 1.2379 1.2551 1.6474 1.6632 2.1629 2.1878 2.2501 2.3072 2.3900 2.4312 2.9468 2.9798 3.1283 3.1819 3.2765 3.2844 3.6406 3.6951 3.8850 3.9227 4.2086 4.2307 4.5822 4.6159 4.7699 4.8272 4.8894 4.9281 4.9759 5.0011 5.1652 5.3453 5.3797 5.4043 5.4195 5.4571 5.5318 5.5732 5.8702 5.8841 6.3229 6.3878 8.3588 8.4231 9.1001 9.1193 9.2489 9.2650 9.7888 9.7960 10.6110 10.9491 11.3966 11.4468 k = 0.2379 0.5930 0.3376 ( 6509 PWs) bands (ev): -7.5447 -7.5443 -6.8907 -6.8845 -6.7181 -6.7156 -6.4895 -6.4804 -2.0089 -1.9738 -1.2459 -1.2030 -1.0867 -1.0234 0.2488 0.3408 0.4081 0.4529 0.5019 0.5218 1.2472 1.2626 1.6472 1.6633 2.1577 2.1860 2.2339 2.3023 2.4008 2.4393 2.9061 2.9384 3.1499 3.2047 3.2735 3.2848 3.6417 3.6968 3.8591 3.9039 4.2061 4.2298 4.5835 4.6269 4.7748 4.8241 4.8834 4.9193 4.9837 5.0004 5.1735 5.3429 5.3830 5.4126 5.4222 5.4640 5.5431 5.5891 5.8650 5.8820 6.3259 6.3869 8.3524 8.4186 9.1177 9.1361 9.2726 9.2914 9.8023 9.8113 10.6737 11.0024 11.3812 11.4198 k = 0.2181 0.5873 0.3447 ( 6503 PWs) bands (ev): -7.5503 -7.5499 -6.8859 -6.8802 -6.7124 -6.7094 -6.4918 -6.4827 -2.0118 -1.9796 -1.2443 -1.2033 -1.0828 -1.0268 0.2503 0.3359 0.4126 0.4527 0.4992 0.5238 1.2573 1.2712 1.6491 1.6652 2.1476 2.1769 2.2243 2.2987 2.4123 2.4489 2.8651 2.8961 3.1704 3.2269 3.2715 3.2874 3.6421 3.6977 3.8336 3.8855 4.2051 4.2298 4.5858 4.6379 4.7772 4.8222 4.8755 4.9109 4.9908 5.0001 5.1828 5.3401 5.3850 5.4206 5.4284 5.4716 5.5562 5.6056 5.8580 5.8777 6.3263 6.3835 8.3474 8.4146 9.1328 9.1545 9.3018 9.3250 9.8146 9.8274 10.7347 11.0517 11.3603 11.3962 k = 0.1982 0.5816 0.3518 ( 6505 PWs) bands (ev): -7.5561 -7.5557 -6.8826 -6.8775 -6.7041 -6.7005 -6.4948 -6.4857 -2.0147 -1.9854 -1.2425 -1.2039 -1.0793 -1.0303 0.2515 0.3304 0.4165 0.4538 0.4961 0.5258 1.2681 1.2809 1.6528 1.6685 2.1341 2.1623 2.2199 2.2960 2.4228 2.4598 2.8241 2.8536 3.1885 3.2458 3.2719 3.2940 3.6417 3.6974 3.8097 3.8677 4.2052 4.2303 4.5890 4.6488 4.7765 4.8219 4.8659 4.9033 4.9967 5.0004 5.1929 5.3374 5.3868 5.4276 5.4370 5.4789 5.5711 5.6227 5.8505 5.8721 6.3227 6.3765 8.3445 8.4115 9.1462 9.1726 9.3374 9.3662 9.8257 9.8435 10.7934 11.0950 11.3319 11.3806 k = 0.1784 0.5758 0.3589 ( 6513 PWs) bands (ev): -7.5619 -7.5615 -6.8807 -6.8761 -6.6937 -6.6895 -6.4986 -6.4895 -2.0176 -1.9912 -1.2407 -1.2046 -1.0762 -1.0338 0.2526 0.3244 0.4195 0.4563 0.4931 0.5274 1.2796 1.2915 1.6580 1.6729 2.1192 2.1461 2.2173 2.2931 2.4319 2.4719 2.7836 2.8122 3.2029 3.2555 3.2799 3.3062 3.6403 3.6956 3.7882 3.8511 4.2060 4.2309 4.5931 4.6596 4.7727 4.8231 4.8550 4.8966 4.9997 5.0029 5.2036 5.3350 5.3891 5.4341 5.4462 5.4853 5.5878 5.6401 5.8441 5.8665 6.3142 6.3649 8.3442 8.4096 9.1586 9.1888 9.3795 9.4147 9.8357 9.8589 10.8482 11.1295 11.2979 11.3734 k = 0.1586 0.5701 0.3660 ( 6508 PWs) bands (ev): -7.5675 -7.5672 -6.8799 -6.8759 -6.6816 -6.6767 -6.5031 -6.4940 -2.0203 -1.9969 -1.2388 -1.2055 -1.0735 -1.0373 0.2535 0.3180 0.4218 0.4597 0.4905 0.5284 1.2916 1.3027 1.6643 1.6780 2.1043 2.1304 2.2148 2.2891 2.4395 2.4847 2.7440 2.7729 3.2131 3.2563 3.2958 3.3233 3.6379 3.6913 3.7708 3.8359 4.2074 4.2313 4.5980 4.6701 4.7664 4.8254 4.8435 4.8908 5.0007 5.0067 5.2147 5.3328 5.3921 5.4399 5.4551 5.4906 5.6059 5.6572 5.8404 5.8620 6.3002 6.3484 8.3468 8.4092 9.1702 9.2025 9.4279 9.4698 9.8446 9.8734 10.8972 11.1525 11.2613 11.3724 k = 0.1388 0.5644 0.3731 ( 6511 PWs) bands (ev): -7.5727 -7.5725 -6.8799 -6.8765 -6.6682 -6.6628 -6.5085 -6.4994 -2.0229 -2.0024 -1.2369 -1.2067 -1.0710 -1.0406 0.2545 0.3113 0.4239 0.4627 0.4890 0.5288 1.3038 1.3142 1.6712 1.6837 2.0904 2.1162 2.2117 2.2834 2.4459 2.4978 2.7056 2.7368 3.2198 3.2546 3.3143 3.3426 3.6345 3.6835 3.7585 3.8223 4.2091 4.2315 4.6039 4.6802 4.7582 4.8276 4.8324 4.8855 5.0016 5.0096 5.2260 5.3306 5.3957 5.4445 5.4630 5.4948 5.6248 5.6728 5.8411 5.8603 6.2806 6.3269 8.3523 8.4104 9.1808 9.2135 9.4813 9.5300 9.8523 9.8869 10.9368 11.1635 11.2243 11.3682 k = 0.1189 0.5587 0.3802 ( 6507 PWs) bands (ev): -7.5775 -7.5773 -6.8804 -6.8776 -6.6541 -6.6481 -6.5147 -6.5057 -2.0251 -2.0076 -1.2348 -1.2082 -1.0688 -1.0437 0.2557 0.3047 0.4260 0.4641 0.4895 0.5286 1.3159 1.3255 1.6784 1.6896 2.0784 2.1037 2.2083 2.2757 2.4515 2.5107 2.6689 2.7048 3.2241 3.2523 3.3339 3.3620 3.6301 3.6724 3.7516 3.8103 4.2111 4.2314 4.6106 4.6898 4.7490 4.8195 4.8322 4.8806 5.0027 5.0117 5.2373 5.3282 5.4000 5.4476 5.4700 5.4980 5.6433 5.6856 5.8473 5.8637 6.2558 6.3005 8.3602 8.4128 9.1905 9.2219 9.5381 9.5934 9.8588 9.8992 10.9613 11.1651 11.1894 11.3331 k = 0.0991 0.5529 0.3873 ( 6499 PWs) bands (ev): -7.5817 -7.5815 -6.8813 -6.8789 -6.6396 -6.6332 -6.5218 -6.5129 -2.0269 -2.0123 -1.2326 -1.2099 -1.0668 -1.0466 0.2572 0.2981 0.4284 0.4633 0.4922 0.5277 1.3275 1.3360 1.6855 1.6955 2.0687 2.0929 2.2049 2.2658 2.4570 2.5229 2.6346 2.6772 3.2271 3.2498 3.3534 3.3802 3.6251 3.6593 3.7490 3.7997 4.2132 4.2309 4.6182 4.6979 4.7397 4.8084 4.8355 4.8759 5.0040 5.0130 5.2484 5.3253 5.4049 5.4489 5.4761 5.5003 5.6598 5.6946 5.8586 5.8753 6.2264 6.2698 8.3700 8.4160 9.1992 9.2280 9.5961 9.6577 9.8640 9.9103 10.9651 11.1567 11.1625 11.2652 k = 0.0793 0.5472 0.3944 ( 6503 PWs) bands (ev): -7.5853 -7.5851 -6.8821 -6.8803 -6.6251 -6.6183 -6.5298 -6.5210 -2.0282 -2.0166 -1.2304 -1.2118 -1.0650 -1.0493 0.2590 0.2918 0.4311 0.4608 0.4963 0.5263 1.3380 1.3453 1.6922 1.7009 2.0616 2.0836 2.2022 2.2544 2.4628 2.5337 2.6042 2.6538 3.2295 3.2473 3.3720 3.3960 3.6197 3.6458 3.7491 3.7905 4.2154 4.2300 4.6267 4.7025 4.7332 4.7976 4.8390 4.8714 5.0053 5.0135 5.2591 5.3216 5.4101 5.4483 5.4815 5.5016 5.6730 5.6997 5.8748 5.8958 6.1938 6.2357 8.3809 8.4191 9.2070 9.2318 9.6527 9.7193 9.8684 9.9199 10.9488 11.1134 11.1598 11.2069 k = 0.0595 0.5415 0.4015 ( 6501 PWs) bands (ev): -7.5881 -7.5880 -6.8829 -6.8815 -6.6109 -6.6037 -6.5387 -6.5301 -2.0290 -2.0203 -1.2280 -1.2138 -1.0633 -1.0518 0.2612 0.2858 0.4342 0.4574 0.5011 0.5242 1.3471 1.3528 1.6983 1.7053 2.0572 2.0757 2.2008 2.2422 2.4697 2.5405 2.5809 2.6342 3.2316 3.2448 3.3889 3.4088 3.6147 3.6334 3.7511 3.7824 4.2176 4.2289 4.6360 4.6994 4.7338 4.7871 4.8426 4.8670 5.0068 5.0135 5.2695 5.3170 5.4157 5.4462 5.4864 5.5019 5.6824 5.7018 5.8968 5.9223 6.1598 6.1993 8.3919 8.4214 9.2139 9.2336 9.7049 9.7725 9.8735 9.9278 10.9229 11.0495 11.1584 11.1788 k = 0.0396 0.5357 0.4086 ( 6492 PWs) bands (ev): -7.5902 -7.5901 -6.8834 -6.8825 -6.5971 -6.5897 -6.5485 -6.5401 -2.0292 -2.0234 -1.2256 -1.2161 -1.0616 -1.0541 0.2639 0.2803 0.4376 0.4535 0.5059 0.5215 1.3542 1.3582 1.7034 1.7084 2.0555 2.0689 2.2014 2.2302 2.4783 2.5344 2.5739 2.6176 3.2337 3.2424 3.4031 3.4175 3.6109 3.6229 3.7544 3.7753 4.2197 4.2274 4.6461 4.6904 4.7401 4.7770 4.8464 4.8627 5.0082 5.0130 5.2794 5.3113 5.4215 5.4427 5.4906 5.5013 5.6889 5.7017 5.9234 5.9499 6.1278 6.1626 8.4020 8.4221 9.2199 9.2336 9.7496 9.8077 9.8844 9.9324 10.9000 10.9847 11.1573 11.1661 k = 0.0198 0.5300 0.4157 ( 6490 PWs) bands (ev): -7.5914 -7.5914 -6.8837 -6.8833 -6.5840 -6.5765 -6.5589 -6.5509 -2.0288 -2.0258 -1.2232 -1.2184 -1.0598 -1.0561 0.2672 0.2754 0.4414 0.4494 0.5104 0.5183 1.3591 1.3611 1.7072 1.7099 2.0562 2.0633 2.2047 2.2194 2.4891 2.5183 2.5805 2.6034 3.2358 3.2401 3.4138 3.4214 3.6092 3.6151 3.7585 3.7690 4.2219 4.2257 4.6568 4.6794 4.7485 4.7672 4.8504 4.8585 5.0097 5.0121 5.2886 5.3047 5.4273 5.4382 5.4943 5.4997 5.6936 5.6999 5.9508 5.9704 6.1055 6.1289 8.4105 8.4207 9.2250 9.2320 9.7842 9.8172 9.9040 9.9315 10.8904 10.9328 11.1565 11.1598 k = 0.0000 0.5243 0.4228 ( 6490 PWs) bands (ev): -7.5918 -7.5918 -6.8837 -6.8837 -6.5724 -6.5724 -6.5619 -6.5619 -2.0276 -2.0276 -1.2208 -1.2208 -1.0580 -1.0580 0.2710 0.2710 0.4453 0.4453 0.5146 0.5146 1.3614 1.3614 1.7094 1.7094 2.0589 2.0589 2.2107 2.2107 2.5025 2.5025 2.5911 2.5911 3.2379 3.2379 3.4202 3.4202 3.6105 3.6105 3.7634 3.7634 4.2239 4.2239 4.6680 4.6680 4.7577 4.7577 4.8544 4.8544 5.0110 5.0110 5.2971 5.2971 5.4330 5.4330 5.4974 5.4974 5.6972 5.6972 5.9708 5.9708 6.1057 6.1057 8.4169 8.4169 9.2291 9.2291 9.8073 9.8073 9.9221 9.9221 10.9006 10.9006 11.1570 11.1570 k = 0.0000 0.5243 0.4228 ( 6490 PWs) bands (ev): -7.5918 -7.5918 -6.8837 -6.8837 -6.5724 -6.5724 -6.5619 -6.5619 -2.0276 -2.0276 -1.2208 -1.2208 -1.0580 -1.0580 0.2710 0.2710 0.4453 0.4453 0.5146 0.5146 1.3614 1.3614 1.7094 1.7094 2.0589 2.0589 2.2107 2.2107 2.5025 2.5025 2.5911 2.5911 3.2379 3.2379 3.4202 3.4202 3.6105 3.6105 3.7634 3.7634 4.2239 4.2239 4.6680 4.6680 4.7577 4.7577 4.8544 4.8544 5.0110 5.0110 5.2971 5.2971 5.4330 5.4330 5.4974 5.4974 5.6972 5.6972 5.9708 5.9708 6.1057 6.1057 8.4169 8.4169 9.2291 9.2291 9.8073 9.8073 9.9221 9.9221 10.9006 10.9006 11.1570 11.1570 k = 0.0089 0.5121 0.4379 ( 6488 PWs) bands (ev): -7.5917 -7.5914 -6.8834 -6.8833 -6.5727 -6.5726 -6.5624 -6.5622 -2.0298 -2.0248 -1.2218 -1.2196 -1.0629 -1.0538 0.2704 0.2714 0.4426 0.4481 0.5140 0.5146 1.3541 1.3576 1.7041 1.7127 2.0404 2.0726 2.1939 2.2323 2.5042 2.5071 2.5934 2.5954 3.2375 3.2389 3.4194 3.4209 3.6103 3.6112 3.7637 3.7650 4.2214 4.2270 4.6677 4.6688 4.7563 4.7589 4.8533 4.8560 5.0104 5.0105 5.2903 5.3011 5.4157 5.4485 5.4871 5.5153 5.6971 5.7031 5.9699 5.9709 6.1024 6.1080 8.4121 8.4155 9.2221 9.2230 9.8089 9.8089 9.9220 9.9271 10.8981 10.9102 11.1535 11.1582 k = 0.0179 0.4999 0.4530 ( 6496 PWs) bands (ev): -7.5909 -7.5904 -6.8826 -6.8824 -6.5734 -6.5732 -6.5635 -6.5631 -2.0313 -2.0214 -1.2227 -1.2182 -1.0684 -1.0504 0.2697 0.2717 0.4400 0.4509 0.5129 0.5139 1.3364 1.3432 1.6969 1.7137 2.0197 2.0725 2.1919 2.2555 2.5130 2.5161 2.6020 2.6068 3.2376 3.2403 3.4187 3.4216 3.6106 3.6124 3.7660 3.7685 4.2196 4.2306 4.6679 4.6701 4.7547 4.7600 4.8528 4.8583 5.0089 5.0090 5.2811 5.3022 5.4003 5.4501 5.4963 5.5373 5.7028 5.7146 5.9682 5.9701 6.0981 6.1093 8.4015 8.4081 9.2028 9.2041 9.8136 9.8137 9.9268 9.9366 10.9024 10.9267 11.1479 11.1572 k = 0.0268 0.4878 0.4681 ( 6494 PWs) bands (ev): -7.5896 -7.5888 -6.8812 -6.8810 -6.5746 -6.5743 -6.5653 -6.5647 -2.0321 -2.0174 -1.2235 -1.2166 -1.0746 -1.0476 0.2688 0.2720 0.4375 0.4536 0.5113 0.5127 1.3098 1.3194 1.6877 1.7120 1.9964 2.0526 2.2113 2.2811 2.5274 2.5279 2.6163 2.6251 3.2382 3.2423 3.4179 3.4224 3.6114 3.6142 3.7702 3.7740 4.2186 4.2344 4.6688 4.6720 4.7528 4.7614 4.8526 4.8615 5.0064 5.0071 5.2702 5.3008 5.3872 5.4414 5.5210 5.5625 5.7138 5.7309 5.9657 5.9689 6.0930 6.1096 8.3855 8.3949 9.1723 9.1735 9.8207 9.8211 9.9361 9.9495 10.9132 10.9496 11.1412 11.1544 k = 0.0357 0.4756 0.4832 ( 6494 PWs) bands (ev): -7.5878 -7.5866 -6.8792 -6.8789 -6.5764 -6.5758 -6.5676 -6.5670 -2.0322 -2.0127 -1.2240 -1.2149 -1.0813 -1.0456 0.2678 0.2722 0.4350 0.4562 0.5093 0.5108 1.2762 1.2881 1.6764 1.7075 1.9694 2.0199 2.2454 2.3107 2.5399 2.5468 2.6361 2.6492 3.2393 3.2448 3.4171 3.4232 3.6125 3.6166 3.7762 3.7813 4.2183 4.2383 4.6705 4.6743 4.7505 4.7631 4.8528 4.8656 5.0030 5.0050 5.2580 5.2977 5.3762 5.4315 5.5515 5.5908 5.7292 5.7511 5.9628 5.9675 6.0870 6.1089 8.3646 8.3764 9.1320 9.1324 9.8298 9.8304 9.9489 9.9648 10.9296 10.9780 11.1343 11.1507 k = 0.0446 0.4634 0.4983 ( 6492 PWs) bands (ev): -7.5853 -7.5839 -6.8767 -6.8763 -6.5788 -6.5779 -6.5704 -6.5699 -2.0316 -2.0076 -1.2244 -1.2130 -1.0885 -1.0443 0.2665 0.2723 0.4327 0.4586 0.5070 0.5085 1.2374 1.2513 1.6631 1.7001 1.9387 1.9812 2.2874 2.3446 2.5536 2.5684 2.6604 2.6775 3.2409 3.2477 3.4164 3.4243 3.6140 3.6197 3.7841 3.7904 4.2186 4.2418 4.6730 4.6771 4.7479 4.7652 4.8533 4.8707 4.9991 5.0031 5.2452 5.2933 5.3670 5.4224 5.5852 5.6217 5.7479 5.7741 5.9599 5.9666 6.0804 6.1073 8.3395 8.3533 9.0825 9.0834 9.8402 9.8412 9.9642 9.9814 10.9504 11.0103 11.1287 11.1468 k = 0.0536 0.4512 0.5134 ( 6488 PWs) bands (ev): -7.5824 -7.5807 -6.8737 -6.8732 -6.5819 -6.5805 -6.5735 -6.5732 -2.0304 -2.0020 -1.2247 -1.2110 -1.0962 -1.0437 0.2650 0.2725 0.4304 0.4606 0.5047 0.5060 1.1951 1.2106 1.6479 1.6899 1.9049 1.9395 2.3339 2.3822 2.5688 2.5916 2.6883 2.7083 3.2430 3.2511 3.4158 3.4256 3.6158 3.6234 3.7938 3.8013 4.2195 4.2448 4.6765 4.6803 4.7451 4.7679 4.8542 4.8768 4.9951 5.0018 5.2321 5.2881 5.3595 5.4143 5.6211 5.6547 5.7684 5.7985 5.9582 5.9671 6.0732 6.1046 8.3111 8.3264 9.0252 9.0278 9.8515 9.8531 9.9808 9.9981 10.9740 11.0434 11.1270 11.1437 k = 0.0625 0.4390 0.5285 ( 6482 PWs) bands (ev): -7.5789 -7.5770 -6.8701 -6.8695 -6.5858 -6.5838 -6.5769 -6.5767 -2.0285 -1.9959 -1.2248 -1.2089 -1.1042 -1.0439 0.2633 0.2726 0.4282 0.4621 0.5023 0.5034 1.1506 1.1674 1.6308 1.6770 1.8686 1.8964 2.3828 2.4225 2.5856 2.6165 2.7185 2.7403 3.2455 3.2548 3.4155 3.4271 3.6181 3.6277 3.8052 3.8140 4.2208 4.2469 4.6810 4.6839 4.7422 4.7712 4.8554 4.8838 4.9916 5.0013 5.2192 5.2825 5.3534 5.4072 5.6588 5.6893 5.7891 5.8222 5.9591 5.9705 6.0656 6.1011 8.2801 8.2964 8.9617 8.9663 9.8635 9.8655 9.9978 10.0142 10.9980 11.0707 11.1348 11.1418 k = 0.0714 0.4269 0.5436 ( 6492 PWs) bands (ev): -7.5750 -7.5729 -6.8660 -6.8654 -6.5905 -6.5878 -6.5808 -6.5802 -2.0259 -1.9895 -1.2247 -1.2067 -1.1126 -1.0449 0.2614 0.2727 0.4260 0.4627 0.5001 0.5011 1.1048 1.1229 1.6122 1.6617 1.8308 1.8528 2.4326 2.4640 2.6042 2.6430 2.7499 2.7725 3.2484 3.2588 3.4154 3.4290 3.6208 3.6327 3.8180 3.8281 4.2221 4.2478 4.6867 4.6877 4.7396 4.7751 4.8571 4.8916 4.9890 5.0020 5.2065 5.2767 5.3488 5.4008 5.6976 5.7245 5.8082 5.8420 5.9654 5.9784 6.0580 6.0967 8.2473 8.2641 8.8931 8.8998 9.8757 9.8784 10.0144 10.0291 11.0194 11.0847 11.1417 11.1570 k = 0.0804 0.4147 0.5587 ( 6490 PWs) bands (ev): -7.5706 -7.5683 -6.8614 -6.8607 -6.5959 -6.5928 -6.5848 -6.5839 -2.0228 -1.9827 -1.2246 -1.2044 -1.1211 -1.0465 0.2594 0.2729 0.4237 0.4622 0.4982 0.4996 1.0585 1.0779 1.5922 1.6442 1.7922 1.8093 2.4822 2.5054 2.6248 2.6712 2.7816 2.8044 3.2517 3.2631 3.4158 3.4312 3.6239 3.6384 3.8323 3.8437 4.2234 4.2473 4.6917 4.6934 4.7376 4.7798 4.8594 4.8999 4.9878 5.0040 5.1944 5.2707 5.3453 5.3950 5.7370 5.7585 5.8252 5.8550 5.9795 5.9925 6.0512 6.0916 8.2134 8.2302 8.8203 8.8291 9.8880 9.8914 10.0298 10.0423 11.0346 11.0903 11.1431 11.1854 k = 0.0893 0.4025 0.5738 ( 6492 PWs) bands (ev): -7.5659 -7.5634 -6.8563 -6.8555 -6.6019 -6.5984 -6.5889 -6.5878 -2.0190 -1.9757 -1.2243 -1.2021 -1.1297 -1.0488 0.2574 0.2731 0.4212 0.4602 0.4966 0.4991 1.0125 1.0331 1.5712 1.6248 1.7534 1.7663 2.5305 2.5458 2.6474 2.7010 2.8133 2.8355 3.2552 3.2677 3.4166 3.4338 3.6276 3.6448 3.8477 3.8605 4.2243 4.2452 4.6954 4.7011 4.7366 4.7852 4.8625 4.9085 4.9888 5.0075 5.1831 5.2646 5.3429 5.3897 5.7762 5.7876 5.8427 5.8608 5.9995 6.0132 6.0473 6.0859 8.1791 8.1956 8.7441 8.7549 9.9001 9.9042 10.0437 10.0535 11.0406 11.0940 11.1452 11.2082 k = 0.0982 0.3903 0.5889 ( 6496 PWs) bands (ev): -7.5608 -7.5581 -6.8508 -6.8499 -6.6084 -6.6046 -6.5932 -6.5920 -2.0147 -1.9686 -1.2240 -1.1998 -1.1383 -1.0517 0.2553 0.2733 0.4186 0.4570 0.4956 0.4996 0.9672 0.9891 1.5494 1.6038 1.7150 1.7241 2.5762 2.5841 2.6723 2.7321 2.8447 2.8653 3.2590 3.2723 3.4181 3.4368 3.6319 3.6518 3.8641 3.8783 4.2244 4.2414 4.6987 4.7093 4.7369 4.7914 4.8666 4.9169 4.9925 5.0127 5.1727 5.2586 5.3412 5.3844 5.8056 5.8134 5.8628 5.8669 6.0142 6.0393 6.0558 6.0804 8.1450 8.1608 8.6653 8.6780 9.9120 9.9167 10.0558 10.0627 11.0359 11.0976 11.1472 11.2179 k = 0.1071 0.3781 0.6040 ( 6494 PWs) bands (ev): -7.5554 -7.5526 -6.8448 -6.8439 -6.6153 -6.6113 -6.5978 -6.5965 -2.0099 -1.9614 -1.2235 -1.1976 -1.1466 -1.0553 0.2533 0.2736 0.4156 0.4526 0.4951 0.5009 0.9231 0.9463 1.5272 1.5813 1.6773 1.6830 2.6182 2.6201 2.6999 2.7638 2.8757 2.8939 3.2629 3.2770 3.4201 3.4400 3.6369 3.6595 3.8812 3.8967 4.2237 4.2358 4.7013 4.7176 4.7388 4.7981 4.8722 4.9248 4.9994 5.0195 5.1635 5.2528 5.3401 5.3792 5.8130 5.8405 5.8711 5.8985 6.0149 6.0624 6.0818 6.0831 8.1115 8.1264 8.5846 8.5989 9.9234 9.9285 10.0656 10.0696 11.0216 11.1013 11.1492 11.2123 k = 0.1161 0.3660 0.6191 ( 6510 PWs) bands (ev): -7.5497 -7.5468 -6.8384 -6.8375 -6.6224 -6.6184 -6.6027 -6.6013 -2.0046 -1.9543 -1.2231 -1.1957 -1.1544 -1.0594 0.2514 0.2739 0.4122 0.4474 0.4953 0.5029 0.8806 0.9051 1.5047 1.5578 1.6408 1.6433 2.6534 2.6557 2.7303 2.7951 2.9065 2.9211 3.2670 3.2818 3.4227 3.4436 3.6427 3.6680 3.8987 3.9154 4.2218 4.2285 4.7033 4.7256 4.7420 4.8050 4.8797 4.9323 5.0095 5.0279 5.1556 5.2470 5.3392 5.3736 5.8153 5.8451 5.8988 5.9329 6.0115 6.0615 6.1098 6.1182 8.0791 8.0928 8.5026 8.5183 9.9341 9.9396 10.0732 10.0744 11.0010 11.1036 11.1514 11.1956 k = 0.1250 0.3538 0.6342 ( 6514 PWs) bands (ev): -7.5439 -7.5409 -6.8317 -6.8306 -6.6298 -6.6257 -6.6079 -6.6064 -1.9988 -1.9473 -1.2226 -1.1944 -1.1614 -1.0640 0.2499 0.2742 0.4083 0.4417 0.4961 0.5052 0.8399 0.8659 1.4824 1.5333 1.6052 1.6058 2.6841 2.6884 2.7627 2.8251 2.9372 2.9471 3.2712 3.2865 3.4260 3.4474 3.6492 3.6771 3.9163 3.9342 4.2185 4.2196 4.7050 4.7328 4.7462 4.8114 4.8899 4.9398 5.0226 5.0376 5.1495 5.2414 5.3385 5.3675 5.8160 5.8430 5.9299 5.9675 6.0096 6.0549 6.1449 6.1555 8.0480 8.0605 8.4200 8.4369 9.9441 9.9497 10.0771 10.0783 10.9780 11.1019 11.1533 11.1761 k = 0.1339 0.3416 0.6493 ( 6510 PWs) bands (ev): -7.5379 -7.5349 -6.8246 -6.8235 -6.6372 -6.6331 -6.6134 -6.6119 -1.9927 -1.9405 -1.2221 -1.1943 -1.1668 -1.0691 0.2487 0.2747 0.4038 0.4355 0.4975 0.5078 0.8014 0.8288 1.4605 1.5084 1.5687 1.5726 2.7125 2.7173 2.7955 2.8528 2.9678 2.9720 3.2754 3.2911 3.4299 3.4514 3.6566 3.6869 3.9338 3.9526 4.2092 4.2138 4.7069 4.7391 4.7508 4.8166 4.9032 4.9479 5.0380 5.0481 5.1454 5.2359 5.3375 5.3608 5.8170 5.8406 5.9545 6.0007 6.0141 6.0481 6.1812 6.1934 8.0187 8.0298 8.3376 8.3553 9.9531 9.9587 10.0777 10.0810 10.9561 11.0925 11.1540 11.1618 k = 0.1429 0.3294 0.6644 ( 6506 PWs) bands (ev): -7.5320 -7.5290 -6.8171 -6.8160 -6.6447 -6.6406 -6.6192 -6.6177 -1.9863 -1.9340 -1.2216 -1.1959 -1.1699 -1.0745 0.2480 0.2752 0.3988 0.4288 0.4995 0.5106 0.7654 0.7941 1.4392 1.4831 1.5341 1.5414 2.7387 2.7434 2.8270 2.8777 2.9961 2.9983 3.2796 3.2956 3.4343 3.4555 3.6649 3.6974 3.9508 3.9703 4.1975 4.2075 4.7091 4.7444 4.7553 4.8201 4.9199 4.9571 5.0549 5.0588 5.1439 5.2306 5.3361 5.3533 5.8195 5.8395 5.9667 6.0287 6.0303 6.0448 6.2173 6.2306 7.9913 8.0009 8.2559 8.2742 9.9612 9.9665 10.0763 10.0812 10.9374 11.0756 11.1528 11.1546 k = 0.1518 0.3172 0.6795 ( 6510 PWs) bands (ev): -7.5260 -7.5231 -6.8094 -6.8082 -6.6520 -6.6480 -6.6254 -6.6238 -1.9797 -1.9280 -1.2212 -1.1994 -1.1707 -1.0803 0.2478 0.2759 0.3932 0.4218 0.5020 0.5134 0.7321 0.7619 1.4190 1.4580 1.5016 1.5121 2.7628 2.7674 2.8557 2.8996 3.0196 3.0282 3.2837 3.2998 3.4392 3.4597 3.6741 3.7085 3.9671 3.9870 4.1847 4.1995 4.7117 4.7488 4.7595 4.8218 4.9396 4.9678 5.0687 5.0724 5.1455 5.2252 5.3340 5.3448 5.8243 5.8405 5.9700 6.0303 6.0544 6.0661 6.2525 6.2664 7.9658 7.9741 8.1758 8.1943 9.9682 9.9731 10.0731 10.0792 10.9234 11.0564 11.1492 11.1506 k = 0.1607 0.3051 0.6946 ( 6512 PWs) bands (ev): -7.5202 -7.5173 -6.8015 -6.8002 -6.6591 -6.6553 -6.6318 -6.6302 -1.9728 -1.9225 -1.2210 -1.2039 -1.1698 -1.0863 0.2484 0.2767 0.3869 0.4142 0.5049 0.5162 0.7017 0.7323 1.4000 1.4336 1.4711 1.4850 2.7848 2.7895 2.8811 2.9186 3.0427 3.0570 3.2878 3.3038 3.4444 3.4639 3.6842 3.7201 3.9826 4.0025 4.1710 4.1901 4.7150 4.7524 4.7630 4.8218 4.9617 4.9800 5.0770 5.0900 5.1502 5.2199 5.3310 5.3352 5.8318 5.8440 5.9704 6.0244 6.0802 6.0929 6.2858 6.3002 7.9425 7.9495 8.0981 8.1166 9.9740 9.9783 10.0683 10.0751 10.9149 11.0393 11.1439 11.1466 k = 0.1696 0.2929 0.7098 ( 6516 PWs) bands (ev): -7.5145 -7.5118 -6.7933 -6.7920 -6.6660 -6.6623 -6.6386 -6.6369 -1.9659 -1.9177 -1.2208 -1.2087 -1.1680 -1.0924 0.2497 0.2778 0.3800 0.4061 0.5082 0.5191 0.6746 0.7056 1.3825 1.4102 1.4430 1.4598 2.8048 2.8099 2.9028 2.9348 3.0654 3.0841 3.2918 3.3074 3.4499 3.4679 3.6952 3.7320 3.9969 4.0165 4.1567 4.1793 4.7187 4.7553 4.7659 4.8202 4.9855 4.9939 5.0836 5.1068 5.1577 5.2148 5.3245 5.3268 5.8423 5.8504 5.9708 6.0185 6.1048 6.1175 6.3167 6.3312 7.9211 7.9271 8.0236 8.0420 9.9788 9.9824 10.0622 10.0693 10.9123 11.0261 11.1376 11.1415 k = 0.1786 0.2807 0.7249 ( 6510 PWs) bands (ev): -7.5092 -7.5066 -6.7849 -6.7836 -6.6724 -6.6689 -6.6456 -6.6439 -1.9589 -1.9136 -1.2208 -1.2131 -1.1657 -1.0986 0.2519 0.2791 0.3727 0.3972 0.5116 0.5218 0.6508 0.6815 1.3666 1.3883 1.4173 1.4367 2.8229 2.8284 2.9210 2.9485 3.0873 3.1089 3.2957 3.3107 3.4554 3.4719 3.7069 3.7441 4.0101 4.0288 4.1422 4.1673 4.7230 4.7578 4.7681 4.8173 5.0093 5.0105 5.0891 5.1222 5.1667 5.2099 5.3129 5.3213 5.8558 5.8597 5.9721 6.0134 6.1274 6.1395 6.3447 6.3588 7.9013 7.9067 7.9536 7.9719 9.9824 9.9853 10.0553 10.0623 10.9157 11.0177 11.1316 11.1361 k = 0.1875 0.2685 0.7400 ( 6514 PWs) bands (ev): -7.5042 -7.5018 -6.7764 -6.7751 -6.6783 -6.6751 -6.6528 -6.6511 -1.9520 -1.9104 -1.2210 -1.2170 -1.1631 -1.1047 0.2550 0.2808 0.3649 0.3876 0.5153 0.5245 0.6306 0.6602 1.3525 1.3684 1.3943 1.4155 2.8390 2.8450 2.9360 2.9599 3.1082 3.1310 3.2994 3.3135 3.4609 3.4755 3.7193 3.7561 4.0221 4.0393 4.1279 4.1544 4.7277 4.7599 4.7696 4.8134 5.0260 5.0359 5.0943 5.1352 5.1759 5.2057 5.3002 5.3143 5.8713 5.8717 5.9747 6.0092 6.1474 6.1586 6.3691 6.3827 7.8796 7.8819 7.8955 7.9108 9.9850 9.9871 10.0479 10.0545 10.9247 11.0144 11.1267 11.1310 k = 0.1964 0.2564 0.7551 ( 6516 PWs) bands (ev): -7.4996 -7.4975 -6.7679 -6.7665 -6.6836 -6.6807 -6.6602 -6.6585 -1.9452 -1.9080 -1.2214 -1.2203 -1.1604 -1.1106 0.2591 0.2829 0.3568 0.3771 0.5189 0.5272 0.6138 0.6415 1.3403 1.3506 1.3741 1.3964 2.8530 2.8595 2.9483 2.9691 3.1275 3.1501 3.3030 3.3160 3.4662 3.4788 3.7321 3.7677 4.0327 4.0480 4.1142 4.1408 4.7329 4.7617 4.7705 4.8085 5.0437 5.0607 5.1002 5.1450 5.1840 5.2030 5.2869 5.3057 5.8846 5.8891 5.9789 6.0063 6.1647 6.1748 6.3897 6.4025 7.8269 7.8369 7.8762 7.8786 9.9864 9.9880 10.0406 10.0466 10.9390 11.0158 11.1234 11.1270 k = 0.2054 0.2442 0.7702 ( 6516 PWs) bands (ev): -7.4956 -7.4938 -6.7593 -6.7579 -6.6882 -6.6857 -6.6678 -6.6661 -1.9387 -1.9065 -1.2229 -1.2219 -1.1574 -1.1164 0.2642 0.2854 0.3487 0.3661 0.5225 0.5296 0.6004 0.6253 1.3299 1.3354 1.3570 1.3794 2.8652 2.8717 2.9584 2.9763 3.1450 3.1660 3.3065 3.3179 3.4711 3.4817 3.7451 3.7782 4.0421 4.0549 4.1017 4.1270 4.7384 4.7633 4.7710 4.8030 5.0622 5.0829 5.1087 5.1504 5.1901 5.2027 5.2732 5.2953 5.8985 5.9065 5.9849 6.0051 6.1793 6.1880 6.4063 6.4179 7.7752 7.7858 7.8632 7.8640 9.9869 9.9880 10.0341 10.0392 10.9577 11.0214 11.1218 11.1246 k = 0.2143 0.2320 0.7853 ( 6516 PWs) bands (ev): -7.4921 -7.4906 -6.7508 -6.7494 -6.6920 -6.6899 -6.6755 -6.6738 -1.9325 -1.9060 -1.2247 -1.2227 -1.1544 -1.1219 0.2702 0.2885 0.3406 0.3546 0.5259 0.5319 0.5903 0.6116 1.3212 1.3228 1.3435 1.3645 2.8754 2.8815 2.9667 2.9816 3.1603 3.1784 3.3097 3.3192 3.4756 3.4841 3.7578 3.7872 4.0501 4.0599 4.0912 4.1134 4.7443 4.7647 4.7711 4.7969 5.0811 5.0984 5.1237 5.1511 5.1935 5.2052 5.2599 5.2831 5.9116 5.9219 5.9924 6.0059 6.1913 6.1985 6.4190 6.4290 7.7313 7.7406 7.8529 7.8534 9.9864 9.9872 10.0287 10.0328 10.9796 11.0302 11.1218 11.1236 k = 0.2232 0.2198 0.8004 ( 6518 PWs) bands (ev): -7.4893 -7.4882 -6.7425 -6.7412 -6.6951 -6.6934 -6.6830 -6.6813 -1.9268 -1.9064 -1.2258 -1.2235 -1.1512 -1.1270 0.2772 0.2920 0.3329 0.3431 0.5290 0.5339 0.5832 0.6001 1.3131 1.3138 1.3341 1.3520 2.8836 2.8889 2.9734 2.9851 3.1730 3.1874 3.3126 3.3201 3.4795 3.4859 3.7699 3.7939 4.0569 4.0633 4.0830 4.1006 4.7505 4.7659 4.7709 4.7905 5.1000 5.1078 5.1436 5.1482 5.1936 5.2096 5.2479 5.2691 5.9228 5.9336 6.0010 6.0089 6.2007 6.2062 6.4282 6.4362 7.6965 7.7038 7.8450 7.8455 9.9852 9.9859 10.0249 10.0278 11.0029 11.0405 11.1230 11.1238 k = 0.2321 0.2076 0.8155 ( 6518 PWs) bands (ev): -7.4872 -7.4864 -6.7348 -6.7336 -6.6973 -6.6960 -6.6901 -6.6885 -1.9216 -1.9077 -1.2264 -1.2244 -1.1479 -1.1319 0.2850 0.2957 0.3258 0.3320 0.5318 0.5353 0.5791 0.5910 1.3063 1.3078 1.3288 1.3419 2.8899 2.8937 2.9788 2.9869 3.1830 3.1930 3.3152 3.3203 3.4826 3.4869 3.7806 3.7978 4.0625 4.0655 4.0776 4.0891 4.7568 4.7670 4.7704 4.7838 5.1154 5.1186 5.1431 5.1610 5.1923 5.2147 5.2384 5.2535 5.9317 5.9404 6.0091 6.0132 6.2076 6.2113 6.4344 6.4401 7.6714 7.6764 7.8395 7.8399 9.9839 9.9843 10.0224 10.0243 11.0250 11.0497 11.1249 11.1251 k = 0.2411 0.1955 0.8306 ( 6518 PWs) bands (ev): -7.4859 -7.4855 -6.7284 -6.7276 -6.6988 -6.6980 -6.6954 -6.6943 -1.9170 -1.9100 -1.2264 -1.2253 -1.1443 -1.1363 0.2929 0.2990 0.3200 0.3225 0.5339 0.5358 0.5779 0.5841 1.3025 1.3036 1.3274 1.3343 2.8941 2.8961 2.9829 2.9871 3.1901 3.1953 3.3173 3.3199 3.4849 3.4871 3.7893 3.7983 4.0669 4.0680 4.0741 4.0798 4.7634 4.7680 4.7698 4.7770 5.1225 5.1344 5.1389 5.1638 5.2001 5.2194 5.2314 5.2367 5.9380 5.9428 6.0152 6.0170 6.2121 6.2140 6.4384 6.4413 7.6567 7.6592 7.8363 7.8365 9.9829 9.9831 10.0213 10.0222 11.0427 11.0548 11.1266 11.1267 k = 0.2500 0.1833 0.8457 ( 6516 PWs) bands (ev): -7.4853 -7.4853 -6.7254 -6.7254 -6.6995 -6.6995 -6.6968 -6.6968 -1.9131 -1.9131 -1.2260 -1.2260 -1.1405 -1.1405 0.2988 0.2988 0.3177 0.3177 0.5354 0.5354 0.5796 0.5796 1.3017 1.3017 1.3294 1.3294 2.8962 2.8962 2.9857 2.9857 3.1943 3.1943 3.3189 3.3189 3.4864 3.4864 3.7954 3.7954 4.0699 4.0699 4.0734 4.0734 4.7688 4.7688 4.7704 4.7704 5.1295 5.1295 5.1528 5.1528 5.2163 5.2163 5.2268 5.2268 5.9418 5.9418 6.0179 6.0179 6.2142 6.2142 6.4407 6.4407 7.6526 7.6526 7.8352 7.8352 9.9826 9.9826 10.0212 10.0212 11.0529 11.0529 11.1275 11.1275 k = 0.2500 0.1833 0.8457 ( 6516 PWs) bands (ev): -7.4853 -7.4853 -6.7254 -6.7254 -6.6995 -6.6995 -6.6968 -6.6968 -1.9131 -1.9131 -1.2260 -1.2260 -1.1405 -1.1405 0.2988 0.2988 0.3177 0.3177 0.5354 0.5354 0.5796 0.5796 1.3017 1.3017 1.3294 1.3294 2.8962 2.8962 2.9857 2.9857 3.1943 3.1943 3.3189 3.3189 3.4864 3.4864 3.7954 3.7954 4.0699 4.0699 4.0734 4.0734 4.7688 4.7688 4.7704 4.7704 5.1295 5.1295 5.1528 5.1528 5.2163 5.2163 5.2268 5.2268 5.9418 5.9418 6.0179 6.0179 6.2142 6.2142 6.4407 6.4407 7.6526 7.6526 7.8352 7.8352 9.9826 9.9826 10.0212 10.0212 11.0529 11.0529 11.1275 11.1275 k = 0.2639 0.1935 0.8330 ( 6514 PWs) bands (ev): -7.4855 -7.4853 -6.7265 -6.7261 -6.6994 -6.6993 -6.6962 -6.6955 -1.9153 -1.9112 -1.2263 -1.2255 -1.1429 -1.1380 0.2961 0.2966 0.3193 0.3221 0.5343 0.5357 0.5788 0.5822 1.2766 1.2800 1.3545 1.3560 2.8850 2.8854 2.9921 2.9955 3.1904 3.1934 3.3179 3.3194 3.4857 3.4869 3.7939 3.7998 4.0599 4.0674 4.0798 4.0806 4.7660 4.7672 4.7694 4.7758 5.1203 5.1290 5.1489 5.1624 5.2077 5.2170 5.2292 5.2372 5.9282 5.9299 6.0306 6.0312 6.2132 6.2144 6.4395 6.4413 7.6376 7.6386 7.8511 7.8514 9.9228 9.9230 10.0806 10.0810 11.0479 11.0542 11.1279 11.1288 k = 0.2778 0.2036 0.8204 ( 6514 PWs) bands (ev): -7.4860 -7.4855 -6.7289 -6.7284 -6.6997 -6.6995 -6.6936 -6.6925 -1.9179 -1.9095 -1.2267 -1.2247 -1.1454 -1.1355 0.2905 0.2926 0.3225 0.3316 0.5320 0.5356 0.5800 0.5863 1.2442 1.2520 1.3921 1.3941 2.8592 2.8594 3.0069 3.0149 3.1820 3.1880 3.3165 3.3196 3.4846 3.4871 3.7943 3.8073 4.0488 4.0651 4.0877 4.0895 4.7618 4.7654 4.7695 4.7817 5.1061 5.1231 5.1483 5.1685 5.2022 5.2136 5.2387 5.2539 5.9018 5.9036 6.0568 6.0597 6.2112 6.2135 6.4379 6.4411 7.6025 7.6032 7.8904 7.8919 9.8478 9.8481 10.1554 10.1557 11.0412 11.0530 11.1270 11.1303 k = 0.2917 0.2138 0.8078 ( 6508 PWs) bands (ev): -7.4865 -7.4858 -6.7319 -6.7316 -6.6999 -6.6997 -6.6900 -6.6888 -1.9208 -1.9082 -1.2271 -1.2237 -1.1480 -1.1329 0.2843 0.2888 0.3268 0.3424 0.5288 0.5352 0.5831 0.5918 1.2138 1.2262 1.4324 1.4349 2.8264 2.8265 3.0218 3.0356 3.1698 3.1794 3.3147 3.3195 3.4834 3.4869 3.7960 3.8170 4.0384 4.0642 4.0961 4.0987 4.7574 4.7636 4.7695 4.7877 5.0915 5.1149 5.1464 5.1657 5.2016 5.2111 5.2556 5.2719 5.8721 5.8737 6.0870 6.0929 6.2080 6.2114 6.4356 6.4403 7.5585 7.5588 7.9414 7.9447 9.7734 9.7740 10.2292 10.2292 11.0339 11.0514 11.1238 11.1299 k = 0.3056 0.2240 0.7952 ( 6524 PWs) bands (ev): -7.4871 -7.4862 -6.7353 -6.7352 -6.7000 -6.6997 -6.6861 -6.6851 -1.9239 -1.9071 -1.2275 -1.2223 -1.1507 -1.1300 0.2787 0.2852 0.3318 0.3535 0.5249 0.5347 0.5877 0.5987 1.1861 1.2034 1.4747 1.4777 2.7895 2.7898 3.0325 3.0538 3.1557 3.1703 3.3128 3.3191 3.4818 3.4863 3.7979 3.8272 4.0296 4.0650 4.1047 4.1080 4.7527 4.7618 4.7691 4.7936 5.0775 5.1058 5.1423 5.1574 5.2026 5.2100 5.2781 5.2910 5.8420 5.8433 6.1181 6.1275 6.2033 6.2081 6.4328 6.4388 7.5108 7.5129 7.9981 8.0036 9.7013 9.7020 10.2995 10.3001 11.0249 11.0495 11.1209 11.1286 k = 0.3194 0.2342 0.7825 ( 6516 PWs) bands (ev): -7.4877 -7.4866 -6.7392 -6.7387 -6.6998 -6.6994 -6.6824 -6.6815 -1.9272 -1.9061 -1.2279 -1.2207 -1.1533 -1.1269 0.2738 0.2819 0.3371 0.3644 0.5207 0.5343 0.5932 0.6069 1.1613 1.1837 1.5188 1.5221 2.7500 2.7504 3.0357 3.0655 3.1440 3.1641 3.3108 3.3187 3.4800 3.4854 3.7989 3.8361 4.0233 4.0676 4.1136 4.1174 4.7480 4.7601 4.7686 4.7993 5.0642 5.0966 5.1365 5.1470 5.2030 5.2096 5.3043 5.3112 5.8125 5.8135 6.1483 6.1612 6.1978 6.2040 6.4294 6.4366 7.4632 7.4678 8.0577 8.0660 9.6323 9.6331 10.3650 10.3666 11.0124 11.0449 11.1233 11.1312 k = 0.3333 0.2444 0.7699 ( 6516 PWs) bands (ev): -7.4882 -7.4870 -6.7433 -6.7423 -6.6993 -6.6989 -6.6790 -6.6783 -1.9306 -1.9054 -1.2284 -1.2188 -1.1558 -1.1236 0.2697 0.2792 0.3426 0.3748 0.5164 0.5341 0.5995 0.6164 1.1394 1.1671 1.5644 1.5681 2.7084 2.7089 3.0295 3.0649 3.1410 3.1634 3.3087 3.3182 3.4779 3.4842 3.7981 3.8418 4.0205 4.0719 4.1227 4.1267 4.7431 4.7583 4.7679 4.8047 5.0517 5.0875 5.1295 5.1362 5.2022 5.2093 5.3324 5.3328 5.7841 5.7848 6.1727 6.1819 6.2020 6.2022 6.4255 6.4337 7.4181 7.4259 8.1187 8.1304 9.5672 9.5679 10.4243 10.4271 10.9952 11.0352 11.1345 11.1425 k = 0.3472 0.2546 0.7573 ( 6514 PWs) bands (ev): -7.4886 -7.4872 -6.7475 -6.7460 -6.6986 -6.6981 -6.6761 -6.6756 -1.9340 -1.9047 -1.2288 -1.2167 -1.1582 -1.1200 0.2663 0.2772 0.3480 0.3844 0.5122 0.5342 0.6063 0.6273 1.1203 1.1536 1.6114 1.6153 2.6652 2.6658 3.0149 3.0516 3.1482 3.1682 3.3065 3.3177 3.4757 3.4826 3.7949 3.8426 4.0223 4.0778 4.1319 4.1359 4.7380 4.7566 4.7670 4.8096 5.0398 5.0784 5.1221 5.1253 5.2003 5.2085 5.3549 5.3627 5.7573 5.7574 6.1747 6.1778 6.2148 6.2293 6.4212 6.4301 7.3773 7.3890 8.1800 8.1956 9.5067 9.5072 10.4764 10.4806 10.9740 11.0198 11.1557 11.1645 k = 0.3611 0.2647 0.7447 ( 6511 PWs) bands (ev): -7.4889 -7.4873 -6.7519 -6.7498 -6.6977 -6.6971 -6.6735 -6.6733 -1.9375 -1.9041 -1.2292 -1.2144 -1.1603 -1.1160 0.2636 0.2760 0.3531 0.3932 0.5082 0.5347 0.6134 0.6393 1.1041 1.1432 1.6595 1.6635 2.6208 2.6214 2.9951 3.0320 3.1601 3.1765 3.3043 3.3170 3.4732 3.4806 3.7889 3.8378 4.0285 4.0848 4.1412 4.1450 4.7329 4.7547 4.7659 4.8141 5.0286 5.0694 5.1148 5.1149 5.1974 5.2068 5.3783 5.3935 5.7316 5.7321 6.1624 6.1697 6.2340 6.2550 6.4164 6.4259 7.3431 7.3593 8.2408 8.2609 9.4511 9.4514 10.5206 10.5262 10.9494 10.9996 11.1860 11.1963 k = 0.3750 0.2749 0.7320 ( 6504 PWs) bands (ev): -7.4890 -7.4873 -6.7564 -6.7539 -6.6964 -6.6958 -6.6715 -6.6713 -1.9409 -1.9036 -1.2296 -1.2121 -1.1621 -1.1117 0.2615 0.2756 0.3578 0.4009 0.5046 0.5355 0.6206 0.6524 1.0909 1.1359 1.7086 1.7127 2.5754 2.5760 2.9727 3.0104 3.1730 3.1861 3.3019 3.3164 3.4705 3.4784 3.7803 3.8279 4.0385 4.0926 4.1505 4.1539 4.7276 4.7527 4.7647 4.8181 5.0179 5.0602 5.1051 5.1081 5.1938 5.2041 5.4027 5.4247 5.7075 5.7087 6.1477 6.1578 6.2484 6.2744 6.4110 6.4210 7.3175 7.3385 8.3001 8.3255 9.4011 9.4012 10.5569 10.5637 10.9219 10.9750 11.2235 11.2358 k = 0.3889 0.2851 0.7194 ( 6512 PWs) bands (ev): -7.4889 -7.4870 -6.7612 -6.7581 -6.6949 -6.6943 -6.6700 -6.6696 -1.9442 -1.9030 -1.2301 -1.2099 -1.1635 -1.1070 0.2599 0.2761 0.3619 0.4075 0.5015 0.5367 0.6277 0.6664 1.0807 1.1317 1.7585 1.7626 2.5293 2.5299 2.9497 2.9889 3.1854 3.1958 3.2994 3.3156 3.4676 3.4758 3.7692 3.8138 4.0511 4.1007 4.1597 4.1624 4.7222 4.7506 4.7632 4.8215 5.0076 5.0505 5.0962 5.1020 5.1896 5.2004 5.4278 5.4557 5.6851 5.6875 6.1309 6.1435 6.2552 6.2854 6.4052 6.4153 7.3022 7.3282 8.3574 8.3887 9.3567 9.3571 10.5858 10.5936 10.8911 10.9457 11.2632 11.2782 k = 0.4028 0.2953 0.7068 ( 6508 PWs) bands (ev): -7.4887 -7.4867 -6.7663 -6.7627 -6.6932 -6.6925 -6.6689 -6.6681 -1.9474 -1.9025 -1.2306 -1.2078 -1.1645 -1.1020 0.2587 0.2775 0.3653 0.4131 0.4989 0.5382 0.6347 0.6811 1.0736 1.1305 1.8089 1.8130 2.4828 2.4833 2.9273 2.9686 3.1966 3.2048 3.2969 3.3148 3.4646 3.4730 3.7560 3.7966 4.0650 4.1088 4.1688 4.1705 4.7168 4.7483 4.7618 4.8245 4.9976 5.0401 5.0885 5.0969 5.1852 5.1959 5.4534 5.4861 5.6645 5.6687 6.1122 6.1275 6.2530 6.2868 6.3988 6.4089 7.2984 7.3293 8.4120 8.4498 9.3187 9.3194 10.6081 10.6163 10.8566 10.9116 11.2874 11.3076 k = 0.4167 0.3055 0.6942 ( 6509 PWs) bands (ev): -7.4883 -7.4861 -6.7718 -6.7677 -6.6911 -6.6904 -6.6680 -6.6669 -1.9505 -1.9019 -1.2310 -1.2061 -1.1648 -1.0966 0.2578 0.2797 0.3680 0.4178 0.4969 0.5398 0.6416 0.6963 1.0698 1.1324 1.8595 1.8636 2.4362 2.4365 2.9062 2.9499 3.2062 3.2128 3.2942 3.3140 3.4614 3.4699 3.7410 3.7771 4.0793 4.1165 4.1776 4.1783 4.7114 4.7458 4.7601 4.8270 4.9879 5.0289 5.0821 5.0927 5.1808 5.1907 5.4790 5.5148 5.6456 5.6530 6.0918 6.1099 6.2416 6.2781 6.3921 6.4017 7.3063 7.3416 8.4632 8.5081 9.2875 9.2885 10.6243 10.6323 10.8179 10.8725 11.2894 11.3203 k = 0.4306 0.3157 0.6815 ( 6507 PWs) bands (ev): -7.4878 -7.4855 -6.7776 -6.7731 -6.6888 -6.6881 -6.6671 -6.6657 -1.9534 -1.9013 -1.2315 -1.2048 -1.1646 -1.0908 0.2570 0.2827 0.3699 0.4218 0.4954 0.5415 0.6484 0.7116 1.0694 1.1373 1.9100 1.9141 2.3896 2.3900 2.8869 2.9331 3.2140 3.2194 3.2915 3.3131 3.4580 3.4666 3.7248 3.7561 4.0936 4.1236 4.1856 4.1860 4.7062 4.7430 4.7584 4.8291 4.9785 5.0169 5.0768 5.0896 5.1767 5.1850 5.5042 5.5397 5.6284 5.6421 6.0698 6.0908 6.2218 6.2601 6.3850 6.3939 7.3249 7.3640 8.5105 8.5630 9.2633 9.2645 10.6350 10.6420 10.7751 10.8291 11.2886 11.3317 k = 0.4444 0.3258 0.6689 ( 6513 PWs) bands (ev): -7.4872 -7.4849 -6.7839 -6.7789 -6.6862 -6.6855 -6.6662 -6.6646 -1.9562 -1.9007 -1.2321 -1.2039 -1.1639 -1.0848 0.2563 0.2865 0.3710 0.4251 0.4945 0.5431 0.6552 0.7269 1.0727 1.1452 1.9599 1.9641 2.3436 2.3440 2.8694 2.9182 3.2197 3.2245 3.2887 3.3122 3.4544 3.4631 3.7079 3.7344 4.1072 4.1301 4.1924 4.1940 4.7011 4.7400 4.7566 4.8310 4.9692 5.0040 5.0726 5.0876 5.1729 5.1790 5.5283 5.5568 5.6129 5.6393 6.0465 6.0706 6.1952 6.2348 6.3776 6.3857 7.3522 7.3946 8.5533 8.6138 9.2466 9.2477 10.6403 10.6450 10.7289 10.7830 11.2915 11.3465 k = 0.4583 0.3360 0.6563 ( 6513 PWs) bands (ev): -7.4867 -7.4842 -6.7905 -6.7852 -6.6834 -6.6826 -6.6652 -6.6634 -1.9588 -1.9001 -1.2326 -1.2035 -1.1627 -1.0785 0.2556 0.2908 0.3715 0.4280 0.4940 0.5444 0.6622 0.7419 1.0798 1.1561 2.0087 2.0132 2.2985 2.2991 2.8538 2.9051 3.2232 3.2279 3.2859 3.3113 3.4507 3.4594 3.6908 3.7124 4.1199 4.1357 4.1988 4.2015 4.6965 4.7367 4.7547 4.8326 4.9601 4.9905 5.0695 5.0864 5.1697 5.1730 5.5506 5.5624 5.5991 5.6478 6.0221 6.0492 6.1640 6.2045 6.3703 6.3774 7.3860 7.4310 8.5912 8.6599 9.2373 9.2382 10.6396 10.6399 10.6810 10.7371 11.2999 11.3661 k = 0.4722 0.3462 0.6437 ( 6506 PWs) bands (ev): -7.4863 -7.4837 -6.7974 -6.7918 -6.6802 -6.6796 -6.6639 -6.6620 -1.9614 -1.8995 -1.2331 -1.2035 -1.1613 -1.0721 0.2547 0.2955 0.3714 0.4305 0.4938 0.5453 0.6698 0.7566 1.0909 1.1699 2.0549 2.0602 2.2554 2.2569 2.8397 2.8933 3.2242 3.2296 3.2831 3.3104 3.4469 3.4556 3.6742 3.6908 4.1312 4.1405 4.2048 4.2083 4.6923 4.7332 4.7527 4.8342 4.9513 4.9764 5.0672 5.0862 5.1671 5.1671 5.5591 5.5693 5.5873 5.6635 5.9968 6.0270 6.1307 6.1720 6.3630 6.3694 7.4238 7.4709 8.6240 8.7006 9.2353 9.2359 10.6239 10.6255 10.6403 10.6957 11.3144 11.3903 k = 0.4861 0.3564 0.6310 ( 6498 PWs) bands (ev): -7.4860 -7.4834 -6.8046 -6.7988 -6.6769 -6.6763 -6.6623 -6.6604 -1.9639 -1.8989 -1.2337 -1.2039 -1.1597 -1.0657 0.2536 0.3003 0.3708 0.4329 0.4938 0.5456 0.6783 0.7707 1.1062 1.1867 2.0941 2.1015 2.2179 2.2214 2.8267 2.8823 3.2226 3.2295 3.2802 3.3096 3.4430 3.4517 3.6586 3.6702 4.1411 4.1444 4.2105 4.2145 4.6888 4.7294 4.7506 4.8357 4.9427 4.9617 5.0656 5.0865 5.1615 5.1652 5.5520 5.5730 5.5876 5.6799 5.9709 6.0042 6.0984 6.1405 6.3561 6.3620 7.4632 7.5121 8.6514 8.7354 9.2404 9.2406 10.5824 10.5951 10.6239 10.6621 11.3348 11.4187 k = 0.5000 0.3666 0.6184 ( 6510 PWs) bands (ev): -7.4862 -7.4834 -6.8119 -6.8059 -6.6733 -6.6727 -6.6603 -6.6585 -1.9663 -1.8984 -1.2342 -1.2045 -1.1581 -1.0594 0.2524 0.3051 0.3700 0.4352 0.4937 0.5452 0.6880 0.7845 1.1258 1.2065 2.1104 2.1203 2.2027 2.2085 2.8143 2.8716 3.2185 3.2276 3.2774 3.3086 3.4389 3.4477 3.6446 3.6510 4.1474 4.1490 4.2159 4.2200 4.6861 4.7254 4.7485 4.8374 4.9344 4.9467 5.0647 5.0873 5.1563 5.1639 5.5436 5.5635 5.5962 5.6920 5.9446 5.9808 6.0706 6.1128 6.3497 6.3555 7.5025 7.5526 8.6732 8.7637 9.2517 9.2520 10.5395 10.5589 10.6039 10.6323 11.3601 11.4501 k = 0.5000 0.3666 0.6184 ( 6510 PWs) bands (ev): -7.4862 -7.4834 -6.8119 -6.8059 -6.6733 -6.6727 -6.6603 -6.6585 -1.9663 -1.8984 -1.2342 -1.2045 -1.1581 -1.0594 0.2524 0.3051 0.3700 0.4352 0.4937 0.5452 0.6880 0.7845 1.1258 1.2065 2.1104 2.1203 2.2027 2.2085 2.8143 2.8716 3.2185 3.2276 3.2774 3.3086 3.4389 3.4477 3.6446 3.6510 4.1474 4.1490 4.2159 4.2200 4.6861 4.7254 4.7485 4.8374 4.9344 4.9467 5.0647 5.0873 5.1563 5.1639 5.5436 5.5635 5.5962 5.6920 5.9446 5.9808 6.0706 6.1128 6.3497 6.3555 7.5025 7.5526 8.6732 8.7637 9.2517 9.2520 10.5395 10.5589 10.6039 10.6323 11.3601 11.4501 k = 0.5000 0.3666 0.5971 ( 6504 PWs) bands (ev): -7.4868 -7.4840 -6.8243 -6.8181 -6.6668 -6.6665 -6.6565 -6.6548 -1.9701 -1.8977 -1.2352 -1.2060 -1.1557 -1.0489 0.2498 0.3132 0.3685 0.4390 0.4934 0.5438 0.7068 0.8075 1.1642 1.2432 2.1041 2.1139 2.2149 2.2204 2.7920 2.8515 3.2087 3.2229 3.2727 3.3069 3.4319 3.4409 3.6221 3.6245 4.1513 4.1604 4.2253 4.2289 4.6832 4.7178 4.7448 4.8408 4.9207 4.9211 5.0637 5.0890 5.1490 5.1629 5.5277 5.5465 5.6054 5.7065 5.8995 5.9405 6.0304 6.0720 6.3395 6.3453 7.5682 7.6201 8.7026 8.8025 9.2749 9.2763 10.4731 10.4949 10.5600 10.5799 11.4112 11.4872 k = 0.5000 0.3666 0.5758 ( 6510 PWs) bands (ev): -7.4877 -7.4848 -6.8372 -6.8308 -6.6600 -6.6599 -6.6521 -6.6508 -1.9737 -1.8971 -1.2363 -1.2079 -1.1536 -1.0387 0.2468 0.3208 0.3675 0.4426 0.4934 0.5421 0.7281 0.8309 1.2060 1.2819 2.0971 2.1068 2.2277 2.2330 2.7672 2.8278 3.1980 3.2174 3.2680 3.3051 3.4249 3.4341 3.5972 3.6083 4.1547 4.1709 4.2354 4.2383 4.6820 4.7089 4.7409 4.8449 4.8946 4.9086 5.0625 5.0907 5.1430 5.1630 5.5097 5.5283 5.6133 5.7200 5.8536 5.8995 5.9927 6.0334 6.3293 6.3351 7.6344 7.6881 8.7259 8.8336 9.2955 9.2990 10.4122 10.4319 10.5074 10.5221 11.4544 11.4734 k = 0.5000 0.3666 0.5544 ( 6518 PWs) bands (ev): -7.4890 -7.4860 -6.8503 -6.8438 -6.6536 -6.6526 -6.6468 -6.6464 -1.9768 -1.8965 -1.2375 -1.2101 -1.1522 -1.0291 0.2435 0.3276 0.3672 0.4462 0.4937 0.5399 0.7517 0.8547 1.2507 1.3222 2.0895 2.0992 2.2411 2.2462 2.7401 2.8008 3.1868 3.2114 3.2635 3.3032 3.4180 3.4275 3.5767 3.5960 4.1578 4.1807 4.2463 4.2484 4.6824 4.6988 4.7367 4.8499 4.8688 4.8971 5.0612 5.0924 5.1382 5.1638 5.4901 5.5093 5.6195 5.7318 5.8075 5.8583 5.9579 5.9971 6.3192 6.3250 7.7010 7.7561 8.7426 8.8561 9.3122 9.3188 10.3583 10.3734 10.4476 10.4578 11.4181 11.5269 k = 0.5000 0.3666 0.5331 ( 6510 PWs) bands (ev): -7.4905 -7.4876 -6.8636 -6.8570 -6.6475 -6.6453 -6.6413 -6.6405 -1.9796 -1.8958 -1.2388 -1.2124 -1.1515 -1.0203 0.2399 0.3327 0.3678 0.4498 0.4947 0.5374 0.7772 0.8788 1.2977 1.3638 2.0813 2.0910 2.2549 2.2598 2.7111 2.7709 3.1755 3.2050 3.2593 3.3011 3.4112 3.4213 3.5608 3.5873 4.1608 4.1900 4.2579 4.2589 4.6846 4.6876 4.7326 4.8438 4.8558 4.8870 5.0597 5.0938 5.1345 5.1647 5.4696 5.4897 5.6238 5.7408 5.7619 5.8174 5.9270 5.9637 6.3089 6.3148 7.7674 7.8238 8.7523 8.8693 9.3232 9.3346 10.3115 10.3211 10.3833 10.3876 11.3780 11.4863 k = 0.5000 0.3666 0.5118 ( 6514 PWs) bands (ev): -7.4925 -7.4896 -6.8770 -6.8704 -6.6417 -6.6383 -6.6351 -6.6332 -1.9818 -1.8950 -1.2403 -1.2150 -1.1516 -1.0125 0.2360 0.3357 0.3693 0.4532 0.4967 0.5343 0.8043 0.9031 1.3462 1.4065 2.0726 2.0824 2.2690 2.2737 2.6808 2.7388 3.1646 3.1983 3.2555 3.2989 3.4047 3.4156 3.5492 3.5817 4.1641 4.1988 4.2699 4.2701 4.6754 4.6878 4.7288 4.8196 4.8626 4.8781 5.0580 5.0947 5.1318 5.1654 5.4488 5.4698 5.6255 5.7176 5.7452 5.7773 5.9014 5.9333 6.2987 6.3045 7.8334 7.8907 8.7549 8.8734 9.3274 9.3451 10.2666 10.2761 10.3125 10.3222 11.3337 11.4346 k = 0.5000 0.3666 0.4905 ( 6508 PWs) bands (ev): -7.4948 -7.4919 -6.8905 -6.8839 -6.6357 -6.6319 -6.6275 -6.6253 -1.9836 -1.8942 -1.2418 -1.2176 -1.1526 -1.0058 0.2319 0.3367 0.3713 0.4566 0.4999 0.5307 0.8326 0.9277 1.3957 1.4497 2.0636 2.0733 2.2833 2.2877 2.6502 2.7055 3.1545 3.1917 3.2523 3.2966 3.3985 3.4106 3.5418 3.5788 4.1679 4.2076 4.2815 4.2828 4.6622 4.6909 4.7265 4.7968 4.8673 4.8732 5.0562 5.0949 5.1299 5.1652 5.4285 5.4502 5.6230 5.6764 5.7350 5.7464 5.8833 5.9066 6.2882 6.2941 7.8985 7.9566 8.7508 8.8686 9.3241 9.3492 10.2071 10.2299 10.2431 10.2823 11.2850 11.3754 k = 0.5000 0.3666 0.4691 ( 6506 PWs) bands (ev): -7.4974 -7.4947 -6.9040 -6.8974 -6.6294 -6.6256 -6.6192 -6.6170 -1.9849 -1.8934 -1.2434 -1.2204 -1.1545 -1.0004 0.2277 0.3363 0.3730 0.4599 0.5046 0.5266 0.8618 0.9524 1.4453 1.4931 2.0541 2.0638 2.2976 2.3018 2.6200 2.6719 3.1454 3.1855 3.2497 3.2942 3.3926 3.4064 3.5379 3.5782 4.1723 4.2165 4.2936 4.2960 4.6483 4.6911 4.7278 4.7759 4.8620 4.8802 5.0544 5.0940 5.1287 5.1635 5.4095 5.4312 5.6094 5.6446 5.6979 5.7352 5.8741 5.8840 6.2777 6.2835 7.9624 8.0208 8.7404 8.8556 9.3134 9.3465 10.1330 10.1503 10.2121 10.2641 11.2317 11.3103 k = 0.5000 0.3666 0.4478 ( 6498 PWs) bands (ev): -7.5005 -7.4979 -6.9173 -6.9108 -6.6228 -6.6188 -6.6107 -6.6084 -1.9858 -1.8924 -1.2450 -1.2233 -1.1572 -0.9965 0.2235 0.3350 0.3738 0.4632 0.5106 0.5219 0.8915 0.9770 1.4943 1.5360 2.0445 2.0542 2.3117 2.3156 2.5911 2.6391 3.1377 3.1799 3.2478 3.2916 3.3872 3.4031 3.5372 3.5795 4.1776 4.2256 4.3061 4.3097 4.6338 4.6862 4.7329 4.7588 4.8560 4.8893 5.0527 5.0918 5.1281 5.1595 5.3929 5.4136 5.5782 5.6290 5.6605 5.7185 5.8659 5.8728 6.2670 6.2727 8.0247 8.0830 8.7243 8.8352 9.2963 9.3373 10.0535 10.0671 10.1889 10.2572 11.1741 11.2408 k = 0.5000 0.3666 0.4265 ( 6498 PWs) bands (ev): -7.5039 -7.5015 -6.9305 -6.9241 -6.6157 -6.6117 -6.6019 -6.5997 -1.9861 -1.8914 -1.2468 -1.2262 -1.1607 -0.9941 0.2193 0.3330 0.3733 0.4663 0.5166 0.5179 0.9213 1.0015 1.5419 1.5778 2.0348 2.0444 2.3255 2.3292 2.5644 2.6081 3.1315 3.1754 3.2467 3.2891 3.3823 3.4005 3.5391 3.5823 4.1840 4.2354 4.3192 4.3237 4.6188 4.6768 4.7319 4.7548 4.8507 4.8988 5.0511 5.0879 5.1279 5.1523 5.3797 5.3981 5.5412 5.6175 5.6242 5.6973 5.8526 5.8770 6.2562 6.2616 8.0849 8.1425 8.7032 8.8084 9.2745 9.3224 9.9723 9.9833 10.1689 10.2555 11.1135 11.1693 k = 0.5000 0.3666 0.4052 ( 6508 PWs) bands (ev): -7.5077 -7.5054 -6.9434 -6.9371 -6.6082 -6.6041 -6.5931 -6.5909 -1.9859 -1.8904 -1.2485 -1.2293 -1.1648 -0.9935 0.2153 0.3306 0.3717 0.4694 0.5108 0.5259 0.9508 1.0254 1.5874 1.6179 2.0252 2.0346 2.3387 2.3424 2.5407 2.5798 3.1271 3.1723 3.2463 3.2867 3.3781 3.3987 3.5432 3.5865 4.1916 4.2459 4.3326 4.3380 4.6034 4.6636 4.7214 4.7663 4.8460 4.9083 5.0497 5.0817 5.1285 5.1414 5.3704 5.3851 5.5045 5.5889 5.6043 5.6738 5.8440 5.8844 6.2451 6.2503 8.1427 8.1990 8.6779 8.7761 9.2495 9.3034 9.8909 9.8998 10.1480 10.2541 11.0519 11.0991 k = 0.5000 0.3666 0.3838 ( 6514 PWs) bands (ev): -7.5117 -7.5096 -6.9560 -6.9499 -6.6004 -6.5962 -6.5843 -6.5821 -1.9852 -1.8893 -1.2502 -1.2324 -1.1695 -0.9945 0.2114 0.3278 0.3690 0.4722 0.5047 0.5343 0.9796 1.0487 1.6300 1.6555 2.0157 2.0250 2.3513 2.3550 2.5205 2.5551 3.1248 3.1707 3.2467 3.2844 3.3744 3.3978 3.5491 3.5919 4.2004 4.2574 4.3465 4.3526 4.5877 4.6477 4.7114 4.7824 4.8421 4.9174 5.0488 5.0724 5.1267 5.1303 5.3654 5.3750 5.4693 5.5550 5.5890 5.6493 5.8398 5.8937 6.2339 6.2388 8.1975 8.2520 8.6491 8.7394 9.2229 9.2818 9.8105 9.8173 10.1217 10.2478 10.9927 11.0339 k = 0.5000 0.3666 0.3625 ( 6512 PWs) bands (ev): -7.5160 -7.5141 -6.9683 -6.9624 -6.5922 -6.5880 -6.5755 -6.5733 -1.9840 -1.8882 -1.2520 -1.2357 -1.1746 -0.9973 0.2078 0.3249 0.3655 0.4743 0.4987 0.5427 1.0076 1.0712 1.6691 1.6901 2.0066 2.0157 2.3630 2.3669 2.5042 2.5344 3.1248 3.1710 3.2478 3.2823 3.3716 3.3975 3.5566 3.5983 4.2106 4.2700 4.3609 4.3674 4.5719 4.6301 4.7030 4.8006 4.8388 4.9259 5.0484 5.0600 5.1087 5.1337 5.3640 5.3671 5.4370 5.5225 5.5718 5.6244 5.8394 5.9041 6.2225 6.2270 8.2492 8.3008 8.6177 8.6995 9.1961 9.2591 9.7316 9.7365 10.0859 10.2311 10.9399 10.9776 k = 0.5000 0.3666 0.3412 ( 6510 PWs) bands (ev): -7.5206 -7.5188 -6.9801 -6.9744 -6.5838 -6.5795 -6.5668 -6.5646 -1.9824 -1.8871 -1.2538 -1.2391 -1.1800 -1.0019 0.2046 0.3216 0.3615 0.4748 0.4938 0.5507 1.0343 1.0925 1.7042 1.7212 1.9979 2.0068 2.3736 2.3781 2.4918 2.5181 3.1272 3.1732 3.2497 3.2806 3.3695 3.3979 3.5654 3.6058 4.2222 4.2838 4.3757 4.3824 4.5560 4.6119 4.6961 4.8199 4.8362 4.9334 5.0446 5.0489 5.0882 5.1385 5.3583 5.3650 5.4103 5.4919 5.5532 5.5995 5.8422 5.9153 6.2108 6.2148 8.2972 8.3451 8.5845 8.6573 9.1699 9.2366 9.6550 9.6578 10.0375 10.1996 10.8978 10.9329 k = 0.5000 0.3666 0.3199 ( 6516 PWs) bands (ev): -7.5252 -7.5236 -6.9914 -6.9860 -6.5752 -6.5709 -6.5583 -6.5561 -1.9802 -1.8860 -1.2555 -1.2427 -1.1853 -1.0082 0.2017 0.3181 0.3571 0.4719 0.4919 0.5581 1.0596 1.1125 1.7352 1.7485 1.9897 1.9984 2.3832 2.3885 2.4832 2.5061 3.1323 3.1775 3.2523 3.2794 3.3682 3.3989 3.5754 3.6142 4.2351 4.2989 4.3910 4.3974 4.5401 4.5936 4.6905 4.8342 4.8399 4.9397 5.0267 5.0502 5.0658 5.1449 5.3421 5.3666 5.3953 5.4646 5.5338 5.5747 5.8477 5.9270 6.1991 6.2025 8.3414 8.3842 8.5507 8.6139 9.1450 9.2151 9.5810 9.5819 9.9758 10.1508 10.8688 10.9010 k = 0.5000 0.3666 0.2985 ( 6508 PWs) bands (ev): -7.5300 -7.5285 -7.0022 -6.9971 -6.5665 -6.5622 -6.5500 -6.5478 -1.9775 -1.8851 -1.2572 -1.2464 -1.1906 -1.0160 0.1993 0.3141 0.3528 0.4657 0.4930 0.5645 1.0832 1.1310 1.7621 1.7719 1.9823 1.9908 2.3916 2.3981 2.4779 2.4979 3.1401 3.1838 3.2555 3.2787 3.3677 3.4003 3.5864 3.6236 4.2495 4.3151 4.4068 4.4124 4.5245 4.5757 4.6862 4.8329 4.8599 4.9447 5.0072 5.0423 5.0529 5.1524 5.3174 5.3647 5.3924 5.4436 5.5144 5.5500 5.8555 5.9391 6.1872 6.1899 8.3814 8.4165 8.5184 8.5703 9.1219 9.1949 9.5091 9.5102 9.9025 10.0856 10.8527 10.8807 k = 0.5000 0.3666 0.2772 ( 6508 PWs) bands (ev): -7.5348 -7.5335 -7.0125 -7.0076 -6.5578 -6.5535 -6.5420 -6.5398 -1.9744 -1.8842 -1.2588 -1.2503 -1.1955 -1.0254 0.1974 0.3098 0.3486 0.4578 0.4955 0.5699 1.1051 1.1480 1.7849 1.7916 1.9757 1.9840 2.3991 2.4068 2.4751 2.4927 3.1503 3.1919 3.2594 3.2785 3.3680 3.4022 3.5984 3.6341 4.2651 4.3324 4.4232 4.4271 4.5092 4.5587 4.6834 4.8323 4.8794 4.9479 4.9870 5.0185 5.0568 5.1608 5.2895 5.3541 5.3954 5.4336 5.4954 5.5254 5.8652 5.9514 6.1753 6.1771 8.4167 8.4345 8.4956 8.5276 9.1006 9.1759 9.4399 9.4430 9.8208 10.0074 10.8471 10.8699 k = 0.5000 0.3666 0.2559 ( 6516 PWs) bands (ev): -7.5395 -7.5384 -7.0221 -7.0176 -6.5492 -6.5450 -6.5343 -6.5321 -1.9709 -1.8836 -1.2605 -1.2543 -1.1999 -1.0361 0.1960 0.3050 0.3447 0.4491 0.4986 0.5740 1.1251 1.1633 1.8040 1.8077 1.9702 1.9784 2.4057 2.4148 2.4739 2.4896 3.1628 3.2016 3.2638 3.2788 3.3691 3.4043 3.6113 3.6454 4.2819 4.3502 4.4401 4.4416 4.4943 4.5431 4.6820 4.8323 4.8976 4.9473 4.9691 4.9949 5.0623 5.1693 5.2612 5.3343 5.4002 5.4348 5.4780 5.5008 5.8766 5.9638 6.1633 6.1643 8.4221 8.4438 8.4899 8.4995 9.0812 9.1575 9.3749 9.3795 9.7347 9.9205 10.8487 10.8658 k = 0.5000 0.3666 0.2346 ( 6520 PWs) bands (ev): -7.5442 -7.5432 -7.0311 -7.0269 -6.5409 -6.5367 -6.5269 -6.5247 -1.9669 -1.8833 -1.2620 -1.2583 -1.2038 -1.0479 0.1951 0.2996 0.3415 0.4399 0.5021 0.5769 1.1433 1.1770 1.8196 1.8207 1.9662 1.9741 2.4116 2.4219 2.4737 2.4878 3.1769 3.2123 3.2686 3.2798 3.3710 3.4065 3.6249 3.6576 4.2997 4.3677 4.4559 4.4578 4.4803 4.5294 4.6825 4.8328 4.9135 4.9352 4.9619 4.9728 5.0696 5.1777 5.2334 5.3095 5.4029 5.4419 5.4646 5.4764 5.8893 5.9762 6.1514 6.1516 8.3930 8.4335 8.4871 8.5172 9.0637 9.1384 9.3150 9.3202 9.6482 9.8292 10.8545 10.8658 k = 0.5000 0.3666 0.2132 ( 6512 PWs) bands (ev): -7.5487 -7.5478 -7.0394 -7.0355 -6.5328 -6.5288 -6.5200 -6.5178 -1.9625 -1.8833 -1.2636 -1.2622 -1.2069 -1.0607 0.1949 0.2937 0.3389 0.4306 0.5058 0.5786 1.1596 1.1891 1.8309 1.8318 1.9639 1.9714 2.4169 2.4282 2.4738 2.4865 3.1921 3.2235 3.2739 3.2814 3.3737 3.4089 3.6393 3.6705 4.3181 4.3836 4.4671 4.4703 4.4765 4.5186 4.6850 4.8337 4.9156 4.9219 4.9573 4.9623 5.0786 5.1849 5.2071 5.2828 5.3989 5.4459 5.4580 5.4595 5.9031 5.9884 6.1388 6.1401 8.3611 8.3974 8.5082 8.5354 9.0478 9.1167 9.2614 9.2653 9.5650 9.7372 10.8624 10.8678 k = 0.5000 0.3666 0.1919 ( 6514 PWs) bands (ev): -7.5529 -7.5522 -7.0469 -7.0434 -6.5252 -6.5213 -6.5135 -6.5114 -1.9578 -1.8836 -1.2660 -1.2651 -1.2093 -1.0742 0.1953 0.2874 0.3370 0.4213 0.5097 0.5790 1.1741 1.1996 1.8384 1.8408 1.9636 1.9705 2.4217 2.4336 2.4738 2.4853 3.2074 3.2346 3.2793 3.2834 3.3771 3.4113 3.6541 3.6839 4.3365 4.3958 4.4556 4.4855 4.4959 4.5115 4.6898 4.8347 4.8949 4.9119 4.9593 4.9644 5.0892 5.1783 5.1948 5.2557 5.3868 5.4243 5.4633 5.4663 5.9176 6.0000 6.1266 6.1290 8.3295 8.3607 8.5283 8.5520 9.0333 9.0900 9.2151 9.2158 9.4882 9.6474 10.8704 10.8706 k = 0.5000 0.3666 0.1706 ( 6526 PWs) bands (ev): -7.5569 -7.5563 -7.0538 -7.0506 -6.5181 -6.5144 -6.5075 -6.5055 -1.9528 -1.8844 -1.2693 -1.2665 -1.2109 -1.0882 0.1963 0.2807 0.3358 0.4120 0.5137 0.5784 1.1869 1.2086 1.8436 1.8469 1.9654 1.9713 2.4258 2.4380 2.4735 2.4838 3.2223 3.2450 3.2848 3.2859 3.3811 3.4135 3.6691 3.6973 4.3540 4.4023 4.4463 4.5021 4.5091 4.5164 4.6969 4.8351 4.8749 4.8924 4.9673 4.9704 5.1009 5.1553 5.1994 5.2287 5.3701 5.3993 5.4722 5.4782 5.9323 6.0106 6.1151 6.1187 8.2994 8.3259 8.5454 8.5665 9.0201 9.0575 9.1699 9.1788 9.4204 9.5622 10.8721 10.8760 k = 0.5000 0.3666 0.1493 ( 6534 PWs) bands (ev): -7.5606 -7.5601 -7.0598 -7.0570 -6.5116 -6.5082 -6.5020 -6.5001 -1.9475 -1.8856 -1.2722 -1.2679 -1.2116 -1.1024 0.1980 0.2738 0.3354 0.4030 0.5178 0.5768 1.1980 1.2163 1.8469 1.8505 1.9689 1.9738 2.4293 2.4416 2.4728 2.4822 3.2361 3.2543 3.2889 3.2902 3.3856 3.4156 3.6840 3.7103 4.3688 4.4032 4.4406 4.5075 4.5236 4.5382 4.7063 4.8330 4.8574 4.8714 4.9712 4.9829 5.1135 5.1334 5.2021 5.2034 5.3515 5.3740 5.4830 5.4902 5.9470 6.0195 6.1049 6.1094 8.2713 8.2937 8.5594 8.5787 9.0078 9.0213 9.1301 9.1487 9.3630 9.4835 10.8420 10.8498 k = 0.5000 0.3666 0.1279 ( 6540 PWs) bands (ev): -7.5638 -7.5635 -7.0651 -7.0627 -6.5058 -6.5028 -6.4970 -6.4953 -1.9420 -1.8874 -1.2745 -1.2692 -1.2114 -1.1165 0.2002 0.2667 0.3357 0.3943 0.5221 0.5743 1.2075 1.2226 1.8487 1.8522 1.9737 1.9774 2.4323 2.4441 2.4719 2.4803 3.2482 3.2623 3.2922 3.2953 3.3905 3.4173 3.6985 3.7224 4.3785 4.4002 4.4404 4.5089 4.5457 4.5610 4.7179 4.8237 4.8471 4.8505 4.9765 4.9957 5.1139 5.1262 5.1762 5.2060 5.3323 5.3490 5.4944 5.5017 5.9608 6.0261 6.0967 6.1013 8.2457 8.2643 8.5701 8.5885 8.9856 8.9961 9.0964 9.1230 9.3162 9.4127 10.8108 10.8175 k = 0.5000 0.3666 0.1066 ( 6546 PWs) bands (ev): -7.5667 -7.5664 -7.0695 -7.0675 -6.5007 -6.4982 -6.4925 -6.4911 -1.9364 -1.8897 -1.2762 -1.2705 -1.2102 -1.1302 0.2032 0.2595 0.3367 0.3860 0.5264 0.5712 1.2156 1.2278 1.8495 1.8526 1.9790 1.9817 2.4347 2.4457 2.4709 2.4784 3.2584 3.2689 3.2958 3.2998 3.3955 3.4186 3.7120 3.7331 4.3819 4.3952 4.4466 4.5100 4.5692 4.5846 4.7311 4.8076 4.8302 4.8430 4.9832 5.0083 5.0975 5.1386 5.1514 5.2070 5.3132 5.3247 5.5054 5.5121 5.9735 6.0294 6.0913 6.0950 8.2230 8.2382 8.5779 8.5954 8.9544 8.9842 9.0699 9.1003 9.2790 9.3510 10.7841 10.7897 k = 0.5000 0.3666 0.0853 ( 6554 PWs) bands (ev): -7.5690 -7.5688 -7.0731 -7.0715 -6.4966 -6.4946 -6.4887 -6.4876 -1.9308 -1.8926 -1.2772 -1.2718 -1.2079 -1.1434 0.2067 0.2524 0.3385 0.3782 0.5309 0.5675 1.2223 1.2317 1.8496 1.8521 1.9843 1.9861 2.4366 2.4463 2.4701 2.4765 3.2665 3.2740 3.2994 3.3036 3.4004 3.4194 3.7242 3.7420 4.3812 4.3898 4.4569 4.5103 4.5930 4.6083 4.7455 4.7900 4.8107 4.8393 4.9915 5.0207 5.0844 5.1270 5.1511 5.2064 5.2949 5.3019 5.5154 5.5211 5.9845 6.0292 6.0887 6.0906 8.2036 8.2157 8.5831 8.5992 8.9307 8.9713 9.0513 9.0806 9.2498 9.2991 10.7622 10.7667 k = 0.5000 0.3666 0.0640 ( 6554 PWs) bands (ev): -7.5709 -7.5708 -7.0759 -7.0747 -6.4932 -6.4918 -6.4857 -6.4849 -1.9251 -1.8960 -1.2776 -1.2730 -1.2045 -1.1558 0.2108 0.2455 0.3409 0.3709 0.5355 0.5634 1.2277 1.2345 1.8494 1.8513 1.9890 1.9901 2.4382 2.4460 2.4698 2.4748 3.2726 3.2777 3.3029 3.3065 3.4050 3.4195 3.7348 3.7487 4.3791 4.3848 4.4682 4.5092 4.6160 4.6310 4.7601 4.7729 4.7925 4.8342 5.0017 5.0323 5.0751 5.1045 5.1623 5.2042 5.2784 5.2818 5.5239 5.5284 5.9935 6.0263 6.0882 6.0882 8.1883 8.1973 8.5864 8.5999 8.9160 8.9571 9.0407 9.0645 9.2272 9.2576 10.7452 10.7486 k = 0.5000 0.3666 0.0426 ( 6556 PWs) bands (ev): -7.5723 -7.5722 -7.0779 -7.0771 -6.4908 -6.4898 -6.4834 -6.4829 -1.9195 -1.8999 -1.2775 -1.2742 -1.1997 -1.1672 0.2154 0.2387 0.3442 0.3642 0.5402 0.5589 1.2318 1.2362 1.8492 1.8505 1.9927 1.9933 2.4397 2.4451 2.4699 2.4733 3.2770 3.2801 3.3058 3.3085 3.4092 3.4189 3.7433 3.7529 4.3771 4.3807 4.4790 4.5066 4.6372 4.6507 4.7577 4.7680 4.7821 4.8270 5.0135 5.0423 5.0690 5.0838 5.1724 5.2005 5.2648 5.2658 5.5305 5.5336 6.0008 6.0218 6.0874 6.0886 8.1773 8.1833 8.5885 8.5983 8.9100 8.9426 9.0364 9.0523 9.2108 9.2270 10.7332 10.7354 k = 0.5000 0.3666 0.0213 ( 6552 PWs) bands (ev): -7.5731 -7.5730 -7.0790 -7.0786 -6.4892 -6.4888 -6.4820 -6.4817 -1.9142 -1.9042 -1.2770 -1.2753 -1.1937 -1.1774 0.2206 0.2323 0.3481 0.3581 0.5449 0.5543 1.2346 1.2368 1.8492 1.8498 1.9950 1.9953 2.4411 2.4438 2.4703 2.4720 3.2797 3.2813 3.3080 3.3094 3.4127 3.4176 3.7495 3.7544 4.3761 4.3778 4.4885 4.5023 4.6549 4.6639 4.7476 4.7565 4.7929 4.8174 5.0270 5.0482 5.0650 5.0668 5.1813 5.1954 5.2555 5.2555 5.5349 5.5365 6.0067 6.0169 6.0878 6.0887 8.1711 8.1741 8.5904 8.5956 8.9114 8.9293 9.0361 9.0439 9.2011 9.2078 10.7261 10.7273 k = 0.5000 0.3666 0.0000 ( 6550 PWs) bands (ev): -7.5733 -7.5733 -7.0792 -7.0792 -6.4886 -6.4886 -6.4814 -6.4814 -1.9090 -1.9090 -1.2763 -1.2763 -1.1862 -1.1862 0.2262 0.2262 0.3528 0.3528 0.5496 0.5496 1.2363 1.2363 1.8494 1.8494 1.9959 1.9959 2.4425 2.4425 2.4710 2.4710 3.2812 3.2812 3.3092 3.3092 3.4156 3.4156 3.7533 3.7533 4.3763 4.3763 4.4963 4.4963 4.6654 4.6654 4.7471 4.7471 4.8059 4.8059 5.0411 5.0411 5.0623 5.0623 5.1890 5.1890 5.2520 5.2520 5.5369 5.5369 6.0119 6.0119 6.0884 6.0884 8.1700 8.1700 8.5928 8.5928 8.9184 8.9184 9.0387 9.0387 9.1995 9.1995 10.7242 10.7242 k = 0.0000 0.0000 0.8457 ( 6504 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7083 -6.7083 -6.6878 -6.6878 -1.9184 -1.9184 -1.2250 -1.2250 -1.1488 -1.1488 0.2606 0.2606 0.3931 0.3931 0.5193 0.5193 0.6239 0.6239 0.9713 0.9713 2.1302 2.1302 2.1540 2.1540 2.9247 2.9247 3.2505 3.2505 3.3150 3.3150 3.4858 3.4858 3.9544 3.9544 4.0124 4.0124 4.1680 4.1680 4.7469 4.7469 4.7968 4.7968 5.0375 5.0375 5.0846 5.0846 5.3083 5.3083 5.4570 5.4570 5.6626 5.6626 6.2140 6.2140 6.4407 6.4407 6.4901 6.4901 7.0127 7.0127 8.3606 8.3606 9.0778 9.0778 10.6997 10.6997 11.0962 11.0962 11.2438 11.2438 k = 0.0167 0.0122 0.8457 ( 6500 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7083 -6.7083 -6.6878 -6.6878 -1.9183 -1.9183 -1.2250 -1.2250 -1.1487 -1.1487 0.2608 0.2608 0.3926 0.3926 0.5194 0.5194 0.6235 0.6235 0.9729 0.9729 2.0797 2.0797 2.2044 2.2044 2.9268 2.9268 3.2494 3.2494 3.3151 3.3151 3.4858 3.4858 3.9539 3.9539 4.0118 4.0118 4.1674 4.1674 4.7470 4.7470 4.7966 4.7966 5.0379 5.0379 5.0853 5.0853 5.3078 5.3078 5.4542 5.4542 5.6640 5.6640 6.2140 6.2140 6.4407 6.4407 6.4864 6.4864 7.0176 7.0176 8.3573 8.3573 9.0834 9.0834 10.6985 10.6985 11.0964 11.0964 11.2409 11.2409 k = 0.0333 0.0244 0.8457 ( 6496 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7081 -6.7081 -6.6880 -6.6880 -1.9182 -1.9182 -1.2250 -1.2250 -1.1485 -1.1485 0.2613 0.2613 0.3910 0.3910 0.5197 0.5197 0.6221 0.6221 0.9778 0.9778 2.0192 2.0192 2.2648 2.2648 2.9332 2.9332 3.2460 3.2460 3.3151 3.3151 3.4859 3.4859 3.9524 3.9524 4.0101 4.0101 4.1658 4.1658 4.7474 4.7474 4.7962 4.7962 5.0391 5.0391 5.0874 5.0874 5.3066 5.3066 5.4460 5.4460 5.6681 5.6681 6.2139 6.2139 6.4407 6.4407 6.4755 6.4755 7.0321 7.0321 8.3475 8.3475 9.1001 9.1001 10.6944 10.6944 11.0971 11.0971 11.2324 11.2324 k = 0.0500 0.0367 0.8457 ( 6506 PWs) bands (ev): -7.4856 -7.4856 -6.7248 -6.7248 -6.7079 -6.7079 -6.6883 -6.6883 -1.9179 -1.9179 -1.2251 -1.2251 -1.1481 -1.1481 0.2621 0.2621 0.3884 0.3884 0.5202 0.5202 0.6199 0.6199 0.9859 0.9859 1.9586 1.9586 2.3250 2.3250 2.9436 2.9436 3.2404 3.2404 3.3151 3.3151 3.4859 3.4859 3.9491 3.9491 4.0081 4.0081 4.1631 4.1631 4.7479 4.7479 4.7954 4.7954 5.0410 5.0410 5.0908 5.0908 5.3044 5.3044 5.4328 5.4328 5.6749 5.6749 6.2138 6.2138 6.4407 6.4407 6.4577 6.4577 7.0557 7.0557 8.3313 8.3313 9.1276 9.1276 10.6869 10.6869 11.0979 11.0979 11.2183 11.2183 k = 0.0667 0.0489 0.8457 ( 6506 PWs) bands (ev): -7.4856 -7.4856 -6.7249 -6.7249 -6.7075 -6.7075 -6.6886 -6.6886 -1.9175 -1.9175 -1.2251 -1.2251 -1.1475 -1.1475 0.2632 0.2632 0.3847 0.3847 0.5210 0.5210 0.6170 0.6170 0.9972 0.9972 1.8984 1.8984 2.3846 2.3846 2.9576 2.9576 3.2326 3.2326 3.3152 3.3152 3.4860 3.4860 3.9435 3.9435 4.0066 4.0066 4.1594 4.1594 4.7486 4.7486 4.7944 4.7944 5.0438 5.0438 5.0955 5.0955 5.3013 5.3013 5.4154 5.4154 5.6846 5.6846 6.2137 6.2137 6.4333 6.4333 6.4410 6.4410 7.0877 7.0877 8.3089 8.3089 9.1651 9.1651 10.6750 10.6750 11.0984 11.0984 11.2002 11.2002 k = 0.0833 0.0611 0.8457 ( 6510 PWs) bands (ev): -7.4855 -7.4855 -6.7249 -6.7249 -6.7070 -6.7070 -6.6891 -6.6891 -1.9171 -1.9171 -1.2252 -1.2252 -1.1468 -1.1468 0.2647 0.2647 0.3802 0.3802 0.5220 0.5220 0.6135 0.6135 1.0116 1.0116 1.8389 1.8389 2.4433 2.4433 2.9747 2.9747 3.2228 3.2228 3.3153 3.3153 3.4861 3.4861 3.9347 3.9347 4.0064 4.0064 4.1547 4.1547 4.7496 4.7496 4.7930 4.7930 5.0474 5.0474 5.1014 5.1014 5.2974 5.2974 5.3946 5.3946 5.6970 5.6970 6.2135 6.2135 6.4040 6.4040 6.4408 6.4408 7.1271 7.1271 8.2806 8.2806 9.2121 9.2121 10.6571 10.6571 11.0971 11.0971 11.1813 11.1813 k = 0.1000 0.0733 0.8457 ( 6510 PWs) bands (ev): -7.4855 -7.4855 -6.7250 -6.7250 -6.7065 -6.7065 -6.6897 -6.6897 -1.9166 -1.9166 -1.2253 -1.2253 -1.1460 -1.1460 0.2666 0.2666 0.3748 0.3748 0.5231 0.5231 0.6094 0.6094 1.0292 1.0292 1.7802 1.7802 2.5008 2.5008 2.9942 2.9942 3.2110 3.2110 3.3154 3.3154 3.4862 3.4862 3.9227 3.9227 4.0079 4.0079 4.1490 4.1490 4.7508 4.7508 4.7914 4.7914 5.0519 5.0519 5.1083 5.1083 5.2925 5.2925 5.3713 5.3713 5.7124 5.7124 6.2133 6.2133 6.3698 6.3698 6.4408 6.4408 7.1728 7.1728 8.2468 8.2468 9.2676 9.2676 10.6315 10.6315 11.0914 11.0914 11.1668 11.1668 k = 0.1167 0.0855 0.8457 ( 6514 PWs) bands (ev): -7.4855 -7.4855 -6.7251 -6.7251 -6.7058 -6.7058 -6.6903 -6.6903 -1.9160 -1.9160 -1.2254 -1.2254 -1.1451 -1.1451 0.2690 0.2690 0.3687 0.3687 0.5245 0.5245 0.6051 0.6051 1.0498 1.0498 1.7225 1.7225 2.5570 2.5570 3.0150 3.0150 3.1979 3.1979 3.3156 3.3156 3.4862 3.4862 3.9078 3.9078 4.0111 4.0111 4.1425 4.1425 4.7522 4.7522 4.7895 4.7895 5.0573 5.0573 5.1163 5.1163 5.2867 5.2867 5.3467 5.3467 5.7305 5.7305 6.2129 6.2129 6.3320 6.3320 6.4407 6.4407 7.2239 7.2239 8.2078 8.2078 9.3307 9.3307 10.5962 10.5962 11.0802 11.0802 11.1604 11.1604 k = 0.1333 0.0977 0.8457 ( 6516 PWs) bands (ev): -7.4854 -7.4854 -6.7251 -6.7251 -6.7051 -6.7051 -6.6911 -6.6911 -1.9155 -1.9155 -1.2255 -1.2255 -1.1443 -1.1443 0.2718 0.2718 0.3620 0.3620 0.5261 0.5261 0.6006 0.6006 1.0734 1.0734 1.6661 1.6661 2.6115 2.6115 3.0354 3.0354 3.1841 3.1841 3.3158 3.3158 3.4863 3.4863 3.8908 3.8908 4.0157 4.0157 4.1353 4.1353 4.7538 4.7538 4.7875 4.7875 5.0638 5.0638 5.1250 5.1250 5.2799 5.2799 5.3215 5.3215 5.7515 5.7515 6.2123 6.2123 6.2916 6.2916 6.4407 6.4407 7.2793 7.2793 8.1641 8.1641 9.4005 9.4005 10.5501 10.5501 11.0669 11.0669 11.1604 11.1604 k = 0.1500 0.1100 0.8457 ( 6512 PWs) bands (ev): -7.4854 -7.4854 -6.7252 -6.7252 -6.7043 -6.7043 -6.6919 -6.6919 -1.9149 -1.9149 -1.2256 -1.2256 -1.1434 -1.1434 0.2750 0.2750 0.3549 0.3549 0.5277 0.5277 0.5961 0.5961 1.0999 1.0999 1.6110 1.6110 2.6641 2.6641 3.0525 3.0525 3.1717 3.1717 3.3162 3.3162 3.4864 3.4864 3.8723 3.8723 4.0216 4.0216 4.1273 4.1273 4.7556 4.7556 4.7852 4.7852 5.0713 5.0713 5.1342 5.1342 5.2719 5.2719 5.2971 5.2971 5.7753 5.7753 6.2106 6.2106 6.2504 6.2504 6.4407 6.4407 7.3380 7.3380 8.1163 8.1163 9.4760 9.4760 10.4932 10.4932 11.0557 11.0557 11.1618 11.1618 k = 0.1667 0.1222 0.8457 ( 6516 PWs) bands (ev): -7.4854 -7.4854 -6.7252 -6.7252 -6.7035 -6.7035 -6.6928 -6.6928 -1.9144 -1.9144 -1.2257 -1.2257 -1.1426 -1.1426 0.2788 0.2788 0.3474 0.3474 0.5295 0.5295 0.5918 0.5918 1.1292 1.1292 1.5574 1.5574 2.7146 2.7146 3.0615 3.0615 3.1646 3.1646 3.3166 3.3166 3.4864 3.4864 3.8535 3.8535 4.0284 4.0284 4.1188 4.1188 4.7575 4.7575 4.7828 4.7828 5.0799 5.0799 5.1436 5.1436 5.2613 5.2613 5.2755 5.2755 5.8017 5.8017 6.1965 6.1965 6.2205 6.2205 6.4407 6.4407 7.3990 7.3990 8.0651 8.0651 9.5564 9.5564 10.4263 10.4263 11.0486 11.0486 11.1604 11.1604 k = 0.1833 0.1344 0.8457 ( 6512 PWs) bands (ev): -7.4853 -7.4853 -6.7253 -6.7253 -6.7026 -6.7026 -6.6937 -6.6937 -1.9140 -1.9140 -1.2258 -1.2258 -1.1419 -1.1419 0.2830 0.2830 0.3399 0.3399 0.5312 0.5312 0.5879 0.5879 1.1612 1.1612 1.5054 1.5054 2.7626 2.7626 3.0577 3.0577 3.1662 3.1662 3.3171 3.3171 3.4865 3.4865 3.8354 3.8354 4.0360 4.0360 4.1098 4.1098 4.7597 4.7597 4.7803 4.7803 5.0896 5.0896 5.1524 5.1524 5.2453 5.2453 5.2608 5.2608 5.8307 5.8307 6.1570 6.1570 6.2157 6.2157 6.4407 6.4407 7.4611 7.4611 8.0113 8.0113 9.6408 9.6408 10.3511 10.3511 11.0457 11.0457 11.1545 11.1545 k = 0.2000 0.1466 0.8457 ( 6502 PWs) bands (ev): -7.4853 -7.4853 -6.7253 -6.7253 -6.7017 -6.7017 -6.6946 -6.6946 -1.9136 -1.9136 -1.2259 -1.2259 -1.1413 -1.1413 0.2876 0.2876 0.3326 0.3326 0.5328 0.5328 0.5845 0.5845 1.1958 1.1958 1.4553 1.4553 2.8075 2.8075 3.0422 3.0422 3.1747 3.1747 3.3177 3.3177 3.4865 3.4865 3.8194 3.8194 4.0442 4.0442 4.1005 4.1005 4.7620 4.7620 4.7777 4.7777 5.1004 5.1004 5.1593 5.1593 5.2285 5.2285 5.2501 5.2501 5.8618 5.8618 6.1143 6.1143 6.2148 6.2148 6.4407 6.4407 7.5228 7.5228 7.9563 7.9563 9.7283 9.7283 10.2696 10.2696 11.0463 11.0463 11.1458 11.1458 k = 0.2167 0.1588 0.8457 ( 6504 PWs) bands (ev): -7.4853 -7.4853 -6.7254 -6.7254 -6.7008 -6.7008 -6.6955 -6.6955 -1.9133 -1.9133 -1.2259 -1.2259 -1.1408 -1.1408 0.2924 0.2924 0.3257 0.3257 0.5342 0.5342 0.5819 0.5819 1.2327 1.2327 1.4073 1.4073 2.8481 2.8481 3.0201 3.0201 3.1845 3.1845 3.3183 3.3183 3.4865 3.4865 3.8066 3.8066 4.0530 4.0530 4.0910 4.0910 4.7644 4.7644 4.7750 4.7750 5.1120 5.1120 5.1616 5.1616 5.2172 5.2172 5.2404 5.2404 5.8942 5.8942 6.0729 6.0729 6.2144 6.2144 6.4407 6.4407 7.5815 7.5815 7.9024 7.9024 9.8178 9.8178 10.1835 10.1835 11.0488 11.0488 11.1368 11.1368 k = 0.2333 0.1711 0.8457 ( 6518 PWs) bands (ev): -7.4853 -7.4853 -6.7254 -6.7254 -6.6999 -6.6999 -6.6964 -6.6964 -1.9131 -1.9131 -1.2260 -1.2260 -1.1405 -1.1405 0.2968 0.2968 0.3201 0.3201 0.5351 0.5351 0.5802 0.5802 1.2714 1.2714 1.3619 1.3619 2.8812 2.8812 2.9974 2.9974 3.1917 3.1917 3.3187 3.3187 3.4864 3.4864 3.7983 3.7983 4.0621 4.0621 4.0814 4.0814 4.7669 4.7669 4.7724 4.7724 5.1233 5.1233 5.1573 5.1573 5.2146 5.2146 5.2316 5.2316 5.9251 5.9251 6.0365 6.0365 6.2142 6.2142 6.4407 6.4407 7.6306 7.6306 7.8563 7.8563 9.9081 9.9081 10.0951 10.0951 11.0517 11.0517 11.1300 11.1300 k = 0.2500 0.1833 0.8457 ( 6516 PWs) bands (ev): -7.4853 -7.4853 -6.7254 -6.7254 -6.6995 -6.6995 -6.6968 -6.6968 -1.9131 -1.9131 -1.2260 -1.2260 -1.1405 -1.1405 0.2988 0.2988 0.3177 0.3177 0.5354 0.5354 0.5796 0.5796 1.3017 1.3017 1.3294 1.3294 2.8962 2.8962 2.9857 2.9857 3.1943 3.1943 3.3189 3.3189 3.4864 3.4864 3.7954 3.7954 4.0699 4.0699 4.0734 4.0734 4.7688 4.7688 4.7704 4.7704 5.1295 5.1295 5.1528 5.1528 5.2163 5.2163 5.2268 5.2268 5.9418 5.9418 6.0179 6.0179 6.2142 6.2142 6.4407 6.4407 7.6526 7.6526 7.8352 7.8352 9.9826 9.9826 10.0212 10.0212 11.0529 11.0529 11.1275 11.1275 Writing output data file Cu2HgGeSe4.save init_run : 1.76s CPU 1.27s WALL ( 1 calls) electrons : 584.73s CPU 437.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.11s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 584.72s CPU 437.90s WALL ( 1 calls) v_of_rho : 0.04s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.04s CPU 0.02s WALL ( 1 calls) newd : 0.44s CPU 0.29s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.46s CPU 0.55s WALL ( 271 calls) cegterg : 511.63s CPU 396.42s WALL ( 414 calls) Called by sum_band: Called by *egterg: h_psi : 405.77s CPU 268.11s WALL ( 6276 calls) s_psi : 14.14s CPU 11.45s WALL ( 6276 calls) g_psi : 0.58s CPU 0.59s WALL ( 5591 calls) cdiaghg : 105.25s CPU 103.31s WALL ( 5862 calls) cegterg:over : 19.18s CPU 18.22s WALL ( 5591 calls) cegterg:upda : 15.79s CPU 15.34s WALL ( 5591 calls) cegterg:last : 7.80s CPU 7.80s WALL ( 1240 calls) cdiaghg:chol : 6.02s CPU 6.10s WALL ( 5862 calls) cdiaghg:inve : 4.36s CPU 4.39s WALL ( 5862 calls) cdiaghg:para : 7.60s CPU 7.80s WALL ( 11724 calls) Called by h_psi: h_psi:vloc : 372.96s CPU 241.17s WALL ( 6276 calls) h_psi:vnl : 32.10s CPU 26.32s WALL ( 6276 calls) add_vuspsi : 16.82s CPU 13.49s WALL ( 6276 calls) General routines calbec : 15.22s CPU 12.81s WALL ( 6276 calls) fft : 0.10s CPU 0.09s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 341.46s CPU 214.40s WALL ( 1204896 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.48s CPU 1.70s WALL ( 542 calls) Parallel routines fft_scatter : 105.39s CPU 84.66s WALL ( 1204919 calls) PWSCF : 10m12.08s CPU 8m 0.66s WALL This run was terminated on: 15:54:35 10Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=