Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 14: 7:15 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaxPOsx2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 74 60 17 1389 1011 162 Max 75 61 18 1390 1029 163 Sum 2669 2167 641 50009 36751 5845 bravais-lattice index = 14 lattice parameter (alat) = 12.7160 a.u. unit-cell volume = 667.5073 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 55.0000 Ry charge density cutoff = 270.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.716003 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.820838 celldm(5)= -0.820838 celldm(6)= 0.641676 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.641676 0.766975 0.000000 ) a(3) = ( -0.820838 -0.383488 0.423275 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.836632 1.181265 ) b(2) = ( 0.000000 1.303823 1.181265 ) b(3) = ( 0.000000 0.000000 2.362530 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Os read from file: /users/gautes/Pseudo/Os.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 1bcb72221b6b17e70f20dab4cda9aff7 Pseudo is Ultrasoft + core correction, Zval = 16.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1275 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 P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 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 Ba 10.00 137.32700 Ba( 1.00) Os 16.00 190.23000 Os( 1.00) P 5.00 30.97380 P( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 345 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 2) = ( 0.0000000 0.0000000 0.0210940), wk = 0.0028986 k( 3) = ( 0.0000000 0.0000000 0.0421880), wk = 0.0028986 k( 4) = ( 0.0000000 0.0000000 0.0632820), wk = 0.0028986 k( 5) = ( 0.0000000 0.0000000 0.0843761), wk = 0.0028986 k( 6) = ( 0.0000000 0.0000000 0.1054701), wk = 0.0028986 k( 7) = ( 0.0000000 0.0000000 0.1265641), wk = 0.0028986 k( 8) = ( 0.0000000 0.0000000 0.1476581), wk = 0.0028986 k( 9) = ( 0.0000000 0.0000000 0.1687521), wk = 0.0028986 k( 10) = ( 0.0000000 0.0000000 0.1898462), wk = 0.0028986 k( 11) = ( 0.0000000 0.0000000 0.2109402), wk = 0.0028986 k( 12) = ( 0.0000000 0.0000000 0.2320342), wk = 0.0028986 k( 13) = ( 0.0000000 0.0000000 0.2531282), wk = 0.0028986 k( 14) = ( 0.0000000 0.0000000 0.2742222), wk = 0.0028986 k( 15) = ( 0.0000000 0.0000000 0.2953162), wk = 0.0028986 k( 16) = ( 0.0000000 0.0000000 0.3164103), wk = 0.0028986 k( 17) = ( 0.0000000 0.0000000 0.3375043), wk = 0.0028986 k( 18) = ( 0.0000000 0.0000000 0.3585983), wk = 0.0028986 k( 19) = ( 0.0000000 0.0000000 0.3796923), wk = 0.0028986 k( 20) = ( 0.0000000 0.0000000 0.4007863), wk = 0.0028986 k( 21) = ( 0.0000000 0.0000000 0.4218804), wk = 0.0028986 k( 22) = ( 0.0000000 0.0000000 0.4429744), wk = 0.0028986 k( 23) = ( 0.0000000 0.0000000 0.4640684), wk = 0.0028986 k( 24) = ( 0.0000000 0.0000000 0.4851624), wk = 0.0028986 k( 25) = ( 0.0000000 0.0000000 0.5062564), wk = 0.0028986 k( 26) = ( 0.0000000 0.0000000 0.5273505), wk = 0.0028986 k( 27) = ( 0.0000000 0.0000000 0.5484445), wk = 0.0028986 k( 28) = ( 0.0000000 0.0000000 0.5695385), wk = 0.0028986 k( 29) = ( 0.0000000 0.0000000 0.5906325), wk = 0.0028986 k( 30) = ( 0.0000000 0.0000000 0.6117265), wk = 0.0028986 k( 31) = ( 0.0000000 0.0000000 0.6328205), wk = 0.0028986 k( 32) = ( 0.0000000 0.0000000 0.6539145), wk = 0.0028986 k( 33) = ( 0.0000000 0.0000000 0.6750086), wk = 0.0028986 k( 34) = ( 0.0000000 0.0000000 0.6961026), wk = 0.0028986 k( 35) = ( 0.0000000 0.0000000 0.7171966), wk = 0.0028986 k( 36) = ( 0.0000000 0.0000000 0.7382906), wk = 0.0028986 k( 37) = ( 0.0000000 0.0000000 0.7593846), wk = 0.0028986 k( 38) = ( 0.0000000 0.0000000 0.7804786), wk = 0.0028986 k( 39) = ( 0.0000000 0.0000000 0.8015727), wk = 0.0028986 k( 40) = ( 0.0000000 0.0000000 0.8226667), wk = 0.0028986 k( 41) = ( 0.0000000 0.0000000 0.8437607), wk = 0.0028986 k( 42) = ( 0.0000000 0.0000000 0.8648547), wk = 0.0028986 k( 43) = ( 0.0000000 0.0000000 0.8859487), wk = 0.0028986 k( 44) = ( 0.0000000 0.0000000 0.9070428), wk = 0.0028986 k( 45) = ( 0.0000000 0.0000000 0.9281368), wk = 0.0028986 k( 46) = ( 0.0000000 0.0000000 0.9492308), wk = 0.0028986 k( 47) = ( 0.0000000 0.0000000 0.9703248), wk = 0.0028986 k( 48) = ( 0.0000000 0.0000000 0.9914188), wk = 0.0028986 k( 49) = ( 0.0000000 0.0000000 1.0125128), wk = 0.0028986 k( 50) = ( 0.0000000 0.0000000 1.0336069), wk = 0.0028986 k( 51) = ( 0.0000000 0.0000000 1.0547009), wk = 0.0028986 k( 52) = ( 0.0000000 0.0000000 1.0757949), wk = 0.0028986 k( 53) = ( 0.0000000 0.0000000 1.0968889), wk = 0.0028986 k( 54) = ( 0.0000000 0.0000000 1.1179829), wk = 0.0028986 k( 55) = ( 0.0000000 0.0000000 1.1390770), wk = 0.0028986 k( 56) = ( 0.0000000 0.0000000 1.1601710), wk = 0.0028986 k( 57) = ( 0.0000000 0.0000000 1.1812650), wk = 0.0028986 k( 58) = ( 0.0000000 0.0000000 1.1812650), wk = 0.0028986 k( 59) = ( -0.0077952 0.0166854 1.1812650), wk = 0.0028986 k( 60) = ( -0.0155905 0.0333707 1.1812650), wk = 0.0028986 k( 61) = ( -0.0233857 0.0500561 1.1812650), wk = 0.0028986 k( 62) = ( -0.0311810 0.0667415 1.1812650), wk = 0.0028986 k( 63) = ( -0.0389762 0.0834268 1.1812650), wk = 0.0028986 k( 64) = ( -0.0467715 0.1001122 1.1812650), wk = 0.0028986 k( 65) = ( -0.0545667 0.1167976 1.1812650), wk = 0.0028986 k( 66) = ( -0.0545667 0.1167976 1.1812650), wk = 0.0028986 k( 67) = ( -0.0609300 0.1304180 1.1662314), wk = 0.0028986 k( 68) = ( -0.0672934 0.1440385 1.1511978), wk = 0.0028986 k( 69) = ( -0.0736567 0.1576589 1.1361643), wk = 0.0028986 k( 70) = ( -0.0800200 0.1712793 1.1211307), wk = 0.0028986 k( 71) = ( -0.0863834 0.1848997 1.1060972), wk = 0.0028986 k( 72) = ( -0.0927467 0.1985202 1.0910636), wk = 0.0028986 k( 73) = ( -0.0991100 0.2121406 1.0760300), wk = 0.0028986 k( 74) = ( -0.1054734 0.2257610 1.0609965), wk = 0.0028986 k( 75) = ( -0.1118367 0.2393815 1.0459629), wk = 0.0028986 k( 76) = ( -0.1182000 0.2530019 1.0309293), wk = 0.0028986 k( 77) = ( -0.1245634 0.2666223 1.0158958), wk = 0.0028986 k( 78) = ( -0.1309267 0.2802427 1.0008622), wk = 0.0028986 k( 79) = ( -0.1372900 0.2938632 0.9858286), wk = 0.0028986 k( 80) = ( -0.1436534 0.3074836 0.9707951), wk = 0.0028986 k( 81) = ( -0.1500167 0.3211040 0.9557615), wk = 0.0028986 k( 82) = ( -0.1563800 0.3347244 0.9407280), wk = 0.0028986 k( 83) = ( -0.1627434 0.3483449 0.9256944), wk = 0.0028986 k( 84) = ( -0.1691067 0.3619653 0.9106608), wk = 0.0028986 k( 85) = ( -0.1754700 0.3755857 0.8956273), wk = 0.0028986 k( 86) = ( -0.1818334 0.3892062 0.8805937), wk = 0.0028986 k( 87) = ( -0.1881967 0.4028266 0.8655601), wk = 0.0028986 k( 88) = ( -0.1945600 0.4164470 0.8505266), wk = 0.0028986 k( 89) = ( -0.2009234 0.4300674 0.8354930), wk = 0.0028986 k( 90) = ( -0.2072867 0.4436879 0.8204595), wk = 0.0028986 k( 91) = ( -0.2136500 0.4573083 0.8054259), wk = 0.0028986 k( 92) = ( -0.2200134 0.4709287 0.7903923), wk = 0.0028986 k( 93) = ( -0.2263767 0.4845491 0.7753588), wk = 0.0028986 k( 94) = ( -0.2327400 0.4981696 0.7603252), wk = 0.0028986 k( 95) = ( -0.2391034 0.5117900 0.7452916), wk = 0.0028986 k( 96) = ( -0.2454667 0.5254104 0.7302581), wk = 0.0028986 k( 97) = ( -0.2518300 0.5390308 0.7152245), wk = 0.0028986 k( 98) = ( -0.2581934 0.5526513 0.7001909), wk = 0.0028986 k( 99) = ( -0.2645567 0.5662717 0.6851574), wk = 0.0028986 k( 100) = ( -0.2709200 0.5798921 0.6701238), wk = 0.0028986 k( 101) = ( -0.2772834 0.5935126 0.6550902), wk = 0.0028986 k( 102) = ( -0.2772834 0.5935126 0.6550902), wk = 0.0028986 k( 103) = ( -0.2709815 0.5800236 0.6402018), wk = 0.0028986 k( 104) = ( -0.2646796 0.5665347 0.6253134), wk = 0.0028986 k( 105) = ( -0.2583777 0.5530458 0.6104250), wk = 0.0028986 k( 106) = ( -0.2520758 0.5395569 0.5955366), wk = 0.0028986 k( 107) = ( -0.2457739 0.5260679 0.5806482), wk = 0.0028986 k( 108) = ( -0.2394720 0.5125790 0.5657598), wk = 0.0028986 k( 109) = ( -0.2331701 0.4990901 0.5508713), wk = 0.0028986 k( 110) = ( -0.2268682 0.4856012 0.5359829), wk = 0.0028986 k( 111) = ( -0.2205663 0.4721123 0.5210945), wk = 0.0028986 k( 112) = ( -0.2142644 0.4586233 0.5062061), wk = 0.0028986 k( 113) = ( -0.2079625 0.4451344 0.4913177), wk = 0.0028986 k( 114) = ( -0.2016606 0.4316455 0.4764293), wk = 0.0028986 k( 115) = ( -0.1953587 0.4181566 0.4615409), wk = 0.0028986 k( 116) = ( -0.1890568 0.4046676 0.4466524), wk = 0.0028986 k( 117) = ( -0.1827549 0.3911787 0.4317640), wk = 0.0028986 k( 118) = ( -0.1764530 0.3776898 0.4168756), wk = 0.0028986 k( 119) = ( -0.1701512 0.3642009 0.4019872), wk = 0.0028986 k( 120) = ( -0.1638493 0.3507120 0.3870988), wk = 0.0028986 k( 121) = ( -0.1575474 0.3372230 0.3722104), wk = 0.0028986 k( 122) = ( -0.1512455 0.3237341 0.3573220), wk = 0.0028986 k( 123) = ( -0.1449436 0.3102452 0.3424335), wk = 0.0028986 k( 124) = ( -0.1386417 0.2967563 0.3275451), wk = 0.0028986 k( 125) = ( -0.1323398 0.2832674 0.3126567), wk = 0.0028986 k( 126) = ( -0.1260379 0.2697784 0.2977683), wk = 0.0028986 k( 127) = ( -0.1197360 0.2562895 0.2828799), wk = 0.0028986 k( 128) = ( -0.1134341 0.2428006 0.2679915), wk = 0.0028986 k( 129) = ( -0.1071322 0.2293117 0.2531031), wk = 0.0028986 k( 130) = ( -0.1008303 0.2158227 0.2382146), wk = 0.0028986 k( 131) = ( -0.0945284 0.2023338 0.2233262), wk = 0.0028986 k( 132) = ( -0.0882265 0.1888449 0.2084378), wk = 0.0028986 k( 133) = ( -0.0819246 0.1753560 0.1935494), wk = 0.0028986 k( 134) = ( -0.0756227 0.1618671 0.1786610), wk = 0.0028986 k( 135) = ( -0.0693208 0.1483781 0.1637726), wk = 0.0028986 k( 136) = ( -0.0630189 0.1348892 0.1488841), wk = 0.0028986 k( 137) = ( -0.0567170 0.1214003 0.1339957), wk = 0.0028986 k( 138) = ( -0.0504152 0.1079114 0.1191073), wk = 0.0028986 k( 139) = ( -0.0441133 0.0944225 0.1042189), wk = 0.0028986 k( 140) = ( -0.0378114 0.0809335 0.0893305), wk = 0.0028986 k( 141) = ( -0.0315095 0.0674446 0.0744421), wk = 0.0028986 k( 142) = ( -0.0252076 0.0539557 0.0595537), wk = 0.0028986 k( 143) = ( -0.0189057 0.0404668 0.0446652), wk = 0.0028986 k( 144) = ( -0.0126038 0.0269778 0.0297768), wk = 0.0028986 k( 145) = ( -0.0063019 0.0134889 0.0148884), wk = 0.0028986 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 148) = ( 0.0192308 0.0089844 0.0000000), wk = 0.0028986 k( 149) = ( 0.0384615 0.0179689 0.0000000), wk = 0.0028986 k( 150) = ( 0.0576923 0.0269533 0.0000000), wk = 0.0028986 k( 151) = ( 0.0769231 0.0359377 0.0000000), wk = 0.0028986 k( 152) = ( 0.0961538 0.0449222 0.0000000), wk = 0.0028986 k( 153) = ( 0.1153846 0.0539066 0.0000000), wk = 0.0028986 k( 154) = ( 0.1346154 0.0628910 0.0000000), wk = 0.0028986 k( 155) = ( 0.1538461 0.0718754 0.0000000), wk = 0.0028986 k( 156) = ( 0.1730769 0.0808599 0.0000000), wk = 0.0028986 k( 157) = ( 0.1923077 0.0898443 0.0000000), wk = 0.0028986 k( 158) = ( 0.2115385 0.0988287 0.0000000), wk = 0.0028986 k( 159) = ( 0.2307692 0.1078132 0.0000000), wk = 0.0028986 k( 160) = ( 0.2500000 0.1167976 0.0000000), wk = 0.0028986 k( 161) = ( 0.2692308 0.1257820 0.0000000), wk = 0.0028986 k( 162) = ( 0.2884615 0.1347665 0.0000000), wk = 0.0028986 k( 163) = ( 0.3076923 0.1437509 0.0000000), wk = 0.0028986 k( 164) = ( 0.3269231 0.1527353 0.0000000), wk = 0.0028986 k( 165) = ( 0.3461538 0.1617197 0.0000000), wk = 0.0028986 k( 166) = ( 0.3653846 0.1707042 0.0000000), wk = 0.0028986 k( 167) = ( 0.3846154 0.1796886 0.0000000), wk = 0.0028986 k( 168) = ( 0.4038462 0.1886730 0.0000000), wk = 0.0028986 k( 169) = ( 0.4230769 0.1976575 0.0000000), wk = 0.0028986 k( 170) = ( 0.4423077 0.2066419 0.0000000), wk = 0.0028986 k( 171) = ( 0.4615385 0.2156263 0.0000000), wk = 0.0028986 k( 172) = ( 0.4807692 0.2246108 0.0000000), wk = 0.0028986 k( 173) = ( 0.5000000 0.2335952 0.0000000), wk = 0.0028986 k( 174) = ( 0.5000000 0.2335952 0.0000000), wk = 0.0028986 k( 175) = ( 0.4936367 0.2472156 0.0150336), wk = 0.0028986 k( 176) = ( 0.4872733 0.2608361 0.0300671), wk = 0.0028986 k( 177) = ( 0.4809100 0.2744565 0.0451007), wk = 0.0028986 k( 178) = ( 0.4745467 0.2880769 0.0601343), wk = 0.0028986 k( 179) = ( 0.4681833 0.3016973 0.0751678), wk = 0.0028986 k( 180) = ( 0.4618200 0.3153178 0.0902014), wk = 0.0028986 k( 181) = ( 0.4554567 0.3289382 0.1052350), wk = 0.0028986 k( 182) = ( 0.4490933 0.3425586 0.1202685), wk = 0.0028986 k( 183) = ( 0.4427300 0.3561790 0.1353021), wk = 0.0028986 k( 184) = ( 0.4363667 0.3697995 0.1503356), wk = 0.0028986 k( 185) = ( 0.4300033 0.3834199 0.1653692), wk = 0.0028986 k( 186) = ( 0.4236400 0.3970403 0.1804028), wk = 0.0028986 k( 187) = ( 0.4172767 0.4106608 0.1954363), wk = 0.0028986 k( 188) = ( 0.4109133 0.4242812 0.2104699), wk = 0.0028986 k( 189) = ( 0.4045500 0.4379016 0.2255035), wk = 0.0028986 k( 190) = ( 0.3981867 0.4515220 0.2405370), wk = 0.0028986 k( 191) = ( 0.3918233 0.4651425 0.2555706), wk = 0.0028986 k( 192) = ( 0.3854600 0.4787629 0.2706042), wk = 0.0028986 k( 193) = ( 0.3790967 0.4923833 0.2856377), wk = 0.0028986 k( 194) = ( 0.3727334 0.5060037 0.3006713), wk = 0.0028986 k( 195) = ( 0.3663700 0.5196242 0.3157049), wk = 0.0028986 k( 196) = ( 0.3600067 0.5332446 0.3307384), wk = 0.0028986 k( 197) = ( 0.3536434 0.5468650 0.3457720), wk = 0.0028986 k( 198) = ( 0.3472800 0.5604854 0.3608055), wk = 0.0028986 k( 199) = ( 0.3409167 0.5741059 0.3758391), wk = 0.0028986 k( 200) = ( 0.3345534 0.5877263 0.3908727), wk = 0.0028986 k( 201) = ( 0.3281900 0.6013467 0.4059062), wk = 0.0028986 k( 202) = ( 0.3218267 0.6149672 0.4209398), wk = 0.0028986 k( 203) = ( 0.3154633 0.6285876 0.4359734), wk = 0.0028986 k( 204) = ( 0.3091000 0.6422080 0.4510069), wk = 0.0028986 k( 205) = ( 0.3027367 0.6558284 0.4660405), wk = 0.0028986 k( 206) = ( 0.2963733 0.6694489 0.4810741), wk = 0.0028986 k( 207) = ( 0.2900100 0.6830693 0.4961076), wk = 0.0028986 k( 208) = ( 0.2836467 0.6966897 0.5111412), wk = 0.0028986 k( 209) = ( 0.2772834 0.7103101 0.5261747), wk = 0.0028986 k( 210) = ( 0.2772834 0.7103101 0.5261747), wk = 0.0028986 k( 211) = ( 0.2574774 0.7061388 0.5307789), wk = 0.0028986 k( 212) = ( 0.2376715 0.7019675 0.5353830), wk = 0.0028986 k( 213) = ( 0.2178655 0.6977961 0.5399871), wk = 0.0028986 k( 214) = ( 0.1980595 0.6936248 0.5445912), wk = 0.0028986 k( 215) = ( 0.1782536 0.6894534 0.5491954), wk = 0.0028986 k( 216) = ( 0.1584476 0.6852821 0.5537995), wk = 0.0028986 k( 217) = ( 0.1386417 0.6811108 0.5584036), wk = 0.0028986 k( 218) = ( 0.1188357 0.6769394 0.5630077), wk = 0.0028986 k( 219) = ( 0.0990298 0.6727681 0.5676119), wk = 0.0028986 k( 220) = ( 0.0792238 0.6685967 0.5722160), wk = 0.0028986 k( 221) = ( 0.0594179 0.6644254 0.5768201), wk = 0.0028986 k( 222) = ( 0.0396119 0.6602540 0.5814242), wk = 0.0028986 k( 223) = ( 0.0198059 0.6560827 0.5860284), wk = 0.0028986 k( 224) = ( 0.0000000 0.6519114 0.5906325), wk = 0.0028986 k( 225) = ( 0.0000000 0.6519114 0.5906325), wk = 0.0028986 k( 226) = ( 0.0064103 0.6381905 0.6057769), wk = 0.0028986 k( 227) = ( 0.0128205 0.6244696 0.6209213), wk = 0.0028986 k( 228) = ( 0.0192308 0.6107488 0.6360658), wk = 0.0028986 k( 229) = ( 0.0256410 0.5970279 0.6512102), wk = 0.0028986 k( 230) = ( 0.0320513 0.5833070 0.6663546), wk = 0.0028986 k( 231) = ( 0.0384615 0.5695862 0.6814990), wk = 0.0028986 k( 232) = ( 0.0448718 0.5558653 0.6966434), wk = 0.0028986 k( 233) = ( 0.0512821 0.5421444 0.7117879), wk = 0.0028986 k( 234) = ( 0.0576923 0.5284236 0.7269323), wk = 0.0028986 k( 235) = ( 0.0641026 0.5147027 0.7420767), wk = 0.0028986 k( 236) = ( 0.0705128 0.5009818 0.7572211), wk = 0.0028986 k( 237) = ( 0.0769231 0.4872610 0.7723656), wk = 0.0028986 k( 238) = ( 0.0833333 0.4735401 0.7875100), wk = 0.0028986 k( 239) = ( 0.0897436 0.4598192 0.8026544), wk = 0.0028986 k( 240) = ( 0.0961538 0.4460984 0.8177988), wk = 0.0028986 k( 241) = ( 0.1025641 0.4323775 0.8329433), wk = 0.0028986 k( 242) = ( 0.1089744 0.4186566 0.8480877), wk = 0.0028986 k( 243) = ( 0.1153846 0.4049358 0.8632321), wk = 0.0028986 k( 244) = ( 0.1217949 0.3912149 0.8783765), wk = 0.0028986 k( 245) = ( 0.1282051 0.3774940 0.8935210), wk = 0.0028986 k( 246) = ( 0.1346154 0.3637732 0.9086654), wk = 0.0028986 k( 247) = ( 0.1410256 0.3500523 0.9238098), wk = 0.0028986 k( 248) = ( 0.1474359 0.3363314 0.9389542), wk = 0.0028986 k( 249) = ( 0.1538461 0.3226106 0.9540986), wk = 0.0028986 k( 250) = ( 0.1602564 0.3088897 0.9692431), wk = 0.0028986 k( 251) = ( 0.1666667 0.2951688 0.9843875), wk = 0.0028986 k( 252) = ( 0.1730769 0.2814480 0.9995319), wk = 0.0028986 k( 253) = ( 0.1794872 0.2677271 1.0146763), wk = 0.0028986 k( 254) = ( 0.1858974 0.2540062 1.0298208), wk = 0.0028986 k( 255) = ( 0.1923077 0.2402854 1.0449652), wk = 0.0028986 k( 256) = ( 0.1987180 0.2265645 1.0601096), wk = 0.0028986 k( 257) = ( 0.2051282 0.2128436 1.0752540), wk = 0.0028986 k( 258) = ( 0.2115385 0.1991228 1.0903984), wk = 0.0028986 k( 259) = ( 0.2179487 0.1854019 1.1055429), wk = 0.0028986 k( 260) = ( 0.2243590 0.1716811 1.1206873), wk = 0.0028986 k( 261) = ( 0.2307692 0.1579602 1.1358317), wk = 0.0028986 k( 262) = ( 0.2371795 0.1442393 1.1509761), wk = 0.0028986 k( 263) = ( 0.2435897 0.1305185 1.1661206), wk = 0.0028986 k( 264) = ( 0.2500000 0.1167976 1.1812650), wk = 0.0028986 k( 265) = ( 0.2500000 0.1167976 1.1812650), wk = 0.0028986 k( 266) = ( 0.2666667 0.1245841 1.1726706), wk = 0.0028986 k( 267) = ( 0.2833333 0.1323706 1.1640763), wk = 0.0028986 k( 268) = ( 0.3000000 0.1401571 1.1554819), wk = 0.0028986 k( 269) = ( 0.3166667 0.1479436 1.1468875), wk = 0.0028986 k( 270) = ( 0.3333333 0.1557301 1.1382931), wk = 0.0028986 k( 271) = ( 0.3500000 0.1635166 1.1296988), wk = 0.0028986 k( 272) = ( 0.3666667 0.1713031 1.1211044), wk = 0.0028986 k( 273) = ( 0.3833333 0.1790896 1.1125100), wk = 0.0028986 k( 274) = ( 0.4000000 0.1868761 1.1039157), wk = 0.0028986 k( 275) = ( 0.4166667 0.1946627 1.0953213), wk = 0.0028986 k( 276) = ( 0.4333333 0.2024492 1.0867270), wk = 0.0028986 k( 277) = ( 0.4500000 0.2102357 1.0781326), wk = 0.0028986 k( 278) = ( 0.4666667 0.2180222 1.0695382), wk = 0.0028986 k( 279) = ( 0.4833333 0.2258087 1.0609439), wk = 0.0028986 k( 280) = ( 0.5000000 0.2335952 1.0523495), wk = 0.0028986 k( 281) = ( 0.5000000 0.2335952 1.0523495), wk = 0.0028986 k( 282) = ( 0.5000000 0.2335952 1.0313025), wk = 0.0028986 k( 283) = ( 0.5000000 0.2335952 1.0102555), wk = 0.0028986 k( 284) = ( 0.5000000 0.2335952 0.9892085), wk = 0.0028986 k( 285) = ( 0.5000000 0.2335952 0.9681615), wk = 0.0028986 k( 286) = ( 0.5000000 0.2335952 0.9471145), wk = 0.0028986 k( 287) = ( 0.5000000 0.2335952 0.9260675), wk = 0.0028986 k( 288) = ( 0.5000000 0.2335952 0.9050206), wk = 0.0028986 k( 289) = ( 0.5000000 0.2335952 0.8839736), wk = 0.0028986 k( 290) = ( 0.5000000 0.2335952 0.8629266), wk = 0.0028986 k( 291) = ( 0.5000000 0.2335952 0.8418796), wk = 0.0028986 k( 292) = ( 0.5000000 0.2335952 0.8208326), wk = 0.0028986 k( 293) = ( 0.5000000 0.2335952 0.7997856), wk = 0.0028986 k( 294) = ( 0.5000000 0.2335952 0.7787386), wk = 0.0028986 k( 295) = ( 0.5000000 0.2335952 0.7576916), wk = 0.0028986 k( 296) = ( 0.5000000 0.2335952 0.7366446), wk = 0.0028986 k( 297) = ( 0.5000000 0.2335952 0.7155977), wk = 0.0028986 k( 298) = ( 0.5000000 0.2335952 0.6945507), wk = 0.0028986 k( 299) = ( 0.5000000 0.2335952 0.6735037), wk = 0.0028986 k( 300) = ( 0.5000000 0.2335952 0.6524567), wk = 0.0028986 k( 301) = ( 0.5000000 0.2335952 0.6314097), wk = 0.0028986 k( 302) = ( 0.5000000 0.2335952 0.6103627), wk = 0.0028986 k( 303) = ( 0.5000000 0.2335952 0.5893157), wk = 0.0028986 k( 304) = ( 0.5000000 0.2335952 0.5682687), wk = 0.0028986 k( 305) = ( 0.5000000 0.2335952 0.5472217), wk = 0.0028986 k( 306) = ( 0.5000000 0.2335952 0.5261747), wk = 0.0028986 k( 307) = ( 0.5000000 0.2335952 0.5051278), wk = 0.0028986 k( 308) = ( 0.5000000 0.2335952 0.4840808), wk = 0.0028986 k( 309) = ( 0.5000000 0.2335952 0.4630338), wk = 0.0028986 k( 310) = ( 0.5000000 0.2335952 0.4419868), wk = 0.0028986 k( 311) = ( 0.5000000 0.2335952 0.4209398), wk = 0.0028986 k( 312) = ( 0.5000000 0.2335952 0.3998928), wk = 0.0028986 k( 313) = ( 0.5000000 0.2335952 0.3788458), wk = 0.0028986 k( 314) = ( 0.5000000 0.2335952 0.3577988), wk = 0.0028986 k( 315) = ( 0.5000000 0.2335952 0.3367518), wk = 0.0028986 k( 316) = ( 0.5000000 0.2335952 0.3157049), wk = 0.0028986 k( 317) = ( 0.5000000 0.2335952 0.2946579), wk = 0.0028986 k( 318) = ( 0.5000000 0.2335952 0.2736109), wk = 0.0028986 k( 319) = ( 0.5000000 0.2335952 0.2525639), wk = 0.0028986 k( 320) = ( 0.5000000 0.2335952 0.2315169), wk = 0.0028986 k( 321) = ( 0.5000000 0.2335952 0.2104699), wk = 0.0028986 k( 322) = ( 0.5000000 0.2335952 0.1894229), wk = 0.0028986 k( 323) = ( 0.5000000 0.2335952 0.1683759), wk = 0.0028986 k( 324) = ( 0.5000000 0.2335952 0.1473289), wk = 0.0028986 k( 325) = ( 0.5000000 0.2335952 0.1262819), wk = 0.0028986 k( 326) = ( 0.5000000 0.2335952 0.1052350), wk = 0.0028986 k( 327) = ( 0.5000000 0.2335952 0.0841880), wk = 0.0028986 k( 328) = ( 0.5000000 0.2335952 0.0631410), wk = 0.0028986 k( 329) = ( 0.5000000 0.2335952 0.0420940), wk = 0.0028986 k( 330) = ( 0.5000000 0.2335952 0.0210470), wk = 0.0028986 k( 331) = ( 0.5000000 0.2335952 0.0000000), wk = 0.0028986 k( 332) = ( 0.0000000 0.0000000 1.1812650), wk = 0.0028986 k( 333) = ( 0.0192308 0.0089844 1.1812650), wk = 0.0028986 k( 334) = ( 0.0384615 0.0179689 1.1812650), wk = 0.0028986 k( 335) = ( 0.0576923 0.0269533 1.1812650), wk = 0.0028986 k( 336) = ( 0.0769231 0.0359377 1.1812650), wk = 0.0028986 k( 337) = ( 0.0961538 0.0449222 1.1812650), wk = 0.0028986 k( 338) = ( 0.1153846 0.0539066 1.1812650), wk = 0.0028986 k( 339) = ( 0.1346154 0.0628910 1.1812650), wk = 0.0028986 k( 340) = ( 0.1538461 0.0718754 1.1812650), wk = 0.0028986 k( 341) = ( 0.1730769 0.0808599 1.1812650), wk = 0.0028986 k( 342) = ( 0.1923077 0.0898443 1.1812650), wk = 0.0028986 k( 343) = ( 0.2115385 0.0988287 1.1812650), wk = 0.0028986 k( 344) = ( 0.2307692 0.1078132 1.1812650), wk = 0.0028986 k( 345) = ( 0.2500000 0.1167976 1.1812650), wk = 0.0028986 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 2) = ( 0.0000000 0.0000000 0.0089286), wk = 0.0028986 k( 3) = ( 0.0000000 0.0000000 0.0178571), wk = 0.0028986 k( 4) = ( 0.0000000 0.0000000 0.0267857), wk = 0.0028986 k( 5) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0028986 k( 6) = ( 0.0000000 0.0000000 0.0446429), wk = 0.0028986 k( 7) = ( 0.0000000 0.0000000 0.0535714), wk = 0.0028986 k( 8) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0028986 k( 9) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0028986 k( 10) = ( 0.0000000 0.0000000 0.0803571), wk = 0.0028986 k( 11) = ( 0.0000000 0.0000000 0.0892857), wk = 0.0028986 k( 12) = ( 0.0000000 0.0000000 0.0982143), wk = 0.0028986 k( 13) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0028986 k( 14) = ( 0.0000000 0.0000000 0.1160714), wk = 0.0028986 k( 15) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0028986 k( 16) = ( 0.0000000 0.0000000 0.1339286), wk = 0.0028986 k( 17) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0028986 k( 18) = ( 0.0000000 0.0000000 0.1517857), wk = 0.0028986 k( 19) = ( 0.0000000 0.0000000 0.1607143), wk = 0.0028986 k( 20) = ( 0.0000000 0.0000000 0.1696429), wk = 0.0028986 k( 21) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0028986 k( 22) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0028986 k( 23) = ( 0.0000000 0.0000000 0.1964286), wk = 0.0028986 k( 24) = ( 0.0000000 0.0000000 0.2053571), wk = 0.0028986 k( 25) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0028986 k( 26) = ( 0.0000000 0.0000000 0.2232143), wk = 0.0028986 k( 27) = ( 0.0000000 0.0000000 0.2321429), wk = 0.0028986 k( 28) = ( 0.0000000 0.0000000 0.2410714), wk = 0.0028986 k( 29) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0028986 k( 30) = ( 0.0000000 0.0000000 0.2589286), wk = 0.0028986 k( 31) = ( 0.0000000 0.0000000 0.2678571), wk = 0.0028986 k( 32) = ( 0.0000000 0.0000000 0.2767857), wk = 0.0028986 k( 33) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0028986 k( 34) = ( 0.0000000 0.0000000 0.2946429), wk = 0.0028986 k( 35) = ( 0.0000000 0.0000000 0.3035714), wk = 0.0028986 k( 36) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0028986 k( 37) = ( 0.0000000 0.0000000 0.3214286), wk = 0.0028986 k( 38) = ( 0.0000000 0.0000000 0.3303571), wk = 0.0028986 k( 39) = ( 0.0000000 0.0000000 0.3392857), wk = 0.0028986 k( 40) = ( 0.0000000 0.0000000 0.3482143), wk = 0.0028986 k( 41) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0028986 k( 42) = ( 0.0000000 0.0000000 0.3660714), wk = 0.0028986 k( 43) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0028986 k( 44) = ( 0.0000000 0.0000000 0.3839286), wk = 0.0028986 k( 45) = ( 0.0000000 0.0000000 0.3928571), wk = 0.0028986 k( 46) = ( 0.0000000 0.0000000 0.4017857), wk = 0.0028986 k( 47) = ( 0.0000000 0.0000000 0.4107143), wk = 0.0028986 k( 48) = ( 0.0000000 0.0000000 0.4196429), wk = 0.0028986 k( 49) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0028986 k( 50) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0028986 k( 51) = ( 0.0000000 0.0000000 0.4464286), wk = 0.0028986 k( 52) = ( 0.0000000 0.0000000 0.4553571), wk = 0.0028986 k( 53) = ( 0.0000000 0.0000000 0.4642857), wk = 0.0028986 k( 54) = ( 0.0000000 0.0000000 0.4732143), wk = 0.0028986 k( 55) = ( 0.0000000 0.0000000 0.4821429), wk = 0.0028986 k( 56) = ( 0.0000000 0.0000000 0.4910714), wk = 0.0028986 k( 57) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 58) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 59) = ( -0.0077952 0.0077952 0.5000000), wk = 0.0028986 k( 60) = ( -0.0155905 0.0155905 0.5000000), wk = 0.0028986 k( 61) = ( -0.0233857 0.0233857 0.5000000), wk = 0.0028986 k( 62) = ( -0.0311810 0.0311810 0.5000000), wk = 0.0028986 k( 63) = ( -0.0389762 0.0389762 0.5000000), wk = 0.0028986 k( 64) = ( -0.0467715 0.0467715 0.5000000), wk = 0.0028986 k( 65) = ( -0.0545667 0.0545667 0.5000000), wk = 0.0028986 k( 66) = ( -0.0545667 0.0545667 0.5000000), wk = 0.0028986 k( 67) = ( -0.0609300 0.0609300 0.4936367), wk = 0.0028986 k( 68) = ( -0.0672934 0.0672934 0.4872733), wk = 0.0028986 k( 69) = ( -0.0736567 0.0736567 0.4809100), wk = 0.0028986 k( 70) = ( -0.0800200 0.0800200 0.4745467), wk = 0.0028986 k( 71) = ( -0.0863834 0.0863834 0.4681833), wk = 0.0028986 k( 72) = ( -0.0927467 0.0927467 0.4618200), wk = 0.0028986 k( 73) = ( -0.0991100 0.0991100 0.4554567), wk = 0.0028986 k( 74) = ( -0.1054734 0.1054734 0.4490933), wk = 0.0028986 k( 75) = ( -0.1118367 0.1118367 0.4427300), wk = 0.0028986 k( 76) = ( -0.1182000 0.1182000 0.4363667), wk = 0.0028986 k( 77) = ( -0.1245634 0.1245634 0.4300033), wk = 0.0028986 k( 78) = ( -0.1309267 0.1309267 0.4236400), wk = 0.0028986 k( 79) = ( -0.1372900 0.1372900 0.4172767), wk = 0.0028986 k( 80) = ( -0.1436534 0.1436534 0.4109133), wk = 0.0028986 k( 81) = ( -0.1500167 0.1500167 0.4045500), wk = 0.0028986 k( 82) = ( -0.1563800 0.1563800 0.3981867), wk = 0.0028986 k( 83) = ( -0.1627434 0.1627434 0.3918233), wk = 0.0028986 k( 84) = ( -0.1691067 0.1691067 0.3854600), wk = 0.0028986 k( 85) = ( -0.1754700 0.1754700 0.3790967), wk = 0.0028986 k( 86) = ( -0.1818334 0.1818334 0.3727334), wk = 0.0028986 k( 87) = ( -0.1881967 0.1881967 0.3663700), wk = 0.0028986 k( 88) = ( -0.1945600 0.1945600 0.3600067), wk = 0.0028986 k( 89) = ( -0.2009234 0.2009234 0.3536434), wk = 0.0028986 k( 90) = ( -0.2072867 0.2072867 0.3472800), wk = 0.0028986 k( 91) = ( -0.2136500 0.2136500 0.3409167), wk = 0.0028986 k( 92) = ( -0.2200134 0.2200134 0.3345534), wk = 0.0028986 k( 93) = ( -0.2263767 0.2263767 0.3281900), wk = 0.0028986 k( 94) = ( -0.2327400 0.2327400 0.3218267), wk = 0.0028986 k( 95) = ( -0.2391034 0.2391034 0.3154634), wk = 0.0028986 k( 96) = ( -0.2454667 0.2454667 0.3091000), wk = 0.0028986 k( 97) = ( -0.2518300 0.2518300 0.3027367), wk = 0.0028986 k( 98) = ( -0.2581934 0.2581934 0.2963733), wk = 0.0028986 k( 99) = ( -0.2645567 0.2645567 0.2900100), wk = 0.0028986 k( 100) = ( -0.2709200 0.2709200 0.2836467), wk = 0.0028986 k( 101) = ( -0.2772834 0.2772834 0.2772834), wk = 0.0028986 k( 102) = ( -0.2772834 0.2772834 0.2772834), wk = 0.0028986 k( 103) = ( -0.2709815 0.2709815 0.2709815), wk = 0.0028986 k( 104) = ( -0.2646796 0.2646796 0.2646796), wk = 0.0028986 k( 105) = ( -0.2583777 0.2583777 0.2583777), wk = 0.0028986 k( 106) = ( -0.2520758 0.2520758 0.2520758), wk = 0.0028986 k( 107) = ( -0.2457739 0.2457739 0.2457739), wk = 0.0028986 k( 108) = ( -0.2394720 0.2394720 0.2394720), wk = 0.0028986 k( 109) = ( -0.2331701 0.2331701 0.2331701), wk = 0.0028986 k( 110) = ( -0.2268682 0.2268682 0.2268682), wk = 0.0028986 k( 111) = ( -0.2205663 0.2205663 0.2205663), wk = 0.0028986 k( 112) = ( -0.2142644 0.2142644 0.2142644), wk = 0.0028986 k( 113) = ( -0.2079625 0.2079625 0.2079625), wk = 0.0028986 k( 114) = ( -0.2016606 0.2016606 0.2016606), wk = 0.0028986 k( 115) = ( -0.1953587 0.1953587 0.1953587), wk = 0.0028986 k( 116) = ( -0.1890568 0.1890568 0.1890568), wk = 0.0028986 k( 117) = ( -0.1827549 0.1827549 0.1827549), wk = 0.0028986 k( 118) = ( -0.1764530 0.1764530 0.1764530), wk = 0.0028986 k( 119) = ( -0.1701512 0.1701511 0.1701512), wk = 0.0028986 k( 120) = ( -0.1638493 0.1638493 0.1638493), wk = 0.0028986 k( 121) = ( -0.1575474 0.1575474 0.1575474), wk = 0.0028986 k( 122) = ( -0.1512455 0.1512455 0.1512455), wk = 0.0028986 k( 123) = ( -0.1449436 0.1449436 0.1449436), wk = 0.0028986 k( 124) = ( -0.1386417 0.1386417 0.1386417), wk = 0.0028986 k( 125) = ( -0.1323398 0.1323398 0.1323398), wk = 0.0028986 k( 126) = ( -0.1260379 0.1260379 0.1260379), wk = 0.0028986 k( 127) = ( -0.1197360 0.1197360 0.1197360), wk = 0.0028986 k( 128) = ( -0.1134341 0.1134341 0.1134341), wk = 0.0028986 k( 129) = ( -0.1071322 0.1071322 0.1071322), wk = 0.0028986 k( 130) = ( -0.1008303 0.1008303 0.1008303), wk = 0.0028986 k( 131) = ( -0.0945284 0.0945284 0.0945284), wk = 0.0028986 k( 132) = ( -0.0882265 0.0882265 0.0882265), wk = 0.0028986 k( 133) = ( -0.0819246 0.0819246 0.0819246), wk = 0.0028986 k( 134) = ( -0.0756227 0.0756227 0.0756227), wk = 0.0028986 k( 135) = ( -0.0693208 0.0693208 0.0693208), wk = 0.0028986 k( 136) = ( -0.0630189 0.0630189 0.0630189), wk = 0.0028986 k( 137) = ( -0.0567170 0.0567170 0.0567170), wk = 0.0028986 k( 138) = ( -0.0504152 0.0504152 0.0504152), wk = 0.0028986 k( 139) = ( -0.0441133 0.0441133 0.0441133), wk = 0.0028986 k( 140) = ( -0.0378114 0.0378114 0.0378114), wk = 0.0028986 k( 141) = ( -0.0315095 0.0315095 0.0315095), wk = 0.0028986 k( 142) = ( -0.0252076 0.0252076 0.0252076), wk = 0.0028986 k( 143) = ( -0.0189057 0.0189057 0.0189057), wk = 0.0028986 k( 144) = ( -0.0126038 0.0126038 0.0126038), wk = 0.0028986 k( 145) = ( -0.0063019 0.0063019 0.0063019), wk = 0.0028986 k( 146) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 147) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028986 k( 148) = ( 0.0192308 0.0192308 -0.0192308), wk = 0.0028986 k( 149) = ( 0.0384615 0.0384615 -0.0384615), wk = 0.0028986 k( 150) = ( 0.0576923 0.0576923 -0.0576923), wk = 0.0028986 k( 151) = ( 0.0769231 0.0769231 -0.0769231), wk = 0.0028986 k( 152) = ( 0.0961538 0.0961539 -0.0961539), wk = 0.0028986 k( 153) = ( 0.1153846 0.1153846 -0.1153846), wk = 0.0028986 k( 154) = ( 0.1346154 0.1346154 -0.1346154), wk = 0.0028986 k( 155) = ( 0.1538461 0.1538461 -0.1538462), wk = 0.0028986 k( 156) = ( 0.1730769 0.1730769 -0.1730769), wk = 0.0028986 k( 157) = ( 0.1923077 0.1923077 -0.1923077), wk = 0.0028986 k( 158) = ( 0.2115385 0.2115385 -0.2115385), wk = 0.0028986 k( 159) = ( 0.2307692 0.2307692 -0.2307692), wk = 0.0028986 k( 160) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0028986 k( 161) = ( 0.2692308 0.2692308 -0.2692308), wk = 0.0028986 k( 162) = ( 0.2884615 0.2884615 -0.2884615), wk = 0.0028986 k( 163) = ( 0.3076923 0.3076923 -0.3076923), wk = 0.0028986 k( 164) = ( 0.3269231 0.3269231 -0.3269231), wk = 0.0028986 k( 165) = ( 0.3461538 0.3461538 -0.3461539), wk = 0.0028986 k( 166) = ( 0.3653846 0.3653846 -0.3653846), wk = 0.0028986 k( 167) = ( 0.3846154 0.3846154 -0.3846154), wk = 0.0028986 k( 168) = ( 0.4038462 0.4038462 -0.4038462), wk = 0.0028986 k( 169) = ( 0.4230769 0.4230769 -0.4230769), wk = 0.0028986 k( 170) = ( 0.4423077 0.4423077 -0.4423077), wk = 0.0028986 k( 171) = ( 0.4615385 0.4615385 -0.4615385), wk = 0.0028986 k( 172) = ( 0.4807692 0.4807692 -0.4807692), wk = 0.0028986 k( 173) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028986 k( 174) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028986 k( 175) = ( 0.4936367 0.5063633 -0.4936367), wk = 0.0028986 k( 176) = ( 0.4872733 0.5127267 -0.4872733), wk = 0.0028986 k( 177) = ( 0.4809100 0.5190900 -0.4809100), wk = 0.0028986 k( 178) = ( 0.4745467 0.5254533 -0.4745467), wk = 0.0028986 k( 179) = ( 0.4681833 0.5318167 -0.4681833), wk = 0.0028986 k( 180) = ( 0.4618200 0.5381800 -0.4618200), wk = 0.0028986 k( 181) = ( 0.4554567 0.5445433 -0.4554567), wk = 0.0028986 k( 182) = ( 0.4490933 0.5509067 -0.4490933), wk = 0.0028986 k( 183) = ( 0.4427300 0.5572700 -0.4427300), wk = 0.0028986 k( 184) = ( 0.4363667 0.5636333 -0.4363667), wk = 0.0028986 k( 185) = ( 0.4300033 0.5699967 -0.4300033), wk = 0.0028986 k( 186) = ( 0.4236400 0.5763600 -0.4236400), wk = 0.0028986 k( 187) = ( 0.4172767 0.5827233 -0.4172767), wk = 0.0028986 k( 188) = ( 0.4109133 0.5890867 -0.4109133), wk = 0.0028986 k( 189) = ( 0.4045500 0.5954500 -0.4045500), wk = 0.0028986 k( 190) = ( 0.3981867 0.6018133 -0.3981867), wk = 0.0028986 k( 191) = ( 0.3918233 0.6081767 -0.3918233), wk = 0.0028986 k( 192) = ( 0.3854600 0.6145400 -0.3854600), wk = 0.0028986 k( 193) = ( 0.3790967 0.6209033 -0.3790967), wk = 0.0028986 k( 194) = ( 0.3727334 0.6272667 -0.3727334), wk = 0.0028986 k( 195) = ( 0.3663700 0.6336300 -0.3663700), wk = 0.0028986 k( 196) = ( 0.3600067 0.6399933 -0.3600067), wk = 0.0028986 k( 197) = ( 0.3536434 0.6463567 -0.3536434), wk = 0.0028986 k( 198) = ( 0.3472800 0.6527200 -0.3472800), wk = 0.0028986 k( 199) = ( 0.3409167 0.6590833 -0.3409167), wk = 0.0028986 k( 200) = ( 0.3345534 0.6654467 -0.3345534), wk = 0.0028986 k( 201) = ( 0.3281900 0.6718100 -0.3281900), wk = 0.0028986 k( 202) = ( 0.3218267 0.6781733 -0.3218267), wk = 0.0028986 k( 203) = ( 0.3154633 0.6845366 -0.3154633), wk = 0.0028986 k( 204) = ( 0.3091000 0.6909000 -0.3091000), wk = 0.0028986 k( 205) = ( 0.3027367 0.6972633 -0.3027367), wk = 0.0028986 k( 206) = ( 0.2963733 0.7036267 -0.2963733), wk = 0.0028986 k( 207) = ( 0.2900100 0.7099900 -0.2900100), wk = 0.0028986 k( 208) = ( 0.2836467 0.7163533 -0.2836467), wk = 0.0028986 k( 209) = ( 0.2772834 0.7227166 -0.2772834), wk = 0.0028986 k( 210) = ( 0.2772834 0.7227166 -0.2772834), wk = 0.0028986 k( 211) = ( 0.2574774 0.7068083 -0.2574774), wk = 0.0028986 k( 212) = ( 0.2376715 0.6909000 -0.2376715), wk = 0.0028986 k( 213) = ( 0.2178655 0.6749917 -0.2178655), wk = 0.0028986 k( 214) = ( 0.1980595 0.6590833 -0.1980595), wk = 0.0028986 k( 215) = ( 0.1782536 0.6431750 -0.1782536), wk = 0.0028986 k( 216) = ( 0.1584476 0.6272667 -0.1584476), wk = 0.0028986 k( 217) = ( 0.1386417 0.6113583 -0.1386417), wk = 0.0028986 k( 218) = ( 0.1188357 0.5954500 -0.1188357), wk = 0.0028986 k( 219) = ( 0.0990298 0.5795417 -0.0990298), wk = 0.0028986 k( 220) = ( 0.0792238 0.5636333 -0.0792238), wk = 0.0028986 k( 221) = ( 0.0594179 0.5477250 -0.0594179), wk = 0.0028986 k( 222) = ( 0.0396119 0.5318167 -0.0396119), wk = 0.0028986 k( 223) = ( 0.0198059 0.5159083 -0.0198060), wk = 0.0028986 k( 224) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028986 k( 225) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028986 k( 226) = ( 0.0064103 0.4935897 0.0064103), wk = 0.0028986 k( 227) = ( 0.0128205 0.4871795 0.0128205), wk = 0.0028986 k( 228) = ( 0.0192308 0.4807692 0.0192308), wk = 0.0028986 k( 229) = ( 0.0256410 0.4743590 0.0256410), wk = 0.0028986 k( 230) = ( 0.0320513 0.4679487 0.0320513), wk = 0.0028986 k( 231) = ( 0.0384615 0.4615385 0.0384615), wk = 0.0028986 k( 232) = ( 0.0448718 0.4551282 0.0448718), wk = 0.0028986 k( 233) = ( 0.0512821 0.4487179 0.0512821), wk = 0.0028986 k( 234) = ( 0.0576923 0.4423077 0.0576923), wk = 0.0028986 k( 235) = ( 0.0641026 0.4358974 0.0641026), wk = 0.0028986 k( 236) = ( 0.0705128 0.4294872 0.0705128), wk = 0.0028986 k( 237) = ( 0.0769231 0.4230769 0.0769231), wk = 0.0028986 k( 238) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0028986 k( 239) = ( 0.0897436 0.4102564 0.0897436), wk = 0.0028986 k( 240) = ( 0.0961538 0.4038461 0.0961538), wk = 0.0028986 k( 241) = ( 0.1025641 0.3974359 0.1025641), wk = 0.0028986 k( 242) = ( 0.1089744 0.3910256 0.1089744), wk = 0.0028986 k( 243) = ( 0.1153846 0.3846154 0.1153846), wk = 0.0028986 k( 244) = ( 0.1217949 0.3782051 0.1217949), wk = 0.0028986 k( 245) = ( 0.1282051 0.3717949 0.1282051), wk = 0.0028986 k( 246) = ( 0.1346154 0.3653846 0.1346154), wk = 0.0028986 k( 247) = ( 0.1410256 0.3589744 0.1410256), wk = 0.0028986 k( 248) = ( 0.1474359 0.3525641 0.1474359), wk = 0.0028986 k( 249) = ( 0.1538461 0.3461538 0.1538462), wk = 0.0028986 k( 250) = ( 0.1602564 0.3397436 0.1602564), wk = 0.0028986 k( 251) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0028986 k( 252) = ( 0.1730769 0.3269231 0.1730769), wk = 0.0028986 k( 253) = ( 0.1794872 0.3205128 0.1794872), wk = 0.0028986 k( 254) = ( 0.1858974 0.3141026 0.1858974), wk = 0.0028986 k( 255) = ( 0.1923077 0.3076923 0.1923077), wk = 0.0028986 k( 256) = ( 0.1987180 0.3012821 0.1987179), wk = 0.0028986 k( 257) = ( 0.2051282 0.2948718 0.2051282), wk = 0.0028986 k( 258) = ( 0.2115385 0.2884615 0.2115385), wk = 0.0028986 k( 259) = ( 0.2179487 0.2820513 0.2179487), wk = 0.0028986 k( 260) = ( 0.2243590 0.2756410 0.2243590), wk = 0.0028986 k( 261) = ( 0.2307692 0.2692308 0.2307692), wk = 0.0028986 k( 262) = ( 0.2371795 0.2628205 0.2371795), wk = 0.0028986 k( 263) = ( 0.2435897 0.2564103 0.2435897), wk = 0.0028986 k( 264) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028986 k( 265) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028986 k( 266) = ( 0.2666667 0.2666667 0.2296955), wk = 0.0028986 k( 267) = ( 0.2833333 0.2833333 0.2093911), wk = 0.0028986 k( 268) = ( 0.3000000 0.3000000 0.1890867), wk = 0.0028986 k( 269) = ( 0.3166667 0.3166667 0.1687822), wk = 0.0028986 k( 270) = ( 0.3333333 0.3333333 0.1484778), wk = 0.0028986 k( 271) = ( 0.3500000 0.3500000 0.1281733), wk = 0.0028986 k( 272) = ( 0.3666667 0.3666667 0.1078689), wk = 0.0028986 k( 273) = ( 0.3833333 0.3833333 0.0875644), wk = 0.0028986 k( 274) = ( 0.4000000 0.4000000 0.0672600), wk = 0.0028986 k( 275) = ( 0.4166667 0.4166667 0.0469555), wk = 0.0028986 k( 276) = ( 0.4333333 0.4333333 0.0266511), wk = 0.0028986 k( 277) = ( 0.4500000 0.4500000 0.0063466), wk = 0.0028986 k( 278) = ( 0.4666667 0.4666667 -0.0139578), wk = 0.0028986 k( 279) = ( 0.4833333 0.4833333 -0.0342623), wk = 0.0028986 k( 280) = ( 0.5000000 0.5000000 -0.0545667), wk = 0.0028986 k( 281) = ( 0.5000000 0.5000000 -0.0545667), wk = 0.0028986 k( 282) = ( 0.5000000 0.5000000 -0.0634754), wk = 0.0028986 k( 283) = ( 0.5000000 0.5000000 -0.0723840), wk = 0.0028986 k( 284) = ( 0.5000000 0.5000000 -0.0812927), wk = 0.0028986 k( 285) = ( 0.5000000 0.5000000 -0.0902014), wk = 0.0028986 k( 286) = ( 0.5000000 0.5000000 -0.0991100), wk = 0.0028986 k( 287) = ( 0.5000000 0.5000000 -0.1080187), wk = 0.0028986 k( 288) = ( 0.5000000 0.5000000 -0.1169274), wk = 0.0028986 k( 289) = ( 0.5000000 0.5000000 -0.1258360), wk = 0.0028986 k( 290) = ( 0.5000000 0.5000000 -0.1347447), wk = 0.0028986 k( 291) = ( 0.5000000 0.5000000 -0.1436534), wk = 0.0028986 k( 292) = ( 0.5000000 0.5000000 -0.1525620), wk = 0.0028986 k( 293) = ( 0.5000000 0.5000000 -0.1614707), wk = 0.0028986 k( 294) = ( 0.5000000 0.5000000 -0.1703794), wk = 0.0028986 k( 295) = ( 0.5000000 0.5000000 -0.1792880), wk = 0.0028986 k( 296) = ( 0.5000000 0.5000000 -0.1881967), wk = 0.0028986 k( 297) = ( 0.5000000 0.5000000 -0.1971054), wk = 0.0028986 k( 298) = ( 0.5000000 0.5000000 -0.2060140), wk = 0.0028986 k( 299) = ( 0.5000000 0.5000000 -0.2149227), wk = 0.0028986 k( 300) = ( 0.5000000 0.5000000 -0.2238314), wk = 0.0028986 k( 301) = ( 0.5000000 0.5000000 -0.2327400), wk = 0.0028986 k( 302) = ( 0.5000000 0.5000000 -0.2416487), wk = 0.0028986 k( 303) = ( 0.5000000 0.5000000 -0.2505574), wk = 0.0028986 k( 304) = ( 0.5000000 0.5000000 -0.2594660), wk = 0.0028986 k( 305) = ( 0.5000000 0.5000000 -0.2683747), wk = 0.0028986 k( 306) = ( 0.5000000 0.5000000 -0.2772834), wk = 0.0028986 k( 307) = ( 0.5000000 0.5000000 -0.2861920), wk = 0.0028986 k( 308) = ( 0.5000000 0.5000000 -0.2951007), wk = 0.0028986 k( 309) = ( 0.5000000 0.5000000 -0.3040094), wk = 0.0028986 k( 310) = ( 0.5000000 0.5000000 -0.3129180), wk = 0.0028986 k( 311) = ( 0.5000000 0.5000000 -0.3218267), wk = 0.0028986 k( 312) = ( 0.5000000 0.5000000 -0.3307354), wk = 0.0028986 k( 313) = ( 0.5000000 0.5000000 -0.3396440), wk = 0.0028986 k( 314) = ( 0.5000000 0.5000000 -0.3485527), wk = 0.0028986 k( 315) = ( 0.5000000 0.5000000 -0.3574614), wk = 0.0028986 k( 316) = ( 0.5000000 0.5000000 -0.3663700), wk = 0.0028986 k( 317) = ( 0.5000000 0.5000000 -0.3752787), wk = 0.0028986 k( 318) = ( 0.5000000 0.5000000 -0.3841873), wk = 0.0028986 k( 319) = ( 0.5000000 0.5000000 -0.3930960), wk = 0.0028986 k( 320) = ( 0.5000000 0.5000000 -0.4020047), wk = 0.0028986 k( 321) = ( 0.5000000 0.5000000 -0.4109133), wk = 0.0028986 k( 322) = ( 0.5000000 0.5000000 -0.4198220), wk = 0.0028986 k( 323) = ( 0.5000000 0.5000000 -0.4287307), wk = 0.0028986 k( 324) = ( 0.5000000 0.5000000 -0.4376393), wk = 0.0028986 k( 325) = ( 0.5000000 0.5000000 -0.4465480), wk = 0.0028986 k( 326) = ( 0.5000000 0.5000000 -0.4554567), wk = 0.0028986 k( 327) = ( 0.5000000 0.5000000 -0.4643653), wk = 0.0028986 k( 328) = ( 0.5000000 0.5000000 -0.4732740), wk = 0.0028986 k( 329) = ( 0.5000000 0.5000000 -0.4821827), wk = 0.0028986 k( 330) = ( 0.5000000 0.5000000 -0.4910913), wk = 0.0028986 k( 331) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028986 k( 332) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028986 k( 333) = ( 0.0192308 0.0192308 0.4807692), wk = 0.0028986 k( 334) = ( 0.0384615 0.0384615 0.4615385), wk = 0.0028986 k( 335) = ( 0.0576923 0.0576923 0.4423077), wk = 0.0028986 k( 336) = ( 0.0769231 0.0769231 0.4230769), wk = 0.0028986 k( 337) = ( 0.0961538 0.0961539 0.4038461), wk = 0.0028986 k( 338) = ( 0.1153846 0.1153846 0.3846154), wk = 0.0028986 k( 339) = ( 0.1346154 0.1346154 0.3653846), wk = 0.0028986 k( 340) = ( 0.1538461 0.1538461 0.3461538), wk = 0.0028986 k( 341) = ( 0.1730769 0.1730769 0.3269231), wk = 0.0028986 k( 342) = ( 0.1923077 0.1923077 0.3076923), wk = 0.0028986 k( 343) = ( 0.2115385 0.2115385 0.2884615), wk = 0.0028986 k( 344) = ( 0.2307692 0.2307692 0.2692308), wk = 0.0028986 k( 345) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028986 Dense grid: 50009 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 36751 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 274, 62) NL pseudopotentials 0.36 Mb ( 137, 171) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1390) G-vector shells 0.01 Mb ( 657) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.04 Mb ( 274, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.32 Mb ( 171, 2, 62) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./BaxPOsx2.save/charge-density.dat Starting wfc are 66 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.2 secs Computing kpt #: 2 total cpu time spent up to now is 5.2 secs Computing kpt #: 3 total cpu time spent up to now is 6.0 secs Computing kpt #: 4 total cpu time spent up to now is 6.9 secs Computing kpt #: 5 total cpu time spent up to now is 7.7 secs Computing kpt #: 6 total cpu time spent up to now is 8.5 secs Computing kpt #: 7 total cpu time spent up to now is 9.4 secs Computing kpt #: 8 total cpu time spent up to now is 10.2 secs Computing kpt #: 9 total cpu time spent up to now is 11.0 secs Computing kpt #: 10 total cpu time spent up to now is 11.8 secs Computing kpt #: 11 total cpu time spent up to now is 12.7 secs Computing kpt #: 12 total cpu time spent up to now is 13.4 secs Computing kpt #: 13 total cpu time spent up to now is 14.2 secs Computing kpt #: 14 total cpu time spent up to now is 15.0 secs Computing kpt #: 15 total cpu time spent up to now is 15.8 secs Computing kpt #: 16 total cpu time spent up to now is 16.6 secs Computing kpt #: 17 total cpu time spent up to now is 17.4 secs Computing kpt #: 18 total cpu time spent up to now is 18.2 secs Computing kpt #: 19 total cpu time spent up to now is 19.0 secs Computing kpt #: 20 total cpu time spent up to now is 19.8 secs Computing kpt #: 21 total cpu time spent up to now is 20.6 secs Computing kpt #: 22 total cpu time spent up to now is 21.4 secs Computing kpt #: 23 total cpu time spent up to now is 22.2 secs Computing kpt #: 24 total cpu time spent up to now is 23.0 secs Computing kpt #: 25 total cpu time spent up to now is 23.9 secs Computing kpt #: 26 total cpu time spent up to now is 24.7 secs Computing kpt #: 27 total cpu time spent up to now is 25.5 secs Computing kpt #: 28 total cpu time spent up to now is 26.3 secs Computing kpt #: 29 total cpu time spent up to now is 27.1 secs Computing kpt #: 30 total cpu time spent up to now is 28.0 secs Computing kpt #: 31 total cpu time spent up to now is 28.8 secs Computing kpt #: 32 total cpu time spent up to now is 29.6 secs Computing kpt #: 33 total cpu time spent up to now is 30.5 secs Computing kpt #: 34 total cpu time spent up to now is 31.3 secs Computing kpt #: 35 total cpu time spent up to now is 32.1 secs Computing kpt #: 36 total cpu time spent up to now is 32.9 secs Computing kpt #: 37 total cpu time spent up to now is 33.7 secs Computing kpt #: 38 total cpu time spent up to now is 34.6 secs Computing kpt #: 39 total cpu time spent up to now is 35.4 secs Computing kpt #: 40 total cpu time spent up to now is 36.2 secs Computing kpt #: 41 total cpu time spent up to now is 37.0 secs Computing kpt #: 42 total cpu time spent up to now is 37.8 secs Computing kpt #: 43 total cpu time spent up to now is 38.6 secs Computing kpt #: 44 total cpu time spent up to now is 39.3 secs Computing kpt #: 45 total cpu time spent up to now is 40.1 secs Computing kpt #: 46 total cpu time spent up to now is 40.9 secs Computing kpt #: 47 total cpu time spent up to now is 41.8 secs Computing kpt #: 48 total cpu time spent up to now is 42.6 secs Computing kpt #: 49 total cpu time spent up to now is 43.4 secs Computing kpt #: 50 total cpu time spent up to now is 44.2 secs Computing kpt #: 51 total cpu time spent up to now is 45.0 secs Computing kpt #: 52 total cpu time spent up to now is 45.9 secs Computing kpt #: 53 total cpu time spent up to now is 46.7 secs Computing kpt #: 54 total cpu time spent up to now is 47.7 secs Computing kpt #: 55 total cpu time spent up to now is 48.7 secs Computing kpt #: 56 total cpu time spent up to now is 49.7 secs Computing kpt #: 57 total cpu time spent up to now is 50.7 secs Computing kpt #: 58 total cpu time spent up to now is 51.8 secs Computing kpt #: 59 total cpu time spent up to now is 52.8 secs Computing kpt #: 60 total cpu time spent up to now is 53.8 secs Computing kpt #: 61 total cpu time spent up to now is 54.8 secs Computing kpt #: 62 total cpu time spent up to now is 55.8 secs Computing kpt #: 63 total cpu time spent up to now is 56.7 secs Computing kpt #: 64 total cpu time spent up to now is 57.7 secs Computing kpt #: 65 total cpu time spent up to now is 58.8 secs Computing kpt #: 66 total cpu time spent up to now is 59.8 secs Computing kpt #: 67 total cpu time spent up to now is 60.8 secs Computing kpt #: 68 total cpu time spent up to now is 61.8 secs Computing kpt #: 69 total cpu time spent up to now is 62.8 secs Computing kpt #: 70 total cpu time spent up to now is 63.6 secs Computing kpt #: 71 total cpu time spent up to now is 64.5 secs Computing kpt #: 72 total cpu time spent up to now is 65.3 secs Computing kpt #: 73 total cpu time spent up to now is 66.1 secs Computing kpt #: 74 total cpu time spent up to now is 67.0 secs Computing kpt #: 75 total cpu time spent up to now is 67.8 secs Computing kpt #: 76 total cpu time spent up to now is 68.6 secs Computing kpt #: 77 total cpu time spent up to now is 69.5 secs Computing kpt #: 78 total cpu time spent up to now is 70.3 secs Computing kpt #: 79 total cpu time spent up to now is 71.1 secs Computing kpt #: 80 total cpu time spent up to now is 72.0 secs Computing kpt #: 81 total cpu time spent up to now is 72.8 secs Computing kpt #: 82 total cpu time spent up to now is 73.7 secs Computing kpt #: 83 total cpu time spent up to now is 74.5 secs Computing kpt #: 84 total cpu time spent up to now is 75.3 secs Computing kpt #: 85 total cpu time spent up to now is 76.1 secs Computing kpt #: 86 total cpu time spent up to now is 76.9 secs Computing kpt #: 87 total cpu time spent up to now is 77.8 secs Computing kpt #: 88 total cpu time spent up to now is 78.6 secs Computing kpt #: 89 total cpu time spent up to now is 79.4 secs Computing kpt #: 90 total cpu time spent up to now is 80.2 secs Computing kpt #: 91 total cpu time spent up to now is 81.0 secs Computing kpt #: 92 total cpu time spent up to now is 81.9 secs Computing kpt #: 93 total cpu time spent up to now is 82.7 secs Computing kpt #: 94 total cpu time spent up to now is 83.5 secs Computing kpt #: 95 total cpu time spent up to now is 84.3 secs Computing kpt #: 96 total cpu time spent up to now is 85.1 secs Computing kpt #: 97 total cpu time spent up to now is 85.9 secs Computing kpt #: 98 total cpu time spent up to now is 86.8 secs Computing kpt #: 99 total cpu time spent up to now is 87.6 secs Computing kpt #: 100 total cpu time spent up to now is 88.4 secs Computing kpt #: 101 total cpu time spent up to now is 89.3 secs Computing kpt #: 102 total cpu time spent up to now is 90.1 secs Computing kpt #: 103 total cpu time spent up to now is 90.9 secs Computing kpt #: 104 total cpu time spent up to now is 91.7 secs Computing kpt #: 105 total cpu time spent up to now is 92.5 secs Computing kpt #: 106 total cpu time spent up to now is 93.4 secs Computing kpt #: 107 total cpu time spent up to now is 94.2 secs Computing kpt #: 108 total cpu time spent up to now is 95.1 secs Computing kpt #: 109 total cpu time spent up to now is 95.9 secs Computing kpt #: 110 total cpu time spent up to now is 96.7 secs Computing kpt #: 111 total cpu time spent up to now is 97.6 secs Computing kpt #: 112 total cpu time spent up to now is 98.4 secs Computing kpt #: 113 total cpu time spent up to now is 99.3 secs Computing kpt #: 114 total cpu time spent up to now is 100.2 secs Computing kpt #: 115 total cpu time spent up to now is 101.0 secs Computing kpt #: 116 total cpu time spent up to now is 101.9 secs Computing kpt #: 117 total cpu time spent up to now is 102.8 secs Computing kpt #: 118 total cpu time spent up to now is 103.6 secs Computing kpt #: 119 total cpu time spent up to now is 104.5 secs Computing kpt #: 120 total cpu time spent up to now is 105.4 secs Computing kpt #: 121 total cpu time spent up to now is 106.3 secs Computing kpt #: 122 total cpu time spent up to now is 107.1 secs Computing kpt #: 123 total cpu time spent up to now is 108.0 secs Computing kpt #: 124 total cpu time spent up to now is 108.9 secs Computing kpt #: 125 total cpu time spent up to now is 109.7 secs Computing kpt #: 126 total cpu time spent up to now is 110.6 secs Computing kpt #: 127 total cpu time spent up to now is 111.5 secs Computing kpt #: 128 total cpu time spent up to now is 112.3 secs Computing kpt #: 129 total cpu time spent up to now is 113.2 secs Computing kpt #: 130 total cpu time spent up to now is 114.0 secs Computing kpt #: 131 total cpu time spent up to now is 114.9 secs Computing kpt #: 132 total cpu time spent up to now is 115.8 secs Computing kpt #: 133 total cpu time spent up to now is 116.6 secs Computing kpt #: 134 total cpu time spent up to now is 117.5 secs Computing kpt #: 135 total cpu time spent up to now is 118.3 secs Computing kpt #: 136 total cpu time spent up to now is 119.2 secs Computing kpt #: 137 total cpu time spent up to now is 120.1 secs Computing kpt #: 138 total cpu time spent up to now is 120.9 secs Computing kpt #: 139 total cpu time spent up to now is 121.8 secs Computing kpt #: 140 total cpu time spent up to now is 122.7 secs Computing kpt #: 141 total cpu time spent up to now is 123.6 secs Computing kpt #: 142 total cpu time spent up to now is 124.4 secs Computing kpt #: 143 total cpu time spent up to now is 125.3 secs Computing kpt #: 144 total cpu time spent up to now is 126.1 secs Computing kpt #: 145 total cpu time spent up to now is 127.0 secs Computing kpt #: 146 total cpu time spent up to now is 127.8 secs Computing kpt #: 147 total cpu time spent up to now is 128.6 secs Computing kpt #: 148 total cpu time spent up to now is 129.4 secs Computing kpt #: 149 total cpu time spent up to now is 130.2 secs Computing kpt #: 150 total cpu time spent up to now is 131.1 secs Computing kpt #: 151 total cpu time spent up to now is 131.9 secs Computing kpt #: 152 total cpu time spent up to now is 132.7 secs Computing kpt #: 153 total cpu time spent up to now is 133.5 secs Computing kpt #: 154 total cpu time spent up to now is 134.4 secs Computing kpt #: 155 total cpu time spent up to now is 135.2 secs Computing kpt #: 156 total cpu time spent up to now is 136.0 secs Computing kpt #: 157 total cpu time spent up to now is 136.9 secs Computing kpt #: 158 total cpu time spent up to now is 137.7 secs Computing kpt #: 159 total cpu time spent up to now is 138.5 secs Computing kpt #: 160 total cpu time spent up to now is 139.4 secs Computing kpt #: 161 total cpu time spent up to now is 140.2 secs Computing kpt #: 162 total cpu time spent up to now is 141.1 secs Computing kpt #: 163 total cpu time spent up to now is 141.9 secs Computing kpt #: 164 total cpu time spent up to now is 142.8 secs Computing kpt #: 165 total cpu time spent up to now is 143.6 secs Computing kpt #: 166 total cpu time spent up to now is 144.4 secs Computing kpt #: 167 total cpu time spent up to now is 145.3 secs Computing kpt #: 168 total cpu time spent up to now is 146.1 secs Computing kpt #: 169 total cpu time spent up to now is 146.9 secs Computing kpt #: 170 total cpu time spent up to now is 147.7 secs Computing kpt #: 171 total cpu time spent up to now is 148.5 secs Computing kpt #: 172 total cpu time spent up to now is 149.3 secs Computing kpt #: 173 total cpu time spent up to now is 150.1 secs Computing kpt #: 174 total cpu time spent up to now is 150.9 secs Computing kpt #: 175 total cpu time spent up to now is 151.7 secs Computing kpt #: 176 total cpu time spent up to now is 152.5 secs Computing kpt #: 177 total cpu time spent up to now is 153.3 secs Computing kpt #: 178 total cpu time spent up to now is 154.1 secs Computing kpt #: 179 total cpu time spent up to now is 154.9 secs Computing kpt #: 180 total cpu time spent up to now is 155.7 secs Computing kpt #: 181 total cpu time spent up to now is 156.6 secs Computing kpt #: 182 total cpu time spent up to now is 157.4 secs Computing kpt #: 183 total cpu time spent up to now is 158.2 secs Computing kpt #: 184 total cpu time spent up to now is 159.0 secs Computing kpt #: 185 total cpu time spent up to now is 159.8 secs Computing kpt #: 186 total cpu time spent up to now is 160.7 secs Computing kpt #: 187 total cpu time spent up to now is 161.6 secs Computing kpt #: 188 total cpu time spent up to now is 162.4 secs Computing kpt #: 189 total cpu time spent up to now is 163.3 secs Computing kpt #: 190 total cpu time spent up to now is 164.1 secs Computing kpt #: 191 total cpu time spent up to now is 165.0 secs Computing kpt #: 192 total cpu time spent up to now is 165.9 secs Computing kpt #: 193 total cpu time spent up to now is 166.7 secs Computing kpt #: 194 total cpu time spent up to now is 167.6 secs Computing kpt #: 195 total cpu time spent up to now is 168.5 secs Computing kpt #: 196 total cpu time spent up to now is 169.3 secs Computing kpt #: 197 total cpu time spent up to now is 170.2 secs Computing kpt #: 198 total cpu time spent up to now is 171.0 secs Computing kpt #: 199 total cpu time spent up to now is 171.8 secs Computing kpt #: 200 total cpu time spent up to now is 172.7 secs Computing kpt #: 201 total cpu time spent up to now is 173.5 secs Computing kpt #: 202 total cpu time spent up to now is 174.3 secs Computing kpt #: 203 total cpu time spent up to now is 175.1 secs Computing kpt #: 204 total cpu time spent up to now is 176.0 secs Computing kpt #: 205 total cpu time spent up to now is 176.8 secs Computing kpt #: 206 total cpu time spent up to now is 177.6 secs Computing kpt #: 207 total cpu time spent up to now is 178.5 secs Computing kpt #: 208 total cpu time spent up to now is 179.3 secs Computing kpt #: 209 total cpu time spent up to now is 180.1 secs Computing kpt #: 210 total cpu time spent up to now is 181.0 secs Computing kpt #: 211 total cpu time spent up to now is 181.8 secs Computing kpt #: 212 total cpu time spent up to now is 182.6 secs Computing kpt #: 213 total cpu time spent up to now is 183.5 secs Computing kpt #: 214 total cpu time spent up to now is 184.3 secs Computing kpt #: 215 total cpu time spent up to now is 185.1 secs Computing kpt #: 216 total cpu time spent up to now is 186.0 secs Computing kpt #: 217 total cpu time spent up to now is 186.8 secs Computing kpt #: 218 total cpu time spent up to now is 187.6 secs Computing kpt #: 219 total cpu time spent up to now is 188.5 secs Computing kpt #: 220 total cpu time spent up to now is 189.3 secs Computing kpt #: 221 total cpu time spent up to now is 190.1 secs Computing kpt #: 222 total cpu time spent up to now is 190.9 secs Computing kpt #: 223 total cpu time spent up to now is 191.8 secs Computing kpt #: 224 total cpu time spent up to now is 192.6 secs Computing kpt #: 225 total cpu time spent up to now is 193.4 secs Computing kpt #: 226 total cpu time spent up to now is 194.2 secs Computing kpt #: 227 total cpu time spent up to now is 195.0 secs Computing kpt #: 228 total cpu time spent up to now is 195.9 secs Computing kpt #: 229 total cpu time spent up to now is 196.7 secs Computing kpt #: 230 total cpu time spent up to now is 197.5 secs Computing kpt #: 231 total cpu time spent up to now is 198.3 secs Computing kpt #: 232 total cpu time spent up to now is 199.2 secs Computing kpt #: 233 total cpu time spent up to now is 200.0 secs Computing kpt #: 234 total cpu time spent up to now is 200.8 secs Computing kpt #: 235 total cpu time spent up to now is 201.8 secs Computing kpt #: 236 total cpu time spent up to now is 202.7 secs Computing kpt #: 237 total cpu time spent up to now is 203.5 secs Computing kpt #: 238 total cpu time spent up to now is 204.4 secs Computing kpt #: 239 total cpu time spent up to now is 205.3 secs Computing kpt #: 240 total cpu time spent up to now is 206.2 secs Computing kpt #: 241 total cpu time spent up to now is 207.0 secs Computing kpt #: 242 total cpu time spent up to now is 207.9 secs Computing kpt #: 243 total cpu time spent up to now is 208.7 secs Computing kpt #: 244 total cpu time spent up to now is 209.5 secs Computing kpt #: 245 total cpu time spent up to now is 210.4 secs Computing kpt #: 246 total cpu time spent up to now is 211.2 secs Computing kpt #: 247 total cpu time spent up to now is 212.1 secs Computing kpt #: 248 total cpu time spent up to now is 212.9 secs Computing kpt #: 249 total cpu time spent up to now is 213.8 secs Computing kpt #: 250 total cpu time spent up to now is 214.6 secs Computing kpt #: 251 total cpu time spent up to now is 215.4 secs Computing kpt #: 252 total cpu time spent up to now is 216.3 secs Computing kpt #: 253 total cpu time spent up to now is 217.1 secs Computing kpt #: 254 total cpu time spent up to now is 218.0 secs Computing kpt #: 255 total cpu time spent up to now is 218.9 secs Computing kpt #: 256 total cpu time spent up to now is 219.7 secs Computing kpt #: 257 total cpu time spent up to now is 220.6 secs Computing kpt #: 258 total cpu time spent up to now is 221.5 secs Computing kpt #: 259 total cpu time spent up to now is 222.3 secs Computing kpt #: 260 total cpu time spent up to now is 223.3 secs Computing kpt #: 261 total cpu time spent up to now is 224.3 secs Computing kpt #: 262 total cpu time spent up to now is 225.4 secs Computing kpt #: 263 total cpu time spent up to now is 226.4 secs Computing kpt #: 264 total cpu time spent up to now is 227.5 secs Computing kpt #: 265 total cpu time spent up to now is 228.6 secs Computing kpt #: 266 total cpu time spent up to now is 229.9 secs Computing kpt #: 267 total cpu time spent up to now is 231.0 secs Computing kpt #: 268 total cpu time spent up to now is 232.0 secs Computing kpt #: 269 total cpu time spent up to now is 233.0 secs Computing kpt #: 270 total cpu time spent up to now is 234.0 secs Computing kpt #: 271 total cpu time spent up to now is 235.0 secs Computing kpt #: 272 total cpu time spent up to now is 236.0 secs Computing kpt #: 273 total cpu time spent up to now is 237.0 secs Computing kpt #: 274 total cpu time spent up to now is 238.0 secs Computing kpt #: 275 total cpu time spent up to now is 238.9 secs Computing kpt #: 276 total cpu time spent up to now is 239.9 secs Computing kpt #: 277 total cpu time spent up to now is 240.9 secs Computing kpt #: 278 total cpu time spent up to now is 241.9 secs Computing kpt #: 279 total cpu time spent up to now is 242.9 secs Computing kpt #: 280 total cpu time spent up to now is 243.9 secs Computing kpt #: 281 total cpu time spent up to now is 244.9 secs Computing kpt #: 282 total cpu time spent up to now is 245.9 secs Computing kpt #: 283 total cpu time spent up to now is 246.9 secs Computing kpt #: 284 total cpu time spent up to now is 247.9 secs Computing kpt #: 285 total cpu time spent up to now is 249.3 secs Computing kpt #: 286 total cpu time spent up to now is 250.3 secs Computing kpt #: 287 total cpu time spent up to now is 251.2 secs Computing kpt #: 288 total cpu time spent up to now is 252.1 secs Computing kpt #: 289 total cpu time spent up to now is 252.9 secs Computing kpt #: 290 total cpu time spent up to now is 253.8 secs Computing kpt #: 291 total cpu time spent up to now is 254.6 secs Computing kpt #: 292 total cpu time spent up to now is 255.5 secs Computing kpt #: 293 total cpu time spent up to now is 256.3 secs Computing kpt #: 294 total cpu time spent up to now is 257.1 secs Computing kpt #: 295 total cpu time spent up to now is 258.0 secs Computing kpt #: 296 total cpu time spent up to now is 258.8 secs Computing kpt #: 297 total cpu time spent up to now is 259.7 secs Computing kpt #: 298 total cpu time spent up to now is 260.6 secs Computing kpt #: 299 total cpu time spent up to now is 261.5 secs Computing kpt #: 300 total cpu time spent up to now is 262.4 secs Computing kpt #: 301 total cpu time spent up to now is 263.2 secs Computing kpt #: 302 total cpu time spent up to now is 264.1 secs Computing kpt #: 303 total cpu time spent up to now is 265.0 secs Computing kpt #: 304 total cpu time spent up to now is 265.9 secs Computing kpt #: 305 total cpu time spent up to now is 266.8 secs Computing kpt #: 306 total cpu time spent up to now is 267.7 secs Computing kpt #: 307 total cpu time spent up to now is 268.6 secs Computing kpt #: 308 total cpu time spent up to now is 269.5 secs Computing kpt #: 309 total cpu time spent up to now is 270.4 secs Computing kpt #: 310 total cpu time spent up to now is 271.4 secs Computing kpt #: 311 total cpu time spent up to now is 272.3 secs Computing kpt #: 312 total cpu time spent up to now is 273.2 secs Computing kpt #: 313 total cpu time spent up to now is 274.1 secs Computing kpt #: 314 total cpu time spent up to now is 275.0 secs Computing kpt #: 315 total cpu time spent up to now is 275.9 secs Computing kpt #: 316 total cpu time spent up to now is 276.8 secs Computing kpt #: 317 total cpu time spent up to now is 277.7 secs Computing kpt #: 318 total cpu time spent up to now is 278.6 secs Computing kpt #: 319 total cpu time spent up to now is 279.5 secs Computing kpt #: 320 total cpu time spent up to now is 280.3 secs Computing kpt #: 321 total cpu time spent up to now is 281.1 secs Computing kpt #: 322 total cpu time spent up to now is 282.0 secs Computing kpt #: 323 total cpu time spent up to now is 282.8 secs Computing kpt #: 324 total cpu time spent up to now is 283.7 secs Computing kpt #: 325 total cpu time spent up to now is 284.5 secs Computing kpt #: 326 total cpu time spent up to now is 285.4 secs Computing kpt #: 327 total cpu time spent up to now is 286.2 secs Computing kpt #: 328 total cpu time spent up to now is 287.0 secs Computing kpt #: 329 total cpu time spent up to now is 287.7 secs Computing kpt #: 330 total cpu time spent up to now is 288.5 secs Computing kpt #: 331 total cpu time spent up to now is 289.3 secs Computing kpt #: 332 total cpu time spent up to now is 290.4 secs Computing kpt #: 333 total cpu time spent up to now is 291.4 secs Computing kpt #: 334 total cpu time spent up to now is 292.4 secs Computing kpt #: 335 total cpu time spent up to now is 293.4 secs Computing kpt #: 336 total cpu time spent up to now is 294.3 secs Computing kpt #: 337 total cpu time spent up to now is 295.3 secs Computing kpt #: 338 total cpu time spent up to now is 296.4 secs Computing kpt #: 339 total cpu time spent up to now is 297.4 secs Computing kpt #: 340 total cpu time spent up to now is 298.4 secs Computing kpt #: 341 total cpu time spent up to now is 299.5 secs Computing kpt #: 342 total cpu time spent up to now is 300.5 secs Computing kpt #: 343 total cpu time spent up to now is 301.6 secs Computing kpt #: 344 total cpu time spent up to now is 302.7 secs Computing kpt #: 345 total cpu time spent up to now is 303.8 secs ethr = 1.92E-08, avg # of iterations = 17.5 total cpu time spent up to now is 303.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1255 -0.1255 1.6195 1.6195 1.7145 1.7145 2.0155 2.0155 3.6314 3.6314 7.8606 7.8606 9.1440 9.1440 9.2430 9.2430 9.5615 9.5615 9.7233 9.7233 10.8716 10.8716 11.0914 11.0914 12.6189 12.6189 12.7497 12.7497 14.2749 14.2749 14.4483 14.4483 14.6116 14.6116 15.2073 15.2073 16.4908 16.4908 16.6314 16.6314 16.8626 16.8626 17.1973 17.1973 k = 0.0000 0.0000 0.0211 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8087 -27.8087 -27.5359 -27.5359 -27.4720 -27.4720 -27.4059 -27.4059 -13.4914 -13.4914 -0.1258 -0.1258 1.6159 1.6159 1.7169 1.7169 2.0177 2.0177 3.6312 3.6312 7.8626 7.8626 9.1432 9.1432 9.2422 9.2422 9.5613 9.5613 9.7257 9.7257 10.8701 10.8701 11.0899 11.0899 12.6170 12.6170 12.7533 12.7533 14.2732 14.2732 14.4460 14.4460 14.6109 14.6109 15.2048 15.2048 16.4930 16.4930 16.6330 16.6330 16.8619 16.8619 17.1927 17.1927 k = 0.0000 0.0000 0.0422 ( 4585 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7455 -39.7455 -39.6416 -39.6416 -27.8082 -27.8082 -27.5358 -27.5358 -27.4721 -27.4721 -27.4065 -27.4065 -13.4911 -13.4911 -0.1266 -0.1266 1.6062 1.6062 1.7230 1.7230 2.0243 2.0243 3.6306 3.6306 7.8686 7.8686 9.1402 9.1402 9.2402 9.2402 9.5607 9.5607 9.7328 9.7328 10.8652 10.8652 11.0858 11.0858 12.6117 12.6117 12.7631 12.7631 14.2680 14.2680 14.4392 14.4392 14.6092 14.6092 15.1972 15.1972 16.4991 16.4991 16.6375 16.6375 16.8602 16.8602 17.1774 17.1774 k = 0.0000 0.0000 0.0633 ( 4585 PWs) bands (ev): -71.2825 -71.2825 -71.2481 -71.2481 -39.7453 -39.7453 -39.6419 -39.6419 -27.8075 -27.8075 -27.5357 -27.5357 -27.4723 -27.4723 -27.4073 -27.4073 -13.4906 -13.4906 -0.1280 -0.1280 1.5928 1.5928 1.7305 1.7305 2.0353 2.0353 3.6296 3.6296 7.8785 7.8785 9.1339 9.1339 9.2385 9.2385 9.5600 9.5600 9.7442 9.7442 10.8558 10.8558 11.0802 11.0802 12.6046 12.6046 12.7777 12.7777 14.2590 14.2590 14.4275 14.4275 14.6072 14.6072 15.1849 15.1849 16.5080 16.5080 16.6436 16.6436 16.8583 16.8583 17.1483 17.1483 k = 0.0000 0.0000 0.0844 ( 4579 PWs) bands (ev): -71.2824 -71.2824 -71.2482 -71.2482 -39.7450 -39.7450 -39.6421 -39.6421 -27.8065 -27.8065 -27.5355 -27.5355 -27.4725 -27.4725 -27.4084 -27.4084 -13.4900 -13.4900 -0.1299 -0.1299 1.5773 1.5773 1.7378 1.7378 2.0506 2.0506 3.6283 3.6283 7.8922 7.8922 9.1231 9.1231 9.2388 9.2388 9.5594 9.5594 9.7595 9.7595 10.8405 10.8405 11.0749 11.0749 12.5972 12.5972 12.7954 12.7954 14.2456 14.2456 14.4108 14.4108 14.6056 14.6056 15.1682 15.1682 16.5167 16.5167 16.6502 16.6502 16.8573 16.8573 17.1048 17.1048 k = 0.0000 0.0000 0.1055 ( 4579 PWs) bands (ev): -71.2823 -71.2823 -71.2483 -71.2483 -39.7447 -39.7447 -39.6425 -39.6425 -27.8052 -27.8052 -27.5353 -27.5353 -27.4729 -27.4729 -27.4099 -27.4099 -13.4892 -13.4892 -0.1324 -0.1324 1.5609 1.5609 1.7440 1.7440 2.0701 2.0701 3.6265 3.6265 7.9096 7.9096 9.1070 9.1070 9.2423 9.2423 9.5592 9.5592 9.7780 9.7780 10.8176 10.8176 11.0715 11.0715 12.5901 12.5901 12.8150 12.8150 14.2271 14.2271 14.3893 14.3893 14.6051 14.6051 15.1477 15.1477 16.5195 16.5195 16.6584 16.6584 16.8567 16.8567 17.0533 17.0533 k = 0.0000 0.0000 0.1266 ( 4587 PWs) bands (ev): -71.2821 -71.2821 -71.2485 -71.2485 -39.7443 -39.7443 -39.6430 -39.6430 -27.8037 -27.8037 -27.5351 -27.5351 -27.4734 -27.4734 -27.4116 -27.4116 -13.4882 -13.4882 -0.1354 -0.1354 1.5441 1.5441 1.7486 1.7486 2.0934 2.0934 3.6244 3.6244 7.9303 7.9303 9.0859 9.0859 9.2495 9.2495 9.5595 9.5595 9.7995 9.7995 10.7862 10.7862 11.0711 11.0711 12.5839 12.5839 12.8355 12.8355 14.2027 14.2027 14.3637 14.3637 14.6054 14.6054 15.1239 15.1239 16.5078 16.5078 16.6717 16.6717 16.8508 16.8508 17.0083 17.0083 k = 0.0000 0.0000 0.1477 ( 4579 PWs) bands (ev): -71.2819 -71.2819 -71.2486 -71.2486 -39.7438 -39.7438 -39.6435 -39.6435 -27.8018 -27.8018 -27.5348 -27.5348 -27.4740 -27.4740 -27.4135 -27.4135 -13.4871 -13.4871 -0.1389 -0.1389 1.5276 1.5276 1.7515 1.7515 2.1202 2.1202 3.6219 3.6219 7.9542 7.9542 9.0607 9.0607 9.2601 9.2601 9.5606 9.5606 9.8235 9.8235 10.7463 10.7463 11.0741 11.0741 12.5788 12.5788 12.8564 12.8564 14.1719 14.1719 14.3351 14.3351 14.6062 14.6062 15.0977 15.0977 16.4761 16.4761 16.6901 16.6901 16.8310 16.8310 16.9884 16.9884 k = 0.0000 0.0000 0.1688 ( 4585 PWs) bands (ev): -71.2817 -71.2817 -71.2488 -71.2488 -39.7432 -39.7432 -39.6441 -39.6441 -27.7998 -27.7998 -27.5344 -27.5344 -27.4748 -27.4748 -27.4155 -27.4155 -13.4858 -13.4858 -0.1429 -0.1429 1.5114 1.5114 1.7530 1.7530 2.1501 2.1501 3.6191 3.6191 7.9807 7.9807 9.0322 9.0322 9.2737 9.2737 9.5628 9.5628 9.8498 9.8498 10.6985 10.6985 11.0801 11.0801 12.5748 12.5748 12.8771 12.8771 14.1348 14.1348 14.3040 14.3040 14.6067 14.6067 15.0698 15.0698 16.4244 16.4244 16.7002 16.7002 16.8123 16.8123 16.9950 16.9950 k = 0.0000 0.0000 0.1898 ( 4579 PWs) bands (ev): -71.2815 -71.2815 -71.2490 -71.2490 -39.7425 -39.7425 -39.6448 -39.6448 -27.7975 -27.7975 -27.5339 -27.5339 -27.4759 -27.4759 -27.4177 -27.4177 -13.4843 -13.4843 -0.1475 -0.1475 1.4958 1.4958 1.7530 1.7530 2.1827 2.1827 3.6159 3.6159 8.0094 8.0094 9.0017 9.0017 9.2900 9.2900 9.5661 9.5661 9.8781 9.8781 10.6436 10.6436 11.0884 11.0884 12.5718 12.5718 12.8971 12.8971 14.0917 14.0917 14.2706 14.2706 14.6057 14.6057 15.0411 15.0411 16.3559 16.3559 16.6810 16.6810 16.8278 16.8278 17.0153 17.0153 k = 0.0000 0.0000 0.2109 ( 4579 PWs) bands (ev): -71.2813 -71.2813 -71.2493 -71.2493 -39.7418 -39.7418 -39.6456 -39.6456 -27.7950 -27.7950 -27.5333 -27.5333 -27.4773 -27.4773 -27.4199 -27.4199 -13.4826 -13.4826 -0.1524 -0.1524 1.4810 1.4810 1.7519 1.7519 2.2177 2.2177 3.6125 3.6125 8.0397 8.0397 8.9701 8.9701 9.3087 9.3087 9.5709 9.5709 9.9082 9.9082 10.5827 10.5827 11.0982 11.0982 12.5695 12.5695 12.9159 12.9159 14.0437 14.0437 14.2346 14.2346 14.6020 14.6020 15.0129 15.0129 16.2754 16.2754 16.6458 16.6458 16.8700 16.8700 17.0408 17.0408 k = 0.0000 0.0000 0.2320 ( 4577 PWs) bands (ev): -71.2810 -71.2810 -71.2496 -71.2496 -39.7410 -39.7410 -39.6464 -39.6464 -27.7923 -27.7923 -27.5327 -27.5327 -27.4791 -27.4791 -27.4221 -27.4221 -13.4809 -13.4809 -0.1579 -0.1579 1.4669 1.4669 1.7498 1.7498 2.2547 2.2547 3.6087 3.6087 8.0707 8.0707 8.9386 8.9386 9.3296 9.3296 9.5773 9.5773 9.9397 9.9397 10.5168 10.5168 11.1090 11.1090 12.5676 12.5676 12.9332 12.9332 13.9918 13.9918 14.1958 14.1958 14.5940 14.5940 14.9866 14.9866 16.1876 16.1876 16.6104 16.6104 16.9242 16.9242 17.0670 17.0670 k = 0.0000 0.0000 0.2531 ( 4573 PWs) bands (ev): -71.2807 -71.2807 -71.2498 -71.2498 -39.7402 -39.7402 -39.6473 -39.6473 -27.7894 -27.7894 -27.5320 -27.5320 -27.4813 -27.4813 -27.4241 -27.4241 -13.4789 -13.4789 -0.1637 -0.1637 1.4537 1.4537 1.7470 1.7470 2.2934 2.2934 3.6047 3.6047 8.1012 8.1012 8.9086 8.9086 9.3524 9.3524 9.5854 9.5854 9.9724 9.9724 10.4470 10.4470 11.1200 11.1200 12.5658 12.5658 12.9484 12.9484 13.9370 13.9370 14.1538 14.1538 14.5802 14.5802 14.9638 14.9638 16.0967 16.0967 16.5792 16.5792 16.9845 16.9845 17.0919 17.0919 k = 0.0000 0.0000 0.2742 ( 4573 PWs) bands (ev): -71.2804 -71.2804 -71.2502 -71.2502 -39.7392 -39.7392 -39.6483 -39.6483 -27.7864 -27.7864 -27.5311 -27.5311 -27.4840 -27.4840 -27.4260 -27.4260 -13.4769 -13.4769 -0.1700 -0.1700 1.4413 1.4413 1.7436 1.7436 2.3337 2.3337 3.6005 3.6005 8.1299 8.1299 8.8816 8.8816 9.3772 9.3772 9.5955 9.5955 10.0053 10.0053 10.3748 10.3748 11.1307 11.1307 12.5637 12.5637 12.9610 12.9610 13.8803 13.8803 14.1088 14.1088 14.5593 14.5593 14.9459 14.9459 16.0058 16.0058 16.5533 16.5533 17.0467 17.0467 17.1158 17.1158 k = 0.0000 0.0000 0.2953 ( 4573 PWs) bands (ev): -71.2800 -71.2800 -71.2505 -71.2505 -39.7383 -39.7383 -39.6493 -39.6493 -27.7832 -27.7832 -27.5301 -27.5301 -27.4872 -27.4872 -27.4276 -27.4276 -13.4746 -13.4746 -0.1766 -0.1766 1.4298 1.4298 1.7398 1.7398 2.3752 2.3752 3.5961 3.5961 8.1549 8.1549 8.8596 8.8596 9.4035 9.4035 9.6075 9.6075 10.0364 10.0364 10.3028 10.3028 11.1407 11.1407 12.5608 12.5608 12.9705 12.9705 13.8224 13.8224 14.0610 14.0610 14.5306 14.5306 14.9336 14.9336 15.9174 15.9174 16.5329 16.5329 17.0959 17.0959 17.1511 17.1511 k = 0.0000 0.0000 0.3164 ( 4581 PWs) bands (ev): -71.2797 -71.2797 -71.2508 -71.2508 -39.7372 -39.7372 -39.6504 -39.6504 -27.7800 -27.7800 -27.5290 -27.5290 -27.4910 -27.4910 -27.4290 -27.4290 -13.4723 -13.4723 -0.1835 -0.1835 1.4191 1.4191 1.7357 1.7357 2.4178 2.4178 3.5915 3.5915 8.1743 8.1743 8.8446 8.8446 9.4314 9.4314 9.6217 9.6217 10.0587 10.0587 10.2385 10.2385 11.1495 11.1495 12.5567 12.5567 12.9761 12.9761 13.7640 13.7640 14.0109 14.0109 14.4945 14.4945 14.9271 14.9271 15.8336 15.8336 16.5177 16.5177 17.1139 17.1139 17.2138 17.2138 k = 0.0000 0.0000 0.3375 ( 4577 PWs) bands (ev): -71.2793 -71.2793 -71.2512 -71.2512 -39.7361 -39.7361 -39.6516 -39.6516 -27.7766 -27.7766 -27.5278 -27.5278 -27.4954 -27.4954 -27.4300 -27.4300 -13.4699 -13.4699 -0.1907 -0.1907 1.4092 1.4092 1.7314 1.7314 2.4612 2.4612 3.5868 3.5868 8.1859 8.1859 8.8388 8.8388 9.4607 9.4607 9.6378 9.6378 10.0506 10.0506 10.2043 10.2043 11.1569 11.1569 12.5510 12.5510 12.9772 12.9772 13.7056 13.7056 13.9592 13.9592 14.4521 14.4521 14.9256 14.9256 15.7558 15.7558 16.5076 16.5076 17.1148 17.1148 17.2882 17.2882 k = 0.0000 0.0000 0.3586 ( 4577 PWs) bands (ev): -71.2789 -71.2789 -71.2516 -71.2516 -39.7350 -39.7350 -39.6528 -39.6528 -27.7731 -27.7731 -27.5264 -27.5264 -27.5003 -27.5003 -27.4308 -27.4308 -13.4673 -13.4673 -0.1981 -0.1981 1.4000 1.4000 1.7271 1.7271 2.5051 2.5051 3.5819 3.5819 8.1883 8.1883 8.8438 8.8438 9.4912 9.4912 9.6554 9.6554 9.9979 9.9979 10.2151 10.2151 11.1625 11.1625 12.5431 12.5431 12.9730 12.9730 13.6475 13.6475 13.9069 13.9069 14.4049 14.4049 14.9280 14.9280 15.6853 15.6853 16.5017 16.5017 17.1049 17.1049 17.3665 17.3665 k = 0.0000 0.0000 0.3797 ( 4581 PWs) bands (ev): -71.2785 -71.2785 -71.2520 -71.2520 -39.7338 -39.7338 -39.6540 -39.6540 -27.7697 -27.7697 -27.5248 -27.5248 -27.5056 -27.5056 -27.4312 -27.4312 -13.4647 -13.4647 -0.2057 -0.2057 1.3916 1.3916 1.7228 1.7228 2.5496 2.5496 3.5771 3.5771 8.1809 8.1809 8.8600 8.8600 9.5228 9.5228 9.6730 9.6730 9.9259 9.9259 10.2476 10.2476 11.1662 11.1662 12.5327 12.5327 12.9626 12.9626 13.5900 13.5900 13.8552 13.8552 14.3547 14.3547 14.9333 14.9333 15.6234 15.6234 16.4994 16.4994 17.0853 17.0853 17.4467 17.4467 k = 0.0000 0.0000 0.4008 ( 4581 PWs) bands (ev): -71.2781 -71.2781 -71.2524 -71.2524 -39.7326 -39.7326 -39.6553 -39.6553 -27.7662 -27.7662 -27.5231 -27.5231 -27.5114 -27.5114 -27.4314 -27.4314 -13.4619 -13.4619 -0.2135 -0.2135 1.3839 1.3839 1.7188 1.7188 2.5942 2.5942 3.5722 3.5722 8.1645 8.1645 8.8870 8.8870 9.5552 9.5552 9.6853 9.6853 9.8544 9.8544 10.2877 10.2877 11.1679 11.1679 12.5193 12.5193 12.9453 12.9453 13.5331 13.5331 13.8051 13.8051 14.3028 14.3028 14.9405 14.9405 15.5707 15.5707 16.4999 16.4999 17.0563 17.0563 17.5274 17.5274 k = 0.0000 0.0000 0.4219 ( 4581 PWs) bands (ev): -71.2777 -71.2777 -71.2528 -71.2528 -39.7314 -39.7314 -39.6567 -39.6567 -27.7627 -27.7627 -27.5213 -27.5213 -27.5175 -27.5175 -27.4314 -27.4314 -13.4591 -13.4591 -0.2215 -0.2215 1.3767 1.3767 1.7150 1.7150 2.6389 2.6389 3.5673 3.5673 8.1403 8.1403 8.9231 8.9231 9.5875 9.5875 9.6735 9.6735 9.8075 9.8075 10.3311 10.3311 11.1676 11.1676 12.5025 12.5025 12.9206 12.9206 13.4768 13.4768 13.7578 13.7578 14.2507 14.2507 14.9487 14.9487 15.5282 15.5282 16.5021 16.5021 17.0185 17.0185 17.6077 17.6077 k = 0.0000 0.0000 0.4430 ( 4577 PWs) bands (ev): -71.2772 -71.2772 -71.2533 -71.2533 -39.7301 -39.7301 -39.6580 -39.6580 -27.7593 -27.7593 -27.5246 -27.5246 -27.5187 -27.5187 -27.4311 -27.4311 -13.4562 -13.4562 -0.2294 -0.2294 1.3701 1.3701 1.7115 1.7115 2.6833 2.6833 3.5626 3.5626 8.1102 8.1102 8.9667 8.9667 9.5997 9.5997 9.6377 9.6377 9.8064 9.8064 10.3765 10.3765 11.1653 11.1653 12.4820 12.4820 12.8883 12.8883 13.4209 13.4209 13.7143 13.7143 14.1994 14.1994 14.9574 14.9574 15.4960 15.4960 16.5048 16.5048 16.9727 16.9727 17.6865 17.6865 k = 0.0000 0.0000 0.4641 ( 4583 PWs) bands (ev): -71.2768 -71.2768 -71.2537 -71.2537 -39.7288 -39.7288 -39.6595 -39.6595 -27.7559 -27.7559 -27.5314 -27.5314 -27.5164 -27.5164 -27.4308 -27.4308 -13.4532 -13.4532 -0.2375 -0.2375 1.3641 1.3641 1.7085 1.7085 2.7274 2.7274 3.5579 3.5579 8.0759 8.0759 9.0157 9.0157 9.5285 9.5285 9.6640 9.6640 9.8292 9.8292 10.4230 10.4230 11.1611 11.1611 12.4574 12.4574 12.8485 12.8485 13.3652 13.3652 13.6750 13.6750 14.1499 14.1499 14.9660 14.9660 15.4746 15.4746 16.5063 16.5063 16.9206 16.9206 17.7624 17.7624 k = 0.0000 0.0000 0.4852 ( 4587 PWs) bands (ev): -71.2763 -71.2763 -71.2542 -71.2542 -39.7274 -39.7274 -39.6609 -39.6609 -27.7527 -27.7527 -27.5385 -27.5385 -27.5139 -27.5139 -27.4302 -27.4302 -13.4502 -13.4502 -0.2455 -0.2455 1.3585 1.3585 1.7059 1.7059 2.7709 2.7709 3.5534 3.5534 8.0389 8.0389 9.0682 9.0682 9.4428 9.4428 9.6997 9.6997 9.8606 9.8606 10.4702 10.4702 11.1553 11.1553 12.4288 12.4288 12.8020 12.8020 13.3094 13.3094 13.6400 13.6400 14.1032 14.1032 14.9742 14.9742 15.4637 15.4637 16.5042 16.5042 16.8648 16.8648 17.8340 17.8340 k = 0.0000 0.0000 0.5063 ( 4599 PWs) bands (ev): -71.2758 -71.2758 -71.2547 -71.2547 -39.7261 -39.7261 -39.6624 -39.6624 -27.7495 -27.7495 -27.5458 -27.5458 -27.5111 -27.5111 -27.4296 -27.4296 -13.4472 -13.4472 -0.2534 -0.2534 1.3533 1.3533 1.7038 1.7038 2.8136 2.8136 3.5491 3.5491 8.0004 8.0004 9.1213 9.1213 9.3562 9.3562 9.7371 9.7371 9.8962 9.8962 10.5175 10.5175 11.1482 11.1482 12.3960 12.3960 12.7496 12.7496 13.2536 13.2536 13.6089 13.6089 14.0601 14.0601 14.9815 14.9815 15.4631 15.4631 16.4942 16.4942 16.8097 16.8097 17.8997 17.8997 k = 0.0000 0.0000 0.5274 ( 4595 PWs) bands (ev): -71.2753 -71.2753 -71.2552 -71.2552 -39.7247 -39.7247 -39.6639 -39.6639 -27.7465 -27.7465 -27.5534 -27.5534 -27.5081 -27.5081 -27.4288 -27.4288 -13.4441 -13.4441 -0.2613 -0.2613 1.3485 1.3485 1.7023 1.7023 2.8552 2.8552 3.5451 3.5451 7.9615 7.9615 9.1638 9.1638 9.2813 9.2813 9.7757 9.7757 9.9345 9.9345 10.5646 10.5646 11.1403 11.1403 12.3591 12.3591 12.6928 12.6928 13.1976 13.1976 13.5810 13.5810 14.0214 14.0214 14.9879 14.9879 15.4724 15.4724 16.4702 16.4702 16.7619 16.7619 17.9575 17.9575 k = 0.0000 0.0000 0.5484 ( 4583 PWs) bands (ev): -71.2748 -71.2748 -71.2556 -71.2556 -39.7233 -39.7233 -39.6654 -39.6654 -27.7436 -27.7436 -27.5610 -27.5610 -27.5049 -27.5049 -27.4279 -27.4279 -13.4409 -13.4409 -0.2691 -0.2691 1.3441 1.3441 1.7013 1.7013 2.8956 2.8956 3.5414 3.5414 7.9229 7.9229 9.1377 9.1377 9.2759 9.2759 9.8154 9.8154 9.9748 9.9748 10.6109 10.6109 11.1322 11.1322 12.3182 12.3182 12.6325 12.6325 13.1417 13.1417 13.5554 13.5554 13.9876 13.9876 14.9928 14.9928 15.4908 15.4908 16.4262 16.4262 16.7281 16.7281 18.0054 18.0054 k = 0.0000 0.0000 0.5695 ( 4585 PWs) bands (ev): -71.2744 -71.2744 -71.2561 -71.2561 -39.7219 -39.7219 -39.6669 -39.6669 -27.7408 -27.7408 -27.5688 -27.5688 -27.5015 -27.5015 -27.4270 -27.4270 -13.4378 -13.4378 -0.2766 -0.2766 1.3400 1.3400 1.7008 1.7008 2.9345 2.9345 3.5380 3.5380 7.8853 7.8853 9.0573 9.0573 9.3256 9.3256 9.8559 9.8559 10.0163 10.0163 10.6559 10.6559 11.1245 11.1245 12.2736 12.2736 12.5702 12.5702 13.0857 13.0857 13.5311 13.5311 13.9592 13.9592 14.9961 14.9961 15.5178 15.5178 16.3612 16.3612 16.7097 16.7097 18.0418 18.0418 k = 0.0000 0.0000 0.5906 ( 4585 PWs) bands (ev): -71.2739 -71.2739 -71.2566 -71.2566 -39.7205 -39.7205 -39.6684 -39.6684 -27.7382 -27.7382 -27.5766 -27.5766 -27.4979 -27.4979 -27.4260 -27.4260 -13.4347 -13.4347 -0.2840 -0.2840 1.3362 1.3362 1.7010 1.7010 2.9717 2.9717 3.5350 3.5350 7.8492 7.8492 8.9689 8.9689 9.3840 9.3840 9.8971 9.8971 10.0586 10.0586 10.6991 10.6991 11.1180 11.1180 12.2257 12.2257 12.5069 12.5069 13.0300 13.0300 13.5076 13.5076 13.9365 13.9365 14.9974 14.9974 15.5525 15.5525 16.2796 16.2796 16.7030 16.7030 18.0653 18.0653 k = 0.0000 0.0000 0.6117 ( 4585 PWs) bands (ev): -71.2734 -71.2734 -71.2571 -71.2571 -39.7191 -39.7191 -39.6699 -39.6699 -27.7358 -27.7358 -27.5845 -27.5845 -27.4941 -27.4941 -27.4250 -27.4250 -13.4315 -13.4315 -0.2912 -0.2912 1.3328 1.3328 1.7016 1.7016 3.0070 3.0070 3.5324 3.5324 7.8151 7.8151 8.8793 8.8793 9.4440 9.4440 9.9387 9.9387 10.1011 10.1011 10.7399 10.7399 11.1136 11.1136 12.1749 12.1749 12.4436 12.4436 12.9746 12.9746 13.4846 13.4846 13.9194 13.9194 14.9963 14.9963 15.5940 15.5940 16.1868 16.1868 16.7032 16.7032 18.0760 18.0760 k = 0.0000 0.0000 0.6328 ( 4599 PWs) bands (ev): -71.2729 -71.2729 -71.2576 -71.2576 -39.7177 -39.7177 -39.6714 -39.6714 -27.7336 -27.7336 -27.5924 -27.5924 -27.4901 -27.4901 -27.4240 -27.4240 -13.4284 -13.4284 -0.2982 -0.2982 1.3296 1.3296 1.7028 1.7028 3.0403 3.0403 3.5303 3.5303 7.7835 7.7835 8.7902 8.7902 9.5039 9.5039 9.9804 9.9804 10.1434 10.1434 10.7779 10.7779 11.1122 11.1122 12.1217 12.1217 12.3812 12.3812 12.9195 12.9195 13.4618 13.4618 13.9076 13.9076 14.9924 14.9924 15.6413 15.6413 16.0869 16.0869 16.7074 16.7074 18.0753 18.0753 k = 0.0000 0.0000 0.6539 ( 4605 PWs) bands (ev): -71.2724 -71.2724 -71.2580 -71.2580 -39.7163 -39.7163 -39.6730 -39.6730 -27.7315 -27.7315 -27.6002 -27.6002 -27.4860 -27.4860 -27.4229 -27.4229 -13.4253 -13.4253 -0.3049 -0.3049 1.3268 1.3268 1.7045 1.7045 3.0713 3.0713 3.5286 3.5286 7.7546 7.7546 8.7021 8.7021 9.5629 9.5629 10.0218 10.0218 10.1848 10.1848 10.8129 10.8129 11.1147 11.1147 12.0666 12.0666 12.3203 12.3203 12.8649 12.8649 13.4398 13.4398 13.9007 13.9007 14.9854 14.9854 15.6926 15.6926 15.9831 15.9831 16.7137 16.7137 18.0657 18.0657 k = 0.0000 0.0000 0.6750 ( 4599 PWs) bands (ev): -71.2719 -71.2719 -71.2585 -71.2585 -39.7150 -39.7150 -39.6745 -39.6745 -27.7296 -27.7296 -27.6080 -27.6080 -27.4817 -27.4817 -27.4218 -27.4218 -13.4222 -13.4222 -0.3113 -0.3113 1.3243 1.3243 1.7066 1.7066 3.0999 3.0999 3.5273 3.5273 7.7288 7.7288 8.6153 8.6153 9.6205 9.6205 10.0626 10.0626 10.2246 10.2246 10.8451 10.8451 11.1215 11.1215 12.0102 12.0102 12.2614 12.2614 12.8108 12.8108 13.4189 13.4189 13.8982 13.8982 14.9749 14.9749 15.7413 15.7413 15.8827 15.8827 16.7211 16.7211 18.0508 18.0508 k = 0.0000 0.0000 0.6961 ( 4595 PWs) bands (ev): -71.2715 -71.2715 -71.2590 -71.2590 -39.7136 -39.7136 -39.6759 -39.6759 -27.7279 -27.7279 -27.6156 -27.6156 -27.4773 -27.4773 -27.4207 -27.4207 -13.4192 -13.4192 -0.3174 -0.3174 1.3221 1.3221 1.7092 1.7092 3.1260 3.1260 3.5266 3.5266 7.7061 7.7061 8.5303 8.5303 9.6764 9.6764 10.1020 10.1020 10.2623 10.2623 10.8754 10.8754 11.1325 11.1325 11.9533 11.9533 12.2049 12.2049 12.7573 12.7573 13.3995 13.3995 13.8994 13.8994 14.9605 14.9605 15.7286 15.7286 15.8450 15.8450 16.7289 16.7289 18.0340 18.0340 k = 0.0000 0.0000 0.7172 ( 4593 PWs) bands (ev): -71.2710 -71.2710 -71.2594 -71.2594 -39.7123 -39.7123 -39.6774 -39.6774 -27.7263 -27.7263 -27.6232 -27.6232 -27.4728 -27.4728 -27.4196 -27.4196 -13.4162 -13.4162 -0.3232 -0.3232 1.3202 1.3202 1.7121 1.7121 3.1493 3.1493 3.5264 3.5264 7.6869 7.6869 8.4472 8.4472 9.7301 9.7301 10.1394 10.1394 10.2973 10.2973 10.9051 10.9051 11.1474 11.1474 11.8962 11.8962 12.1510 12.1510 12.7045 12.7045 13.3821 13.3821 13.9036 13.9036 14.9419 14.9419 15.6294 15.6294 15.8952 15.8952 16.7369 16.7369 18.0185 18.0185 k = 0.0000 0.0000 0.7383 ( 4587 PWs) bands (ev): -71.2706 -71.2706 -71.2599 -71.2599 -39.7110 -39.7110 -39.6788 -39.6788 -27.7249 -27.7249 -27.6306 -27.6306 -27.4682 -27.4682 -27.4185 -27.4185 -13.4133 -13.4133 -0.3288 -0.3288 1.3187 1.3187 1.7153 1.7153 3.1700 3.1700 3.5267 3.5267 7.6712 7.6712 8.3663 8.3663 9.7814 9.7814 10.1740 10.1740 10.3293 10.3293 10.9358 10.9358 11.1652 11.1652 11.8397 11.8397 12.1000 12.1000 12.6525 12.6525 13.3673 13.3673 13.9103 13.9103 14.9184 14.9184 15.5180 15.5180 15.9588 15.9588 16.7449 16.7449 18.0073 18.0073 k = 0.0000 0.0000 0.7594 ( 4587 PWs) bands (ev): -71.2701 -71.2701 -71.2603 -71.2603 -39.7097 -39.7097 -39.6802 -39.6802 -27.7237 -27.7237 -27.6378 -27.6378 -27.4637 -27.4637 -27.4174 -27.4174 -13.4105 -13.4105 -0.3340 -0.3340 1.3175 1.3175 1.7189 1.7189 3.1879 3.1879 3.5275 3.5275 7.6590 7.6590 8.2878 8.2878 9.8299 9.8299 10.2049 10.2049 10.3584 10.3584 10.9688 10.9688 11.1853 11.1853 11.7843 11.7843 12.0518 12.0518 12.6015 12.6015 13.3555 13.3555 13.9191 13.9191 14.8894 14.8894 15.4052 15.4052 16.0255 16.0255 16.7525 16.7525 18.0026 18.0026 k = 0.0000 0.0000 0.7805 ( 4595 PWs) bands (ev): -71.2697 -71.2697 -71.2607 -71.2607 -39.7085 -39.7085 -39.6816 -39.6816 -27.7226 -27.7226 -27.6449 -27.6449 -27.4591 -27.4591 -27.4164 -27.4164 -13.4078 -13.4078 -0.3389 -0.3389 1.3167 1.3167 1.7226 1.7226 3.2031 3.2031 3.5287 3.5287 7.6504 7.6504 8.2119 8.2119 9.8755 9.8755 10.2310 10.2310 10.3851 10.3851 11.0044 11.0044 11.2075 11.2075 11.7303 11.7303 12.0065 12.0065 12.5516 12.5516 13.3470 13.3470 13.9295 13.9295 14.8537 14.8537 15.2937 15.2937 16.0929 16.0929 16.7598 16.7598 18.0061 18.0061 k = 0.0000 0.0000 0.8016 ( 4593 PWs) bands (ev): -71.2692 -71.2692 -71.2612 -71.2612 -39.7073 -39.7073 -39.6829 -39.6829 -27.7217 -27.7217 -27.6517 -27.6517 -27.4546 -27.4546 -27.4153 -27.4153 -13.4051 -13.4051 -0.3435 -0.3435 1.3161 1.3161 1.7266 1.7266 3.2155 3.2155 3.5303 3.5303 7.6453 7.6453 8.1387 8.1387 9.9178 9.9178 10.2515 10.2515 10.4103 10.4103 11.0418 11.0418 11.2325 11.2325 11.6783 11.6783 11.9640 11.9640 12.5030 12.5030 13.3422 13.3422 13.9410 13.9410 14.8098 14.8098 15.1860 15.1860 16.1599 16.1599 16.7667 16.7667 18.0194 18.0194 k = 0.0000 0.0000 0.8227 ( 4597 PWs) bands (ev): -71.2688 -71.2688 -71.2616 -71.2616 -39.7061 -39.7061 -39.6842 -39.6842 -27.7209 -27.7209 -27.6583 -27.6583 -27.4502 -27.4502 -27.4143 -27.4143 -13.4025 -13.4025 -0.3478 -0.3478 1.3160 1.3160 1.7307 1.7307 3.2253 3.2253 3.5324 3.5324 7.6436 7.6436 8.0685 8.0685 9.9567 9.9567 10.2661 10.2661 10.4348 10.4348 11.0788 11.0788 11.2622 11.2622 11.6287 11.6287 11.9242 11.9242 12.4558 12.4558 13.3413 13.3413 13.9533 13.9533 14.7553 14.7553 15.0848 15.0848 16.2255 16.2255 16.7731 16.7731 18.0432 18.0432 k = 0.0000 0.0000 0.8438 ( 4592 PWs) bands (ev): -71.2684 -71.2684 -71.2620 -71.2620 -39.7050 -39.7050 -39.6854 -39.6854 -27.7202 -27.7202 -27.6646 -27.6646 -27.4458 -27.4458 -27.4133 -27.4133 -13.4001 -13.4001 -0.3518 -0.3518 1.3161 1.3161 1.7349 1.7349 3.2326 3.2326 3.5348 3.5348 7.6450 7.6450 8.0015 8.0015 9.9919 9.9919 10.2751 10.2751 10.4589 10.4589 11.1119 11.1119 11.2991 11.2991 11.5820 11.5820 11.8870 11.8870 12.4106 12.4106 13.3446 13.3446 13.9662 13.9662 14.6877 14.6877 14.9931 14.9931 16.2892 16.2892 16.7789 16.7789 18.0782 18.0782 k = 0.0000 0.0000 0.8649 ( 4592 PWs) bands (ev): -71.2681 -71.2681 -71.2623 -71.2623 -39.7039 -39.7039 -39.6866 -39.6866 -27.7196 -27.7196 -27.6706 -27.6706 -27.4415 -27.4415 -27.4124 -27.4124 -13.3977 -13.3977 -0.3554 -0.3554 1.3165 1.3165 1.7392 1.7392 3.2377 3.2377 3.5375 3.5375 7.6494 7.6494 7.9377 7.9377 10.0234 10.0234 10.2792 10.2792 10.4826 10.4826 11.1383 11.1383 11.3450 11.3450 11.5389 11.5389 11.8521 11.8521 12.3673 12.3673 13.3522 13.3522 13.9794 13.9794 14.6056 14.6056 14.9126 14.9126 16.3502 16.3502 16.7843 16.7843 18.1244 18.1244 k = 0.0000 0.0000 0.8859 ( 4588 PWs) bands (ev): -71.2677 -71.2677 -71.2627 -71.2627 -39.7029 -39.7029 -39.6877 -39.6877 -27.7190 -27.7190 -27.6763 -27.6763 -27.4373 -27.4373 -27.4115 -27.4115 -13.3955 -13.3955 -0.3588 -0.3588 1.3172 1.3172 1.7435 1.7435 3.2406 3.2406 3.5404 3.5404 7.6563 7.6563 7.8774 7.8774 10.0510 10.0510 10.2796 10.2796 10.5055 10.5055 11.1571 11.1571 11.3985 11.3985 11.5012 11.5012 11.8194 11.8194 12.3266 12.3266 13.3641 13.3641 13.9926 13.9926 14.5108 14.5108 14.8420 14.8420 16.4084 16.4084 16.7891 16.7891 18.1816 18.1816 k = 0.0000 0.0000 0.9070 ( 4592 PWs) bands (ev): -71.2674 -71.2674 -71.2630 -71.2630 -39.7020 -39.7020 -39.6888 -39.6888 -27.7186 -27.7186 -27.6818 -27.6818 -27.4334 -27.4334 -27.4106 -27.4106 -13.3934 -13.3934 -0.3619 -0.3619 1.3181 1.3181 1.7479 1.7479 3.2416 3.2416 3.5434 3.5434 7.6655 7.6655 7.8208 7.8208 10.0747 10.0747 10.2773 10.2773 10.5274 10.5274 11.1693 11.1693 11.4391 11.4391 11.4878 11.4878 11.7888 11.7888 12.2887 12.2887 13.3804 13.3804 14.0055 14.0055 14.4066 14.4066 14.7784 14.7784 16.4635 16.4635 16.7933 16.7933 18.2492 18.2492 k = 0.0000 0.0000 0.9281 ( 4596 PWs) bands (ev): -71.2671 -71.2671 -71.2633 -71.2633 -39.7011 -39.7011 -39.6898 -39.6898 -27.7182 -27.7182 -27.6869 -27.6869 -27.4296 -27.4296 -27.4098 -27.4098 -13.3914 -13.3914 -0.3648 -0.3648 1.3192 1.3192 1.7521 1.7521 3.2410 3.2410 3.5466 3.5466 7.6763 7.6763 7.7682 7.7682 10.0945 10.0945 10.2733 10.2733 10.5478 10.5478 11.1760 11.1760 11.4218 11.4218 11.5415 11.5415 11.7609 11.7609 12.2544 12.2544 13.4010 13.4010 14.0179 14.0179 14.2965 14.2965 14.7187 14.7187 16.5153 16.5153 16.7971 16.7971 18.3262 18.3262 k = 0.0000 0.0000 0.9492 ( 4602 PWs) bands (ev): -71.2668 -71.2668 -71.2636 -71.2636 -39.7003 -39.7003 -39.6907 -39.6907 -27.7179 -27.7179 -27.6916 -27.6916 -27.4260 -27.4260 -27.4091 -27.4091 -13.3895 -13.3895 -0.3673 -0.3673 1.3204 1.3204 1.7563 1.7563 3.2390 3.2390 3.5498 3.5498 7.6863 7.6863 7.7216 7.7216 10.1105 10.1105 10.2683 10.2683 10.5666 10.5666 11.1782 11.1782 11.3972 11.3972 11.6068 11.6068 11.7384 11.7384 12.2245 12.2245 13.4257 13.4257 14.0289 14.0289 14.1838 14.1838 14.6611 14.6611 16.5637 16.5637 16.8004 16.8004 18.4114 18.4114 k = 0.0000 0.0000 0.9703 ( 4606 PWs) bands (ev): -71.2665 -71.2665 -71.2639 -71.2639 -39.6995 -39.6995 -39.6915 -39.6915 -27.7177 -27.7177 -27.6960 -27.6960 -27.4226 -27.4226 -27.4084 -27.4084 -13.3878 -13.3878 -0.3696 -0.3696 1.3217 1.3217 1.7603 1.7603 3.2359 3.2359 3.5529 3.5529 7.6682 7.6682 7.7083 7.7083 10.1228 10.1228 10.2630 10.2630 10.5838 10.5838 11.1762 11.1762 11.3771 11.3771 11.6532 11.6532 11.7382 11.7382 12.2007 12.2007 13.4543 13.4543 14.0307 14.0307 14.0778 14.0778 14.6042 14.6042 16.6086 16.6086 16.8035 16.8035 18.5036 18.5036 k = 0.0000 0.0000 0.9914 ( 4622 PWs) bands (ev): -71.2663 -71.2663 -71.2641 -71.2641 -39.6988 -39.6988 -39.6923 -39.6923 -27.7175 -27.7175 -27.7000 -27.7000 -27.4196 -27.4196 -27.4077 -27.4077 -13.3863 -13.3863 -0.3717 -0.3717 1.3231 1.3231 1.7642 1.7642 3.2321 3.2321 3.5560 3.5560 7.6289 7.6289 7.7208 7.7208 10.1319 10.1319 10.2579 10.2579 10.5991 10.5991 11.1706 11.1706 11.3626 11.3626 11.6514 11.6514 11.7852 11.7852 12.1854 12.1854 13.4865 13.4865 13.9444 13.9444 14.0583 14.0583 14.5475 14.5475 16.6498 16.6498 16.8064 16.8064 18.6010 18.6010 k = 0.0000 0.0000 1.0125 ( 4626 PWs) bands (ev): -71.2661 -71.2661 -71.2644 -71.2644 -39.6982 -39.6982 -39.6930 -39.6930 -27.7174 -27.7174 -27.7036 -27.7036 -27.4168 -27.4168 -27.4072 -27.4072 -13.3849 -13.3849 -0.3735 -0.3735 1.3245 1.3245 1.7678 1.7678 3.2277 3.2277 3.5589 3.5589 7.5921 7.5921 7.7350 7.7350 10.1380 10.1380 10.2531 10.2531 10.6126 10.6126 11.1620 11.1620 11.3538 11.3538 11.6312 11.6312 11.8442 11.8442 12.1834 12.1834 13.5220 13.5220 13.8302 13.8302 14.0661 14.0661 14.4911 14.4911 16.6871 16.6871 16.8094 16.8094 18.7020 18.7020 k = 0.0000 0.0000 1.0336 ( 4626 PWs) bands (ev): -71.2659 -71.2659 -71.2645 -71.2645 -39.6976 -39.6976 -39.6937 -39.6937 -27.7172 -27.7172 -27.7069 -27.7069 -27.4142 -27.4142 -27.4067 -27.4067 -13.3836 -13.3836 -0.3751 -0.3751 1.3259 1.3259 1.7712 1.7712 3.2231 3.2231 3.5616 3.5616 7.5592 7.5592 7.7492 7.7492 10.1416 10.1416 10.2489 10.2489 10.6244 10.6244 11.1517 11.1517 11.3502 11.3502 11.6079 11.6079 11.8925 11.8925 12.2012 12.2012 13.5599 13.5599 13.7157 13.7157 14.0743 14.0743 14.4350 14.4350 16.7197 16.7197 16.8131 16.8131 18.8046 18.8046 k = 0.0000 0.0000 1.0547 ( 4626 PWs) bands (ev): -71.2657 -71.2657 -71.2647 -71.2647 -39.6971 -39.6971 -39.6942 -39.6942 -27.7171 -27.7171 -27.7097 -27.7097 -27.4120 -27.4120 -27.4062 -27.4062 -13.3825 -13.3825 -0.3765 -0.3765 1.3271 1.3271 1.7742 1.7742 3.2185 3.2185 3.5641 3.5641 7.5305 7.5305 7.7627 7.7627 10.1434 10.1434 10.2453 10.2453 10.6345 10.6345 11.1405 11.1405 11.3508 11.3508 11.5845 11.5845 11.9223 11.9223 12.2433 12.2433 13.5881 13.5881 13.6146 13.6146 14.0815 14.0815 14.3798 14.3798 16.7468 16.7468 16.8180 16.8180 18.9064 18.9064 k = 0.0000 0.0000 1.0758 ( 4628 PWs) bands (ev): -71.2656 -71.2656 -71.2649 -71.2649 -39.6967 -39.6967 -39.6947 -39.6947 -27.7170 -27.7170 -27.7121 -27.7121 -27.4101 -27.4101 -27.4058 -27.4058 -13.3816 -13.3816 -0.3776 -0.3776 1.3283 1.3283 1.7768 1.7768 3.2142 3.2142 3.5662 3.5662 7.5060 7.5060 7.7750 7.7750 10.1438 10.1438 10.2423 10.2423 10.6428 10.6428 11.1297 11.1297 11.3545 11.3545 11.5620 11.5620 11.9354 11.9354 12.3062 12.3062 13.4887 13.4887 13.6449 13.6449 14.0873 14.0873 14.3262 14.3262 16.7672 16.7672 16.8254 16.8254 19.0045 19.0045 k = 0.0000 0.0000 1.0969 ( 4628 PWs) bands (ev): -71.2654 -71.2654 -71.2650 -71.2650 -39.6963 -39.6963 -39.6951 -39.6951 -27.7170 -27.7170 -27.7140 -27.7140 -27.4085 -27.4085 -27.4055 -27.4055 -13.3809 -13.3809 -0.3785 -0.3785 1.3293 1.3293 1.7791 1.7791 3.2103 3.2103 3.5681 3.5681 7.4859 7.4859 7.7857 7.7857 10.1435 10.1435 10.2398 10.2398 10.6496 10.6496 11.1200 11.1200 11.3605 11.3605 11.5411 11.5411 11.9386 11.9386 12.3812 12.3812 13.3825 13.3825 13.6865 13.6865 14.0911 14.0911 14.2757 14.2757 16.7804 16.7804 16.8353 16.8353 19.0954 19.0954 k = 0.0000 0.0000 1.1180 ( 4628 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6961 -39.6961 -39.6954 -39.6954 -27.7170 -27.7170 -27.7155 -27.7155 -27.4073 -27.4073 -27.4053 -27.4053 -13.3803 -13.3803 -0.3792 -0.3792 1.3301 1.3301 1.7809 1.7809 3.2071 3.2071 3.5695 3.5695 7.4703 7.4703 7.7944 7.7944 10.1427 10.1427 10.2378 10.2378 10.6548 10.6548 11.1119 11.1119 11.3677 11.3677 11.5225 11.5225 11.9375 11.9375 12.4599 12.4599 13.2827 13.2827 13.7268 13.7268 14.0923 14.0923 14.2307 14.2307 16.7877 16.7877 16.8462 16.8462 19.1736 19.1736 k = 0.0000 0.0000 1.1391 ( 4624 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6959 -39.6959 -39.6956 -39.6956 -27.7170 -27.7170 -27.7165 -27.7165 -27.4064 -27.4064 -27.4051 -27.4051 -13.3798 -13.3798 -0.3798 -0.3798 1.3307 1.3307 1.7822 1.7822 3.2047 3.2047 3.5706 3.5706 7.4590 7.4590 7.8009 7.8009 10.1420 10.1420 10.2364 10.2364 10.6584 10.6584 11.1060 11.1060 11.3749 11.3749 11.5072 11.5072 11.9353 11.9353 12.5339 12.5339 13.1952 13.1952 13.7622 13.7622 14.0900 14.0900 14.1953 14.1953 16.7915 16.7915 16.8555 16.8555 19.2313 19.2313 k = 0.0000 0.0000 1.1602 ( 4624 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7174 -27.7174 -27.7168 -27.7168 -27.4058 -27.4058 -27.4050 -27.4050 -13.3796 -13.3796 -0.3801 -0.3801 1.3311 1.3311 1.7829 1.7829 3.2032 3.2032 3.5712 3.5712 7.4523 7.4523 7.8048 7.8048 10.1414 10.1414 10.2356 10.2356 10.6606 10.6606 11.1023 11.1023 11.3804 11.3804 11.4968 11.4968 11.9335 11.9335 12.5910 12.5910 13.1305 13.1305 13.7878 13.7878 14.0849 14.0849 14.1735 14.1735 16.7934 16.7934 16.8616 16.8616 19.2592 19.2592 k = 0.0000 0.0000 1.1813 ( 4632 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2027 3.2027 3.5714 3.5714 7.4500 7.4500 7.8061 7.8061 10.1412 10.1412 10.2353 10.2353 10.6613 10.6613 11.1010 11.1010 11.3826 11.3826 11.4931 11.4931 11.9328 11.9328 12.6136 12.6136 13.1054 13.1054 13.7974 13.7974 14.0817 14.0817 14.1665 14.1665 16.7939 16.7939 16.8638 16.8638 19.2653 19.2653 k = 0.0000 0.0000 1.1813 ( 4632 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2027 3.2027 3.5714 3.5714 7.4500 7.4500 7.8061 7.8061 10.1412 10.1412 10.2353 10.2353 10.6613 10.6613 11.1010 11.1010 11.3826 11.3826 11.4931 11.4931 11.9328 11.9328 12.6136 12.6136 13.1054 13.1054 13.7974 13.7974 14.0817 14.0817 14.1665 14.1665 16.7939 16.7939 16.8638 16.8638 19.2653 19.2653 k =-0.0078 0.0167 1.1813 ( 4622 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7166 -27.7166 -27.4057 -27.4057 -27.4051 -27.4051 -13.3796 -13.3796 -0.3801 -0.3801 1.3312 1.3312 1.7830 1.7830 3.2036 3.2036 3.5701 3.5701 7.4516 7.4516 7.8079 7.8079 10.1402 10.1402 10.2350 10.2350 10.6609 10.6609 11.1000 11.1000 11.3815 11.3815 11.4939 11.4939 11.9325 11.9325 12.6146 12.6146 13.1057 13.1057 13.7983 13.7983 14.0815 14.0815 14.1677 14.1677 16.7927 16.7927 16.8643 16.8643 19.2666 19.2666 k =-0.0156 0.0334 1.1813 ( 4622 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6959 -39.6959 -39.6956 -39.6956 -27.7177 -27.7177 -27.7161 -27.7161 -27.4058 -27.4058 -27.4054 -27.4054 -13.3797 -13.3797 -0.3798 -0.3798 1.3312 1.3312 1.7823 1.7823 3.2061 3.2061 3.5661 3.5661 7.4564 7.4564 7.8131 7.8131 10.1370 10.1370 10.2339 10.2339 10.6598 10.6598 11.0969 11.0969 11.3782 11.3782 11.4964 11.4964 11.9316 11.9316 12.6178 12.6178 13.1066 13.1066 13.8008 13.8008 14.0806 14.0806 14.1713 14.1713 16.7892 16.7892 16.8660 16.8660 19.2704 19.2704 k =-0.0234 0.0501 1.1813 ( 4630 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6961 -39.6961 -39.6954 -39.6954 -27.7177 -27.7177 -27.7153 -27.7153 -27.4063 -27.4063 -27.4058 -27.4058 -13.3801 -13.3801 -0.3793 -0.3793 1.3313 1.3313 1.7811 1.7811 3.2102 3.2102 3.5596 3.5596 7.4643 7.4643 7.8218 7.8218 10.1317 10.1317 10.2321 10.2321 10.6580 10.6580 11.0914 11.0914 11.3731 11.3731 11.5005 11.5005 11.9300 11.9300 12.6232 12.6232 13.1079 13.1079 13.8050 13.8050 14.0793 14.0793 14.1774 14.1774 16.7838 16.7838 16.8684 16.8684 19.2765 19.2765 k =-0.0312 0.0667 1.1813 ( 4634 PWs) bands (ev): -71.2654 -71.2654 -71.2651 -71.2651 -39.6963 -39.6963 -39.6952 -39.6952 -27.7177 -27.7177 -27.7141 -27.7141 -27.4072 -27.4072 -27.4060 -27.4060 -13.3805 -13.3805 -0.3786 -0.3786 1.3314 1.3314 1.7795 1.7795 3.2158 3.2158 3.5506 3.5506 7.4753 7.4753 7.8340 7.8340 10.1242 10.1242 10.2294 10.2294 10.6561 10.6561 11.0833 11.0833 11.3665 11.3665 11.5059 11.5059 11.9273 11.9273 12.6309 12.6309 13.1099 13.1099 13.8111 13.8111 14.0775 14.0775 14.1858 14.1858 16.7768 16.7768 16.8714 16.8714 19.2843 19.2843 k =-0.0390 0.0834 1.1813 ( 4634 PWs) bands (ev): -71.2655 -71.2655 -71.2650 -71.2650 -39.6965 -39.6965 -39.6949 -39.6949 -27.7178 -27.7178 -27.7126 -27.7126 -27.4084 -27.4084 -27.4063 -27.4063 -13.3811 -13.3811 -0.3778 -0.3778 1.3316 1.3316 1.7774 1.7774 3.2230 3.2230 3.5391 3.5391 7.4892 7.4892 7.8496 7.8496 10.1144 10.1144 10.2258 10.2258 10.6542 10.6542 11.0725 11.0725 11.3590 11.3590 11.5128 11.5128 11.9234 11.9234 12.6408 12.6408 13.1124 13.1124 13.8189 13.8189 14.0753 14.0753 14.1966 14.1966 16.7685 16.7685 16.8747 16.8747 19.2930 19.2930 k =-0.0468 0.1001 1.1813 ( 4628 PWs) bands (ev): -71.2656 -71.2656 -71.2648 -71.2648 -39.6968 -39.6968 -39.6945 -39.6945 -27.7178 -27.7178 -27.7108 -27.7108 -27.4099 -27.4099 -27.4066 -27.4066 -13.3818 -13.3818 -0.3767 -0.3767 1.3318 1.3318 1.7749 1.7749 3.2316 3.2316 3.5254 3.5254 7.5059 7.5059 7.8686 7.8686 10.1024 10.1024 10.2211 10.2211 10.6528 10.6528 11.0586 11.0586 11.3509 11.3509 11.5208 11.5208 11.9180 11.9180 12.6531 12.6531 13.1157 13.1157 13.8286 13.8286 14.0729 14.0729 14.2097 14.2097 16.7593 16.7593 16.8781 16.8781 19.3007 19.3007 k =-0.0546 0.1168 1.1813 ( 4624 PWs) bands (ev): -71.2657 -71.2657 -71.2647 -71.2647 -39.6972 -39.6972 -39.6941 -39.6941 -27.7179 -27.7179 -27.7086 -27.7086 -27.4116 -27.4116 -27.4069 -27.4069 -13.3826 -13.3826 -0.3755 -0.3755 1.3322 1.3322 1.7719 1.7719 3.2415 3.2415 3.5097 3.5097 7.5252 7.5252 7.8909 7.8909 10.0880 10.0880 10.2153 10.2153 10.6521 10.6521 11.0418 11.0418 11.3425 11.3425 11.5301 11.5301 11.9108 11.9108 12.6678 12.6678 13.1196 13.1196 13.8402 13.8402 14.0703 14.0703 14.2253 14.2253 16.7492 16.7492 16.8815 16.8815 19.3039 19.3039 k =-0.0546 0.1168 1.1813 ( 4624 PWs) bands (ev): -71.2657 -71.2657 -71.2647 -71.2647 -39.6972 -39.6972 -39.6941 -39.6941 -27.7179 -27.7179 -27.7086 -27.7086 -27.4116 -27.4116 -27.4069 -27.4069 -13.3826 -13.3826 -0.3755 -0.3755 1.3322 1.3322 1.7719 1.7719 3.2415 3.2415 3.5097 3.5097 7.5252 7.5252 7.8909 7.8909 10.0880 10.0880 10.2153 10.2153 10.6521 10.6521 11.0418 11.0418 11.3425 11.3425 11.5301 11.5301 11.9108 11.9108 12.6678 12.6678 13.1196 13.1196 13.8402 13.8402 14.0703 14.0703 14.2253 14.2253 16.7492 16.7492 16.8815 16.8815 19.3039 19.3039 k =-0.0609 0.1304 1.1662 ( 4618 PWs) bands (ev): -71.2658 -71.2658 -71.2646 -71.2646 -39.6975 -39.6975 -39.6938 -39.6938 -27.7178 -27.7178 -27.7066 -27.7066 -27.4131 -27.4131 -27.4073 -27.4073 -13.3834 -13.3834 -0.3743 -0.3743 1.3325 1.3325 1.7691 1.7691 3.2508 3.2508 3.4953 3.4953 7.5439 7.5439 7.9109 7.9109 10.0747 10.0747 10.2100 10.2100 10.6518 10.6518 11.0263 11.0263 11.3346 11.3346 11.5395 11.5395 11.9035 11.9035 12.6729 12.6729 13.1334 13.1334 13.8456 13.8456 14.0723 14.0723 14.2416 14.2416 16.7404 16.7404 16.8833 16.8833 19.2886 19.2886 k =-0.0673 0.1440 1.1512 ( 4616 PWs) bands (ev): -71.2659 -71.2659 -71.2645 -71.2645 -39.6978 -39.6978 -39.6934 -39.6934 -27.7176 -27.7176 -27.7044 -27.7044 -27.4149 -27.4149 -27.4080 -27.4080 -13.3844 -13.3844 -0.3730 -0.3730 1.3327 1.3327 1.7659 1.7659 3.2611 3.2611 3.4796 3.4796 7.5663 7.5663 7.9316 7.9316 10.0604 10.0604 10.2044 10.2044 10.6517 10.6517 11.0098 11.0098 11.3252 11.3252 11.5515 11.5515 11.8947 11.8947 12.6663 12.6663 13.1633 13.1633 13.8419 13.8419 14.0827 14.0827 14.2628 14.2628 16.7311 16.7311 16.8834 16.8834 19.2361 19.2361 k =-0.0737 0.1577 1.1362 ( 4618 PWs) bands (ev): -71.2660 -71.2660 -71.2644 -71.2644 -39.6982 -39.6982 -39.6930 -39.6930 -27.7171 -27.7171 -27.7021 -27.7021 -27.4169 -27.4169 -27.4088 -27.4088 -13.3855 -13.3855 -0.3715 -0.3715 1.3327 1.3327 1.7627 1.7627 3.2725 3.2725 3.4628 3.4628 7.5922 7.5922 7.9530 7.9530 10.0452 10.0452 10.1986 10.1986 10.6515 10.6515 10.9924 10.9924 11.3143 11.3143 11.5651 11.5651 11.8841 11.8841 12.6549 12.6549 13.2021 13.2021 13.8318 13.8318 14.0997 14.0997 14.2886 14.2886 16.7213 16.7213 16.8819 16.8819 19.1508 19.1508 k =-0.0800 0.1713 1.1211 ( 4622 PWs) bands (ev): -71.2662 -71.2662 -71.2642 -71.2642 -39.6985 -39.6985 -39.6926 -39.6926 -27.7164 -27.7164 -27.6995 -27.6995 -27.4191 -27.4191 -27.4099 -27.4099 -13.3867 -13.3867 -0.3700 -0.3700 1.3325 1.3325 1.7594 1.7594 3.2847 3.2847 3.4449 3.4449 7.6216 7.6216 7.9750 7.9750 10.0293 10.0293 10.1926 10.1926 10.6510 10.6510 10.9740 10.9740 11.3025 11.3025 11.5792 11.5792 11.8722 11.8722 12.6441 12.6441 13.2439 13.2439 13.8180 13.8180 14.1210 14.1210 14.3187 14.3187 16.7113 16.7113 16.8792 16.8792 19.0446 19.0446 k =-0.0864 0.1849 1.1061 ( 4618 PWs) bands (ev): -71.2663 -71.2663 -71.2641 -71.2641 -39.6988 -39.6988 -39.6923 -39.6923 -27.7156 -27.7156 -27.6967 -27.6967 -27.4214 -27.4214 -27.4111 -27.4111 -13.3881 -13.3881 -0.3684 -0.3684 1.3321 1.3321 1.7564 1.7564 3.2976 3.2976 3.4263 3.4263 7.6542 7.6542 7.9975 7.9975 10.0129 10.0129 10.1867 10.1867 10.6498 10.6498 10.9547 10.9547 11.2900 11.2900 11.5926 11.5926 11.8601 11.8601 12.6372 12.6372 13.2844 13.2844 13.8029 13.8029 14.1454 14.1454 14.3526 14.3526 16.7014 16.7014 16.8754 16.8754 18.9266 18.9266 k =-0.0927 0.1985 1.0911 ( 4612 PWs) bands (ev): -71.2664 -71.2664 -71.2640 -71.2640 -39.6990 -39.6990 -39.6919 -39.6919 -27.7145 -27.7145 -27.6937 -27.6937 -27.4239 -27.4239 -27.4126 -27.4126 -13.3896 -13.3896 -0.3668 -0.3668 1.3315 1.3315 1.7537 1.7537 3.3108 3.3108 3.4073 3.4073 7.6899 7.6899 8.0206 8.0206 9.9963 9.9963 10.1807 10.1807 10.6473 10.6473 10.9348 10.9348 11.2773 11.2773 11.6034 11.6034 11.8494 11.8494 12.6358 12.6358 13.3206 13.3206 13.7878 13.7878 14.1721 14.1721 14.3898 14.3898 16.6915 16.6915 16.8711 16.8711 18.8021 18.8021 k =-0.0991 0.2121 1.0760 ( 4612 PWs) bands (ev): -71.2665 -71.2665 -71.2639 -71.2639 -39.6993 -39.6993 -39.6915 -39.6915 -27.7132 -27.7132 -27.6905 -27.6905 -27.4266 -27.4266 -27.4143 -27.4143 -13.3912 -13.3912 -0.3653 -0.3653 1.3304 1.3304 1.7515 1.7515 3.3236 3.3236 3.3884 3.3884 7.7284 7.7284 8.0442 8.0442 9.9797 9.9797 10.1747 10.1747 10.6428 10.6428 10.9143 10.9143 11.2648 11.2648 11.6097 11.6097 11.8428 11.8428 12.6404 12.6404 13.3508 13.3508 13.7733 13.7733 14.2011 14.2011 14.4298 14.4298 16.6818 16.6818 16.8664 16.8664 18.6750 18.6750 k =-0.1055 0.2258 1.0610 ( 4613 PWs) bands (ev): -71.2666 -71.2666 -71.2638 -71.2638 -39.6996 -39.6996 -39.6912 -39.6912 -27.7118 -27.7118 -27.6872 -27.6872 -27.4295 -27.4295 -27.4162 -27.4162 -13.3930 -13.3930 -0.3639 -0.3639 1.3290 1.3290 1.7501 1.7501 3.3338 3.3338 3.3720 3.3720 7.7697 7.7697 8.0683 8.0683 9.9632 9.9632 10.1686 10.1686 10.6355 10.6355 10.8934 10.8934 11.2533 11.2533 11.6096 11.6096 11.8426 11.8426 12.6509 12.6509 13.3738 13.3738 13.7597 13.7597 14.2322 14.2322 14.4723 14.4723 16.6722 16.6722 16.8618 16.8618 18.5483 18.5483 k =-0.1118 0.2394 1.0460 ( 4621 PWs) bands (ev): -71.2667 -71.2667 -71.2637 -71.2637 -39.6999 -39.6999 -39.6908 -39.6908 -27.7102 -27.7102 -27.6837 -27.6837 -27.4325 -27.4325 -27.4183 -27.4183 -13.3948 -13.3948 -0.3626 -0.3626 1.3271 1.3271 1.7496 1.7496 3.3320 3.3320 3.3676 3.3676 7.8134 7.8134 8.0929 8.0929 9.9470 9.9470 10.1625 10.1625 10.6245 10.6245 10.8721 10.8721 11.2436 11.2436 11.6024 11.6024 11.8501 11.8501 12.6666 12.6666 13.3893 13.3893 13.7468 13.7468 14.2649 14.2649 14.5169 14.5169 16.6626 16.6626 16.8574 16.8574 18.4242 18.4242 k =-0.1182 0.2530 1.0309 ( 4619 PWs) bands (ev): -71.2668 -71.2668 -71.2636 -71.2636 -39.7001 -39.7001 -39.6905 -39.6905 -27.7084 -27.7084 -27.6800 -27.6800 -27.4356 -27.4356 -27.4205 -27.4205 -13.3967 -13.3967 -0.3614 -0.3614 1.3248 1.3248 1.7501 1.7501 3.3161 3.3161 3.3771 3.3771 7.8595 7.8595 8.1179 8.1179 9.9312 9.9312 10.1563 10.1563 10.6094 10.6094 10.8503 10.8503 11.2364 11.2364 11.5894 11.5894 11.8652 11.8652 12.6868 12.6868 13.3974 13.3974 13.7345 13.7345 14.2986 14.2986 14.5635 14.5635 16.6526 16.6526 16.8537 16.8537 18.3048 18.3048 k =-0.1246 0.2666 1.0159 ( 4615 PWs) bands (ev): -71.2669 -71.2669 -71.2635 -71.2635 -39.7003 -39.7003 -39.6901 -39.6901 -27.7064 -27.7064 -27.6762 -27.6762 -27.4389 -27.4389 -27.4230 -27.4230 -13.3987 -13.3987 -0.3604 -0.3604 1.3219 1.3219 1.7517 1.7517 3.2964 3.2964 3.3903 3.3903 7.9077 7.9077 8.1435 8.1435 9.9160 9.9160 10.1499 10.1499 10.5899 10.5899 10.8276 10.8276 11.2327 11.2327 11.5724 11.5724 11.8863 11.8863 12.7106 12.7106 13.3987 13.3987 13.7224 13.7224 14.3326 14.3326 14.6121 14.6121 16.6417 16.6417 16.8508 16.8508 18.1916 18.1916 k =-0.1309 0.2802 1.0009 ( 4616 PWs) bands (ev): -71.2670 -71.2670 -71.2634 -71.2634 -39.7006 -39.7006 -39.6898 -39.6898 -27.7043 -27.7043 -27.6722 -27.6722 -27.4423 -27.4423 -27.4257 -27.4257 -13.4007 -13.4007 -0.3597 -0.3597 1.3184 1.3184 1.7545 1.7545 3.2758 3.2758 3.4042 3.4042 7.9579 7.9579 8.1697 8.1697 9.9013 9.9013 10.1431 10.1431 10.5662 10.5662 10.8034 10.8034 11.2332 11.2332 11.5535 11.5535 11.9119 11.9119 12.7372 12.7372 13.3938 13.3938 13.7100 13.7100 14.3658 14.3658 14.6629 14.6629 16.6292 16.6292 16.8491 16.8491 18.0862 18.0862 k =-0.1373 0.2939 0.9858 ( 4616 PWs) bands (ev): -71.2671 -71.2671 -71.2633 -71.2633 -39.7008 -39.7008 -39.6894 -39.6894 -27.7020 -27.7020 -27.6681 -27.6681 -27.4458 -27.4458 -27.4285 -27.4285 -13.4028 -13.4028 -0.3592 -0.3592 1.3144 1.3144 1.7586 1.7586 3.2551 3.2551 3.4182 3.4182 8.0099 8.0099 8.1963 8.1963 9.8872 9.8872 10.1358 10.1358 10.5387 10.5387 10.7771 10.7771 11.2383 11.2383 11.5341 11.5341 11.9409 11.9409 12.7657 12.7657 13.3836 13.3836 13.6971 13.6971 14.3972 14.3972 14.7160 14.7160 16.6139 16.6139 16.8489 16.8489 17.9897 17.9897 k =-0.1437 0.3075 0.9708 ( 4616 PWs) bands (ev): -71.2672 -71.2672 -71.2633 -71.2633 -39.7010 -39.7010 -39.6891 -39.6891 -27.6995 -27.6995 -27.6639 -27.6639 -27.4494 -27.4494 -27.4315 -27.4315 -13.4049 -13.4049 -0.3589 -0.3589 1.3099 1.3099 1.7640 1.7640 3.2346 3.2346 3.4320 3.4320 8.0634 8.0634 8.2236 8.2236 9.8736 9.8736 10.1279 10.1279 10.5080 10.5080 10.7484 10.7484 11.2483 11.2483 11.5155 11.5155 11.9722 11.9722 12.7953 12.7953 13.3688 13.3688 13.6836 13.6836 14.4262 14.4262 14.7717 14.7717 16.5947 16.5947 16.8506 16.8506 17.9027 17.9027 k =-0.1500 0.3211 0.9558 ( 4613 PWs) bands (ev): -71.2673 -71.2673 -71.2632 -71.2632 -39.7012 -39.7012 -39.6888 -39.6888 -27.6970 -27.6970 -27.6595 -27.6595 -27.4531 -27.4531 -27.4347 -27.4347 -13.4070 -13.4070 -0.3588 -0.3588 1.3048 1.3048 1.7706 1.7706 3.2143 3.2143 3.4454 3.4454 8.1181 8.1181 8.2514 8.2514 9.8607 9.8607 10.1190 10.1190 10.4750 10.4750 10.7171 10.7171 11.2629 11.2629 11.4984 11.4984 12.0053 12.0053 12.8252 12.8252 13.3500 13.3500 13.6696 13.6696 14.4520 14.4520 14.8298 14.8298 16.5702 16.5702 16.8546 16.8546 17.8253 17.8253 k =-0.1564 0.3347 0.9407 ( 4613 PWs) bands (ev): -71.2674 -71.2674 -71.2631 -71.2631 -39.7014 -39.7014 -39.6885 -39.6885 -27.6943 -27.6943 -27.6550 -27.6550 -27.4569 -27.4569 -27.4380 -27.4380 -13.4091 -13.4091 -0.3590 -0.3590 1.2993 1.2993 1.7784 1.7784 3.1946 3.1946 3.4583 3.4583 8.1738 8.1738 8.2800 8.2800 9.8483 9.8483 10.1090 10.1090 10.4403 10.4403 10.6834 10.6834 11.2819 11.2819 11.4833 11.4833 12.0397 12.0397 12.8545 12.8545 13.3277 13.3277 13.6553 13.6553 14.4745 14.4745 14.8906 14.8906 16.5395 16.5395 16.8612 16.8612 17.7566 17.7566 k =-0.1627 0.3483 0.9257 ( 4613 PWs) bands (ev): -71.2674 -71.2674 -71.2630 -71.2630 -39.7016 -39.7016 -39.6882 -39.6882 -27.6915 -27.6915 -27.6504 -27.6504 -27.4607 -27.4607 -27.4414 -27.4414 -13.4113 -13.4113 -0.3595 -0.3595 1.2934 1.2934 1.7873 1.7873 3.1754 3.1754 3.4706 3.4706 8.2300 8.2300 8.3097 8.3097 9.8365 9.8365 10.0975 10.0975 10.4046 10.4046 10.6476 10.6476 11.3047 11.3047 11.4708 11.4708 12.0746 12.0746 12.8823 12.8823 13.3024 13.3024 13.6412 13.6412 14.4937 14.4937 14.9539 14.9539 16.5021 16.5021 16.8707 16.8707 17.6947 17.6947 k =-0.1691 0.3620 0.9107 ( 4615 PWs) bands (ev): -71.2675 -71.2675 -71.2629 -71.2629 -39.7017 -39.7017 -39.6879 -39.6879 -27.6886 -27.6886 -27.6458 -27.6458 -27.4646 -27.4646 -27.4451 -27.4451 -13.4134 -13.4134 -0.3602 -0.3602 1.2872 1.2872 1.7971 1.7971 3.1569 3.1569 3.4823 3.4823 8.2853 8.2853 8.3414 8.3414 9.8251 9.8251 10.0843 10.0843 10.3687 10.3687 10.6102 10.6102 11.3301 11.3301 11.4616 11.4616 12.1098 12.1098 12.9078 12.9078 13.2745 13.2745 13.6277 13.6277 14.5098 14.5098 15.0197 15.0197 16.4579 16.4579 16.8827 16.8827 17.6369 17.6369 k =-0.1755 0.3756 0.8956 ( 4615 PWs) bands (ev): -71.2676 -71.2676 -71.2629 -71.2629 -39.7019 -39.7019 -39.6876 -39.6876 -27.6857 -27.6857 -27.6410 -27.6410 -27.4685 -27.4685 -27.4488 -27.4488 -13.4154 -13.4154 -0.3610 -0.3610 1.2808 1.2808 1.8077 1.8077 3.1391 3.1391 3.4933 3.4933 8.3364 8.3364 8.3783 8.3783 9.8142 9.8142 10.0688 10.0688 10.3331 10.3331 10.5718 10.5718 11.3564 11.3564 11.4574 11.4574 12.1447 12.1447 12.9302 12.9302 13.2443 13.2443 13.6155 13.6155 14.5234 14.5234 15.0877 15.0877 16.4074 16.4074 16.8972 16.8972 17.5804 17.5804 k =-0.1818 0.3892 0.8806 ( 4617 PWs) bands (ev): -71.2677 -71.2677 -71.2628 -71.2628 -39.7021 -39.7021 -39.6874 -39.6874 -27.6827 -27.6827 -27.6362 -27.6362 -27.4724 -27.4724 -27.4526 -27.4526 -13.4174 -13.4174 -0.3621 -0.3621 1.2743 1.2743 1.8189 1.8189 3.1222 3.1222 3.5037 3.5037 8.3779 8.3779 8.4256 8.4256 9.8037 9.8037 10.0509 10.0509 10.2984 10.2984 10.5328 10.5328 11.3795 11.3795 11.4615 11.4615 12.1789 12.1789 12.9488 12.9488 13.2120 13.2120 13.6053 13.6053 14.5352 14.5352 15.1579 15.1579 16.3514 16.3514 16.9135 16.9135 17.5228 17.5228 k =-0.1882 0.4028 0.8656 ( 4609 PWs) bands (ev): -71.2677 -71.2677 -71.2628 -71.2628 -39.7022 -39.7022 -39.6871 -39.6871 -27.6797 -27.6797 -27.6314 -27.6314 -27.4762 -27.4762 -27.4565 -27.4565 -13.4194 -13.4194 -0.3633 -0.3633 1.2677 1.2677 1.8306 1.8306 3.1061 3.1061 3.5133 3.5133 8.4118 8.4118 8.4808 8.4808 9.7936 9.7936 10.0303 10.0303 10.2649 10.2649 10.4940 10.4940 11.3943 11.3943 11.4790 11.4790 12.2117 12.2117 12.9629 12.9629 13.1781 13.1781 13.5976 13.5976 14.5459 14.5459 15.2301 15.2301 16.2909 16.2909 16.9309 16.9309 17.4629 17.4629 k =-0.1946 0.4164 0.8505 ( 4603 PWs) bands (ev): -71.2678 -71.2678 -71.2627 -71.2627 -39.7023 -39.7023 -39.6869 -39.6869 -27.6766 -27.6766 -27.6265 -27.6265 -27.4801 -27.4801 -27.4605 -27.4605 -13.4212 -13.4212 -0.3646 -0.3646 1.2612 1.2612 1.8425 1.8425 3.0910 3.0910 3.5222 3.5222 8.4427 8.4427 8.5389 8.5389 9.7840 9.7840 10.0069 10.0069 10.2328 10.2328 10.4558 10.4558 11.4009 11.4009 11.5091 11.5091 12.2428 12.2428 12.9722 12.9722 13.1426 13.1426 13.5929 13.5929 14.5565 14.5565 15.3040 15.3040 16.2266 16.2266 16.9487 16.9487 17.4009 17.4009 k =-0.2009 0.4301 0.8355 ( 4595 PWs) bands (ev): -71.2678 -71.2678 -71.2626 -71.2626 -39.7024 -39.7024 -39.6867 -39.6867 -27.6735 -27.6735 -27.6217 -27.6217 -27.4838 -27.4838 -27.4646 -27.4646 -13.4230 -13.4230 -0.3661 -0.3661 1.2548 1.2548 1.8545 1.8545 3.0769 3.0769 3.5304 3.5304 8.4722 8.4722 8.5980 8.5980 9.7748 9.7748 9.9809 9.9809 10.2021 10.2021 10.4190 10.4190 11.4038 11.4038 11.5469 11.5469 12.2716 12.2716 12.9766 12.9766 13.1057 13.1057 13.5915 13.5915 14.5678 14.5678 15.3793 15.3793 16.1594 16.1594 16.9659 16.9659 17.3381 17.3381 k =-0.2073 0.4437 0.8205 ( 4593 PWs) bands (ev): -71.2679 -71.2679 -71.2626 -71.2626 -39.7025 -39.7025 -39.6864 -39.6864 -27.6705 -27.6705 -27.6169 -27.6169 -27.4875 -27.4875 -27.4687 -27.4687 -13.4247 -13.4247 -0.3675 -0.3675 1.2486 1.2486 1.8664 1.8664 3.0638 3.0638 3.5378 3.5378 8.5008 8.5008 8.6571 8.6571 9.7660 9.7660 9.9527 9.9527 10.1722 10.1722 10.3842 10.3842 11.4059 11.4059 11.5889 11.5889 12.2977 12.2977 12.9764 12.9764 13.0678 13.0678 13.5933 13.5933 14.5808 14.5808 15.4556 15.4556 16.0898 16.0898 16.9813 16.9813 17.2761 17.2761 k =-0.2137 0.4573 0.8054 ( 4588 PWs) bands (ev): -71.2679 -71.2679 -71.2625 -71.2625 -39.7026 -39.7026 -39.6863 -39.6863 -27.6676 -27.6676 -27.6121 -27.6121 -27.4910 -27.4910 -27.4728 -27.4728 -13.4263 -13.4263 -0.3690 -0.3690 1.2427 1.2427 1.8780 1.8780 3.0518 3.0518 3.5445 3.5445 8.5284 8.5284 8.7157 8.7157 9.7575 9.7575 9.9232 9.9232 10.1429 10.1429 10.3520 10.3520 11.4084 11.4084 11.6335 11.6335 12.3208 12.3208 12.9717 12.9717 13.0296 13.0296 13.5980 13.5980 14.5961 14.5961 15.5326 15.5326 16.0184 16.0184 16.9937 16.9937 17.2170 17.2170 k =-0.2200 0.4709 0.7904 ( 4588 PWs) bands (ev): -71.2680 -71.2680 -71.2625 -71.2625 -39.7027 -39.7027 -39.6861 -39.6861 -27.6647 -27.6647 -27.6075 -27.6075 -27.4944 -27.4944 -27.4768 -27.4768 -13.4277 -13.4277 -0.3705 -0.3705 1.2372 1.2372 1.8891 1.8891 3.0408 3.0408 3.5506 3.5506 8.5548 8.5548 8.7733 8.7733 9.7490 9.7490 9.8933 9.8933 10.1136 10.1136 10.3229 10.3229 11.4114 11.4114 11.6796 11.6796 12.3405 12.3405 12.9611 12.9611 12.9935 12.9935 13.6050 13.6050 14.6144 14.6144 15.6094 15.6094 15.9459 15.9459 17.0013 17.0013 17.1628 17.1628 k =-0.2264 0.4845 0.7754 ( 4592 PWs) bands (ev): -71.2680 -71.2680 -71.2624 -71.2624 -39.7028 -39.7028 -39.6859 -39.6859 -27.6620 -27.6620 -27.6030 -27.6030 -27.4976 -27.4976 -27.4808 -27.4808 -13.4290 -13.4290 -0.3719 -0.3719 1.2321 1.2321 1.8995 1.8995 3.0310 3.0310 3.5559 3.5559 8.5798 8.5798 8.8296 8.8296 9.7398 9.7398 9.8645 9.8645 10.0841 10.0841 10.2972 10.2972 11.4151 11.4151 11.7263 11.7263 12.3569 12.3569 12.9359 12.9359 12.9696 12.9696 13.6137 13.6137 14.6360 14.6360 15.6849 15.6849 15.8735 15.8735 17.0016 17.0016 17.1162 17.1162 k =-0.2327 0.4982 0.7603 ( 4594 PWs) bands (ev): -71.2681 -71.2681 -71.2624 -71.2624 -39.7029 -39.7029 -39.6858 -39.6858 -27.6595 -27.6595 -27.5987 -27.5987 -27.5006 -27.5006 -27.4846 -27.4846 -13.4302 -13.4302 -0.3732 -0.3732 1.2274 1.2274 1.9091 1.9091 3.0223 3.0223 3.5605 3.5605 8.6030 8.6030 8.8838 8.8838 9.7290 9.7290 9.8387 9.8387 10.0544 10.0544 10.2752 10.2752 11.4192 11.4192 11.7729 11.7729 12.3699 12.3699 12.8984 12.8984 12.9570 12.9570 13.6234 13.6234 14.6612 14.6612 15.7518 15.7518 15.8085 15.8085 16.9918 16.9918 17.0801 17.0801 k =-0.2391 0.5118 0.7453 ( 4592 PWs) bands (ev): -71.2681 -71.2681 -71.2624 -71.2624 -39.7029 -39.7029 -39.6857 -39.6857 -27.6572 -27.6572 -27.5946 -27.5946 -27.5033 -27.5033 -27.4883 -27.4883 -13.4313 -13.4313 -0.3745 -0.3745 1.2233 1.2233 1.9177 1.9177 3.0148 3.0148 3.5645 3.5645 8.6242 8.6242 8.9353 8.9353 9.7149 9.7149 9.8183 9.8183 10.0249 10.0249 10.2566 10.2566 11.4236 11.4236 11.8183 11.8183 12.3798 12.3798 12.8588 12.8588 12.9471 12.9471 13.6333 13.6333 14.6895 14.6895 15.7213 15.7213 15.8394 15.8394 16.9715 16.9715 17.0550 17.0550 k =-0.2455 0.5254 0.7303 ( 4591 PWs) bands (ev): -71.2681 -71.2681 -71.2624 -71.2624 -39.7030 -39.7030 -39.6856 -39.6856 -27.6551 -27.6551 -27.5910 -27.5910 -27.5056 -27.5056 -27.4916 -27.4916 -13.4322 -13.4322 -0.3755 -0.3755 1.2198 1.2198 1.9253 1.9253 3.0084 3.0084 3.5679 3.5679 8.6429 8.6429 8.9833 8.9833 9.6969 9.6969 9.8050 9.8050 9.9962 9.9962 10.2415 10.2415 11.4280 11.4280 11.8614 11.8614 12.3871 12.3871 12.8199 12.8199 12.9386 12.9386 13.6429 13.6429 14.7202 14.7202 15.6547 15.6547 15.9050 15.9050 16.9462 16.9462 17.0360 17.0360 k =-0.2518 0.5390 0.7152 ( 4590 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7030 -39.7030 -39.6855 -39.6855 -27.6534 -27.6534 -27.5877 -27.5877 -27.5076 -27.5076 -27.4946 -27.4946 -13.4329 -13.4329 -0.3765 -0.3765 1.2168 1.2168 1.9316 1.9316 3.0032 3.0032 3.5706 3.5706 8.6588 8.6588 9.0265 9.0265 9.6762 9.6762 9.7985 9.7985 9.9693 9.9693 10.2294 10.2294 11.4321 11.4321 11.9007 11.9007 12.3922 12.3922 12.7838 12.7838 12.9314 12.9314 13.6515 13.6515 14.7520 14.7520 15.5914 15.5914 15.9660 15.9660 16.9219 16.9219 17.0185 17.0185 k =-0.2582 0.5527 0.7002 ( 4594 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6520 -27.6520 -27.5851 -27.5851 -27.5092 -27.5092 -27.4971 -27.4971 -13.4335 -13.4335 -0.3772 -0.3772 1.2145 1.2145 1.9366 1.9366 2.9991 2.9991 3.5727 3.5727 8.6716 8.6716 9.0633 9.0633 9.6554 9.6554 9.7972 9.7972 9.9452 9.9452 10.2203 10.2203 11.4357 11.4357 11.9346 11.9346 12.3956 12.3956 12.7522 12.7522 12.9257 12.9257 13.6587 13.6587 14.7827 14.7827 15.5354 15.5354 16.0185 16.0185 16.9015 16.9015 17.0015 17.0015 k =-0.2646 0.5663 0.6852 ( 4593 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6509 -27.6509 -27.5831 -27.5831 -27.5104 -27.5104 -27.4989 -27.4989 -13.4339 -13.4339 -0.3777 -0.3777 1.2128 1.2128 1.9402 1.9402 2.9962 2.9962 3.5742 3.5742 8.6809 8.6809 9.0920 9.0920 9.6376 9.6376 9.7990 9.7990 9.9255 9.9255 10.2138 10.2138 11.4384 11.4384 11.9609 11.9609 12.3978 12.3978 12.7272 12.7272 12.9215 12.9215 13.6641 13.6641 14.8091 14.8091 15.4905 15.4905 16.0594 16.0594 16.8863 16.8863 16.9867 16.9867 k =-0.2709 0.5799 0.6701 ( 4593 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6502 -27.6502 -27.5819 -27.5819 -27.5111 -27.5111 -27.5001 -27.5001 -13.4342 -13.4342 -0.3781 -0.3781 1.2118 1.2118 1.9424 1.9424 2.9945 2.9945 3.5751 3.5751 8.6866 8.6866 9.1105 9.1105 9.6256 9.6256 9.8017 9.8017 9.9120 9.9120 10.2100 10.2100 11.4401 11.4401 11.9777 11.9777 12.3990 12.3990 12.7112 12.7112 12.9190 12.9190 13.6675 13.6675 14.8273 14.8273 15.4611 15.4611 16.0855 16.0855 16.8769 16.8769 16.9764 16.9764 k =-0.2773 0.5935 0.6551 ( 4595 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6500 -27.6500 -27.5815 -27.5815 -27.5113 -27.5113 -27.5005 -27.5005 -13.4342 -13.4342 -0.3782 -0.3782 1.2114 1.2114 1.9432 1.9432 2.9939 2.9939 3.5754 3.5754 8.6885 8.6885 9.1169 9.1169 9.6213 9.6213 9.8030 9.8030 9.9072 9.9072 10.2088 10.2088 11.4407 11.4407 11.9835 11.9835 12.3994 12.3994 12.7056 12.7056 12.9181 12.9181 13.6686 13.6686 14.8339 14.8339 15.4507 15.4507 16.0945 16.0945 16.8737 16.8737 16.9726 16.9726 k =-0.2773 0.5935 0.6551 ( 4595 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6500 -27.6500 -27.5815 -27.5815 -27.5113 -27.5113 -27.5005 -27.5005 -13.4342 -13.4342 -0.3782 -0.3782 1.2114 1.2114 1.9432 1.9432 2.9939 2.9939 3.5754 3.5754 8.6885 8.6885 9.1169 9.1169 9.6213 9.6213 9.8030 9.8030 9.9072 9.9072 10.2088 10.2088 11.4407 11.4407 11.9835 11.9835 12.3994 12.3994 12.7056 12.7056 12.9181 12.9181 13.6686 13.6686 14.8339 14.8339 15.4507 15.4507 16.0945 16.0945 16.8737 16.8737 16.9726 16.9726 k =-0.2710 0.5800 0.6402 ( 4583 PWs) bands (ev): -71.2675 -71.2675 -71.2630 -71.2630 -39.7011 -39.7011 -39.6874 -39.6874 -27.6422 -27.6422 -27.5894 -27.5894 -27.5101 -27.5101 -27.5017 -27.5017 -13.4336 -13.4336 -0.3823 -0.3823 1.2108 1.2108 1.9536 1.9536 3.0065 3.0065 3.5619 3.5619 8.6516 8.6516 9.1632 9.1632 9.6556 9.6556 9.7717 9.7717 9.9227 9.9227 10.2029 10.2029 11.5137 11.5137 11.9589 11.9589 12.3780 12.3780 12.6448 12.6448 12.8898 12.8898 13.6341 13.6341 14.7910 14.7910 15.4363 15.4363 16.1246 16.1246 16.8899 16.8899 16.9948 16.9948 k =-0.2647 0.5665 0.6253 ( 4587 PWs) bands (ev): -71.2668 -71.2668 -71.2637 -71.2637 -39.6990 -39.6990 -39.6894 -39.6894 -27.6344 -27.6344 -27.5974 -27.5974 -27.5089 -27.5089 -27.5030 -27.5030 -13.4331 -13.4331 -0.3855 -0.3855 1.2103 1.2103 1.9626 1.9626 3.0210 3.0210 3.5453 3.5453 8.6172 8.6172 9.2104 9.2104 9.6880 9.6880 9.7370 9.7370 9.9378 9.9378 10.1949 10.1949 11.5849 11.5849 11.9283 11.9283 12.3671 12.3671 12.5938 12.5938 12.8675 12.8675 13.6022 13.6022 14.7496 14.7496 15.4252 15.4252 16.1571 16.1571 16.8412 16.8412 17.0854 17.0854 k =-0.2584 0.5530 0.6104 ( 4585 PWs) bands (ev): -71.2662 -71.2662 -71.2643 -71.2643 -39.6970 -39.6970 -39.6915 -39.6915 -27.6265 -27.6265 -27.6054 -27.6054 -27.5076 -27.5076 -27.5043 -27.5043 -13.4328 -13.4328 -0.3877 -0.3877 1.2098 1.2098 1.9701 1.9701 3.0372 3.0372 3.5255 3.5255 8.5857 8.5857 9.2578 9.2578 9.7006 9.7006 9.7182 9.7182 9.9507 9.9507 10.1850 10.1850 11.6530 11.6530 11.8911 11.8911 12.3677 12.3677 12.5543 12.5543 12.8513 12.8513 13.5732 13.5732 14.7099 14.7099 15.4173 15.4173 16.1914 16.1914 16.7881 16.7881 17.1836 17.1836 k =-0.2521 0.5396 0.5955 ( 4581 PWs) bands (ev): -71.2655 -71.2655 -71.2650 -71.2650 -39.6949 -39.6949 -39.6936 -39.6936 -27.6186 -27.6186 -27.6133 -27.6133 -27.5064 -27.5064 -27.5055 -27.5055 -13.4327 -13.4327 -0.3889 -0.3889 1.2094 1.2094 1.9760 1.9760 3.0552 3.0552 3.5026 3.5026 8.5574 8.5574 9.3050 9.3050 9.6657 9.6657 9.7413 9.7413 9.9625 9.9625 10.1736 10.1736 11.7149 11.7149 11.8494 11.8494 12.3803 12.3803 12.5275 12.5275 12.8408 12.8408 13.5475 13.5475 14.6719 14.6719 15.4126 15.4126 16.2272 16.2272 16.7358 16.7358 17.2842 17.2842 k =-0.2458 0.5261 0.5806 ( 4583 PWs) bands (ev): -71.2657 -71.2657 -71.2648 -71.2648 -39.6956 -39.6956 -39.6929 -39.6929 -27.6213 -27.6213 -27.6106 -27.6106 -27.5068 -27.5068 -27.5051 -27.5051 -13.4328 -13.4328 -0.3891 -0.3891 1.2092 1.2092 1.9802 1.9802 3.0747 3.0747 3.4766 3.4766 8.5326 8.5326 9.3513 9.3513 9.6309 9.6309 9.7559 9.7559 9.9759 9.9759 10.1612 10.1612 11.7485 11.7485 11.8251 11.8251 12.4044 12.4044 12.5138 12.5138 12.8359 12.8359 13.5255 13.5255 14.6360 14.6360 15.4114 15.4114 16.2638 16.2638 16.6852 16.6852 17.3860 17.3860 k =-0.2395 0.5126 0.5658 ( 4583 PWs) bands (ev): -71.2664 -71.2664 -71.2641 -71.2641 -39.6977 -39.6977 -39.6908 -39.6908 -27.6292 -27.6292 -27.6027 -27.6027 -27.5081 -27.5081 -27.5038 -27.5038 -13.4330 -13.4330 -0.3883 -0.3883 1.2091 1.2091 1.9829 1.9829 3.0957 3.0957 3.4477 3.4477 8.5113 8.5113 9.3959 9.3959 9.5970 9.5970 9.7587 9.7587 9.9938 9.9938 10.1485 10.1485 11.7113 11.7113 11.8614 11.8614 12.4389 12.4389 12.5135 12.5135 12.8360 12.8360 13.5075 13.5075 14.6023 14.6023 15.4134 15.4134 16.3008 16.3008 16.6373 16.6373 17.4882 17.4882 k =-0.2332 0.4991 0.5509 ( 4591 PWs) bands (ev): -71.2671 -71.2671 -71.2634 -71.2634 -39.6997 -39.6997 -39.6887 -39.6887 -27.6371 -27.6371 -27.5947 -27.5947 -27.5093 -27.5093 -27.5026 -27.5026 -13.4335 -13.4335 -0.3864 -0.3864 1.2093 1.2093 1.9839 1.9839 3.1181 3.1181 3.4159 3.4159 8.4934 8.4934 9.4380 9.4380 9.5643 9.5643 9.7485 9.7485 10.0172 10.0172 10.1365 10.1365 11.6499 11.6499 11.9131 11.9131 12.4805 12.4805 12.5280 12.5280 12.8408 12.8408 13.4939 13.4939 14.5709 14.5709 15.4189 15.4189 16.3368 16.3368 16.5929 16.5929 17.5900 17.5900 k =-0.2269 0.4856 0.5360 ( 4593 PWs) bands (ev): -71.2678 -71.2678 -71.2627 -71.2627 -39.7018 -39.7018 -39.6867 -39.6867 -27.6449 -27.6449 -27.5867 -27.5867 -27.5105 -27.5105 -27.5013 -27.5013 -13.4341 -13.4341 -0.3834 -0.3834 1.2097 1.2097 1.9835 1.9835 3.1415 3.1415 3.3815 3.3815 8.4791 8.4791 9.4754 9.4754 9.5338 9.5338 9.7269 9.7269 10.0445 10.0445 10.1271 10.1271 11.5818 11.5818 11.9640 11.9640 12.5210 12.5210 12.5630 12.5630 12.8497 12.8497 13.4852 13.4852 14.5423 14.5423 15.4278 15.4278 16.3699 16.3699 16.5542 16.5542 17.6903 17.6903 k =-0.2206 0.4721 0.5211 ( 4593 PWs) bands (ev): -71.2684 -71.2684 -71.2621 -71.2621 -39.7038 -39.7038 -39.6847 -39.6847 -27.6526 -27.6526 -27.5788 -27.5788 -27.5118 -27.5118 -27.5000 -27.5000 -13.4349 -13.4349 -0.3795 -0.3795 1.2104 1.2104 1.9817 1.9817 3.1658 3.1658 3.3445 3.3445 8.4681 8.4681 9.4918 9.4918 9.5202 9.5202 9.6971 9.6971 10.0700 10.0700 10.1254 10.1254 11.5104 11.5104 12.0124 12.0124 12.5572 12.5572 12.6191 12.6191 12.8621 12.8621 13.4815 13.4815 14.5167 14.5167 15.4402 15.4402 16.3945 16.3945 16.5264 16.5264 17.7882 17.7882 k =-0.2143 0.4586 0.5062 ( 4597 PWs) bands (ev): -71.2691 -71.2691 -71.2614 -71.2614 -39.7058 -39.7058 -39.6826 -39.6826 -27.6603 -27.6603 -27.5709 -27.5709 -27.5130 -27.5130 -27.4987 -27.4987 -13.4358 -13.4358 -0.3745 -0.3745 1.2115 1.2115 1.9786 1.9786 3.1909 3.1909 3.3053 3.3053 8.4604 8.4604 9.4677 9.4677 9.5391 9.5391 9.6642 9.6642 10.0828 10.0828 10.1419 10.1419 11.4371 11.4371 12.0582 12.0582 12.5961 12.5961 12.6864 12.6864 12.8774 12.8774 13.4835 13.4835 14.4944 14.4944 15.4560 15.4560 16.3998 16.3998 16.5202 16.5202 17.8822 17.8822 k =-0.2080 0.4451 0.4913 ( 4597 PWs) bands (ev): -71.2698 -71.2698 -71.2607 -71.2607 -39.7078 -39.7078 -39.6806 -39.6806 -27.6679 -27.6679 -27.5630 -27.5630 -27.5141 -27.5141 -27.4975 -27.4975 -13.4369 -13.4369 -0.3686 -0.3686 1.2129 1.2129 1.9744 1.9744 3.2164 3.2164 3.2639 3.2639 8.4557 8.4557 9.4399 9.4399 9.5431 9.5431 9.6397 9.6397 10.0858 10.0858 10.1738 10.1738 11.3628 11.3628 12.1016 12.1016 12.6400 12.6400 12.7600 12.7600 12.8951 12.8951 13.4913 13.4913 14.4757 14.4757 15.4752 15.4752 16.3838 16.3838 16.5377 16.5377 17.9703 17.9703 k =-0.2017 0.4316 0.4764 ( 4605 PWs) bands (ev): -71.2704 -71.2704 -71.2601 -71.2601 -39.7098 -39.7098 -39.6786 -39.6786 -27.6754 -27.6754 -27.5552 -27.5552 -27.5153 -27.5153 -27.4962 -27.4962 -13.4382 -13.4382 -0.3618 -0.3618 1.2149 1.2149 1.9691 1.9691 3.2207 3.2207 3.2421 3.2421 8.4538 8.4538 9.4127 9.4127 9.5167 9.5167 9.6358 9.6358 10.0891 10.0891 10.2112 10.2112 11.2883 11.2883 12.1430 12.1430 12.6882 12.6882 12.8374 12.8374 12.9152 12.9152 13.5054 13.5054 14.4609 14.4609 15.4979 15.4979 16.3587 16.3587 16.5662 16.5662 18.0498 18.0498 k =-0.1954 0.4182 0.4615 ( 4601 PWs) bands (ev): -71.2711 -71.2711 -71.2594 -71.2594 -39.7117 -39.7117 -39.6766 -39.6766 -27.6827 -27.6827 -27.5475 -27.5475 -27.5164 -27.5164 -27.4949 -27.4949 -13.4397 -13.4397 -0.3542 -0.3542 1.2173 1.2173 1.9630 1.9630 3.1758 3.1758 3.2679 3.2679 8.4544 8.4544 9.3863 9.3863 9.4711 9.4711 9.6419 9.6419 10.0964 10.0964 10.2505 10.2505 11.2140 11.2140 12.1824 12.1824 12.7399 12.7399 12.9131 12.9131 12.9412 12.9412 13.5259 13.5259 14.4504 14.4504 15.5240 15.5240 16.3324 16.3324 16.5981 16.5981 18.1168 18.1168 k =-0.1891 0.4047 0.4467 ( 4593 PWs) bands (ev): -71.2717 -71.2717 -71.2588 -71.2588 -39.7136 -39.7136 -39.6747 -39.6747 -27.6899 -27.6899 -27.5399 -27.5399 -27.5174 -27.5174 -27.4937 -27.4937 -13.4412 -13.4412 -0.3458 -0.3458 1.2203 1.2203 1.9561 1.9561 3.1294 3.1294 3.2935 3.2935 8.4571 8.4571 9.3603 9.3603 9.4187 9.4187 9.6473 9.6473 10.1086 10.1086 10.2905 10.2905 11.1404 11.1404 12.2201 12.2201 12.7935 12.7935 12.9523 12.9523 13.0069 13.0069 13.5529 13.5529 14.4445 14.4445 15.5535 15.5535 16.3076 16.3076 16.6306 16.6306 18.1657 18.1657 k =-0.1828 0.3912 0.4318 ( 4593 PWs) bands (ev): -71.2724 -71.2724 -71.2582 -71.2582 -39.7155 -39.7155 -39.6728 -39.6728 -27.6970 -27.6970 -27.5325 -27.5325 -27.5184 -27.5184 -27.4924 -27.4924 -13.4429 -13.4429 -0.3368 -0.3368 1.2240 1.2240 1.9486 1.9486 3.0818 3.0818 3.3187 3.3187 8.4615 8.4615 9.3316 9.3316 9.3672 9.3672 9.6491 9.6491 10.1257 10.1257 10.3305 10.3305 11.0678 11.0678 12.2558 12.2558 12.8473 12.8473 12.9775 12.9775 13.0896 13.0896 13.5862 13.5862 14.4433 14.4433 15.5863 15.5863 16.2856 16.2856 16.6626 16.6626 18.1889 18.1889 k =-0.1765 0.3777 0.4169 ( 4587 PWs) bands (ev): -71.2730 -71.2730 -71.2575 -71.2575 -39.7173 -39.7173 -39.6709 -39.6709 -27.7039 -27.7039 -27.5256 -27.5256 -27.5189 -27.5189 -27.4912 -27.4912 -13.4447 -13.4447 -0.3272 -0.3272 1.2284 1.2284 1.9405 1.9405 3.0332 3.0332 3.3434 3.3434 8.4671 8.4671 9.2893 9.2893 9.3295 9.3295 9.6472 9.6472 10.1469 10.1469 10.3702 10.3702 10.9966 10.9966 12.2895 12.2895 12.8981 12.8981 13.0055 13.0055 13.1737 13.1737 13.6258 13.6258 14.4472 14.4472 15.6224 15.6224 16.2668 16.2668 16.6936 16.6936 18.1761 18.1761 k =-0.1702 0.3642 0.4020 ( 4599 PWs) bands (ev): -71.2736 -71.2736 -71.2569 -71.2569 -39.7192 -39.7192 -39.6691 -39.6691 -27.7107 -27.7107 -27.5221 -27.5221 -27.5162 -27.5162 -27.4900 -27.4900 -13.4467 -13.4467 -0.3170 -0.3170 1.2335 1.2335 1.9321 1.9321 2.9838 2.9838 3.3674 3.3674 8.4731 8.4731 9.2354 9.2354 9.3052 9.3052 9.6423 9.6423 10.1713 10.1713 10.4091 10.4091 10.9272 10.9272 12.3211 12.3211 12.9406 12.9406 13.0414 13.0414 13.2578 13.2578 13.6710 13.6710 14.4560 14.4560 15.6615 15.6615 16.2518 16.2518 16.7235 16.7235 18.1197 18.1197 k =-0.1638 0.3507 0.3871 ( 4599 PWs) bands (ev): -71.2742 -71.2742 -71.2563 -71.2563 -39.7209 -39.7209 -39.6672 -39.6672 -27.7173 -27.7173 -27.5224 -27.5224 -27.5098 -27.5098 -27.4888 -27.4888 -13.4487 -13.4487 -0.3065 -0.3065 1.2394 1.2394 1.9233 1.9233 2.9339 2.9339 3.3906 3.3906 8.4789 8.4789 9.1802 9.1802 9.2853 9.2853 9.6353 9.6353 10.1979 10.1979 10.4468 10.4468 10.8602 10.8602 12.3504 12.3504 12.9710 12.9710 13.0889 13.0889 13.3409 13.3409 13.7214 13.7214 14.4697 14.4697 15.7037 15.7037 16.2407 16.2407 16.7524 16.7524 18.0274 18.0274 k =-0.1575 0.3372 0.3722 ( 4593 PWs) bands (ev): -71.2748 -71.2748 -71.2558 -71.2558 -39.7226 -39.7226 -39.6655 -39.6655 -27.7237 -27.7237 -27.5232 -27.5232 -27.5030 -27.5030 -27.4875 -27.4875 -13.4508 -13.4508 -0.2957 -0.2957 1.2462 1.2462 1.9143 1.9143 2.8836 2.8836 3.4128 3.4128 8.4833 8.4833 9.1272 9.1272 9.2676 9.2676 9.6270 9.6270 10.2258 10.2258 10.4825 10.4825 10.7966 10.7966 12.3775 12.3775 12.9912 12.9912 13.1454 13.1454 13.4226 13.4226 13.7763 13.7763 14.4882 14.4882 15.7487 15.7487 16.2339 16.2339 16.7804 16.7804 17.9172 17.9172 k =-0.1512 0.3237 0.3573 ( 4593 PWs) bands (ev): -71.2753 -71.2753 -71.2552 -71.2552 -39.7243 -39.7243 -39.6637 -39.6637 -27.7300 -27.7300 -27.5241 -27.5241 -27.4963 -27.4963 -27.4862 -27.4862 -13.4530 -13.4530 -0.2846 -0.2846 1.2539 1.2539 1.9052 1.9052 2.8332 2.8332 3.4340 3.4340 8.4851 8.4851 9.0783 9.0783 9.2517 9.2517 9.6180 9.6180 10.2540 10.2540 10.5145 10.5145 10.7384 10.7384 12.4022 12.4022 13.0048 13.0048 13.2071 13.2071 13.5022 13.5022 13.8348 13.8348 14.5109 14.5109 15.7963 15.7963 16.2316 16.2316 16.8077 16.8077 17.8016 17.8016 k =-0.1449 0.3102 0.3424 ( 4587 PWs) bands (ev): -71.2759 -71.2759 -71.2546 -71.2546 -39.7259 -39.7259 -39.6621 -39.6621 -27.7361 -27.7361 -27.5250 -27.5250 -27.4902 -27.4902 -27.4846 -27.4846 -13.4552 -13.4552 -0.2734 -0.2734 1.2626 1.2626 1.8960 1.8960 2.7829 2.7829 3.4541 3.4541 8.4828 8.4828 9.0354 9.0354 9.2375 9.2375 9.6090 9.6090 10.2813 10.2813 10.5379 10.5379 10.6911 10.6911 12.4247 12.4247 13.0139 13.0139 13.2715 13.2715 13.5793 13.5793 13.8961 13.8961 14.5375 14.5375 15.8463 15.8463 16.2341 16.2341 16.8346 16.8346 17.6867 17.6867 k =-0.1386 0.2968 0.3275 ( 4579 PWs) bands (ev): -71.2764 -71.2764 -71.2541 -71.2541 -39.7275 -39.7275 -39.6604 -39.6604 -27.7420 -27.7420 -27.5259 -27.5259 -27.4859 -27.4859 -27.4812 -27.4812 -13.4575 -13.4575 -0.2623 -0.2623 1.2722 1.2722 1.8868 1.8868 2.7328 2.7328 3.4730 3.4730 8.4749 8.4749 9.0001 9.0001 9.2249 9.2249 9.6002 9.6002 10.3060 10.3060 10.5412 10.5412 10.6681 10.6681 12.4450 12.4450 13.0196 13.0196 13.3375 13.3375 13.6534 13.6534 13.9593 13.9593 14.5674 14.5674 15.8982 15.8982 16.2416 16.2416 16.8611 16.8611 17.5754 17.5754 k =-0.1323 0.2833 0.3127 ( 4583 PWs) bands (ev): -71.2769 -71.2769 -71.2536 -71.2536 -39.7291 -39.7291 -39.6588 -39.6588 -27.7476 -27.7476 -27.5267 -27.5267 -27.4841 -27.4841 -27.4757 -27.4757 -13.4598 -13.4598 -0.2512 -0.2512 1.2828 1.2828 1.8777 1.8777 2.6831 2.6831 3.4907 3.4907 8.4601 8.4601 8.9736 8.9736 9.2138 9.2138 9.5920 9.5920 10.3241 10.3241 10.5212 10.5212 10.6758 10.6758 12.4630 12.4630 13.0223 13.0223 13.4042 13.4042 13.7242 13.7242 14.0234 14.0234 14.5998 14.5998 15.9516 15.9516 16.2545 16.2545 16.8872 16.8872 17.4696 17.4696 k =-0.1260 0.2698 0.2978 ( 4579 PWs) bands (ev): -71.2774 -71.2774 -71.2531 -71.2531 -39.7305 -39.7305 -39.6573 -39.6573 -27.7531 -27.7531 -27.5275 -27.5275 -27.4829 -27.4829 -27.4698 -27.4698 -13.4621 -13.4621 -0.2402 -0.2402 1.2944 1.2944 1.8686 1.8686 2.6340 2.6340 3.5071 3.5071 8.4381 8.4381 8.9567 8.9567 9.2042 9.2042 9.5845 9.5845 10.3284 10.3284 10.5004 10.5004 10.6991 10.6991 12.4790 12.4790 13.0226 13.0226 13.4712 13.4712 13.7916 13.7916 14.0876 14.0876 14.6342 14.6342 16.0059 16.0059 16.2731 16.2731 16.9129 16.9129 17.3706 17.3706 k =-0.1197 0.2563 0.2829 ( 4571 PWs) bands (ev): -71.2779 -71.2779 -71.2526 -71.2526 -39.7319 -39.7319 -39.6559 -39.6559 -27.7583 -27.7583 -27.5283 -27.5283 -27.4818 -27.4818 -27.4640 -27.4640 -13.4644 -13.4644 -0.2295 -0.2295 1.3071 1.3071 1.8598 1.8598 2.5857 2.5857 3.5223 3.5223 8.4091 8.4091 8.9487 8.9487 9.1962 9.1962 9.5778 9.5778 10.3117 10.3117 10.4966 10.4966 10.7272 10.7272 12.4931 12.4931 13.0205 13.0205 13.5379 13.5379 13.8553 13.8553 14.1510 14.1510 14.6698 14.6698 16.0603 16.0603 16.2979 16.2979 16.9378 16.9378 17.2795 17.2795 k =-0.1134 0.2428 0.2680 ( 4571 PWs) bands (ev): -71.2784 -71.2784 -71.2522 -71.2522 -39.7333 -39.7333 -39.6544 -39.6544 -27.7633 -27.7633 -27.5291 -27.5291 -27.4808 -27.4808 -27.4584 -27.4584 -13.4667 -13.4667 -0.2192 -0.2192 1.3207 1.3207 1.8511 1.8511 2.5383 2.5383 3.5363 3.5363 8.3744 8.3744 8.9486 8.9486 9.1897 9.1897 9.5720 9.5720 10.2775 10.2775 10.5100 10.5100 10.7565 10.7565 12.5053 12.5053 13.0164 13.0164 13.6039 13.6039 13.9152 13.9152 14.2125 14.2125 14.7060 14.7060 16.1140 16.1140 16.3292 16.3292 16.9612 16.9612 17.1970 17.1970 k =-0.1071 0.2293 0.2531 ( 4577 PWs) bands (ev): -71.2788 -71.2788 -71.2517 -71.2517 -39.7346 -39.7346 -39.6531 -39.6531 -27.7681 -27.7681 -27.5298 -27.5298 -27.4799 -27.4799 -27.4530 -27.4530 -13.4689 -13.4689 -0.2092 -0.2092 1.3352 1.3352 1.8426 1.8426 2.4919 2.4919 3.5490 3.5490 8.3356 8.3356 8.9546 8.9546 9.1846 9.1846 9.5671 9.5671 10.2346 10.2346 10.5326 10.5326 10.7857 10.7857 12.5158 12.5158 13.0103 13.0103 13.6687 13.6687 13.9715 13.9715 14.2713 14.2713 14.7425 14.7425 16.1660 16.1660 16.3673 16.3673 16.9821 16.9821 17.1239 17.1239 k =-0.1008 0.2158 0.2382 ( 4575 PWs) bands (ev): -71.2792 -71.2792 -71.2513 -71.2513 -39.7358 -39.7358 -39.6518 -39.6518 -27.7726 -27.7726 -27.5305 -27.5305 -27.4790 -27.4790 -27.4479 -27.4479 -13.4712 -13.4712 -0.1997 -0.1997 1.3507 1.3507 1.8343 1.8343 2.4467 2.4467 3.5606 3.5606 8.2942 8.2942 8.9653 8.9653 9.1810 9.1810 9.5631 9.5631 10.1887 10.1887 10.5595 10.5595 10.8144 10.8144 12.5248 12.5248 13.0023 13.0023 13.7321 13.7321 14.0240 14.0240 14.3265 14.3265 14.7789 14.7789 16.2157 16.2157 16.4120 16.4120 16.9973 16.9973 17.0625 17.0625 k =-0.0945 0.2023 0.2233 ( 4571 PWs) bands (ev): -71.2796 -71.2796 -71.2509 -71.2509 -39.7370 -39.7370 -39.6506 -39.6506 -27.7769 -27.7769 -27.5311 -27.5311 -27.4782 -27.4782 -27.4430 -27.4430 -13.4733 -13.4733 -0.1906 -0.1906 1.3671 1.3671 1.8263 1.8263 2.4028 2.4028 3.5711 3.5711 8.2515 8.2515 8.9792 8.9792 9.1789 9.1789 9.5599 9.5599 10.1423 10.1423 10.5883 10.5883 10.8421 10.8421 12.5325 12.5325 12.9925 12.9925 13.7935 13.7935 14.0731 14.0731 14.3772 14.3772 14.8151 14.8151 16.2631 16.2631 16.4622 16.4622 16.9877 16.9877 17.0310 17.0310 k =-0.0882 0.1888 0.2084 ( 4575 PWs) bands (ev): -71.2800 -71.2800 -71.2505 -71.2505 -39.7381 -39.7381 -39.6495 -39.6495 -27.7809 -27.7809 -27.5317 -27.5317 -27.4774 -27.4774 -27.4383 -27.4383 -13.4754 -13.4754 -0.1822 -0.1822 1.3842 1.3842 1.8185 1.8185 2.3603 2.3603 3.5804 3.5804 8.2086 8.2086 8.9950 8.9950 9.1783 9.1783 9.5574 9.5574 10.0966 10.0966 10.6178 10.6178 10.8689 10.8689 12.5391 12.5391 12.9810 12.9810 13.8528 13.8528 14.1187 14.1187 14.4225 14.4225 14.8510 14.8510 16.3082 16.3082 16.5163 16.5163 16.9476 16.9476 17.0333 17.0333 k =-0.0819 0.1754 0.1935 ( 4565 PWs) bands (ev): -71.2803 -71.2803 -71.2502 -71.2502 -39.7391 -39.7391 -39.6484 -39.6484 -27.7847 -27.7847 -27.5323 -27.5323 -27.4767 -27.4767 -27.4340 -27.4340 -13.4774 -13.4774 -0.1742 -0.1742 1.4021 1.4021 1.8108 1.8108 2.3195 2.3195 3.5888 3.5888 8.1664 8.1664 9.0121 9.0121 9.1791 9.1791 9.5556 9.5556 10.0522 10.0522 10.6473 10.6473 10.8947 10.8947 12.5448 12.5448 12.9677 12.9677 13.9095 13.9095 14.1610 14.1610 14.4620 14.4620 14.8870 14.8870 16.3514 16.3514 16.5718 16.5718 16.9095 16.9095 17.0356 17.0356 k =-0.0756 0.1619 0.1787 ( 4569 PWs) bands (ev): -71.2807 -71.2807 -71.2499 -71.2499 -39.7400 -39.7400 -39.6474 -39.6474 -27.7882 -27.7882 -27.5328 -27.5328 -27.4760 -27.4760 -27.4299 -27.4299 -13.4794 -13.4794 -0.1669 -0.1669 1.4206 1.4206 1.8034 1.8034 2.2803 2.2803 3.5962 3.5962 8.1255 8.1255 9.0294 9.0294 9.1812 9.1812 9.5544 9.5544 10.0095 10.0095 10.6763 10.6763 10.9193 10.9193 12.5499 12.5499 12.9528 12.9528 13.9633 13.9633 14.2002 14.2002 14.4953 14.4953 14.9228 14.9228 16.3925 16.3925 16.6250 16.6250 16.8783 16.8783 17.0328 17.0328 k =-0.0693 0.1484 0.1638 ( 4577 PWs) bands (ev): -71.2810 -71.2810 -71.2496 -71.2496 -39.7409 -39.7409 -39.6465 -39.6465 -27.7914 -27.7914 -27.5333 -27.5333 -27.4754 -27.4754 -27.4261 -27.4261 -13.4812 -13.4812 -0.1601 -0.1601 1.4397 1.4397 1.7960 1.7960 2.2430 2.2430 3.6026 3.6026 8.0864 8.0864 9.0464 9.0464 9.1848 9.1848 9.5538 9.5538 9.9689 9.9689 10.7044 10.7044 10.9428 10.9428 12.5547 12.5547 12.9362 12.9362 14.0139 14.0139 14.2363 14.2363 14.5224 14.5224 14.9585 14.9585 16.4314 16.4314 16.6693 16.6693 16.8575 16.8575 17.0250 17.0250 k =-0.0630 0.1349 0.1489 ( 4569 PWs) bands (ev): -71.2812 -71.2812 -71.2493 -71.2493 -39.7417 -39.7417 -39.6456 -39.6456 -27.7944 -27.7944 -27.5337 -27.5337 -27.4748 -27.4748 -27.4226 -27.4226 -13.4829 -13.4829 -0.1540 -0.1540 1.4591 1.4591 1.7887 1.7887 2.2076 2.2076 3.6083 3.6083 8.0496 8.0496 9.0627 9.0627 9.1895 9.1895 9.5537 9.5537 9.9306 9.9306 10.7312 10.7312 10.9651 10.9651 12.5593 12.5593 12.9181 12.9181 14.0609 14.0609 14.2696 14.2696 14.5439 14.5439 14.9939 14.9939 16.4672 16.4672 16.6941 16.6941 16.8539 16.8539 17.0148 17.0148 k =-0.0567 0.1214 0.1340 ( 4573 PWs) bands (ev): -71.2815 -71.2815 -71.2490 -71.2490 -39.7425 -39.7425 -39.6448 -39.6448 -27.7971 -27.7971 -27.5342 -27.5342 -27.4743 -27.4743 -27.4195 -27.4195 -13.4844 -13.4844 -0.1485 -0.1485 1.4789 1.4789 1.7813 1.7813 2.1745 2.1745 3.6132 3.6132 8.0154 8.0154 9.0778 9.0778 9.1954 9.1954 9.5539 9.5539 9.8947 9.8947 10.7563 10.7563 10.9861 10.9861 12.5641 12.5641 12.8988 12.8988 14.1040 14.1040 14.3002 14.3002 14.5606 14.5606 15.0285 15.0285 16.4985 16.4985 16.6941 16.6941 16.8683 16.8683 17.0075 17.0075 k =-0.0504 0.1079 0.1191 ( 4581 PWs) bands (ev): -71.2817 -71.2817 -71.2488 -71.2488 -39.7432 -39.7432 -39.6441 -39.6441 -27.7996 -27.7996 -27.5345 -27.5345 -27.4738 -27.4738 -27.4166 -27.4166 -13.4859 -13.4859 -0.1436 -0.1436 1.4988 1.4988 1.7738 1.7738 2.1438 2.1438 3.6174 3.6174 7.9841 7.9841 9.0915 9.0915 9.2021 9.2021 9.5545 9.5545 9.8616 9.8616 10.7796 10.7796 11.0059 11.0059 12.5693 12.5693 12.8784 12.8784 14.1425 14.1425 14.3282 14.3282 14.5732 14.5732 15.0616 15.0616 16.5233 16.5233 16.6804 16.6804 16.8830 16.8830 17.0118 17.0118 k =-0.0441 0.0944 0.1042 ( 4587 PWs) bands (ev): -71.2819 -71.2819 -71.2486 -71.2486 -39.7438 -39.7438 -39.6435 -39.6435 -27.8017 -27.8017 -27.5348 -27.5348 -27.4734 -27.4734 -27.4141 -27.4141 -13.4871 -13.4871 -0.1393 -0.1393 1.5187 1.5187 1.7660 1.7660 2.1156 2.1156 3.6209 3.6209 7.9560 7.9560 9.1037 9.1037 9.2093 9.2093 9.5553 9.5553 9.8313 9.8313 10.8006 10.8006 11.0241 11.0241 12.5751 12.5751 12.8574 12.8574 14.1761 14.1761 14.3537 14.3537 14.5829 14.5829 15.0927 15.0927 16.5384 16.5384 16.6655 16.6655 16.8842 16.8842 17.0333 17.0333 k =-0.0378 0.0809 0.0893 ( 4587 PWs) bands (ev): -71.2821 -71.2821 -71.2485 -71.2485 -39.7443 -39.7443 -39.6430 -39.6430 -27.8036 -27.8036 -27.5351 -27.5351 -27.4730 -27.4730 -27.4119 -27.4119 -13.4883 -13.4883 -0.1356 -0.1356 1.5384 1.5384 1.7579 1.7579 2.0904 2.0904 3.6238 3.6238 7.9312 7.9312 9.1143 9.1143 9.2167 9.2167 9.5563 9.5563 9.8042 9.8042 10.8191 10.8191 11.0406 11.0406 12.5816 12.5816 12.8362 12.8362 14.2046 14.2046 14.3767 14.3767 14.5904 14.5904 15.1211 15.1211 16.5412 16.5412 16.6561 16.6561 16.8761 16.8761 17.0654 17.0654 k =-0.0315 0.0674 0.0744 ( 4579 PWs) bands (ev): -71.2823 -71.2823 -71.2483 -71.2483 -39.7447 -39.7447 -39.6425 -39.6425 -27.8052 -27.8052 -27.5353 -27.5353 -27.4727 -27.4727 -27.4100 -27.4100 -13.4892 -13.4892 -0.1325 -0.1325 1.5575 1.5575 1.7493 1.7493 2.0684 2.0684 3.6263 3.6263 7.9099 7.9099 9.1233 9.1233 9.2238 9.2238 9.5575 9.5575 9.7805 9.7805 10.8350 10.8350 11.0553 11.0553 12.5888 12.5888 12.8154 12.8154 14.2278 14.2278 14.3972 14.3972 14.5965 14.5965 15.1463 15.1463 16.5338 16.5338 16.6517 16.6517 16.8670 16.8670 17.0997 17.0997 k =-0.0252 0.0540 0.0596 ( 4581 PWs) bands (ev): -71.2824 -71.2824 -71.2482 -71.2482 -39.7450 -39.7450 -39.6422 -39.6422 -27.8065 -27.8065 -27.5355 -27.5355 -27.4725 -27.4725 -27.4085 -27.4085 -13.4900 -13.4900 -0.1299 -0.1299 1.5756 1.5756 1.7404 1.7404 2.0498 2.0498 3.6282 3.6282 7.8923 7.8923 9.1307 9.1307 9.2302 9.2302 9.5587 9.5587 9.7605 9.7605 10.8481 10.8481 11.0678 11.0678 12.5966 12.5966 12.7956 12.7956 14.2458 14.2458 14.4148 14.4148 14.6016 14.6016 15.1676 15.1676 16.5216 16.5216 16.6480 16.6480 16.8613 16.8613 17.1318 17.1318 k =-0.0189 0.0405 0.0447 ( 4587 PWs) bands (ev): -71.2825 -71.2825 -71.2481 -71.2481 -39.7453 -39.7453 -39.6419 -39.6419 -27.8075 -27.8075 -27.5357 -27.5357 -27.4723 -27.4723 -27.4073 -27.4073 -13.4906 -13.4906 -0.1280 -0.1280 1.5921 1.5921 1.7315 1.7315 2.0350 2.0350 3.6296 3.6296 7.8785 7.8785 9.1365 9.1365 9.2356 9.2356 9.5598 9.5598 9.7445 9.7445 10.8584 10.8584 11.0779 11.0779 12.6044 12.6044 12.7778 12.7778 14.2590 14.2590 14.4290 14.4290 14.6057 14.6057 15.1847 15.1847 16.5093 16.5093 16.6430 16.6430 16.8596 16.8596 17.1590 17.1590 k =-0.0126 0.0270 0.0298 ( 4591 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7455 -39.7455 -39.6417 -39.6417 -27.8082 -27.8082 -27.5358 -27.5358 -27.4721 -27.4721 -27.4065 -27.4065 -13.4911 -13.4911 -0.1266 -0.1266 1.6061 1.6061 1.7232 1.7232 2.0242 2.0242 3.6306 3.6306 7.8686 7.8686 9.1407 9.1407 9.2396 9.2396 9.5607 9.5607 9.7328 9.7328 10.8657 10.8657 11.0853 11.0853 12.6117 12.6117 12.7631 12.7631 14.2680 14.2680 14.4396 14.4396 14.6089 14.6089 15.1972 15.1972 16.4993 16.4993 16.6374 16.6374 16.8605 16.8605 17.1798 17.1798 k =-0.0063 0.0135 0.0149 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8087 -27.8087 -27.5359 -27.5359 -27.4720 -27.4720 -27.4059 -27.4059 -13.4914 -13.4914 -0.1258 -0.1258 1.6159 1.6159 1.7169 1.7169 2.0177 2.0177 3.6312 3.6312 7.8626 7.8626 9.1432 9.1432 9.2422 9.2422 9.5613 9.5613 9.7257 9.7257 10.8701 10.8701 11.0899 11.0899 12.6170 12.6170 12.7532 12.7532 14.2732 14.2732 14.4461 14.4461 14.6109 14.6109 15.2048 15.2048 16.4930 16.4930 16.6330 16.6330 16.8619 16.8619 17.1929 17.1929 k = 0.0000 0.0000 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1255 -0.1255 1.6195 1.6195 1.7145 1.7145 2.0155 2.0155 3.6314 3.6314 7.8606 7.8606 9.1440 9.1440 9.2430 9.2430 9.5615 9.5615 9.7233 9.7233 10.8716 10.8716 11.0914 11.0914 12.6189 12.6189 12.7497 12.7497 14.2749 14.2749 14.4483 14.4483 14.6116 14.6116 15.2073 15.2073 16.4908 16.4908 16.6314 16.6314 16.8626 16.8626 17.1973 17.1973 k = 0.0000 0.0000 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1255 -0.1255 1.6195 1.6195 1.7145 1.7145 2.0155 2.0155 3.6314 3.6314 7.8606 7.8606 9.1440 9.1440 9.2430 9.2430 9.5615 9.5615 9.7233 9.7233 10.8716 10.8716 11.0914 11.0914 12.6189 12.6189 12.7497 12.7497 14.2749 14.2749 14.4483 14.4483 14.6116 14.6116 15.2073 15.2073 16.4908 16.4908 16.6314 16.6314 16.8626 16.8626 17.1973 17.1973 k = 0.0192 0.0090 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1259 -0.1259 1.6041 1.6041 1.7315 1.7315 2.0155 2.0155 3.6303 3.6303 7.8619 7.8619 9.1432 9.1432 9.2422 9.2422 9.5596 9.5596 9.7233 9.7233 10.8722 10.8722 11.0918 11.0918 12.6201 12.6201 12.7463 12.7463 14.2780 14.2780 14.4497 14.4497 14.6156 14.6156 15.2079 15.2079 16.4767 16.4767 16.6423 16.6423 16.8607 16.8607 17.1985 17.1985 k = 0.0385 0.0180 0.0000 ( 4583 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1272 -0.1272 1.5731 1.5731 1.7674 1.7674 2.0157 2.0157 3.6270 3.6270 7.8658 7.8658 9.1407 9.1407 9.2398 9.2398 9.5541 9.5541 9.7234 9.7234 10.8740 10.8740 11.0928 11.0928 12.6235 12.6235 12.7362 12.7362 14.2872 14.2872 14.4542 14.4542 14.6277 14.6277 15.2095 15.2095 16.4404 16.4404 16.6692 16.6692 16.8555 16.8555 17.2020 17.2020 k = 0.0577 0.0270 0.0000 ( 4583 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4914 -13.4914 -0.1293 -0.1293 1.5388 1.5388 1.8098 1.8098 2.0159 2.0159 3.6214 3.6214 7.8722 7.8722 9.1365 9.1365 9.2359 9.2359 9.5449 9.5449 9.7234 9.7234 10.8770 10.8770 11.0946 11.0946 12.6293 12.6293 12.7199 12.7199 14.3014 14.3014 14.4615 14.4615 14.6482 14.6482 15.2122 15.2122 16.3884 16.3884 16.7051 16.7051 16.8485 16.8485 17.2078 17.2078 k = 0.0769 0.0359 0.0000 ( 4591 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4913 -13.4913 -0.1321 -0.1321 1.5045 1.5045 1.8553 1.8553 2.0162 2.0162 3.6137 3.6137 7.8811 7.8811 9.1308 9.1308 9.2305 9.2305 9.5324 9.5324 9.7235 9.7235 10.8811 10.8811 11.0970 11.0970 12.6374 12.6374 12.6982 12.6982 14.3197 14.3197 14.4716 14.4716 14.6773 14.6773 15.2162 15.2162 16.3235 16.3235 16.7472 16.7472 16.8417 16.8417 17.2157 17.2157 k = 0.0962 0.0449 0.0000 ( 4595 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4913 -13.4913 -0.1358 -0.1358 1.4713 1.4713 1.9028 1.9028 2.0165 2.0165 3.6039 3.6039 7.8922 7.8922 9.1236 9.1236 9.2237 9.2237 9.5168 9.5168 9.7236 9.7236 10.8862 10.8862 11.1001 11.1001 12.6478 12.6478 12.6719 12.6719 14.3405 14.3405 14.4843 14.4843 14.7150 14.7150 15.2216 15.2216 16.2468 16.2468 16.7914 16.7914 16.8403 16.8403 17.2256 17.2256 k = 0.1154 0.0539 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4912 -13.4912 -0.1401 -0.1401 1.4395 1.4395 1.9519 1.9519 2.0169 2.0169 3.5919 3.5919 7.9054 7.9054 9.1152 9.1152 9.2156 9.2156 9.4983 9.4983 9.7239 9.7239 10.8921 10.8921 11.1037 11.1037 12.6421 12.6421 12.6605 12.6605 14.3629 14.3629 14.4995 14.4995 14.7611 14.7611 15.2288 15.2288 16.1598 16.1598 16.8133 16.8133 16.8693 16.8693 17.2374 17.2374 k = 0.1346 0.0629 0.0000 ( 4583 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4911 -13.4911 -0.1451 -0.1451 1.4094 1.4094 2.0022 2.0022 2.0174 2.0174 3.5779 3.5779 7.9205 7.9205 9.1055 9.1055 9.2064 9.2064 9.4775 9.4775 9.7241 9.7241 10.8989 10.8989 11.1077 11.1077 12.6096 12.6096 12.6757 12.6757 14.3860 14.3860 14.5169 14.5169 14.8146 14.8146 15.2382 15.2382 16.0641 16.0641 16.8132 16.8132 16.9288 16.9288 17.2508 17.2508 k = 0.1538 0.0719 0.0000 ( 4583 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4910 -13.4910 -0.1506 -0.1506 1.3811 1.3811 2.0180 2.0180 2.0536 2.0536 3.5619 3.5619 7.9371 7.9371 9.0950 9.0950 9.1962 9.1962 9.4546 9.4546 9.7243 9.7243 10.9062 10.9062 11.1121 11.1121 12.5753 12.5753 12.6932 12.6932 14.4092 14.4092 14.5362 14.5362 14.8741 14.8741 15.2506 15.2506 15.9617 15.9617 16.8106 16.8106 16.9989 16.9989 17.2656 17.2656 k = 0.1731 0.0809 0.0000 ( 4583 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4909 -13.4909 -0.1566 -0.1566 1.3545 1.3545 2.0186 2.0186 2.1058 2.1058 3.5439 3.5439 7.9551 7.9551 9.0836 9.0836 9.1852 9.1852 9.4301 9.4301 9.7246 9.7246 10.9140 10.9140 11.1168 11.1168 12.5399 12.5399 12.7131 12.7131 14.4323 14.4323 14.5569 14.5569 14.9374 14.9374 15.2674 15.2674 15.8545 15.8545 16.8083 16.8083 17.0766 17.0766 17.2816 17.2816 k = 0.1923 0.0898 0.0000 ( 4575 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4907 -13.4907 -0.1630 -0.1630 1.3297 1.3297 2.0192 2.0192 2.1587 2.1587 3.5240 3.5240 7.9741 7.9741 9.0716 9.0716 9.1735 9.1735 9.4044 9.4044 9.7248 9.7248 10.9222 10.9222 11.1218 11.1218 12.5043 12.5043 12.7354 12.7354 14.4552 14.4552 14.5785 14.5785 15.0011 15.0011 15.2908 15.2908 15.7443 15.7443 16.8067 16.8067 17.1610 17.1610 17.2984 17.2984 k = 0.2115 0.0988 0.0000 ( 4587 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4906 -13.4906 -0.1696 -0.1696 1.3067 1.3067 2.0199 2.0199 2.2121 2.2121 3.5023 3.5023 7.9937 7.9937 9.0592 9.0592 9.1614 9.1614 9.3781 9.3781 9.7251 9.7251 10.9306 10.9306 11.1269 11.1269 12.4688 12.4688 12.7601 12.7601 14.4777 14.4777 14.6003 14.6003 15.0610 15.0610 15.3241 15.3241 15.6329 15.6329 16.8055 16.8055 17.2513 17.2513 17.3156 17.3156 k = 0.2308 0.1078 0.0000 ( 4571 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4905 -13.4905 -0.1765 -0.1765 1.2855 1.2855 2.0206 2.0206 2.2659 2.2659 3.4788 3.4788 8.0137 8.0137 9.0466 9.0466 9.1492 9.1492 9.3515 9.3515 9.7254 9.7254 10.9390 10.9390 11.1321 11.1321 12.4341 12.4341 12.7872 12.7872 14.4998 14.4998 14.6214 14.6214 15.1123 15.1123 15.3710 15.3710 15.5224 15.5224 16.8048 16.8048 17.3331 17.3331 17.3467 17.3467 k = 0.2500 0.1168 0.0000 ( 4571 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4904 -13.4904 -0.1834 -0.1834 1.2660 1.2660 2.0213 2.0213 2.3199 2.3199 3.4536 3.4536 8.0337 8.0337 9.0340 9.0340 9.1370 9.1370 9.3250 9.3250 9.7257 9.7257 10.9473 10.9473 11.1372 11.1372 12.4005 12.4005 12.8167 12.8167 14.5213 14.5213 14.6401 14.6401 15.1527 15.1527 15.4148 15.4148 15.4328 15.4328 16.8044 16.8044 17.3503 17.3503 17.4454 17.4454 k = 0.2692 0.1258 0.0000 ( 4567 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4902 -13.4902 -0.1903 -0.1903 1.2482 1.2482 2.0220 2.0220 2.3740 2.3740 3.4266 3.4266 8.0533 8.0533 9.0216 9.0216 9.1252 9.1252 9.2990 9.2990 9.7260 9.7260 10.9555 10.9555 11.1422 11.1422 12.3683 12.3683 12.8486 12.8486 14.5420 14.5420 14.6545 14.6545 15.1835 15.1835 15.3130 15.3130 15.5071 15.5071 16.8042 16.8042 17.3671 17.3671 17.5384 17.5384 k = 0.2885 0.1348 0.0000 ( 4567 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4901 -13.4901 -0.1971 -0.1971 1.2321 1.2321 2.0226 2.0226 2.4281 2.4281 3.3981 3.3981 8.0721 8.0721 9.0095 9.0095 9.1139 9.1139 9.2737 9.2737 9.7264 9.7264 10.9633 10.9633 11.1471 11.1471 12.3380 12.3380 12.8827 12.8827 14.5619 14.5619 14.6612 14.6612 15.2078 15.2078 15.2207 15.2207 15.5895 15.5895 16.8040 16.8040 17.3831 17.3831 17.5889 17.5889 k = 0.3077 0.1438 0.0000 ( 4575 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4900 -13.4900 -0.2037 -0.2037 1.2175 1.2175 2.0233 2.0233 2.4819 2.4819 3.3679 3.3679 8.0900 8.0900 8.9978 8.9978 9.1034 9.1034 9.2496 9.2496 9.7267 9.7267 10.9707 10.9707 11.1518 11.1518 12.3096 12.3096 12.9189 12.9189 14.5806 14.5806 14.6555 14.6555 15.1430 15.1430 15.2281 15.2281 15.6764 15.6764 16.8039 16.8039 17.3982 17.3982 17.6122 17.6122 k = 0.3269 0.1527 0.0000 ( 4571 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4899 -13.4899 -0.2100 -0.2100 1.2046 1.2046 2.0239 2.0239 2.5355 2.5355 3.3362 3.3362 8.1066 8.1066 8.9869 8.9869 9.0941 9.0941 9.2267 9.2267 9.7269 9.7269 10.9777 10.9777 11.1562 11.1562 12.2835 12.2835 12.9569 12.9569 14.5980 14.5980 14.6326 14.6326 15.0854 15.0854 15.2459 15.2459 15.7649 15.7649 16.8038 16.8038 17.4122 17.4122 17.6303 17.6303 k = 0.3462 0.1617 0.0000 ( 4579 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4898 -13.4898 -0.2159 -0.2159 1.1931 1.1931 2.0245 2.0245 2.5886 2.5886 3.3029 3.3029 8.1218 8.1218 8.9767 8.9767 9.0861 9.0861 9.2052 9.2052 9.7272 9.7272 10.9841 10.9841 11.1602 11.1602 12.2597 12.2597 12.9964 12.9964 14.5905 14.5905 14.6139 14.6139 15.0502 15.0502 15.2619 15.2619 15.8524 15.8524 16.8037 16.8037 17.4250 17.4250 17.6458 17.6458 k = 0.3654 0.1707 0.0000 ( 4579 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4896 -13.4896 -0.2213 -0.2213 1.1831 1.1831 2.0251 2.0251 2.6411 2.6411 3.2681 3.2681 8.1352 8.1352 8.9674 8.9674 9.0797 9.0797 9.1852 9.1852 9.7274 9.7274 10.9899 10.9899 11.1639 11.1639 12.2385 12.2385 13.0368 13.0368 14.5331 14.5331 14.6283 14.6283 15.0341 15.0341 15.2766 15.2766 15.9370 15.9370 16.8036 16.8036 17.4368 17.4368 17.6592 17.6592 k = 0.3846 0.1797 0.0000 ( 4579 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6415 -39.6415 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4896 -13.4896 -0.2261 -0.2261 1.1745 1.1745 2.0256 2.0256 2.6929 2.6929 3.2319 3.2319 8.1469 8.1469 8.9591 8.9591 9.0750 9.0750 9.1668 9.1668 9.7276 9.7276 10.9950 10.9950 11.1672 11.1672 12.2198 12.2198 13.0774 13.0774 14.4675 14.4675 14.6409 14.6409 15.0309 15.0309 15.2898 15.2898 16.0166 16.0166 16.8034 16.8034 17.4474 17.4474 17.6704 17.6704 k = 0.4038 0.1887 0.0000 ( 4552 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4895 -13.4895 -0.2304 -0.2304 1.1674 1.1674 2.0260 2.0260 2.7439 2.7439 3.1942 3.1942 8.1567 8.1567 8.9520 8.9520 9.0722 9.0722 9.1499 9.1499 9.7279 9.7279 10.9994 10.9994 11.1700 11.1700 12.2039 12.2039 13.1169 13.1169 14.4005 14.4005 14.6518 14.6518 15.0346 15.0346 15.3018 15.3018 16.0890 16.0890 16.8032 16.8032 17.4571 17.4571 17.6797 17.6797 k = 0.4231 0.1977 0.0000 ( 4560 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4894 -13.4894 -0.2339 -0.2339 1.1615 1.1615 2.0264 2.0264 2.7940 2.7940 3.1551 3.1551 8.1647 8.1647 8.9460 8.9460 9.0712 9.0712 9.1348 9.1348 9.7280 9.7280 11.0030 11.0030 11.1724 11.1724 12.1908 12.1908 13.1541 13.1541 14.3376 14.3376 14.6607 14.6607 15.0413 15.0413 15.3119 15.3119 16.1521 16.1521 16.8031 16.8031 17.4657 17.4657 17.6870 17.6870 k = 0.4423 0.2066 0.0000 ( 4560 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4894 -13.4894 -0.2367 -0.2367 1.1571 1.1571 2.0267 2.0267 2.8431 2.8431 3.1146 3.1146 8.1709 8.1709 8.9413 8.9413 9.0721 9.0721 9.1214 9.1214 9.7281 9.7281 11.0058 11.0058 11.1743 11.1743 12.1806 12.1806 13.1868 13.1868 14.2831 14.2831 14.6676 14.6676 15.0484 15.0484 15.3201 15.3201 16.2039 16.2039 16.8029 16.8029 17.4730 17.4730 17.6924 17.6924 k = 0.4615 0.2156 0.0000 ( 4568 PWs) bands (ev): -71.2826 -71.2826 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4893 -13.4893 -0.2387 -0.2387 1.1539 1.1539 2.0269 2.0269 2.8910 2.8910 3.0728 3.0728 8.1752 8.1752 8.9378 8.9378 9.0747 9.0747 9.1099 9.1099 9.7282 9.7282 11.0079 11.0079 11.1756 11.1756 12.1732 12.1732 13.2127 13.2127 14.2406 14.2406 14.6726 14.6726 15.0543 15.0543 15.3261 15.3261 16.2425 16.2425 16.8027 16.8027 17.4787 17.4787 17.6961 17.6961 k = 0.4808 0.2246 0.0000 ( 4556 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5359 -27.5359 -27.4720 -27.4720 -27.4057 -27.4057 -13.4893 -13.4893 -0.2399 -0.2399 1.1519 1.1519 2.0270 2.0270 2.9374 2.9374 3.0302 3.0302 8.1778 8.1778 8.9358 8.9358 9.0783 9.0783 9.1009 9.1009 9.7283 9.7283 11.0091 11.0091 11.1764 11.1764 12.1688 12.1688 13.2296 13.2296 14.2136 14.2136 14.6756 14.6756 15.0583 15.0583 15.3298 15.3298 16.2664 16.2664 16.8026 16.8026 17.4825 17.4825 17.6983 17.6983 k = 0.5000 0.2336 0.0000 ( 4580 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5360 -27.5360 -27.4720 -27.4720 -27.4057 -27.4057 -13.4893 -13.4893 -0.2403 -0.2403 1.1513 1.1513 2.0270 2.0270 2.9740 2.9740 2.9949 2.9949 8.1786 8.1786 8.9350 8.9350 9.0806 9.0806 9.0968 9.0968 9.7283 9.7283 11.0095 11.0095 11.1767 11.1767 12.1673 12.1673 13.2355 13.2355 14.2043 14.2043 14.6766 14.6766 15.0596 15.0596 15.3311 15.3311 16.2744 16.2744 16.8025 16.8025 17.4837 17.4837 17.6990 17.6990 k = 0.5000 0.2336 0.0000 ( 4580 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5360 -27.5360 -27.4720 -27.4720 -27.4057 -27.4057 -13.4893 -13.4893 -0.2403 -0.2403 1.1513 1.1513 2.0270 2.0270 2.9740 2.9740 2.9949 2.9949 8.1786 8.1786 8.9350 8.9350 9.0806 9.0806 9.0968 9.0968 9.7283 9.7283 11.0095 11.0095 11.1767 11.1767 12.1673 12.1673 13.2355 13.2355 14.2043 14.2043 14.6766 14.6766 15.0596 15.0596 15.3311 15.3311 16.2744 16.2744 16.8025 16.8025 17.4837 17.4837 17.6990 17.6990 k = 0.4936 0.2472 0.0150 ( 4564 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7456 -39.7456 -39.6415 -39.6415 -27.8086 -27.8086 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4892 -13.4892 -0.2403 -0.2403 1.1515 1.1515 2.0253 2.0253 2.9728 2.9728 2.9980 2.9980 8.1805 8.1805 8.9299 8.9299 9.0642 9.0642 9.1198 9.1198 9.7300 9.7300 11.0061 11.0061 11.1732 11.1732 12.1710 12.1710 13.2340 13.2340 14.2046 14.2046 14.6741 14.6741 15.0586 15.0586 15.3284 15.3284 16.2756 16.2756 16.8008 16.8008 17.4781 17.4781 17.6931 17.6931 k = 0.4873 0.2608 0.0301 ( 4573 PWs) bands (ev): -71.2825 -71.2825 -71.2481 -71.2481 -39.7455 -39.7455 -39.6416 -39.6416 -27.8082 -27.8082 -27.5359 -27.5359 -27.4721 -27.4721 -27.4064 -27.4064 -13.4889 -13.4889 -0.2400 -0.2400 1.1522 1.1522 2.0203 2.0203 2.9706 2.9706 3.0061 3.0061 8.1860 8.1860 8.9151 8.9151 9.0493 9.0493 9.1538 9.1538 9.7353 9.7353 10.9958 10.9958 11.1631 11.1631 12.1817 12.1817 13.2297 13.2297 14.2055 14.2055 14.6666 14.6666 15.0553 15.0553 15.3205 15.3205 16.2789 16.2789 16.7951 16.7951 17.4602 17.4602 17.6777 17.6777 k = 0.4809 0.2745 0.0451 ( 4569 PWs) bands (ev): -71.2824 -71.2824 -71.2481 -71.2481 -39.7453 -39.7453 -39.6418 -39.6418 -27.8074 -27.8074 -27.5357 -27.5357 -27.4722 -27.4722 -27.4073 -27.4073 -13.4885 -13.4885 -0.2397 -0.2397 1.1533 1.1533 2.0121 2.0121 2.9685 2.9685 3.0177 3.0177 8.1952 8.1952 8.8933 8.8933 9.0409 9.0409 9.1913 9.1913 9.7440 9.7440 10.9784 10.9784 11.1474 11.1474 12.1987 12.1987 13.2226 13.2226 14.2069 14.2069 14.6542 14.6542 15.0500 15.0500 15.3076 15.3076 16.2845 16.2845 16.7854 16.7854 17.4275 17.4275 17.6591 17.6591 k = 0.4745 0.2881 0.0601 ( 4567 PWs) bands (ev): -71.2823 -71.2823 -71.2482 -71.2482 -39.7450 -39.7450 -39.6421 -39.6421 -27.8064 -27.8064 -27.5356 -27.5356 -27.4725 -27.4725 -27.4085 -27.4085 -13.4879 -13.4879 -0.2393 -0.2393 1.1549 1.1549 2.0011 2.0011 2.9668 2.9668 3.0324 3.0324 8.2080 8.2080 8.8675 8.8675 9.0373 9.0373 9.2310 9.2310 9.7562 9.7562 10.9534 10.9534 11.1274 11.1274 12.2209 12.2209 13.2128 13.2128 14.2085 14.2085 14.6373 14.6373 15.0423 15.0423 15.2904 15.2904 16.2924 16.2924 16.7712 16.7712 17.3787 17.3787 17.6427 17.6427 k = 0.4682 0.3017 0.0752 ( 4571 PWs) bands (ev): -71.2822 -71.2822 -71.2483 -71.2483 -39.7447 -39.7447 -39.6425 -39.6425 -27.8051 -27.8051 -27.5354 -27.5354 -27.4727 -27.4727 -27.4101 -27.4101 -13.4871 -13.4871 -0.2388 -0.2388 1.1568 1.1568 1.9876 1.9876 2.9655 2.9655 3.0498 3.0498 8.2243 8.2243 8.8402 8.8402 9.0367 9.0367 9.2721 9.2721 9.7717 9.7717 10.9209 10.9209 11.1044 11.1044 12.2467 12.2467 13.2004 13.2004 14.2101 14.2101 14.6159 14.6159 15.0321 15.0321 15.2696 15.2696 16.3025 16.3025 16.7520 16.7520 17.3160 17.3160 17.6307 17.6307 k = 0.4618 0.3153 0.0902 ( 4563 PWs) bands (ev): -71.2821 -71.2821 -71.2485 -71.2485 -39.7442 -39.7442 -39.6430 -39.6430 -27.8035 -27.8035 -27.5351 -27.5351 -27.4730 -27.4730 -27.4120 -27.4120 -13.4861 -13.4861 -0.2383 -0.2383 1.1592 1.1592 1.9721 1.9721 2.9645 2.9645 3.0696 3.0696 8.2440 8.2440 8.8129 8.8129 9.0383 9.0383 9.3142 9.3142 9.7905 9.7905 10.8812 10.8812 11.0793 11.0793 12.2748 12.2748 13.1860 13.1860 14.2112 14.2112 14.5906 14.5906 15.0188 15.0188 15.2467 15.2467 16.3149 16.3149 16.7274 16.7274 17.2432 17.2432 17.6226 17.6226 k = 0.4555 0.3289 0.1052 ( 4571 PWs) bands (ev): -71.2819 -71.2819 -71.2487 -71.2487 -39.7437 -39.7437 -39.6435 -39.6435 -27.8016 -27.8016 -27.5349 -27.5349 -27.4734 -27.4734 -27.4142 -27.4142 -13.4850 -13.4850 -0.2378 -0.2378 1.1619 1.1619 1.9551 1.9551 2.9637 2.9637 3.0915 3.0915 8.2670 8.2670 8.7865 8.7865 9.0416 9.0416 9.3570 9.3570 9.8123 9.8123 10.8349 10.8349 11.0526 11.0526 12.3037 12.3037 13.1698 13.1698 14.2113 14.2113 14.5617 14.5617 15.0009 15.0009 15.2234 15.2234 16.3296 16.3296 16.6968 16.6968 17.1644 17.1644 17.6173 17.6173 k = 0.4491 0.3426 0.1203 ( 4567 PWs) bands (ev): -71.2817 -71.2817 -71.2489 -71.2489 -39.7431 -39.7431 -39.6442 -39.6442 -27.7994 -27.7994 -27.5345 -27.5345 -27.4738 -27.4738 -27.4168 -27.4168 -13.4837 -13.4837 -0.2375 -0.2375 1.1650 1.1650 1.9370 1.9370 2.9631 2.9631 3.1152 3.1152 8.2932 8.2932 8.7616 8.7616 9.0462 9.0462 9.4001 9.4001 9.8373 9.8373 10.7830 10.7830 11.0244 11.0244 12.3319 12.3319 13.1525 13.1525 14.2094 14.2094 14.5298 14.5298 14.9771 14.9771 15.2024 15.2024 16.3464 16.3464 16.6602 16.6602 17.0824 17.0824 17.6137 17.6137 k = 0.4427 0.3562 0.1353 ( 4567 PWs) bands (ev): -71.2814 -71.2814 -71.2491 -71.2491 -39.7424 -39.7424 -39.6449 -39.6449 -27.7969 -27.7969 -27.5342 -27.5342 -27.4743 -27.4743 -27.4197 -27.4197 -13.4823 -13.4823 -0.2373 -0.2373 1.1684 1.1684 1.9184 1.9184 2.9625 2.9625 3.1404 3.1404 8.3223 8.3223 8.7387 8.7387 9.0522 9.0522 9.4434 9.4434 9.8649 9.8649 10.7264 10.7264 10.9946 10.9946 12.3580 12.3580 13.1350 13.1350 14.2047 14.2047 14.4956 14.4956 14.9456 14.9456 15.1858 15.1858 16.3651 16.3651 16.6177 16.6177 16.9996 16.9996 17.6112 17.6112 k = 0.4364 0.3698 0.1503 ( 4575 PWs) bands (ev): -71.2812 -71.2812 -71.2493 -71.2493 -39.7417 -39.7417 -39.6457 -39.6457 -27.7941 -27.7941 -27.5337 -27.5337 -27.4749 -27.4749 -27.4229 -27.4229 -13.4807 -13.4807 -0.2374 -0.2374 1.1720 1.1720 1.8997 1.8997 2.9619 2.9619 3.1668 3.1668 8.3542 8.3542 8.7181 8.7181 9.0595 9.0595 9.4867 9.4867 9.8952 9.8952 10.6660 10.6660 10.9633 10.9633 12.3806 12.3806 13.1180 13.1180 14.1958 14.1958 14.4599 14.4599 14.9055 14.9055 15.1754 15.1754 16.3852 16.3852 16.5698 16.5698 16.9174 16.9174 17.6092 17.6092 k = 0.4300 0.3834 0.1654 ( 4575 PWs) bands (ev): -71.2809 -71.2809 -71.2496 -71.2496 -39.7408 -39.7408 -39.6465 -39.6465 -27.7911 -27.7911 -27.5333 -27.5333 -27.4755 -27.4755 -27.4265 -27.4265 -13.4791 -13.4791 -0.2379 -0.2379 1.1758 1.1758 1.8813 1.8813 2.9613 2.9613 3.1941 3.1941 8.3884 8.3884 8.7002 8.7002 9.0680 9.0680 9.5298 9.5298 9.9279 9.9279 10.6028 10.6028 10.9303 10.9303 12.3984 12.3984 13.1026 13.1026 14.1812 14.1812 14.4240 14.4240 14.8572 14.8572 15.1713 15.1713 16.4056 16.4056 16.5173 16.5173 16.8373 16.8373 17.6069 17.6069 k = 0.4236 0.3970 0.1804 ( 4583 PWs) bands (ev): -71.2806 -71.2806 -71.2499 -71.2499 -39.7399 -39.7399 -39.6475 -39.6475 -27.7878 -27.7878 -27.5328 -27.5328 -27.4761 -27.4761 -27.4303 -27.4303 -13.4773 -13.4773 -0.2387 -0.2387 1.1798 1.1798 1.8636 1.8636 2.9606 2.9606 3.2220 3.2220 8.4247 8.4247 8.6854 8.6854 9.0779 9.0779 9.5725 9.5725 9.9625 9.9625 10.5377 10.5377 10.8958 10.8958 12.4103 12.4103 13.0894 13.0894 14.1593 14.1593 14.3891 14.3891 14.8017 14.8017 15.1731 15.1731 16.4244 16.4244 16.4616 16.4616 16.7605 16.7605 17.6028 17.6028 k = 0.4173 0.4107 0.1954 ( 4587 PWs) bands (ev): -71.2803 -71.2803 -71.2503 -71.2503 -39.7390 -39.7390 -39.6485 -39.6485 -27.7842 -27.7842 -27.5323 -27.5323 -27.4768 -27.4768 -27.4345 -27.4345 -13.4754 -13.4754 -0.2401 -0.2401 1.1838 1.1838 1.8470 1.8470 2.9599 2.9599 3.2503 3.2503 8.4623 8.4623 8.6744 8.6744 9.0892 9.0892 9.6147 9.6147 9.9983 9.9983 10.4718 10.4718 10.8598 10.8598 12.4156 12.4156 13.0790 13.0790 14.1290 14.1290 14.3558 14.3558 14.7404 14.7404 15.1799 15.1799 16.4019 16.4019 16.4405 16.4405 16.6888 16.6888 17.5930 17.5930 k = 0.4109 0.4243 0.2105 ( 4591 PWs) bands (ev): -71.2799 -71.2799 -71.2506 -71.2506 -39.7379 -39.7379 -39.6496 -39.6496 -27.7804 -27.7804 -27.5317 -27.5317 -27.4776 -27.4776 -27.4389 -27.4389 -13.4734 -13.4734 -0.2420 -0.2420 1.1879 1.1879 1.8319 1.8319 2.9590 2.9590 3.2787 3.2787 8.5001 8.5001 8.6680 8.6680 9.1018 9.1018 9.6562 9.6562 10.0340 10.0340 10.4069 10.4069 10.8225 10.8225 12.4140 12.4140 13.0714 13.0714 14.0901 14.0901 14.3238 14.3238 14.6747 14.6747 15.1907 15.1907 16.3429 16.3429 16.4447 16.4447 16.6257 16.6257 17.5678 17.5678 k = 0.4046 0.4379 0.2255 ( 4591 PWs) bands (ev): -71.2796 -71.2796 -71.2510 -71.2510 -39.7368 -39.7368 -39.6508 -39.6508 -27.7763 -27.7763 -27.5311 -27.5311 -27.4783 -27.4783 -27.4437 -27.4437 -13.4713 -13.4713 -0.2445 -0.2445 1.1918 1.1918 1.8184 1.8184 2.9581 2.9581 3.3071 3.3071 8.5360 8.5360 8.6682 8.6682 9.1159 9.1159 9.6968 9.6968 10.0666 10.0666 10.3464 10.3464 10.7841 10.7841 12.4058 12.4058 13.0660 13.0660 14.0436 14.0436 14.2915 14.2915 14.6065 14.6065 15.2046 15.2046 16.2839 16.2839 16.4303 16.4303 16.5768 16.5768 17.5190 17.5190 k = 0.3982 0.4515 0.2405 ( 4595 PWs) bands (ev): -71.2792 -71.2792 -71.2514 -71.2514 -39.7356 -39.7356 -39.6520 -39.6520 -27.7719 -27.7719 -27.5304 -27.5304 -27.4792 -27.4792 -27.4486 -27.4486 -13.4692 -13.4692 -0.2476 -0.2476 1.1957 1.1957 1.8070 1.8070 2.9570 2.9570 3.3351 3.3351 8.5666 8.5666 8.6782 8.6782 9.1314 9.1314 9.7364 9.7364 10.0878 10.0878 10.2987 10.2987 10.7448 10.7448 12.3918 12.3918 13.0619 13.0619 13.9908 13.9908 14.2566 14.2566 14.5375 14.5375 15.2207 15.2207 16.2259 16.2259 16.3931 16.3931 16.5419 16.5419 17.4647 17.4647 k = 0.3918 0.4651 0.2556 ( 4595 PWs) bands (ev): -71.2787 -71.2787 -71.2518 -71.2518 -39.7344 -39.7344 -39.6533 -39.6533 -27.7673 -27.7673 -27.5297 -27.5297 -27.4801 -27.4801 -27.4539 -27.4539 -13.4670 -13.4670 -0.2514 -0.2514 1.1993 1.1993 1.7978 1.7978 2.9559 2.9559 3.3627 3.3627 8.5885 8.5885 8.7012 8.7012 9.1484 9.1484 9.7747 9.7747 10.0816 10.0816 10.2803 10.2803 10.7051 10.7051 12.3729 12.3729 13.0575 13.0575 13.9332 13.9332 14.2159 14.2159 14.4702 14.4702 15.2380 15.2380 16.1699 16.1699 16.3421 16.3421 16.5087 16.5087 17.4274 17.4274 k = 0.3855 0.4788 0.2706 ( 4601 PWs) bands (ev): -71.2783 -71.2783 -71.2523 -71.2523 -39.7331 -39.7331 -39.6547 -39.6547 -27.7625 -27.7625 -27.5290 -27.5290 -27.4810 -27.4810 -27.4594 -27.4594 -13.4647 -13.4647 -0.2559 -0.2559 1.2026 1.2026 1.7909 1.7909 2.9546 2.9546 3.3897 3.3897 8.6031 8.6031 8.7353 8.7353 9.1668 9.1668 9.8114 9.8114 10.0431 10.0431 10.2963 10.2963 10.6655 10.6655 12.3504 12.3504 13.0515 13.0515 13.8722 13.8722 14.1666 14.1666 14.4073 14.4073 15.2553 15.2553 16.1163 16.1163 16.2871 16.2871 16.4676 16.4676 17.4155 17.4155 k = 0.3791 0.4924 0.2856 ( 4601 PWs) bands (ev): -71.2778 -71.2778 -71.2527 -71.2527 -39.7317 -39.7317 -39.6561 -39.6561 -27.7574 -27.7574 -27.5282 -27.5282 -27.4820 -27.4820 -27.4651 -27.4651 -13.4625 -13.4625 -0.2611 -0.2611 1.2055 1.2055 1.7865 1.7865 2.9533 2.9533 3.4157 3.4157 8.6146 8.6146 8.7756 8.7756 9.1867 9.1867 9.8459 9.8459 9.9884 9.9884 10.3307 10.3307 10.6272 10.6272 12.3253 12.3253 13.0425 13.0425 13.8089 13.8089 14.1067 14.1067 14.3507 14.3507 15.2716 15.2716 16.0651 16.0651 16.2329 16.2329 16.4177 16.4177 17.4279 17.4279 k = 0.3727 0.5060 0.3007 ( 4605 PWs) bands (ev): -71.2773 -71.2773 -71.2532 -71.2532 -39.7302 -39.7302 -39.6576 -39.6576 -27.7520 -27.7520 -27.5274 -27.5274 -27.4832 -27.4832 -27.4710 -27.4710 -13.4602 -13.4602 -0.2669 -0.2669 1.2081 1.2081 1.7846 1.7846 2.9520 2.9520 3.4408 3.4408 8.6262 8.6262 8.8184 8.8184 9.2078 9.2078 9.8740 9.8740 9.9330 9.9330 10.3702 10.3702 10.5931 10.5931 12.2986 12.2986 13.0290 13.0290 13.7441 13.7441 14.0361 14.0361 14.3005 14.3005 15.2854 15.2854 16.0158 16.0158 16.1817 16.1817 16.3638 16.3638 17.4573 17.4573 k = 0.3664 0.5196 0.3157 ( 4613 PWs) bands (ev): -71.2768 -71.2768 -71.2537 -71.2537 -39.7288 -39.7288 -39.6592 -39.6592 -27.7465 -27.7465 -27.5266 -27.5266 -27.4845 -27.4845 -27.4769 -27.4769 -13.4579 -13.4579 -0.2734 -0.2734 1.2102 1.2102 1.7852 1.7852 2.9507 2.9507 3.4646 3.4646 8.6394 8.6394 8.8612 8.8612 9.2301 9.2301 9.8547 9.8547 9.9231 9.9231 10.4034 10.4034 10.5706 10.5706 12.2713 12.2713 13.0101 13.0101 13.6785 13.6785 13.9570 13.9570 14.2548 14.2548 15.2950 15.2950 15.9676 15.9676 16.1350 16.1350 16.3125 16.3125 17.4903 17.4903 k = 0.3600 0.5332 0.3307 ( 4605 PWs) bands (ev): -71.2763 -71.2763 -71.2543 -71.2543 -39.7272 -39.7272 -39.6608 -39.6608 -27.7407 -27.7407 -27.5257 -27.5257 -27.4866 -27.4866 -27.4822 -27.4822 -13.4557 -13.4557 -0.2805 -0.2805 1.2120 1.2120 1.7883 1.7883 2.9495 2.9495 3.4870 3.4870 8.6549 8.6549 8.9021 8.9021 9.2533 9.2533 9.8011 9.8011 9.9485 9.9485 10.4136 10.4136 10.5748 10.5748 12.2441 12.2441 12.9853 12.9853 13.6128 13.6128 13.8717 13.8717 14.2119 14.2119 15.2988 15.2988 15.9194 15.9194 16.0937 16.0937 16.2704 16.2704 17.5110 17.5110 k = 0.3536 0.5469 0.3458 ( 4605 PWs) bands (ev): -71.2758 -71.2758 -71.2548 -71.2548 -39.7256 -39.7256 -39.6624 -39.6624 -27.7348 -27.7348 -27.5248 -27.5248 -27.4915 -27.4915 -27.4851 -27.4851 -13.4535 -13.4535 -0.2880 -0.2880 1.2133 1.2133 1.7936 1.7936 2.9484 2.9484 3.5079 3.5079 8.6730 8.6730 8.9390 8.9390 9.2768 9.2768 9.7503 9.7503 9.9747 9.9747 10.3964 10.3964 10.6099 10.6099 12.2175 12.2175 12.9542 12.9542 13.5473 13.5473 13.7823 13.7823 14.1700 14.1700 15.2952 15.2952 15.8705 15.8705 16.0585 16.0585 16.2424 16.2424 17.5120 17.5120 k = 0.3473 0.5605 0.3608 ( 4605 PWs) bands (ev): -71.2752 -71.2752 -71.2553 -71.2553 -39.7239 -39.7239 -39.6641 -39.6641 -27.7286 -27.7286 -27.5239 -27.5239 -27.4978 -27.4978 -27.4866 -27.4866 -13.4513 -13.4513 -0.2959 -0.2959 1.2143 1.2143 1.8011 1.8011 2.9477 2.9477 3.5270 3.5270 8.6938 8.6938 8.9696 8.9696 9.3002 9.3002 9.7080 9.7080 9.9982 9.9982 10.3657 10.3657 10.6620 10.6620 12.1919 12.1919 12.9170 12.9170 13.4823 13.4823 13.6904 13.6904 14.1284 14.1284 15.2830 15.2830 15.8213 15.8213 16.0297 16.0297 16.2309 16.2309 17.4972 17.4972 k = 0.3409 0.5741 0.3758 ( 4607 PWs) bands (ev): -71.2746 -71.2746 -71.2559 -71.2559 -39.7222 -39.7222 -39.6659 -39.6659 -27.7222 -27.7222 -27.5231 -27.5231 -27.5046 -27.5046 -27.4879 -27.4879 -13.4492 -13.4492 -0.3042 -0.3042 1.2149 1.2149 1.8105 1.8105 2.9473 2.9473 3.5441 3.5441 8.7173 8.7173 8.9914 8.9914 9.3230 9.3230 9.6778 9.6778 10.0180 10.0180 10.3312 10.3312 10.7218 10.7218 12.1675 12.1675 12.8743 12.8743 13.4178 13.4178 13.5972 13.5972 14.0863 14.0863 15.2621 15.2621 15.7729 15.7729 16.0077 16.0077 16.2363 16.2363 17.4713 17.4713 k = 0.3346 0.5877 0.3909 ( 4607 PWs) bands (ev): -71.2740 -71.2740 -71.2565 -71.2565 -39.7205 -39.7205 -39.6677 -39.6677 -27.7156 -27.7156 -27.5223 -27.5223 -27.5115 -27.5115 -27.4891 -27.4891 -13.4471 -13.4471 -0.3126 -0.3126 1.2152 1.2152 1.8215 1.8215 2.9473 2.9473 3.5592 3.5592 8.7433 8.7433 9.0019 9.0019 9.3454 9.3454 9.6622 9.6622 10.0326 10.0326 10.2974 10.2974 10.7861 10.7861 12.1447 12.1447 12.8270 12.8270 13.3538 13.3538 13.5036 13.5036 14.0438 14.0438 15.2330 15.2330 15.7264 15.7264 15.9922 15.9922 16.2576 16.2576 17.4373 17.4373 k = 0.3282 0.6013 0.4059 ( 4603 PWs) bands (ev): -71.2734 -71.2734 -71.2571 -71.2571 -39.7187 -39.7187 -39.6695 -39.6695 -27.7089 -27.7089 -27.5224 -27.5224 -27.5175 -27.5175 -27.4903 -27.4903 -13.4452 -13.4452 -0.3212 -0.3212 1.2153 1.2153 1.8338 1.8338 2.9480 2.9480 3.5720 3.5720 8.7713 8.7713 8.9997 8.9997 9.3683 9.3683 9.6618 9.6618 10.0403 10.0403 10.2673 10.2673 10.8534 10.8534 12.1235 12.1235 12.7761 12.7761 13.2902 13.2902 13.4109 13.4109 14.0008 14.0008 15.1971 15.1971 15.6827 15.6827 15.9833 15.9833 16.2929 16.2929 17.3968 17.3968 k = 0.3218 0.6150 0.4209 ( 4603 PWs) bands (ev): -71.2728 -71.2728 -71.2577 -71.2577 -39.7168 -39.7168 -39.6714 -39.6714 -27.7020 -27.7020 -27.5274 -27.5274 -27.5189 -27.5189 -27.4916 -27.4916 -13.4434 -13.4434 -0.3296 -0.3296 1.2152 1.2152 1.8472 1.8472 2.9495 2.9495 3.5824 3.5824 8.8003 8.8003 8.9861 8.9861 9.3930 9.3930 9.6747 9.6747 10.0386 10.0386 10.2437 10.2437 10.9229 10.9229 12.1038 12.1038 12.7229 12.7229 13.2263 13.2263 13.3204 13.3204 13.9574 13.9574 15.1561 15.1561 15.6423 15.6423 15.9804 15.9804 16.3402 16.3402 17.3511 17.3511 k = 0.3155 0.6286 0.4360 ( 4603 PWs) bands (ev): -71.2722 -71.2722 -71.2583 -71.2583 -39.7150 -39.7150 -39.6733 -39.6733 -27.6950 -27.6950 -27.5346 -27.5346 -27.5182 -27.5182 -27.4928 -27.4928 -13.4416 -13.4416 -0.3380 -0.3380 1.2149 1.2149 1.8613 1.8613 2.9519 2.9519 3.5902 3.5902 8.8275 8.8275 8.9661 8.9661 9.4203 9.4203 9.6974 9.6974 10.0264 10.0264 10.2284 10.2284 10.9942 10.9942 12.0857 12.0857 12.6687 12.6687 13.1603 13.1603 13.2350 13.2350 13.9138 13.9138 15.1117 15.1117 15.6052 15.6052 15.9832 15.9832 16.3978 16.3978 17.3013 17.3013 k = 0.3091 0.6422 0.4510 ( 4611 PWs) bands (ev): -71.2716 -71.2716 -71.2590 -71.2590 -39.7131 -39.7131 -39.6753 -39.6753 -27.6878 -27.6878 -27.5421 -27.5421 -27.5171 -27.5171 -27.4941 -27.4941 -13.4400 -13.4400 -0.3460 -0.3460 1.2145 1.2145 1.8758 1.8758 2.9553 2.9553 3.5953 3.5953 8.8441 8.8441 8.9515 8.9515 9.4502 9.4502 9.7262 9.7262 10.0046 10.0046 10.2204 10.2204 11.0669 11.0669 12.0687 12.0687 12.6148 12.6148 13.0889 13.0889 13.1591 13.1591 13.8705 13.8705 15.0654 15.0654 15.5714 15.5714 15.9912 15.9912 16.4639 16.4639 17.2484 17.2484 k = 0.3027 0.6558 0.4660 ( 4603 PWs) bands (ev): -71.2709 -71.2709 -71.2596 -71.2596 -39.7111 -39.7111 -39.6772 -39.6772 -27.6805 -27.6805 -27.5498 -27.5498 -27.5161 -27.5161 -27.4953 -27.4953 -13.4386 -13.4386 -0.3537 -0.3537 1.2140 1.2140 1.8904 1.8904 2.9600 2.9600 3.5974 3.5974 8.8351 8.8351 8.9602 8.9602 9.4822 9.4822 9.7577 9.7577 9.9762 9.9762 10.2172 10.2172 11.1408 11.1408 12.0528 12.0528 12.5626 12.5626 13.0109 13.0109 13.0952 13.0952 13.8277 13.8277 15.0183 15.0183 15.5409 15.5409 16.0040 16.0040 16.5372 16.5372 17.1932 17.1932 k = 0.2964 0.6694 0.4811 ( 4603 PWs) bands (ev): -71.2702 -71.2702 -71.2603 -71.2603 -39.7092 -39.7092 -39.6792 -39.6792 -27.6730 -27.6730 -27.5576 -27.5576 -27.5149 -27.5149 -27.4966 -27.4966 -13.4372 -13.4372 -0.3608 -0.3608 1.2134 1.2134 1.9047 1.9047 2.9661 2.9661 3.5966 3.5966 8.8051 8.8051 8.9899 8.9899 9.5159 9.5159 9.7884 9.7884 9.9450 9.9450 10.2161 10.2161 11.2155 11.2155 12.0372 12.0372 12.5134 12.5134 12.9301 12.9301 13.0409 13.0409 13.7857 13.7857 14.9711 14.9711 15.5136 15.5136 16.0211 16.0211 16.6166 16.6166 17.1365 17.1365 k = 0.2900 0.6831 0.4961 ( 4609 PWs) bands (ev): -71.2696 -71.2696 -71.2610 -71.2610 -39.7072 -39.7072 -39.6813 -39.6813 -27.6655 -27.6655 -27.5655 -27.5655 -27.5138 -27.5138 -27.4979 -27.4979 -13.4361 -13.4361 -0.3673 -0.3673 1.2127 1.2127 1.9184 1.9184 2.9737 2.9737 3.5927 3.5927 8.7672 8.7672 9.0286 9.0286 9.5507 9.5507 9.8137 9.8137 9.9159 9.9159 10.2149 10.2149 11.2907 11.2907 12.0212 12.0212 12.4688 12.4688 12.8506 12.8506 12.9937 12.9937 13.7449 13.7449 14.9244 14.9244 15.4894 15.4894 16.0422 16.0422 16.7009 16.7009 17.0793 17.0793 k = 0.2836 0.6967 0.5111 ( 4603 PWs) bands (ev): -71.2689 -71.2689 -71.2616 -71.2616 -39.7052 -39.7052 -39.6833 -39.6833 -27.6578 -27.6578 -27.5735 -27.5735 -27.5126 -27.5126 -27.4992 -27.4992 -13.4351 -13.4351 -0.3732 -0.3732 1.2121 1.2121 1.9314 1.9314 2.9829 2.9829 3.5857 3.5857 8.7276 8.7276 9.0715 9.0715 9.5860 9.5860 9.8217 9.8217 9.9002 9.9002 10.2127 10.2127 11.3659 11.3659 12.0038 12.0038 12.4303 12.4303 12.7751 12.7751 12.9529 12.9529 13.7058 13.7058 14.8786 14.8786 15.4685 15.4685 16.0668 16.0668 16.7886 16.7886 17.0227 17.0227 k = 0.2773 0.7103 0.5262 ( 4595 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6500 -27.6500 -27.5815 -27.5815 -27.5113 -27.5113 -27.5005 -27.5005 -13.4342 -13.4342 -0.3782 -0.3782 1.2114 1.2114 1.9432 1.9432 2.9939 2.9939 3.5754 3.5754 8.6885 8.6885 9.1169 9.1169 9.6213 9.6213 9.8030 9.8030 9.9072 9.9072 10.2088 10.2088 11.4407 11.4407 11.9835 11.9835 12.3994 12.3994 12.7056 12.7056 12.9181 12.9181 13.6686 13.6686 14.8339 14.8339 15.4507 15.4507 16.0945 16.0945 16.8737 16.8737 16.9726 16.9726 k = 0.2773 0.7103 0.5262 ( 4595 PWs) bands (ev): -71.2682 -71.2682 -71.2623 -71.2623 -39.7031 -39.7031 -39.6854 -39.6854 -27.6500 -27.6500 -27.5815 -27.5815 -27.5113 -27.5113 -27.5005 -27.5005 -13.4342 -13.4342 -0.3782 -0.3782 1.2114 1.2114 1.9432 1.9432 2.9939 2.9939 3.5754 3.5754 8.6885 8.6885 9.1169 9.1169 9.6213 9.6213 9.8030 9.8030 9.9072 9.9072 10.2088 10.2088 11.4407 11.4407 11.9835 11.9835 12.3994 12.3994 12.7056 12.7056 12.9181 12.9181 13.6686 13.6686 14.8339 14.8339 15.4507 15.4507 16.0945 16.0945 16.8737 16.8737 16.9726 16.9726 k = 0.2575 0.7061 0.5308 ( 4598 PWs) bands (ev): -71.2680 -71.2680 -71.2625 -71.2625 -39.7025 -39.7025 -39.6860 -39.6860 -27.6476 -27.6476 -27.5839 -27.5839 -27.5110 -27.5110 -27.5009 -27.5009 -13.4340 -13.4340 -0.3796 -0.3796 1.2112 1.2112 1.9467 1.9467 2.9977 2.9977 3.5712 3.5712 8.6769 8.6769 9.1309 9.1309 9.6314 9.6314 9.7945 9.7945 9.9124 9.9124 10.2067 10.2067 11.4637 11.4637 11.9768 11.9768 12.3924 12.3924 12.6857 12.6857 12.9091 12.9091 13.6529 13.6529 14.8255 14.8255 15.4449 15.4449 16.1011 16.1011 16.8944 16.8944 16.9682 16.9682 k = 0.2377 0.7020 0.5354 ( 4600 PWs) bands (ev): -71.2678 -71.2678 -71.2627 -71.2627 -39.7019 -39.7019 -39.6866 -39.6866 -27.6452 -27.6452 -27.5864 -27.5864 -27.5106 -27.5106 -27.5013 -27.5013 -13.4338 -13.4338 -0.3809 -0.3809 1.2111 1.2111 1.9504 1.9504 3.0020 3.0020 3.5662 3.5662 8.6658 8.6658 9.1444 9.1444 9.6401 9.6401 9.7863 9.7863 9.9191 9.9191 10.2036 10.2036 11.4873 11.4873 11.9701 11.9701 12.3879 12.3879 12.6664 12.6664 12.9015 12.9015 13.6283 13.6283 14.8270 14.8270 15.4372 15.4372 16.1036 16.1036 16.9067 16.9067 16.9811 16.9811 k = 0.2179 0.6978 0.5400 ( 4598 PWs) bands (ev): -71.2676 -71.2676 -71.2629 -71.2629 -39.7012 -39.7012 -39.6873 -39.6873 -27.6428 -27.6428 -27.5889 -27.5889 -27.5102 -27.5102 -27.5017 -27.5017 -13.4336 -13.4336 -0.3821 -0.3821 1.2109 1.2109 1.9542 1.9542 3.0065 3.0065 3.5605 3.5605 8.6554 8.6554 9.1568 9.1568 9.6471 9.6471 9.7793 9.7793 9.9271 9.9271 10.1993 10.1993 11.5114 11.5114 11.9630 11.9630 12.3860 12.3860 12.6478 12.6478 12.8955 12.8955 13.5957 13.5957 14.8374 14.8374 15.4281 15.4281 16.1023 16.1023 16.9128 16.9128 17.0076 17.0076 k = 0.1981 0.6936 0.5446 ( 4596 PWs) bands (ev): -71.2674 -71.2674 -71.2631 -71.2631 -39.7006 -39.7006 -39.6879 -39.6879 -27.6404 -27.6404 -27.5913 -27.5913 -27.5098 -27.5098 -27.5021 -27.5021 -13.4335 -13.4335 -0.3833 -0.3833 1.2107 1.2107 1.9581 1.9581 3.0111 3.0111 3.5542 3.5542 8.6460 8.6460 9.1680 9.1680 9.6523 9.6523 9.7738 9.7738 9.9360 9.9360 10.1940 10.1940 11.5359 11.5359 11.9552 11.9552 12.3867 12.3867 12.6300 12.6300 12.8914 12.8914 13.5566 13.5566 14.8552 14.8552 15.4178 15.4178 16.0979 16.0979 16.9197 16.9197 17.0395 17.0395 k = 0.1783 0.6895 0.5492 ( 4592 PWs) bands (ev): -71.2672 -71.2672 -71.2633 -71.2633 -39.7000 -39.7000 -39.6885 -39.6885 -27.6380 -27.6380 -27.5938 -27.5938 -27.5094 -27.5094 -27.5024 -27.5024 -13.4333 -13.4333 -0.3844 -0.3844 1.2105 1.2105 1.9619 1.9619 3.0159 3.0159 3.5476 3.5476 8.6376 8.6376 9.1778 9.1778 9.6556 9.6556 9.7701 9.7701 9.9457 9.9457 10.1876 10.1876 11.5609 11.5609 11.9464 11.9464 12.3898 12.3898 12.6131 12.6131 12.8895 12.8895 13.5126 13.5126 14.8787 14.8787 15.4069 15.4069 16.0906 16.0906 16.9299 16.9299 17.0721 17.0721 k = 0.1584 0.6853 0.5538 ( 4592 PWs) bands (ev): -71.2669 -71.2669 -71.2636 -71.2636 -39.6993 -39.6993 -39.6892 -39.6892 -27.6355 -27.6355 -27.5962 -27.5962 -27.5091 -27.5091 -27.5028 -27.5028 -13.4332 -13.4332 -0.3854 -0.3854 1.2103 1.2103 1.9656 1.9656 3.0206 3.0206 3.5410 3.5410 8.6303 8.6303 9.1860 9.1860 9.6571 9.6571 9.7682 9.7682 9.9560 9.9560 10.1803 10.1803 11.5862 11.5862 11.9362 11.9362 12.3954 12.3954 12.5972 12.5972 12.8900 12.8900 13.4653 13.4653 14.9058 14.9058 15.3959 15.3959 16.0810 16.0810 16.9440 16.9440 17.1036 17.1036 k = 0.1386 0.6811 0.5584 ( 4588 PWs) bands (ev): -71.2667 -71.2667 -71.2638 -71.2638 -39.6987 -39.6987 -39.6898 -39.6898 -27.6331 -27.6331 -27.5987 -27.5987 -27.5087 -27.5087 -27.5032 -27.5032 -13.4331 -13.4331 -0.3863 -0.3863 1.2102 1.2102 1.9690 1.9690 3.0252 3.0252 3.5344 3.5344 8.6241 8.6241 9.1929 9.1929 9.6572 9.6572 9.7680 9.7680 9.9667 9.9667 10.1723 10.1723 11.6117 11.6117 11.9244 11.9244 12.4029 12.4029 12.5822 12.5822 12.8932 12.8932 13.4162 13.4162 14.9347 14.9347 15.3856 15.3856 16.0695 16.0695 16.9614 16.9614 17.1327 17.1327 k = 0.1188 0.6769 0.5630 ( 4590 PWs) bands (ev): -71.2665 -71.2665 -71.2640 -71.2640 -39.6981 -39.6981 -39.6904 -39.6904 -27.6307 -27.6307 -27.6012 -27.6012 -27.5083 -27.5083 -27.5036 -27.5036 -13.4330 -13.4330 -0.3871 -0.3871 1.2100 1.2100 1.9722 1.9722 3.0295 3.0295 3.5281 3.5281 8.6190 8.6190 9.1983 9.1983 9.6561 9.6561 9.7689 9.7689 9.9776 9.9776 10.1636 10.1636 11.6373 11.6373 11.9110 11.9110 12.4120 12.4120 12.5683 12.5683 12.8992 12.8992 13.3667 13.3667 14.9636 14.9636 15.3763 15.3763 16.0569 16.0569 16.9810 16.9810 17.1586 17.1586 k = 0.0990 0.6728 0.5676 ( 4588 PWs) bands (ev): -71.2663 -71.2663 -71.2642 -71.2642 -39.6974 -39.6974 -39.6911 -39.6911 -27.6282 -27.6282 -27.6036 -27.6036 -27.5079 -27.5079 -27.5040 -27.5040 -13.4329 -13.4329 -0.3877 -0.3877 1.2099 1.2099 1.9751 1.9751 3.0334 3.0334 3.5224 3.5224 8.6148 8.6148 9.2025 9.2025 9.6544 9.6544 9.7706 9.7706 9.9885 9.9885 10.1547 10.1547 11.6629 11.6629 11.8960 11.8960 12.4221 12.4221 12.5554 12.5554 12.9083 12.9083 13.3184 13.3184 14.9908 14.9908 15.3687 15.3687 16.0439 16.0439 17.0016 17.0016 17.1809 17.1809 k = 0.0792 0.6686 0.5722 ( 4584 PWs) bands (ev): -71.2661 -71.2661 -71.2644 -71.2644 -39.6968 -39.6968 -39.6917 -39.6917 -27.6258 -27.6258 -27.6061 -27.6061 -27.5075 -27.5075 -27.5044 -27.5044 -13.4328 -13.4328 -0.3883 -0.3883 1.2098 1.2098 1.9775 1.9775 3.0369 3.0369 3.5174 3.5174 8.6115 8.6115 9.2057 9.2057 9.6526 9.6526 9.7725 9.7725 9.9990 9.9990 10.1457 10.1457 11.6880 11.6880 11.8796 11.8796 12.4326 12.4326 12.5437 12.5437 12.9201 12.9201 13.2725 13.2725 15.0149 15.0149 15.3631 15.3631 16.0314 16.0314 17.0217 17.0217 17.1991 17.1991 k = 0.0594 0.6644 0.5768 ( 4578 PWs) bands (ev): -71.2659 -71.2659 -71.2646 -71.2646 -39.6962 -39.6962 -39.6923 -39.6923 -27.6233 -27.6233 -27.6086 -27.6086 -27.5071 -27.5071 -27.5048 -27.5048 -13.4328 -13.4328 -0.3888 -0.3888 1.2097 1.2097 1.9794 1.9794 3.0396 3.0396 3.5133 3.5133 8.6091 8.6091 9.2079 9.2079 9.6508 9.6508 9.7744 9.7744 10.0086 10.0086 10.1373 10.1373 11.7125 11.7125 11.8619 11.8619 12.4429 12.4429 12.5332 12.5332 12.9340 12.9340 13.2311 13.2311 15.0345 15.0345 15.3593 15.3593 16.0202 16.0202 17.0397 17.0397 17.2130 17.2130 k = 0.0396 0.6603 0.5814 ( 4578 PWs) bands (ev): -71.2657 -71.2657 -71.2648 -71.2648 -39.6955 -39.6955 -39.6930 -39.6930 -27.6209 -27.6209 -27.6110 -27.6110 -27.5067 -27.5067 -27.5052 -27.5052 -13.4327 -13.4327 -0.3891 -0.3891 1.2097 1.2097 1.9808 1.9808 3.0417 3.0417 3.5102 3.5102 8.6074 8.6074 9.2094 9.2094 9.6494 9.6494 9.7760 9.7760 10.0165 10.0165 10.1302 10.1302 11.7355 11.7355 11.8438 11.8438 12.4519 12.4519 12.5243 12.5243 12.9483 12.9483 13.1964 13.1964 15.0490 15.0490 15.3572 15.3572 16.0113 16.0113 17.0541 17.0541 17.2228 17.2228 k = 0.0198 0.6561 0.5860 ( 4578 PWs) bands (ev): -71.2654 -71.2654 -71.2650 -71.2650 -39.6949 -39.6949 -39.6936 -39.6936 -27.6184 -27.6184 -27.6135 -27.6135 -27.5063 -27.5063 -27.5056 -27.5056 -13.4327 -13.4327 -0.3893 -0.3893 1.2096 1.2096 1.9817 1.9817 3.0430 3.0430 3.5084 3.5084 8.6064 8.6064 9.2102 9.2102 9.6485 9.6485 9.7770 9.7770 10.0220 10.0220 10.1253 10.1253 11.7550 11.7550 11.8272 11.8272 12.4586 12.4586 12.5180 12.5180 12.9599 12.9599 13.1723 13.1723 15.0578 15.0578 15.3562 15.3562 16.0056 16.0056 17.0634 17.0634 17.2286 17.2286 k = 0.0000 0.6519 0.5906 ( 4580 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6942 -39.6942 -39.6942 -39.6942 -27.6160 -27.6160 -27.6160 -27.6160 -27.5060 -27.5060 -27.5060 -27.5060 -13.4327 -13.4327 -0.3893 -0.3893 1.2096 1.2096 1.9820 1.9820 3.0434 3.0434 3.5077 3.5077 8.6060 8.6060 9.2105 9.2105 9.6482 9.6482 9.7773 9.7773 10.0239 10.0239 10.1235 10.1235 11.7641 11.7641 11.8191 11.8191 12.4612 12.4612 12.5155 12.5155 12.9646 12.9646 13.1635 13.1635 15.0607 15.0607 15.3559 15.3559 16.0036 16.0036 17.0666 17.0666 17.2305 17.2305 k = 0.0000 0.6519 0.5906 ( 4580 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6942 -39.6942 -39.6942 -39.6942 -27.6160 -27.6160 -27.6160 -27.6160 -27.5060 -27.5060 -27.5060 -27.5060 -13.4327 -13.4327 -0.3893 -0.3893 1.2096 1.2096 1.9820 1.9820 3.0434 3.0434 3.5077 3.5077 8.6060 8.6060 9.2105 9.2105 9.6482 9.6482 9.7773 9.7773 10.0239 10.0239 10.1235 10.1235 11.7641 11.7641 11.8191 11.8191 12.4612 12.4612 12.5155 12.5155 12.9646 12.9646 13.1635 13.1635 15.0607 15.0607 15.3559 15.3559 16.0036 16.0036 17.0666 17.0666 17.2305 17.2305 k = 0.0064 0.6382 0.6058 ( 4580 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6943 -39.6943 -39.6942 -39.6942 -27.6166 -27.6166 -27.6160 -27.6160 -27.5059 -27.5059 -27.5054 -27.5054 -13.4326 -13.4326 -0.3892 -0.3892 1.2099 1.2099 1.9812 1.9812 3.0442 3.0442 3.5075 3.5075 8.6041 8.6041 9.1998 9.1998 9.6572 9.6572 9.7786 9.7786 10.0244 10.0244 10.1262 10.1262 11.7610 11.7610 11.8149 11.8149 12.4593 12.4593 12.5247 12.5247 12.9624 12.9624 13.1649 13.1649 15.0594 15.0594 15.3560 15.3560 16.0038 16.0038 17.0205 17.0205 17.2815 17.2815 k = 0.0128 0.6245 0.6209 ( 4578 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6943 -39.6943 -39.6942 -39.6942 -27.6178 -27.6178 -27.6166 -27.6166 -27.5053 -27.5053 -27.5041 -27.5041 -13.4324 -13.4324 -0.3888 -0.3888 1.2107 1.2107 1.9788 1.9788 3.0465 3.0465 3.5066 3.5066 8.5983 8.5983 9.1703 9.1703 9.6815 9.6815 9.7823 9.7823 10.0260 10.0260 10.1340 10.1340 11.7515 11.7515 11.8028 11.8028 12.4574 12.4574 12.5478 12.5478 12.9562 12.9562 13.1691 13.1691 15.0553 15.0553 15.3557 15.3557 16.0046 16.0046 16.9405 16.9405 17.3764 17.3764 k = 0.0192 0.6107 0.6361 ( 4586 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6943 -39.6943 -39.6943 -39.6943 -27.6196 -27.6196 -27.6178 -27.6178 -27.5041 -27.5041 -27.5024 -27.5024 -13.4319 -13.4319 -0.3882 -0.3882 1.2121 1.2121 1.9748 1.9748 3.0503 3.0503 3.5053 3.5053 8.5887 8.5887 9.1271 9.1271 9.7155 9.7155 9.7887 9.7887 10.0290 10.0290 10.1471 10.1471 11.7355 11.7355 11.7850 11.7850 12.4584 12.4584 12.5793 12.5793 12.9468 12.9468 13.1760 13.1760 15.0482 15.0482 15.3546 15.3546 16.0068 16.0068 16.8597 16.8597 17.4816 17.4816 k = 0.0256 0.5970 0.6512 ( 4592 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6943 -39.6943 -39.6943 -39.6943 -27.6219 -27.6219 -27.6196 -27.6196 -27.5023 -27.5023 -27.5002 -27.5002 -13.4314 -13.4314 -0.3874 -0.3874 1.2140 1.2140 1.9693 1.9693 3.0556 3.0556 3.5034 3.5034 8.5754 8.5754 9.0750 9.0750 9.7529 9.7529 9.7987 9.7987 10.0338 10.0338 10.1652 10.1652 11.7126 11.7126 11.7642 11.7642 12.4619 12.4619 12.6157 12.6157 12.9357 12.9357 13.1855 13.1855 15.0380 15.0380 15.3515 15.3515 16.0118 16.0118 16.7846 16.7846 17.5899 17.5899 k = 0.0321 0.5833 0.6664 ( 4596 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6944 -39.6944 -39.6943 -39.6943 -27.6247 -27.6247 -27.6218 -27.6218 -27.5000 -27.5000 -27.4975 -27.4975 -13.4306 -13.4306 -0.3864 -0.3864 1.2165 1.2165 1.9624 1.9624 3.0624 3.0624 3.5009 3.5009 8.5587 8.5587 9.0174 9.0174 9.7844 9.7844 9.8179 9.8179 10.0409 10.0409 10.1882 10.1882 11.6829 11.6829 11.7428 11.7428 12.4659 12.4659 12.6549 12.6549 12.9252 12.9252 13.1973 13.1973 15.0242 15.0242 15.3452 15.3452 16.0207 16.0207 16.7175 16.7175 17.6977 17.6977 k = 0.0385 0.5696 0.6815 ( 4598 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6944 -39.6944 -39.6943 -39.6943 -27.6277 -27.6277 -27.6245 -27.6245 -27.4973 -27.4973 -27.4944 -27.4944 -13.4297 -13.4297 -0.3851 -0.3851 1.2195 1.2195 1.9542 1.9542 3.0706 3.0706 3.4979 3.4979 8.5387 8.5387 8.9563 8.9563 9.8022 9.8022 9.8511 9.8511 10.0509 10.0509 10.2159 10.2159 11.6479 11.6479 11.7219 11.7219 12.4675 12.4675 12.6947 12.6947 12.9179 12.9179 13.2114 13.2114 15.0069 15.0069 15.3345 15.3345 16.0348 16.0348 16.6595 16.6595 17.8020 17.8020 k = 0.0449 0.5559 0.6966 ( 4596 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6944 -39.6944 -39.6943 -39.6943 -27.6311 -27.6311 -27.6276 -27.6276 -27.4942 -27.4942 -27.4911 -27.4911 -13.4286 -13.4286 -0.3837 -0.3837 1.2229 1.2229 1.9448 1.9448 3.0802 3.0802 3.4942 3.4942 8.5157 8.5157 8.8932 8.8932 9.8142 9.8142 9.8888 9.8888 10.0645 10.0645 10.2479 10.2479 11.6094 11.6094 11.7018 11.7018 12.4639 12.4639 12.7332 12.7332 12.9165 12.9165 13.2277 13.2277 14.9861 14.9861 15.3188 15.3188 16.0547 16.0547 16.6114 16.6114 17.8992 17.8992 k = 0.0513 0.5421 0.7118 ( 4598 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6945 -39.6945 -39.6944 -39.6944 -27.6347 -27.6347 -27.6309 -27.6309 -27.4908 -27.4908 -27.4875 -27.4875 -13.4274 -13.4274 -0.3822 -0.3822 1.2268 1.2268 1.9344 1.9344 3.0911 3.0911 3.4900 3.4900 8.4900 8.4900 8.8290 8.8290 9.8244 9.8244 9.9254 9.9254 10.0822 10.0822 10.2836 10.2836 11.5690 11.5690 11.6826 11.6826 12.4528 12.4528 12.7686 12.7686 12.9230 12.9230 13.2462 13.2462 14.9620 14.9620 15.2978 15.2978 16.0802 16.0802 16.5738 16.5738 17.9852 17.9852 k = 0.0577 0.5284 0.7269 ( 4600 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6945 -39.6945 -39.6944 -39.6944 -27.6385 -27.6385 -27.6345 -27.6345 -27.4872 -27.4872 -27.4838 -27.4838 -13.4261 -13.4261 -0.3805 -0.3805 1.2311 1.2311 1.9231 1.9231 3.1033 3.1033 3.4852 3.4852 8.4616 8.4616 8.7642 8.7642 9.8335 9.8335 9.9599 9.9599 10.1041 10.1041 10.3223 10.3223 11.5279 11.5279 11.6647 11.6647 12.4335 12.4335 12.7994 12.7994 12.9382 12.9382 13.2671 13.2671 14.9350 14.9350 15.2717 15.2717 16.1106 16.1106 16.5468 16.5468 18.0558 18.0558 k = 0.0641 0.5147 0.7421 ( 4600 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6945 -39.6945 -39.6944 -39.6944 -27.6424 -27.6424 -27.6383 -27.6383 -27.4835 -27.4835 -27.4799 -27.4799 -13.4246 -13.4246 -0.3788 -0.3788 1.2358 1.2358 1.9111 1.9111 3.1167 3.1167 3.4798 3.4798 8.4311 8.4311 8.6995 8.6995 9.8416 9.8416 9.9925 9.9925 10.1301 10.1301 10.3631 10.3631 11.4871 11.4871 11.6481 11.6481 12.4065 12.4065 12.8251 12.8251 12.9606 12.9606 13.2905 13.2905 14.9056 14.9056 15.2412 15.2412 16.1449 16.1449 16.5305 16.5305 18.1087 18.1087 k = 0.0705 0.5010 0.7572 ( 4604 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6946 -39.6946 -39.6945 -39.6945 -27.6465 -27.6465 -27.6422 -27.6422 -27.4796 -27.4796 -27.4759 -27.4759 -13.4230 -13.4230 -0.3771 -0.3771 1.2409 1.2409 1.8986 1.8986 3.1313 3.1313 3.4738 3.4738 8.3986 8.3986 8.6352 8.6352 9.8487 9.8487 10.0237 10.0237 10.1593 10.1593 10.4053 10.4053 11.4472 11.4472 11.6331 11.6331 12.3731 12.3731 12.8453 12.8453 12.9877 12.9877 13.3167 13.3167 14.8743 14.8743 15.2070 15.2070 16.1816 16.1816 16.5244 16.5244 18.1443 18.1443 k = 0.0769 0.4873 0.7724 ( 4600 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6946 -39.6946 -39.6945 -39.6945 -27.6505 -27.6505 -27.6462 -27.6462 -27.4756 -27.4756 -27.4719 -27.4719 -13.4213 -13.4213 -0.3754 -0.3754 1.2462 1.2462 1.8857 1.8857 3.1469 3.1469 3.4672 3.4672 8.3644 8.3644 8.5715 8.5715 9.8549 9.8549 10.0540 10.0540 10.1909 10.1909 10.4481 10.4481 11.4088 11.4088 11.6200 11.6200 12.3352 12.3352 12.8596 12.8596 13.0175 13.0175 13.3458 13.3458 14.8418 14.8418 15.1700 15.1700 16.2194 16.2194 16.5280 16.5280 18.1657 18.1657 k = 0.0833 0.4735 0.7875 ( 4600 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6947 -39.6947 -39.6945 -39.6945 -27.6546 -27.6546 -27.6502 -27.6502 -27.4715 -27.4715 -27.4678 -27.4678 -13.4195 -13.4195 -0.3737 -0.3737 1.2517 1.2517 1.8727 1.8727 3.1635 3.1635 3.4599 3.4599 8.3288 8.3288 8.5088 8.5088 9.8607 9.8607 10.0840 10.0840 10.2240 10.2240 10.4909 10.4909 11.3725 11.3725 11.6087 11.6087 12.2942 12.2942 12.8673 12.8673 13.0485 13.0485 13.3775 13.3775 14.8083 14.8083 15.1310 15.1310 16.2572 16.2572 16.5401 16.5401 18.1770 18.1770 k = 0.0897 0.4598 0.8027 ( 4598 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6948 -39.6948 -39.6946 -39.6946 -27.6587 -27.6587 -27.6543 -27.6543 -27.4674 -27.4674 -27.4638 -27.4638 -13.4176 -13.4176 -0.3721 -0.3721 1.2575 1.2575 1.8598 1.8598 3.1810 3.1810 3.4520 3.4520 8.2920 8.2920 8.4473 8.4473 9.8662 9.8662 10.1139 10.1139 10.2579 10.2579 10.5334 10.5334 11.3387 11.3387 11.5992 11.5992 12.2518 12.2518 12.8679 12.8679 13.0799 13.0799 13.4114 13.4114 14.7741 14.7741 15.0907 15.0907 16.2944 16.2944 16.5593 16.5593 18.1824 18.1824 k = 0.0962 0.4461 0.8178 ( 4606 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6948 -39.6948 -39.6947 -39.6947 -27.6627 -27.6627 -27.6583 -27.6583 -27.4634 -27.4634 -27.4598 -27.4598 -13.4157 -13.4157 -0.3706 -0.3706 1.2633 1.2633 1.8471 1.8471 3.1993 3.1993 3.4435 3.4435 8.2543 8.2543 8.3871 8.3871 9.8717 9.8717 10.1434 10.1434 10.2919 10.2919 10.5751 10.5751 11.3077 11.3077 11.5914 11.5914 12.2091 12.2091 12.8611 12.8611 13.1113 13.1113 13.4468 13.4468 14.7392 14.7392 15.0497 15.0497 16.3305 16.3305 16.5836 16.5836 18.1854 18.1854 k = 0.1026 0.4324 0.8329 ( 4596 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6949 -39.6949 -39.6947 -39.6947 -27.6667 -27.6667 -27.6624 -27.6624 -27.4594 -27.4594 -27.4558 -27.4558 -13.4136 -13.4136 -0.3692 -0.3692 1.2692 1.2692 1.8348 1.8348 3.2182 3.2182 3.4344 3.4344 8.2159 8.2159 8.3285 8.3285 9.8776 9.8776 10.1726 10.1726 10.3251 10.3251 10.6161 10.6161 11.2801 11.2801 11.5850 11.5850 12.1672 12.1672 12.8476 12.8476 13.1421 13.1421 13.4830 13.4830 14.7037 14.7037 15.0084 15.0084 16.3654 16.3654 16.6113 16.6113 18.1891 18.1891 k = 0.1090 0.4187 0.8481 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6949 -39.6949 -39.6948 -39.6948 -27.6707 -27.6707 -27.6664 -27.6664 -27.4554 -27.4554 -27.4519 -27.4519 -13.4116 -13.4116 -0.3680 -0.3680 1.2750 1.2750 1.8232 1.8232 3.2376 3.2376 3.4248 3.4248 8.1770 8.1770 8.2716 8.2716 9.8840 9.8840 10.2011 10.2011 10.3570 10.3570 10.6564 10.6564 11.2560 11.2560 11.5796 11.5796 12.1272 12.1272 12.8278 12.8278 13.1718 13.1718 13.5192 13.5192 14.6673 14.6673 14.9671 14.9671 16.3990 16.3990 16.6404 16.6404 18.1960 18.1960 k = 0.1154 0.4049 0.8632 ( 4610 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6950 -39.6950 -39.6948 -39.6948 -27.6745 -27.6745 -27.6703 -27.6703 -27.4515 -27.4515 -27.4481 -27.4481 -13.4095 -13.4095 -0.3671 -0.3671 1.2808 1.2808 1.8123 1.8123 3.2574 3.2574 3.4148 3.4148 8.1379 8.1379 8.2165 8.2165 9.8912 9.8912 10.2285 10.2285 10.3868 10.3868 10.6962 10.6962 11.2359 11.2359 11.5747 11.5747 12.0899 12.0899 12.8030 12.8030 13.2002 13.2002 13.5547 13.5547 14.6298 14.6298 14.9257 14.9257 16.4310 16.4310 16.6694 16.6694 18.2085 18.2085 k = 0.1218 0.3912 0.8784 ( 4610 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6951 -39.6951 -39.6949 -39.6949 -27.6783 -27.6783 -27.6741 -27.6741 -27.4477 -27.4477 -27.4444 -27.4444 -13.4073 -13.4073 -0.3663 -0.3663 1.2864 1.2864 1.8024 1.8024 3.2774 3.2774 3.4044 3.4044 8.0988 8.0988 8.1634 8.1634 9.8993 9.8993 10.2545 10.2545 10.4138 10.4138 10.7358 10.7358 11.2200 11.2200 11.5695 11.5695 12.0562 12.0562 12.7740 12.7740 13.2268 13.2268 13.5887 13.5887 14.5913 14.5913 14.8840 14.8840 16.4614 16.4614 16.6971 16.6971 18.2286 18.2286 k = 0.1282 0.3775 0.8935 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6951 -39.6951 -39.6949 -39.6949 -27.6819 -27.6819 -27.6779 -27.6779 -27.4440 -27.4440 -27.4408 -27.4408 -13.4052 -13.4052 -0.3658 -0.3658 1.2917 1.2917 1.7935 1.7935 3.2970 3.2970 3.3940 3.3940 8.0600 8.0600 8.1124 8.1124 9.9085 9.9085 10.2787 10.2787 10.4376 10.4376 10.7755 10.7755 11.2086 11.2086 11.5635 11.5635 12.0269 12.0269 12.7421 12.7421 13.2515 13.2515 13.6207 13.6207 14.5518 14.5518 14.8418 14.8418 16.4899 16.4899 16.7226 16.7226 18.2579 18.2579 k = 0.1346 0.3638 0.9087 ( 4610 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6952 -39.6952 -39.6950 -39.6950 -27.6854 -27.6854 -27.6815 -27.6815 -27.4404 -27.4404 -27.4373 -27.4373 -13.4030 -13.4030 -0.3655 -0.3655 1.2968 1.2968 1.7857 1.7857 3.3156 3.3156 3.3844 3.3844 8.0215 8.0215 8.0636 8.0636 9.9187 9.9187 10.3009 10.3009 10.4576 10.4576 10.8153 10.8153 11.2018 11.2018 11.5560 11.5560 12.0023 12.0023 12.7084 12.7084 13.2741 13.2741 13.6502 13.6502 14.5113 14.5113 14.7987 14.7987 16.5166 16.5166 16.7454 16.7454 18.2975 18.2975 k = 0.1410 0.3501 0.9238 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6952 -39.6952 -39.6951 -39.6951 -27.6887 -27.6887 -27.6850 -27.6850 -27.4369 -27.4369 -27.4340 -27.4340 -13.4009 -13.4009 -0.3655 -0.3655 1.3016 1.3016 1.7791 1.7791 3.3307 3.3307 3.3779 3.3779 7.9835 7.9835 8.0172 8.0172 9.9301 9.9301 10.3208 10.3208 10.4738 10.4738 10.8552 10.8552 11.1996 11.1996 11.5465 11.5465 11.9828 11.9828 12.6739 12.6739 13.2947 13.2947 13.6768 13.6768 14.4701 14.4701 14.7542 14.7542 16.5415 16.5415 16.7651 16.7651 18.3480 18.3480 k = 0.1474 0.3363 0.9390 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6953 -39.6953 -39.6951 -39.6951 -27.6919 -27.6919 -27.6883 -27.6883 -27.4336 -27.4336 -27.4308 -27.4308 -13.3988 -13.3988 -0.3657 -0.3657 1.3060 1.3060 1.7738 1.7738 3.3362 3.3362 3.3806 3.3806 7.9463 7.9463 7.9732 7.9732 9.9427 9.9427 10.3383 10.3383 10.4861 10.4861 10.8949 10.8949 11.2021 11.2021 11.5350 11.5350 11.9682 11.9682 12.6398 12.6398 13.3132 13.3132 13.6999 13.6999 14.4285 14.4285 14.7082 14.7082 16.5647 16.5647 16.7819 16.7819 18.4093 18.4093 k = 0.1538 0.3226 0.9541 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6954 -39.6954 -39.6952 -39.6952 -27.6950 -27.6950 -27.6915 -27.6915 -27.4304 -27.4304 -27.4277 -27.4277 -13.3968 -13.3968 -0.3662 -0.3662 1.3099 1.3099 1.7697 1.7697 3.3306 3.3306 3.3937 3.3937 7.9099 7.9099 7.9319 7.9319 9.9564 9.9564 10.3533 10.3533 10.4949 10.4949 10.9339 10.9339 11.2091 11.2091 11.5215 11.5215 11.9581 11.9581 12.6071 12.6071 13.3299 13.3299 13.7190 13.7190 14.3869 14.3869 14.6604 14.6604 16.5867 16.5867 16.7961 16.7961 18.4805 18.4805 k = 0.1603 0.3089 0.9692 ( 4612 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6954 -39.6954 -39.6952 -39.6952 -27.6979 -27.6979 -27.6946 -27.6946 -27.4274 -27.4274 -27.4249 -27.4249 -13.3948 -13.3948 -0.3669 -0.3669 1.3135 1.3135 1.7668 1.7668 3.3205 3.3205 3.4110 3.4110 7.8745 7.8745 7.8933 7.8933 9.9711 9.9711 10.3658 10.3658 10.5003 10.5003 10.9717 10.9717 11.2203 11.2203 11.5065 11.5065 11.9518 11.9518 12.5768 12.5768 13.3449 13.3449 13.7337 13.7337 14.3459 14.3459 14.6112 14.6112 16.6077 16.6077 16.8079 16.8079 18.5599 18.5599 k = 0.1667 0.2952 0.9844 ( 4616 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6955 -39.6955 -39.6953 -39.6953 -27.7006 -27.7006 -27.6975 -27.6975 -27.4246 -27.4246 -27.4222 -27.4222 -13.3929 -13.3929 -0.3678 -0.3678 1.3166 1.3166 1.7650 1.7650 3.3088 3.3088 3.4292 3.4292 7.8403 7.8403 7.8574 7.8574 9.9869 9.9869 10.3760 10.3760 10.5028 10.5028 11.0075 11.0075 11.2351 11.2351 11.4908 11.4908 11.9484 11.9484 12.5498 12.5498 13.3584 13.3584 13.7433 13.7433 14.3059 14.3059 14.5609 14.5609 16.6279 16.6279 16.8178 16.8178 18.6445 18.6445 k = 0.1731 0.2814 0.9995 ( 4620 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6955 -39.6955 -39.6954 -39.6954 -27.7031 -27.7031 -27.7002 -27.7002 -27.4219 -27.4219 -27.4197 -27.4197 -13.3911 -13.3911 -0.3688 -0.3688 1.3194 1.3194 1.7643 1.7643 3.2966 3.2966 3.4474 3.4474 7.8077 7.8077 7.8243 7.8243 10.0036 10.0036 10.3841 10.3841 10.5029 10.5029 11.0408 11.0408 11.2528 11.2528 11.4750 11.4750 11.9470 11.9470 12.5271 12.5271 13.3708 13.3708 13.7471 13.7471 14.2678 14.2678 14.5102 14.5102 16.6476 16.6476 16.8263 16.8263 18.7304 18.7304 k = 0.1795 0.2677 1.0147 ( 4610 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6955 -39.6955 -39.6954 -39.6954 -27.7054 -27.7054 -27.7027 -27.7027 -27.4194 -27.4194 -27.4173 -27.4173 -13.3894 -13.3894 -0.3700 -0.3700 1.3217 1.3217 1.7645 1.7645 3.2844 3.2844 3.4649 3.4649 7.7769 7.7769 7.7937 7.7937 10.0209 10.0209 10.3903 10.3903 10.5011 10.5011 11.0712 11.0712 11.2725 11.2725 11.4597 11.4597 11.9470 11.9470 12.5094 12.5094 13.3822 13.3822 13.7444 13.7444 14.2323 14.2323 14.4597 14.4597 16.6670 16.6670 16.8337 16.8337 18.8132 18.8132 k = 0.1859 0.2540 1.0298 ( 4608 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6956 -39.6956 -39.6955 -39.6955 -27.7075 -27.7075 -27.7050 -27.7050 -27.4171 -27.4171 -27.4152 -27.4152 -13.3877 -13.3877 -0.3712 -0.3712 1.3237 1.3237 1.7655 1.7655 3.2724 3.2724 3.4816 3.4816 7.7482 7.7482 7.7655 7.7655 10.0388 10.0388 10.3946 10.3946 10.4977 10.4977 11.0984 11.0984 11.2929 11.2929 11.4456 11.4456 11.9477 11.9477 12.4975 12.4975 13.3927 13.3927 13.7346 13.7346 14.2005 14.2005 14.4103 14.4103 16.6859 16.6859 16.8403 16.8403 18.8908 18.8908 k = 0.1923 0.2403 1.0450 ( 4612 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6956 -39.6956 -39.6955 -39.6955 -27.7095 -27.7095 -27.7072 -27.7072 -27.4150 -27.4150 -27.4132 -27.4132 -13.3863 -13.3863 -0.3725 -0.3725 1.3254 1.3254 1.7672 1.7672 3.2609 3.2609 3.4973 3.4973 7.7219 7.7219 7.7398 7.7398 10.0569 10.0569 10.3974 10.3974 10.4932 10.4932 11.1224 11.1224 11.3127 11.3127 11.4331 11.4331 11.9487 11.9487 12.4916 12.4916 13.4024 13.4024 13.7173 13.7173 14.1730 14.1730 14.3630 14.3630 16.7043 16.7043 16.8460 16.8460 18.9639 18.9639 k = 0.1987 0.2266 1.0601 ( 4612 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6957 -39.6957 -39.6955 -39.6955 -27.7112 -27.7112 -27.7091 -27.7091 -27.4131 -27.4131 -27.4115 -27.4115 -13.3849 -13.3849 -0.3738 -0.3738 1.3268 1.3268 1.7692 1.7692 3.2501 3.2501 3.5118 3.5118 7.6981 7.6981 7.7166 7.7166 10.0751 10.0751 10.3986 10.3986 10.4881 10.4881 11.1434 11.1434 11.3307 11.3307 11.4225 11.4225 11.9499 11.9499 12.4921 12.4921 13.4111 13.4111 13.6931 13.6931 14.1503 14.1503 14.3185 14.3185 16.7221 16.7221 16.8510 16.8510 19.0345 19.0345 k = 0.2051 0.2128 1.0753 ( 4614 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6957 -39.6957 -39.6956 -39.6956 -27.7127 -27.7127 -27.7109 -27.7109 -27.4114 -27.4114 -27.4099 -27.4099 -13.3837 -13.3837 -0.3751 -0.3751 1.3280 1.3280 1.7716 1.7716 3.2400 3.2400 3.5249 3.5249 7.6768 7.6768 7.6959 7.6959 10.0929 10.0929 10.3986 10.3986 10.4827 10.4827 11.1614 11.1614 11.3459 11.3459 11.4141 11.4141 11.9509 11.9509 12.4986 12.4986 13.4185 13.4185 13.6632 13.6632 14.1324 14.1324 14.2776 14.2776 16.7390 16.7390 16.8554 16.8554 19.1038 19.1038 k = 0.2115 0.1991 1.0904 ( 4620 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6957 -39.6957 -39.6956 -39.6956 -27.7141 -27.7141 -27.7124 -27.7124 -27.4099 -27.4099 -27.4086 -27.4086 -13.3826 -13.3826 -0.3763 -0.3763 1.3289 1.3289 1.7740 1.7740 3.2310 3.2310 3.5366 3.5366 7.6582 7.6582 7.6779 7.6779 10.1100 10.1100 10.3973 10.3973 10.4775 10.4775 11.1766 11.1766 11.3579 11.3579 11.4079 11.4079 11.9517 11.9517 12.5105 12.5105 13.4238 13.4238 13.6303 13.6303 14.1189 14.1189 14.2408 14.2408 16.7549 16.7549 16.8589 16.8589 19.1725 19.1725 k = 0.2179 0.1854 1.1055 ( 4622 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6957 -39.6957 -39.6957 -39.6957 -27.7152 -27.7152 -27.7137 -27.7137 -27.4086 -27.4086 -27.4075 -27.4075 -13.3816 -13.3816 -0.3774 -0.3774 1.3296 1.3296 1.7764 1.7764 3.2230 3.2230 3.5466 3.5466 7.6424 7.6424 7.6625 7.6625 10.1261 10.1261 10.3949 10.3949 10.4728 10.4728 11.1891 11.1891 11.3666 11.3666 11.4038 11.4038 11.9524 11.9524 12.5267 12.5267 13.4256 13.4256 13.5979 13.5979 14.1089 14.1089 14.2087 14.2087 16.7694 16.7694 16.8617 16.8617 19.2408 19.2408 k = 0.2244 0.1717 1.1207 ( 4624 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6957 -39.6957 -39.6957 -39.6957 -27.7161 -27.7161 -27.7148 -27.7148 -27.4076 -27.4076 -27.4066 -27.4066 -13.3809 -13.3809 -0.3783 -0.3783 1.3302 1.3302 1.7785 1.7785 3.2163 3.2163 3.5550 3.5550 7.6294 7.6294 7.6498 7.6498 10.1405 10.1405 10.3918 10.3918 10.4688 10.4688 11.1991 11.1991 11.3727 11.3727 11.4012 11.4012 11.9528 11.9528 12.5452 12.5452 13.4225 13.4225 13.5702 13.5702 14.1017 14.1017 14.1817 14.1817 16.7821 16.7821 16.8636 16.8636 19.3087 19.3087 k = 0.2308 0.1580 1.1358 ( 4622 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7167 -27.7167 -27.7157 -27.7157 -27.4068 -27.4068 -27.4058 -27.4058 -13.3803 -13.3803 -0.3791 -0.3791 1.3306 1.3306 1.7803 1.7803 3.2110 3.2110 3.5616 3.5616 7.6192 7.6192 7.6400 7.6400 10.1527 10.1527 10.3884 10.3884 10.4658 10.4658 11.2066 11.2066 11.3770 11.3770 11.3992 11.3992 11.9530 11.9530 12.5638 12.5638 13.4137 13.4137 13.5506 13.5506 14.0966 14.0966 14.1602 14.1602 16.7928 16.7928 16.8647 16.8647 19.3755 19.3755 k = 0.2372 0.1442 1.1510 ( 4630 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7172 -27.7172 -27.7164 -27.7164 -27.4062 -27.4062 -27.4054 -27.4054 -13.3798 -13.3798 -0.3797 -0.3797 1.3309 1.3309 1.7817 1.7817 3.2071 3.2071 3.5664 3.5664 7.6119 7.6119 7.6329 7.6329 10.1621 10.1621 10.3853 10.3853 10.4636 10.4636 11.2118 11.2118 11.3804 11.3804 11.3974 11.3974 11.9531 11.9531 12.5799 12.5799 13.4017 13.4017 13.5394 13.5394 14.0933 14.0933 14.1446 14.1446 16.8010 16.8010 16.8652 16.8652 19.4397 19.4397 k = 0.2436 0.1305 1.1661 ( 4630 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7175 -27.7175 -27.7167 -27.7167 -27.4058 -27.4058 -27.4051 -27.4051 -13.3796 -13.3796 -0.3800 -0.3800 1.3311 1.3311 1.7826 1.7826 3.2047 3.2047 3.5692 3.5692 7.6075 7.6075 7.6286 7.6286 10.1680 10.1680 10.3831 10.3831 10.4623 10.4623 11.2149 11.2149 11.3829 11.3829 11.3956 11.3956 11.9531 11.9531 12.5909 12.5909 13.3916 13.3916 13.5344 13.5344 14.0913 14.0913 14.1352 14.1352 16.8061 16.8061 16.8653 16.8653 19.4940 19.4940 k = 0.2500 0.1168 1.1813 ( 4640 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3311 1.3311 1.7829 1.7829 3.2039 3.2039 3.5702 3.5702 7.6060 7.6060 7.6272 7.6272 10.1700 10.1700 10.3823 10.3823 10.4619 10.4619 11.2159 11.2159 11.3840 11.3840 11.3948 11.3948 11.9531 11.9531 12.5949 12.5949 13.3877 13.3877 13.5329 13.5329 14.0906 14.0906 14.1321 14.1321 16.8079 16.8079 16.8652 16.8652 19.5161 19.5161 k = 0.2500 0.1168 1.1813 ( 4640 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3311 1.3311 1.7829 1.7829 3.2039 3.2039 3.5702 3.5702 7.6060 7.6060 7.6272 7.6272 10.1700 10.1700 10.3823 10.3823 10.4619 10.4619 11.2159 11.2159 11.3840 11.3840 11.3948 11.3948 11.9531 11.9531 12.5949 12.5949 13.3877 13.3877 13.5329 13.5329 14.0906 14.0906 14.1321 14.1321 16.8079 16.8079 16.8652 16.8652 19.5161 19.5161 k = 0.2667 0.1246 1.1727 ( 4634 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3311 1.3311 1.7828 1.7828 3.2041 3.2041 3.5700 3.5700 7.5958 7.5958 7.6381 7.6381 10.1695 10.1695 10.3770 10.3770 10.4677 10.4677 11.2143 11.2143 11.3813 11.3813 11.3988 11.3988 11.9529 11.9529 12.5946 12.5946 13.3797 13.3797 13.5417 13.5417 14.0907 14.0907 14.1329 14.1329 16.8074 16.8074 16.8653 16.8653 19.5023 19.5023 k = 0.2833 0.1324 1.1641 ( 4636 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7175 -27.7175 -27.7169 -27.7169 -27.4058 -27.4058 -27.4050 -27.4050 -13.3795 -13.3795 -0.3800 -0.3800 1.3311 1.3311 1.7827 1.7827 3.2044 3.2044 3.5695 3.5695 7.5798 7.5798 7.6564 7.6564 10.1680 10.1680 10.3642 10.3642 10.4820 10.4820 11.2095 11.2095 11.3768 11.3768 11.4069 11.4069 11.9522 11.9522 12.5942 12.5942 13.3589 13.3589 13.5641 13.5641 14.0904 14.0904 14.1351 14.1351 16.8060 16.8060 16.8655 16.8655 19.4684 19.4684 k = 0.3000 0.1402 1.1555 ( 4638 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7173 -27.7173 -27.7168 -27.7168 -27.4060 -27.4060 -27.4050 -27.4050 -13.3796 -13.3796 -0.3799 -0.3799 1.3311 1.3311 1.7825 1.7825 3.2051 3.2051 3.5686 3.5686 7.5640 7.5640 7.6762 7.6762 10.1655 10.1655 10.3481 10.3481 10.5004 10.5004 11.2016 11.2016 11.3727 11.3727 11.4168 11.4168 11.9510 11.9510 12.5944 12.5944 13.3317 13.3317 13.5934 13.5934 14.0899 14.0899 14.1388 14.1388 16.8037 16.8037 16.8659 16.8659 19.4285 19.4285 k = 0.3167 0.1479 1.1469 ( 4632 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6959 -39.6959 -39.6957 -39.6957 -27.7172 -27.7172 -27.7167 -27.7167 -27.4062 -27.4062 -27.4050 -27.4050 -13.3797 -13.3797 -0.3798 -0.3798 1.3311 1.3311 1.7822 1.7822 3.2061 3.2061 3.5671 3.5671 7.5495 7.5495 7.6967 7.6967 10.1622 10.1622 10.3310 10.3310 10.5203 10.5203 11.1912 11.1912 11.3691 11.3691 11.4278 11.4278 11.9494 11.9494 12.5955 12.5955 13.3022 13.3022 13.6254 13.6254 14.0891 14.0891 14.1436 14.1436 16.8006 16.8006 16.8665 16.8665 19.3894 19.3894 k = 0.3333 0.1557 1.1383 ( 4623 PWs) bands (ev): -71.2652 -71.2652 -71.2651 -71.2651 -39.6959 -39.6959 -39.6956 -39.6956 -27.7171 -27.7171 -27.7165 -27.7165 -27.4065 -27.4065 -27.4051 -27.4051 -13.3798 -13.3798 -0.3796 -0.3796 1.3311 1.3311 1.7817 1.7817 3.2074 3.2074 3.5651 3.5651 7.5365 7.5365 7.7174 7.7174 10.1580 10.1580 10.3141 10.3141 10.5406 10.5406 11.1786 11.1786 11.3661 11.3661 11.4393 11.4393 11.9473 11.9473 12.5978 12.5978 13.2725 13.2725 13.6573 13.6573 14.0879 14.0879 14.1495 14.1495 16.7968 16.7968 16.8674 16.8674 19.3541 19.3541 k = 0.3500 0.1635 1.1297 ( 4625 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6960 -39.6960 -39.6955 -39.6955 -27.7170 -27.7170 -27.7161 -27.7161 -27.4068 -27.4068 -27.4051 -27.4051 -13.3800 -13.3800 -0.3794 -0.3794 1.3311 1.3311 1.7812 1.7812 3.2091 3.2091 3.5624 3.5624 7.5253 7.5253 7.7381 7.7381 10.1530 10.1530 10.2979 10.2979 10.5603 10.5603 11.1644 11.1644 11.3634 11.3634 11.4511 11.4511 11.9448 11.9448 12.6014 12.6014 13.2440 13.2440 13.6880 13.6880 14.0864 14.0864 14.1560 14.1560 16.7925 16.7925 16.8685 16.8685 19.3238 19.3238 k = 0.3667 0.1713 1.1211 ( 4626 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6961 -39.6961 -39.6954 -39.6954 -27.7170 -27.7170 -27.7157 -27.7157 -27.4072 -27.4072 -27.4052 -27.4052 -13.3802 -13.3802 -0.3792 -0.3792 1.3311 1.3311 1.7806 1.7806 3.2112 3.2112 3.5590 3.5590 7.5163 7.5163 7.7585 7.7585 10.1472 10.1472 10.2828 10.2828 10.5790 10.5790 11.1491 11.1491 11.3611 11.3611 11.4628 11.4628 11.9419 11.9419 12.6062 12.6062 13.2174 13.2174 13.7165 13.7165 14.0847 14.0847 14.1632 14.1632 16.7878 16.7878 16.8698 16.8698 19.2994 19.2994 k = 0.3833 0.1791 1.1125 ( 4622 PWs) bands (ev): -71.2653 -71.2653 -71.2651 -71.2651 -39.6962 -39.6962 -39.6953 -39.6953 -27.7170 -27.7170 -27.7151 -27.7151 -27.4076 -27.4076 -27.4053 -27.4053 -13.3804 -13.3804 -0.3788 -0.3788 1.3312 1.3312 1.7799 1.7799 3.2137 3.2137 3.5550 3.5550 7.5094 7.5094 7.7785 7.7785 10.1408 10.1408 10.2692 10.2692 10.5962 10.5962 11.1333 11.1333 11.3591 11.3591 11.4741 11.4741 11.9386 11.9386 12.6121 12.6121 13.1933 13.1933 13.7423 13.7423 14.0829 14.0829 14.1708 14.1708 16.7829 16.7829 16.8711 16.8711 19.2816 19.2816 k = 0.4000 0.1869 1.1039 ( 4617 PWs) bands (ev): -71.2654 -71.2654 -71.2650 -71.2650 -39.6963 -39.6963 -39.6952 -39.6952 -27.7171 -27.7171 -27.7145 -27.7145 -27.4081 -27.4081 -27.4053 -27.4053 -13.3806 -13.3806 -0.3785 -0.3785 1.3313 1.3313 1.7791 1.7791 3.2166 3.2166 3.5502 3.5502 7.5049 7.5049 7.7979 7.7979 10.1338 10.1338 10.2570 10.2570 10.6114 10.6114 11.1175 11.1175 11.3572 11.3572 11.4849 11.4849 11.9351 11.9351 12.6189 12.6189 13.1722 13.1722 13.7650 13.7650 14.0811 14.0811 14.1785 14.1785 16.7780 16.7780 16.8726 16.8726 19.2705 19.2705 k = 0.4167 0.1947 1.0953 ( 4617 PWs) bands (ev): -71.2654 -71.2654 -71.2650 -71.2650 -39.6964 -39.6964 -39.6950 -39.6950 -27.7171 -27.7171 -27.7138 -27.7138 -27.4087 -27.4087 -27.4055 -27.4055 -13.3809 -13.3809 -0.3781 -0.3781 1.3314 1.3314 1.7781 1.7781 3.2199 3.2199 3.5448 3.5448 7.5027 7.5027 7.8164 7.8164 10.1263 10.1263 10.2464 10.2464 10.6244 10.6244 11.1021 11.1021 11.3554 11.3554 11.4948 11.4948 11.9313 11.9313 12.6265 12.6265 13.1544 13.1544 13.7845 13.7845 14.0792 14.0792 14.1864 14.1864 16.7729 16.7729 16.8741 16.8741 19.2663 19.2663 k = 0.4333 0.2024 1.0867 ( 4619 PWs) bands (ev): -71.2655 -71.2655 -71.2649 -71.2649 -39.6965 -39.6965 -39.6949 -39.6949 -27.7171 -27.7171 -27.7131 -27.7131 -27.4093 -27.4093 -27.4056 -27.4056 -13.3812 -13.3812 -0.3777 -0.3777 1.3315 1.3315 1.7771 1.7771 3.2236 3.2236 3.5387 3.5387 7.5029 7.5029 7.8338 7.8338 10.1185 10.1185 10.2374 10.2374 10.6350 10.6350 11.0875 11.0875 11.3535 11.3535 11.5038 11.5038 11.9273 11.9273 12.6347 12.6347 13.1401 13.1401 13.8009 13.8009 14.0773 14.0773 14.1942 14.1942 16.7680 16.7680 16.8756 16.8756 19.2685 19.2685 k = 0.4500 0.2102 1.0781 ( 4620 PWs) bands (ev): -71.2655 -71.2655 -71.2649 -71.2649 -39.6967 -39.6967 -39.6947 -39.6947 -27.7171 -27.7171 -27.7122 -27.7122 -27.4099 -27.4099 -27.4057 -27.4057 -13.3815 -13.3815 -0.3772 -0.3772 1.3316 1.3316 1.7760 1.7760 3.2276 3.2276 3.5321 3.5321 7.5054 7.5054 7.8500 7.8500 10.1107 10.1107 10.2299 10.2299 10.6429 10.6429 11.0741 11.0741 11.3514 11.3514 11.5118 11.5118 11.9232 11.9232 12.6432 12.6432 13.1294 13.1294 13.8144 13.8144 14.0756 14.0756 14.2019 14.2019 16.7631 16.7631 16.8771 16.8771 19.2763 19.2763 k = 0.4667 0.2180 1.0695 ( 4625 PWs) bands (ev): -71.2656 -71.2656 -71.2648 -71.2648 -39.6968 -39.6968 -39.6945 -39.6945 -27.7171 -27.7171 -27.7113 -27.7113 -27.4107 -27.4107 -27.4059 -27.4059 -13.3818 -13.3818 -0.3767 -0.3767 1.3318 1.3318 1.7747 1.7747 3.2320 3.2320 3.5250 3.5250 7.5101 7.5101 7.8649 7.8649 10.1029 10.1029 10.2237 10.2237 10.6483 10.6483 11.0620 11.0620 11.3489 11.3489 11.5188 11.5188 11.9191 11.9191 12.6518 12.6518 13.1224 13.1224 13.8251 13.8251 14.0739 14.0739 14.2094 14.2094 16.7583 16.7583 16.8787 16.8787 19.2878 19.2878 k = 0.4833 0.2258 1.0609 ( 4629 PWs) bands (ev): -71.2656 -71.2656 -71.2648 -71.2648 -39.6970 -39.6970 -39.6944 -39.6944 -27.7172 -27.7172 -27.7104 -27.7104 -27.4114 -27.4114 -27.4060 -27.4060 -13.3822 -13.3822 -0.3761 -0.3761 1.3320 1.3320 1.7733 1.7733 3.2367 3.2367 3.5175 3.5175 7.5170 7.5170 7.8784 7.8784 10.0953 10.0953 10.2188 10.2188 10.6513 10.6513 11.0514 11.0514 11.3460 11.3460 11.5247 11.5247 11.9150 11.9150 12.6601 12.6601 13.1192 13.1192 13.8336 13.8336 14.0724 14.0724 14.2170 14.2170 16.7535 16.7535 16.8803 16.8803 19.2990 19.2990 k = 0.5000 0.2336 1.0523 ( 4624 PWs) bands (ev): -71.2657 -71.2657 -71.2647 -71.2647 -39.6972 -39.6972 -39.6941 -39.6941 -27.7172 -27.7172 -27.7093 -27.7093 -27.4123 -27.4123 -27.4062 -27.4062 -13.3826 -13.3826 -0.3755 -0.3755 1.3322 1.3322 1.7719 1.7719 3.2415 3.2415 3.5097 3.5097 7.5257 7.5257 7.8904 7.8904 10.0880 10.0880 10.2152 10.2152 10.6521 10.6521 11.0422 11.0422 11.3423 11.3423 11.5297 11.5297 11.9111 11.9111 12.6679 12.6679 13.1195 13.1195 13.8402 13.8402 14.0711 14.0711 14.2246 14.2246 16.7488 16.7488 16.8819 16.8819 19.3037 19.3037 k = 0.5000 0.2336 1.0523 ( 4624 PWs) bands (ev): -71.2657 -71.2657 -71.2647 -71.2647 -39.6972 -39.6972 -39.6941 -39.6941 -27.7172 -27.7172 -27.7093 -27.7093 -27.4123 -27.4123 -27.4062 -27.4062 -13.3826 -13.3826 -0.3755 -0.3755 1.3322 1.3322 1.7719 1.7719 3.2415 3.2415 3.5097 3.5097 7.5257 7.5257 7.8904 7.8904 10.0880 10.0880 10.2152 10.2152 10.6521 10.6521 11.0422 11.0422 11.3423 11.3423 11.5297 11.5297 11.9111 11.9111 12.6679 12.6679 13.1195 13.1195 13.8402 13.8402 14.0711 14.0711 14.2246 14.2246 16.7488 16.7488 16.8819 16.8819 19.3037 19.3037 k = 0.5000 0.2336 1.0313 ( 4616 PWs) bands (ev): -71.2659 -71.2659 -71.2645 -71.2645 -39.6977 -39.6977 -39.6936 -39.6936 -27.7173 -27.7173 -27.7065 -27.7065 -27.4145 -27.4145 -27.4066 -27.4066 -13.3837 -13.3837 -0.3738 -0.3738 1.3328 1.3328 1.7679 1.7679 3.2543 3.2543 3.4894 3.4894 7.5507 7.5507 7.9200 7.9200 10.0687 10.0687 10.2071 10.2071 10.6522 10.6522 11.0194 11.0194 11.3325 11.3325 11.5415 11.5415 11.9006 11.9006 12.6877 12.6877 13.1249 13.1249 13.8558 13.8558 14.0681 14.0681 14.2453 14.2453 16.7367 16.7367 16.8857 16.8857 19.2946 19.2946 k = 0.5000 0.2336 1.0103 ( 4616 PWs) bands (ev): -71.2661 -71.2661 -71.2643 -71.2643 -39.6983 -39.6983 -39.6930 -39.6930 -27.7174 -27.7174 -27.7032 -27.7032 -27.4171 -27.4171 -27.4072 -27.4072 -13.3849 -13.3849 -0.3719 -0.3719 1.3335 1.3335 1.7632 1.7632 3.2685 3.2685 3.4669 3.4669 7.5785 7.5785 7.9539 7.9539 10.0465 10.0465 10.1974 10.1974 10.6533 10.6533 10.9934 10.9934 11.3228 11.3228 11.5542 11.5542 11.8878 11.8878 12.7106 12.7106 13.1314 13.1314 13.8737 13.8737 14.0655 14.0655 14.2691 14.2691 16.7242 16.7242 16.8895 16.8895 19.2624 19.2624 k = 0.5000 0.2336 0.9892 ( 4606 PWs) bands (ev): -71.2663 -71.2663 -71.2641 -71.2641 -39.6989 -39.6989 -39.6922 -39.6922 -27.7175 -27.7175 -27.6996 -27.6996 -27.4199 -27.4199 -27.4078 -27.4078 -13.3863 -13.3863 -0.3698 -0.3698 1.3346 1.3346 1.7580 1.7580 3.2839 3.2839 3.4425 3.4425 7.6089 7.6089 7.9919 7.9919 10.0215 10.0215 10.1860 10.1860 10.6549 10.6549 10.9650 10.9650 11.3132 11.3132 11.5673 11.5673 11.8729 11.8729 12.7365 12.7365 13.1391 13.1391 13.8934 13.8934 14.0641 14.0641 14.2959 14.2959 16.7116 16.7116 16.8931 16.8931 19.2020 19.2020 k = 0.5000 0.2336 0.9682 ( 4614 PWs) bands (ev): -71.2665 -71.2665 -71.2639 -71.2639 -39.6996 -39.6996 -39.6914 -39.6914 -27.7178 -27.7178 -27.6956 -27.6956 -27.4230 -27.4230 -27.4084 -27.4084 -13.3879 -13.3879 -0.3674 -0.3674 1.3359 1.3359 1.7520 1.7520 3.3002 3.3002 3.4166 3.4166 7.6414 7.6414 8.0340 8.0340 9.9939 9.9939 10.1729 10.1729 10.6559 10.6559 10.9353 10.9353 11.3041 11.3041 11.5799 11.5799 11.8569 11.8569 12.7653 12.7653 13.1481 13.1481 13.9139 13.9139 14.0651 14.0651 14.3257 14.3257 16.6992 16.6992 16.8965 16.8965 19.1157 19.1157 k = 0.5000 0.2336 0.9471 ( 4610 PWs) bands (ev): -71.2668 -71.2668 -71.2636 -71.2636 -39.7004 -39.7004 -39.6906 -39.6906 -27.7180 -27.7180 -27.6911 -27.6911 -27.4264 -27.4264 -27.4091 -27.4091 -13.3895 -13.3895 -0.3647 -0.3647 1.3376 1.3376 1.7454 1.7454 3.3171 3.3171 3.3897 3.3897 7.6756 7.6756 8.0800 8.0800 9.9641 9.9641 10.1582 10.1582 10.6548 10.6548 10.9056 10.9056 11.2961 11.2961 11.5903 11.5903 11.8414 11.8414 12.7967 12.7967 13.1588 13.1588 13.9332 13.9332 14.0706 14.0706 14.3586 14.3586 16.6872 16.6872 16.8999 16.8999 19.0099 19.0099 k = 0.5000 0.2336 0.9261 ( 4602 PWs) bands (ev): -71.2671 -71.2671 -71.2633 -71.2633 -39.7012 -39.7012 -39.6897 -39.6897 -27.7183 -27.7183 -27.6864 -27.6864 -27.4299 -27.4299 -27.4099 -27.4099 -13.3914 -13.3914 -0.3618 -0.3618 1.3397 1.3397 1.7381 1.7381 3.3338 3.3338 3.3626 3.3626 7.7113 7.7113 8.1299 8.1299 9.9324 9.9324 10.1418 10.1418 10.6498 10.6498 10.8775 10.8775 11.2898 11.2898 11.5961 11.5961 11.8290 11.8290 12.8305 12.8305 13.1713 13.1713 13.9486 13.9486 14.0835 14.0835 14.3944 14.3944 16.6760 16.6760 16.9031 16.9031 18.8904 18.8904 k = 0.5000 0.2336 0.9050 ( 4604 PWs) bands (ev): -71.2674 -71.2674 -71.2630 -71.2630 -39.7021 -39.7021 -39.6887 -39.6887 -27.7187 -27.7187 -27.6813 -27.6813 -27.4337 -27.4337 -27.4107 -27.4107 -13.3933 -13.3933 -0.3586 -0.3586 1.3422 1.3422 1.7300 1.7300 3.3308 3.3308 3.3550 3.3550 7.7481 7.7481 8.1834 8.1834 9.8990 9.8990 10.1238 10.1238 10.6386 10.6386 10.8524 10.8524 11.2863 11.2863 11.5939 11.5939 11.8232 11.8232 12.8663 12.8663 13.1858 13.1858 13.9580 13.9580 14.1062 14.1062 14.4332 14.4332 16.6657 16.6657 16.9061 16.9061 18.7620 18.7620 k = 0.5000 0.2336 0.8840 ( 4600 PWs) bands (ev): -71.2678 -71.2678 -71.2626 -71.2626 -39.7030 -39.7030 -39.6876 -39.6876 -27.7191 -27.7191 -27.6758 -27.6758 -27.4377 -27.4377 -27.4116 -27.4116 -13.3954 -13.3954 -0.3552 -0.3552 1.3452 1.3452 1.7212 1.7212 3.3032 3.3032 3.3718 3.3718 7.7855 7.7855 8.2405 8.2405 9.8643 9.8643 10.1043 10.1043 10.6199 10.6199 10.8309 10.8309 11.2868 11.2868 11.5811 11.5811 11.8267 11.8267 12.9038 12.9038 13.2027 13.2027 13.9615 13.9615 14.1385 14.1385 14.4749 14.4749 16.6568 16.6568 16.9091 16.9091 18.6280 18.6280 k = 0.5000 0.2336 0.8629 ( 4604 PWs) bands (ev): -71.2681 -71.2681 -71.2623 -71.2623 -39.7041 -39.7041 -39.6865 -39.6865 -27.7196 -27.7196 -27.6701 -27.6701 -27.4419 -27.4419 -27.4125 -27.4125 -13.3976 -13.3976 -0.3515 -0.3515 1.3487 1.3487 1.7115 1.7115 3.2749 3.2749 3.3893 3.3893 7.8234 7.8234 8.3009 8.3009 9.8284 9.8284 10.0832 10.0832 10.5939 10.5939 10.8120 10.8120 11.2924 11.2924 11.5576 11.5576 11.8400 11.8400 12.9426 12.9426 13.2222 13.2222 13.9610 13.9610 14.1786 14.1786 14.5193 14.5193 16.6493 16.6493 16.9119 16.9119 18.4910 18.4910 k = 0.5000 0.2336 0.8419 ( 4604 PWs) bands (ev): -71.2685 -71.2685 -71.2619 -71.2619 -39.7051 -39.7051 -39.6853 -39.6853 -27.7202 -27.7202 -27.6640 -27.6640 -27.4462 -27.4462 -27.4134 -27.4134 -13.3999 -13.3999 -0.3476 -0.3476 1.3527 1.3527 1.7011 1.7011 3.2468 3.2468 3.4065 3.4065 7.8613 7.8613 8.3645 8.3645 9.7916 9.7916 10.0606 10.0606 10.5618 10.5618 10.7941 10.7941 11.3040 11.3040 11.5251 11.5251 11.8617 11.8617 12.9822 12.9822 13.2446 13.2446 13.9583 13.9583 14.2250 14.2250 14.5666 14.5666 16.6436 16.6436 16.9148 16.9148 18.3529 18.3529 k = 0.5000 0.2336 0.8208 ( 4606 PWs) bands (ev): -71.2689 -71.2689 -71.2615 -71.2615 -39.7062 -39.7062 -39.6841 -39.6841 -27.7209 -27.7209 -27.6577 -27.6577 -27.4505 -27.4505 -27.4144 -27.4144 -13.4024 -13.4024 -0.3435 -0.3435 1.3572 1.3572 1.6900 1.6900 3.2193 3.2193 3.4231 3.4231 7.8990 7.8990 8.4311 8.4311 9.7539 9.7539 10.0366 10.0366 10.5252 10.5252 10.7752 10.7752 11.3217 11.3217 11.4865 11.4865 11.8899 11.8899 13.0221 13.0221 13.2702 13.2702 13.9545 13.9545 14.2764 14.2764 14.6165 14.6165 16.6397 16.6397 16.9176 16.9176 18.2149 18.2149 k = 0.5000 0.2336 0.7998 ( 4600 PWs) bands (ev): -71.2693 -71.2693 -71.2611 -71.2611 -39.7074 -39.7074 -39.6828 -39.6828 -27.7218 -27.7218 -27.6511 -27.6511 -27.4550 -27.4550 -27.4154 -27.4154 -13.4049 -13.4049 -0.3391 -0.3391 1.3621 1.3621 1.6781 1.6781 3.1928 3.1928 3.4388 3.4388 7.9362 7.9362 8.5005 8.5005 9.7154 9.7154 10.0112 10.0112 10.4858 10.4858 10.7545 10.7545 11.3434 11.3434 11.4456 11.4456 11.9230 11.9230 13.0620 13.0620 13.2992 13.2992 13.9507 13.9507 14.3321 14.3321 14.6690 14.6690 16.6378 16.6378 16.9206 16.9206 18.0783 18.0783 k = 0.5000 0.2336 0.7787 ( 4600 PWs) bands (ev): -71.2697 -71.2697 -71.2607 -71.2607 -39.7086 -39.7086 -39.6815 -39.6815 -27.7227 -27.7227 -27.6443 -27.6443 -27.4596 -27.4596 -27.4165 -27.4165 -13.4075 -13.4075 -0.3345 -0.3345 1.3675 1.3675 1.6655 1.6655 3.1673 3.1673 3.4534 3.4534 7.9726 7.9726 8.5724 8.5724 9.6761 9.6761 9.9844 9.9844 10.4447 10.4447 10.7316 10.7316 11.3539 11.3539 11.4186 11.4186 11.9601 11.9601 13.1014 13.1014 13.3316 13.3316 13.9474 13.9474 14.3914 14.3914 14.7242 14.7242 16.6380 16.6380 16.9239 16.9239 17.9437 17.9437 k = 0.5000 0.2336 0.7577 ( 4598 PWs) bands (ev): -71.2702 -71.2702 -71.2603 -71.2603 -39.7098 -39.7098 -39.6801 -39.6801 -27.7238 -27.7238 -27.6373 -27.6373 -27.4641 -27.4641 -27.4175 -27.4175 -13.4102 -13.4102 -0.3298 -0.3298 1.3733 1.3733 1.6524 1.6524 3.1432 3.1432 3.4667 3.4667 8.0082 8.0082 8.6467 8.6467 9.6359 9.6359 9.9563 9.9563 10.4028 10.4028 10.7069 10.7069 11.3214 11.3214 11.4377 11.4377 12.0006 12.0006 13.1399 13.1399 13.3672 13.3672 13.9453 13.9453 14.4540 14.4540 14.7818 14.7818 16.6403 16.6403 16.9278 16.9278 17.8121 17.8121 k = 0.5000 0.2336 0.7366 ( 4598 PWs) bands (ev): -71.2706 -71.2706 -71.2598 -71.2598 -39.7111 -39.7111 -39.6787 -39.6787 -27.7251 -27.7251 -27.6300 -27.6300 -27.4686 -27.4686 -27.4186 -27.4186 -13.4130 -13.4130 -0.3248 -0.3248 1.3792 1.3792 1.6390 1.6390 3.1205 3.1205 3.4786 3.4786 8.0426 8.0426 8.7231 8.7231 9.5948 9.5948 9.9270 9.9270 10.3606 10.3606 10.6810 10.6810 11.2703 11.2703 11.4782 11.4782 12.0438 12.0438 13.1775 13.1775 13.4059 13.4059 13.9450 13.9450 14.5195 14.5195 14.8418 14.8418 16.6445 16.6445 16.9324 16.9324 17.6839 17.6839 k = 0.5000 0.2336 0.7156 ( 4602 PWs) bands (ev): -71.2711 -71.2711 -71.2594 -71.2594 -39.7124 -39.7124 -39.6773 -39.6773 -27.7265 -27.7265 -27.6226 -27.6226 -27.4731 -27.4731 -27.4197 -27.4197 -13.4158 -13.4158 -0.3197 -0.3197 1.3852 1.3852 1.6255 1.6255 3.0993 3.0993 3.4888 3.4888 8.0759 8.0759 8.8013 8.8013 9.5526 9.5526 9.8965 9.8965 10.3187 10.3187 10.6548 10.6548 11.2145 11.2145 11.5265 11.5265 12.0894 12.0894 13.2139 13.2139 13.4471 13.4471 13.9470 13.9470 14.5874 14.5874 14.9041 14.9041 16.6506 16.6506 16.9381 16.9381 17.5598 17.5598 k = 0.5000 0.2336 0.6946 ( 4604 PWs) bands (ev): -71.2715 -71.2715 -71.2589 -71.2589 -39.7137 -39.7137 -39.6758 -39.6758 -27.7280 -27.7280 -27.6151 -27.6151 -27.4776 -27.4776 -27.4208 -27.4208 -13.4187 -13.4187 -0.3145 -0.3145 1.3908 1.3908 1.6123 1.6123 3.0798 3.0798 3.4972 3.4972 8.1078 8.1078 8.8811 8.8811 9.5091 9.5091 9.8650 9.8650 10.2775 10.2775 10.6291 10.6291 11.1564 11.1564 11.5799 11.5799 12.1370 12.1370 13.2492 13.2492 13.4904 13.4904 13.9520 13.9520 14.6575 14.6575 14.9683 14.9683 16.6581 16.6581 16.9455 16.9455 17.4407 17.4407 k = 0.5000 0.2336 0.6735 ( 4608 PWs) bands (ev): -71.2720 -71.2720 -71.2585 -71.2585 -39.7151 -39.7151 -39.6744 -39.6744 -27.7297 -27.7297 -27.6074 -27.6074 -27.4820 -27.4820 -27.4219 -27.4219 -13.4217 -13.4217 -0.3091 -0.3091 1.3957 1.3957 1.5999 1.5999 3.0620 3.0620 3.5038 3.5038 8.1383 8.1383 8.9621 8.9621 9.4644 9.4644 9.8324 9.8324 10.2371 10.2371 10.6046 10.6046 11.0970 11.0970 11.6372 11.6372 12.1863 12.1863 13.2833 13.2833 13.5351 13.5351 13.9605 13.9605 14.7292 14.7292 15.0345 15.0345 16.6666 16.6666 16.9551 16.9551 17.3271 17.3271 k = 0.5000 0.2336 0.6525 ( 4600 PWs) bands (ev): -71.2725 -71.2725 -71.2580 -71.2580 -39.7164 -39.7164 -39.6729 -39.6729 -27.7316 -27.7316 -27.5997 -27.5997 -27.4862 -27.4862 -27.4230 -27.4230 -13.4247 -13.4247 -0.3037 -0.3037 1.3993 1.3993 1.5891 1.5891 3.0458 3.0458 3.5083 3.5083 8.1675 8.1675 9.0440 9.0440 9.4183 9.4183 9.7990 9.7990 10.1978 10.1978 10.5820 10.5820 11.0369 11.0369 11.6980 11.6980 12.2369 12.2369 13.3161 13.3161 13.5809 13.5809 13.9731 13.9731 14.8022 14.8022 15.1022 15.1022 16.6755 16.6755 16.9672 16.9672 17.2206 17.2206 k = 0.5000 0.2336 0.6314 ( 4600 PWs) bands (ev): -71.2730 -71.2730 -71.2575 -71.2575 -39.7178 -39.7178 -39.6714 -39.6714 -27.7337 -27.7337 -27.5919 -27.5919 -27.4903 -27.4903 -27.4241 -27.4241 -13.4277 -13.4277 -0.2982 -0.2982 1.4008 1.4008 1.5807 1.5807 3.0313 3.0313 3.5107 3.5107 8.1953 8.1953 9.1264 9.1264 9.3708 9.3708 9.7648 9.7648 10.1596 10.1596 10.5617 10.5617 10.9767 10.9767 11.7616 11.7616 12.2880 12.2880 13.3477 13.3477 13.6275 13.6275 13.9900 13.9900 14.8759 14.8759 15.1711 15.1711 16.6841 16.6841 16.9804 16.9804 17.1241 17.1241 k = 0.5000 0.2336 0.6104 ( 4600 PWs) bands (ev): -71.2734 -71.2734 -71.2571 -71.2571 -39.7192 -39.7192 -39.6698 -39.6698 -27.7360 -27.7360 -27.5840 -27.5840 -27.4943 -27.4943 -27.4251 -27.4251 -13.4308 -13.4308 -0.2928 -0.2928 1.3995 1.3995 1.5755 1.5755 3.0185 3.0185 3.5109 3.5109 8.2217 8.2217 9.2078 9.2078 9.3230 9.3230 9.7302 9.7302 10.1225 10.1225 10.5443 10.5443 10.9169 10.9169 11.8274 11.8274 12.3393 12.3393 13.3783 13.3783 13.6748 13.6748 14.0113 14.0113 14.9496 14.9496 15.2407 15.2407 16.6918 16.6918 16.9790 16.9790 17.0553 17.0553 k = 0.5000 0.2336 0.5893 ( 4600 PWs) bands (ev): -71.2739 -71.2739 -71.2566 -71.2566 -39.7206 -39.7206 -39.6683 -39.6683 -27.7384 -27.7384 -27.5762 -27.5762 -27.4981 -27.4981 -27.4261 -27.4261 -13.4339 -13.4339 -0.2874 -0.2874 1.3949 1.3949 1.5742 1.5742 3.0071 3.0071 3.5089 3.5089 8.2469 8.2469 9.2587 9.2587 9.3038 9.3038 9.6956 9.6956 10.0863 10.0863 10.5297 10.5297 10.8582 10.8582 11.8952 11.8952 12.3898 12.3898 13.4079 13.4079 13.7229 13.7229 14.0370 14.0370 15.0225 15.0225 15.3107 15.3107 16.6980 16.6980 16.9231 16.9231 17.0560 17.0560 k = 0.5000 0.2336 0.5683 ( 4598 PWs) bands (ev): -71.2744 -71.2744 -71.2561 -71.2561 -39.7220 -39.7220 -39.6668 -39.6668 -27.7410 -27.7410 -27.5684 -27.5684 -27.5017 -27.5017 -27.4271 -27.4271 -13.4369 -13.4369 -0.2820 -0.2820 1.3870 1.3870 1.5770 1.5770 2.9973 2.9973 3.5046 3.5046 8.2710 8.2710 9.2143 9.2143 9.3772 9.3772 9.6621 9.6621 10.0510 10.0510 10.5178 10.5178 10.8013 10.8013 11.9644 11.9644 12.4389 12.4389 13.4374 13.4374 13.7717 13.7717 14.0665 14.0665 15.0934 15.0934 15.3805 15.3805 16.7027 16.7027 16.8549 16.8549 17.0861 17.0861 k = 0.5000 0.2336 0.5472 ( 4600 PWs) bands (ev): -71.2749 -71.2749 -71.2556 -71.2556 -39.7234 -39.7234 -39.6653 -39.6653 -27.7437 -27.7437 -27.5606 -27.5606 -27.5051 -27.5051 -27.4280 -27.4280 -13.4400 -13.4400 -0.2768 -0.2768 1.3761 1.3761 1.5836 1.5836 2.9888 2.9888 3.4981 3.4981 8.2941 8.2941 9.1617 9.1617 9.4529 9.4529 9.6327 9.6327 10.0162 10.0162 10.5077 10.5077 10.7477 10.7477 12.0347 12.0347 12.4854 12.4854 13.4675 13.4675 13.8215 13.8215 14.0994 14.0994 15.1604 15.1604 15.4499 15.4499 16.7058 16.7058 16.7958 16.7958 17.1260 17.1260 k = 0.5000 0.2336 0.5262 ( 4596 PWs) bands (ev): -71.2754 -71.2754 -71.2551 -71.2551 -39.7248 -39.7248 -39.6638 -39.6638 -27.7466 -27.7466 -27.5530 -27.5530 -27.5083 -27.5083 -27.4289 -27.4289 -13.4431 -13.4431 -0.2718 -0.2718 1.3631 1.3631 1.5933 1.5933 2.9817 2.9817 3.4894 3.4894 8.3163 8.3163 9.1075 9.1075 9.5101 9.5101 9.6220 9.6220 9.9819 9.9819 10.4975 10.4975 10.6995 10.6995 12.1055 12.1055 12.5284 12.5284 13.4992 13.4992 13.8720 13.8720 14.1351 14.1351 15.2213 15.2213 15.5191 15.5191 16.7065 16.7065 16.7513 16.7513 17.1727 17.1727 k = 0.5000 0.2336 0.5051 ( 4600 PWs) bands (ev): -71.2759 -71.2759 -71.2547 -71.2547 -39.7261 -39.7261 -39.6623 -39.6623 -27.7497 -27.7497 -27.5455 -27.5455 -27.5113 -27.5113 -27.4296 -27.4296 -13.4461 -13.4461 -0.2670 -0.2670 1.3486 1.3486 1.6058 1.6058 2.9756 2.9756 3.4785 3.4785 8.3378 8.3378 9.0525 9.0525 9.5153 9.5153 9.6626 9.6626 9.9479 9.9479 10.4837 10.4837 10.6607 10.6607 12.1764 12.1764 12.5668 12.5668 13.5337 13.5337 13.9231 13.9231 14.1732 14.1732 15.2730 15.2730 15.5888 15.5888 16.6976 16.6976 16.7318 16.7318 17.2221 17.2221 k = 0.5000 0.2336 0.4841 ( 4604 PWs) bands (ev): -71.2763 -71.2763 -71.2542 -71.2542 -39.7275 -39.7275 -39.6608 -39.6608 -27.7528 -27.7528 -27.5382 -27.5382 -27.5141 -27.5141 -27.4303 -27.4303 -13.4491 -13.4491 -0.2624 -0.2624 1.3332 1.3332 1.6203 1.6203 2.9707 2.9707 3.4655 3.4655 8.3588 8.3588 8.9970 8.9970 9.4901 9.4901 9.7329 9.7329 9.9141 9.9141 10.4616 10.4616 10.6358 10.6358 12.2469 12.2469 12.5999 12.5999 13.5720 13.5720 13.9741 13.9741 14.2134 14.2134 15.3126 15.3126 15.6602 15.6602 16.6802 16.6802 16.7383 16.7383 17.2015 17.2015 k = 0.5000 0.2336 0.4630 ( 4598 PWs) bands (ev): -71.2768 -71.2768 -71.2537 -71.2537 -39.7288 -39.7288 -39.6594 -39.6594 -27.7561 -27.7561 -27.5311 -27.5311 -27.5166 -27.5166 -27.4308 -27.4308 -13.4520 -13.4520 -0.2581 -0.2581 1.3175 1.3175 1.6366 1.6366 2.9667 2.9667 3.4505 3.4505 8.3794 8.3794 8.9414 8.9414 9.4583 9.4583 9.8078 9.8078 9.8814 9.8814 10.4296 10.4296 10.6267 10.6267 12.3160 12.3160 12.6272 12.6272 13.6148 13.6148 14.0244 14.0244 14.2559 14.2559 15.3380 15.3380 15.7344 15.7344 16.6662 16.6662 16.7600 16.7600 17.1290 17.1290 k = 0.5000 0.2336 0.4420 ( 4600 PWs) bands (ev): -71.2773 -71.2773 -71.2533 -71.2533 -39.7302 -39.7302 -39.6580 -39.6580 -27.7595 -27.7595 -27.5243 -27.5243 -27.5188 -27.5188 -27.4312 -27.4312 -13.4549 -13.4549 -0.2542 -0.2542 1.3017 1.3017 1.6542 1.6542 2.9635 2.9635 3.4335 3.4335 8.3997 8.3997 8.8862 8.8862 9.4250 9.4250 9.8413 9.8413 9.8901 9.8901 10.3910 10.3910 10.6305 10.6305 12.3827 12.3827 12.6492 12.6492 13.6625 13.6625 14.0726 14.0726 14.3011 14.3011 15.3490 15.3490 15.8122 15.8122 16.6552 16.6552 16.7970 16.7970 17.0592 17.0592 k = 0.5000 0.2336 0.4209 ( 4600 PWs) bands (ev): -71.2777 -71.2777 -71.2528 -71.2528 -39.7314 -39.7314 -39.6566 -39.6566 -27.7629 -27.7629 -27.5214 -27.5214 -27.5173 -27.5173 -27.4314 -27.4314 -13.4578 -13.4578 -0.2506 -0.2506 1.2863 1.2863 1.6731 1.6731 2.9611 2.9611 3.4147 3.4147 8.4199 8.4199 8.8317 8.8317 9.3916 9.3916 9.8093 9.8093 9.9617 9.9617 10.3502 10.3502 10.6433 10.6433 12.4450 12.4450 12.6672 12.6672 13.7148 13.7148 14.1178 14.1178 14.3493 14.3493 15.3472 15.3472 15.8933 15.8933 16.6448 16.6448 16.8495 16.8495 16.9955 16.9955 k = 0.5000 0.2336 0.3999 ( 4604 PWs) bands (ev): -71.2781 -71.2781 -71.2524 -71.2524 -39.7327 -39.7327 -39.6553 -39.6553 -27.7664 -27.7664 -27.5232 -27.5232 -27.5112 -27.5112 -27.4314 -27.4314 -13.4605 -13.4605 -0.2475 -0.2475 1.2714 1.2714 1.6930 1.6930 2.9593 2.9593 3.3942 3.3942 8.4400 8.4400 8.7784 8.7784 9.3588 9.3588 9.7750 9.7750 10.0300 10.0300 10.3124 10.3124 10.6623 10.6623 12.4993 12.4993 12.6846 12.6846 13.7712 13.7712 14.1591 14.1591 14.4010 14.4010 15.3352 15.3352 15.9772 15.9772 16.6335 16.6335 16.9055 16.9055 16.9502 16.9502 k = 0.5000 0.2336 0.3788 ( 4606 PWs) bands (ev): -71.2786 -71.2786 -71.2520 -71.2520 -39.7339 -39.7339 -39.6540 -39.6540 -27.7698 -27.7698 -27.5249 -27.5249 -27.5055 -27.5055 -27.4312 -27.4312 -13.4632 -13.4632 -0.2447 -0.2447 1.2572 1.2572 1.7137 1.7137 2.9581 2.9581 3.3722 3.3722 8.4598 8.4598 8.7268 8.7268 9.3268 9.3268 9.7403 9.7403 10.0858 10.0858 10.2860 10.2860 10.6858 10.6858 12.5392 12.5392 12.7080 12.7080 13.8304 13.8304 14.1961 14.1961 14.4562 14.4562 15.3161 15.3161 16.0628 16.0628 16.6206 16.6206 16.8785 16.8785 17.0090 17.0090 k = 0.5000 0.2336 0.3578 ( 4610 PWs) bands (ev): -71.2790 -71.2790 -71.2516 -71.2516 -39.7351 -39.7351 -39.6527 -39.6527 -27.7733 -27.7733 -27.5265 -27.5265 -27.5002 -27.5002 -27.4308 -27.4308 -13.4658 -13.4658 -0.2423 -0.2423 1.2439 1.2439 1.7352 1.7352 2.9573 2.9573 3.3489 3.3489 8.4788 8.4788 8.6781 8.6781 9.2959 9.2959 9.7052 9.7052 10.1117 10.1117 10.2887 10.2887 10.7128 10.7128 12.5592 12.5592 12.7429 12.7429 13.8913 13.8913 14.2288 14.2288 14.5145 14.5145 15.2928 15.2928 16.1490 16.1490 16.6056 16.6056 16.8383 16.8383 17.1017 17.1017 k = 0.5000 0.2336 0.3368 ( 4598 PWs) bands (ev): -71.2794 -71.2794 -71.2512 -71.2512 -39.7362 -39.7362 -39.6515 -39.6515 -27.7767 -27.7767 -27.5279 -27.5279 -27.4953 -27.4953 -27.4300 -27.4300 -13.4683 -13.4683 -0.2404 -0.2404 1.2315 1.2315 1.7571 1.7571 2.9569 2.9569 3.3243 3.3243 8.4951 8.4951 8.6345 8.6345 9.2662 9.2662 9.6699 9.6699 10.1005 10.1005 10.3282 10.3282 10.7424 10.7424 12.5609 12.5609 12.7882 12.7882 13.9520 13.9520 14.2582 14.2582 14.5750 14.5750 15.2678 15.2678 16.2337 16.2337 16.5889 16.5889 16.8075 16.8075 17.2051 17.2051 k = 0.5000 0.2336 0.3157 ( 4604 PWs) bands (ev): -71.2797 -71.2797 -71.2509 -71.2509 -39.7373 -39.7373 -39.6504 -39.6504 -27.7801 -27.7801 -27.5291 -27.5291 -27.4910 -27.4910 -27.4290 -27.4290 -13.4707 -13.4707 -0.2388 -0.2388 1.2200 1.2200 1.7796 1.7796 2.9568 2.9568 3.2988 3.2988 8.5025 8.5025 8.6025 8.6025 9.2378 9.2378 9.6343 9.6343 10.0706 10.0706 10.3859 10.3859 10.7740 10.7740 12.5501 12.5501 12.8383 12.8383 14.0104 14.0104 14.2853 14.2853 14.6367 14.6367 15.2433 15.2433 16.3131 16.3131 16.5730 16.5730 16.7881 16.7881 17.3165 17.3165 k = 0.5000 0.2336 0.2947 ( 4604 PWs) bands (ev): -71.2801 -71.2801 -71.2505 -71.2505 -39.7383 -39.7383 -39.6493 -39.6493 -27.7833 -27.7833 -27.5302 -27.5302 -27.4872 -27.4872 -27.4276 -27.4276 -13.4729 -13.4729 -0.2377 -0.2377 1.2096 1.2096 1.8023 1.8023 2.9570 2.9570 3.2726 3.2726 8.4893 8.4893 8.5942 8.5942 9.2109 9.2109 9.5984 9.5984 10.0349 10.0349 10.4490 10.4490 10.8070 10.8070 12.5312 12.5312 12.8891 12.8891 14.0643 14.0643 14.3119 14.3119 14.6982 14.6982 15.2210 15.2210 16.3787 16.3787 16.5651 16.5651 16.7816 16.7816 17.4342 17.4342 k = 0.5000 0.2336 0.2736 ( 4604 PWs) bands (ev): -71.2804 -71.2804 -71.2502 -71.2502 -39.7393 -39.7393 -39.6483 -39.6483 -27.7865 -27.7865 -27.5312 -27.5312 -27.4840 -27.4840 -27.4260 -27.4260 -13.4751 -13.4751 -0.2369 -0.2369 1.2002 1.2002 1.8251 1.8251 2.9574 2.9574 3.2459 3.2459 8.4587 8.4587 8.6066 8.6066 9.1856 9.1856 9.5623 9.5623 9.9981 9.9981 10.5130 10.5130 10.8411 10.8411 12.5068 12.5068 12.9384 12.9384 14.1109 14.1109 14.3402 14.3402 14.7584 14.7584 15.2024 15.2024 16.4142 16.4142 16.5790 16.5790 16.7904 16.7904 17.5561 17.5561 k = 0.5000 0.2336 0.2526 ( 4592 PWs) bands (ev): -71.2807 -71.2807 -71.2499 -71.2499 -39.7402 -39.7402 -39.6473 -39.6473 -27.7895 -27.7895 -27.5320 -27.5320 -27.4813 -27.4813 -27.4241 -27.4241 -13.4771 -13.4771 -0.2364 -0.2364 1.1918 1.1918 1.8480 1.8480 2.9580 2.9580 3.2189 3.2189 8.4228 8.4228 8.6278 8.6278 9.1619 9.1619 9.5259 9.5259 9.9619 9.9619 10.5760 10.5760 10.8757 10.8757 12.4784 12.4784 12.9849 12.9849 14.1481 14.1481 14.3720 14.3720 14.8156 14.8156 15.1888 15.1888 16.4162 16.4162 16.6132 16.6132 16.8187 16.8187 17.6209 17.6209 k = 0.5000 0.2336 0.2315 ( 4592 PWs) bands (ev): -71.2810 -71.2810 -71.2496 -71.2496 -39.7410 -39.7410 -39.6464 -39.6464 -27.7924 -27.7924 -27.5328 -27.5328 -27.4791 -27.4791 -27.4220 -27.4220 -13.4790 -13.4790 -0.2363 -0.2363 1.1843 1.1843 1.8706 1.8706 2.9587 2.9587 3.1919 3.1919 8.3869 8.3869 8.6529 8.6529 9.1399 9.1399 9.4892 9.4892 9.9272 9.9272 10.6370 10.6370 10.9105 10.9105 12.4472 12.4472 13.0278 13.0278 14.1749 14.1749 14.4076 14.4076 14.8682 14.8682 15.1813 15.1813 16.4019 16.4019 16.6474 16.6474 16.8693 16.8693 17.6108 17.6108 k = 0.5000 0.2336 0.2105 ( 4588 PWs) bands (ev): -71.2813 -71.2813 -71.2493 -71.2493 -39.7418 -39.7418 -39.6456 -39.6456 -27.7951 -27.7951 -27.5334 -27.5334 -27.4773 -27.4773 -27.4199 -27.4199 -13.4807 -13.4807 -0.2364 -0.2364 1.1778 1.1778 1.8927 1.8927 2.9595 2.9595 3.1654 3.1654 8.3527 8.3527 8.6802 8.6802 9.1198 9.1198 9.4522 9.4522 9.8945 9.8945 10.6955 10.6955 10.9450 10.9450 12.4140 12.4140 13.0668 13.0668 14.1926 14.1926 14.4460 14.4460 14.9143 14.9143 15.1811 15.1811 16.3829 16.3829 16.6736 16.6736 16.9377 16.9377 17.6033 17.6033 k = 0.5000 0.2336 0.1894 ( 4580 PWs) bands (ev): -71.2815 -71.2815 -71.2491 -71.2491 -39.7425 -39.7425 -39.6448 -39.6448 -27.7975 -27.7975 -27.5340 -27.5340 -27.4759 -27.4759 -27.4176 -27.4176 -13.4823 -13.4823 -0.2366 -0.2366 1.1722 1.1722 1.9142 1.9142 2.9604 2.9604 3.1394 3.1394 8.3209 8.3209 8.7091 8.7091 9.1016 9.1016 9.4148 9.4148 9.8642 9.8642 10.7507 10.7507 10.9789 10.9789 12.3797 12.3797 13.1016 13.1016 14.2031 14.2031 14.4850 14.4850 14.9526 14.9526 15.1888 15.1888 16.3634 16.3634 16.6945 16.6945 17.0158 17.0158 17.5995 17.5995 k = 0.5000 0.2336 0.1684 ( 4580 PWs) bands (ev): -71.2817 -71.2817 -71.2488 -71.2488 -39.7432 -39.7432 -39.6441 -39.6441 -27.7998 -27.7998 -27.5344 -27.5344 -27.4748 -27.4748 -27.4155 -27.4155 -13.4837 -13.4837 -0.2371 -0.2371 1.1673 1.1673 1.9348 1.9348 2.9613 2.9613 3.1145 3.1145 8.2918 8.2918 8.7393 8.7393 9.0855 9.0855 9.3772 9.3772 9.8365 9.8365 10.8020 10.8020 11.0119 11.0119 12.3451 12.3451 13.1320 13.1320 14.2086 14.2086 14.5226 14.5226 14.9824 14.9824 15.2038 15.2038 16.3451 16.3451 16.7129 16.7129 17.0975 17.0975 17.5993 17.5993 k = 0.5000 0.2336 0.1473 ( 4572 PWs) bands (ev): -71.2819 -71.2819 -71.2486 -71.2486 -39.7438 -39.7438 -39.6435 -39.6435 -27.8019 -27.8019 -27.5348 -27.5348 -27.4740 -27.4740 -27.4134 -27.4134 -13.4850 -13.4850 -0.2376 -0.2376 1.1633 1.1633 1.9541 1.9541 2.9624 2.9624 3.0910 3.0910 8.2658 8.2658 8.7703 8.7703 9.0715 9.0715 9.3392 9.3392 9.8116 9.8116 10.8489 10.8489 11.0437 11.0437 12.3110 12.3110 13.1581 13.1581 14.2108 14.2108 14.5574 14.5574 15.0046 15.0046 15.2243 15.2243 16.3286 16.3286 16.7302 16.7302 17.1786 17.1786 17.6029 17.6029 k = 0.5000 0.2336 0.1263 ( 4580 PWs) bands (ev): -71.2821 -71.2821 -71.2485 -71.2485 -39.7443 -39.7443 -39.6430 -39.6430 -27.8037 -27.8037 -27.5351 -27.5351 -27.4734 -27.4734 -27.4115 -27.4115 -13.4861 -13.4861 -0.2382 -0.2382 1.1599 1.1599 1.9719 1.9719 2.9635 2.9635 3.0692 3.0692 8.2430 8.2430 8.8019 8.8019 9.0599 9.0599 9.3011 9.3011 9.7898 9.7898 10.8906 10.8906 11.0737 11.0737 12.2783 12.2783 13.1799 13.1799 14.2109 14.2109 14.5884 14.5884 15.0210 15.0210 15.2473 15.2473 16.3141 16.3141 16.7467 16.7467 17.2557 17.2557 17.6103 17.6103 k = 0.5000 0.2336 0.1052 ( 4576 PWs) bands (ev): -71.2822 -71.2822 -71.2483 -71.2483 -39.7447 -39.7447 -39.6425 -39.6425 -27.8052 -27.8052 -27.5354 -27.5354 -27.4729 -27.4729 -27.4098 -27.4098 -13.4871 -13.4871 -0.2387 -0.2387 1.1571 1.1571 1.9877 1.9877 2.9649 2.9649 3.0494 3.0494 8.2235 8.2235 8.8334 8.8334 9.0512 9.0512 9.2630 9.2630 9.7711 9.7711 10.9265 10.9265 11.1015 11.1015 12.2480 12.2480 13.1977 13.1977 14.2099 14.2099 14.6151 14.6151 15.0334 15.0334 15.2702 15.2702 16.3019 16.3019 16.7620 16.7620 17.3257 17.3257 17.6218 17.6218 k = 0.5000 0.2336 0.0842 ( 4568 PWs) bands (ev): -71.2823 -71.2823 -71.2482 -71.2482 -39.7450 -39.7450 -39.6421 -39.6421 -27.8065 -27.8065 -27.5356 -27.5356 -27.4725 -27.4725 -27.4083 -27.4083 -13.4879 -13.4879 -0.2393 -0.2393 1.1550 1.1550 2.0013 2.0013 2.9665 2.9665 3.0321 3.0321 8.2074 8.2074 8.8640 8.8640 9.0458 9.0458 9.2252 9.2252 9.7558 9.7558 10.9563 10.9563 11.1264 11.1264 12.2210 12.2210 13.2118 13.2118 14.2084 14.2084 14.6372 14.6372 15.0430 15.0430 15.2909 15.2909 16.2920 16.2920 16.7756 16.7756 17.3849 17.3849 17.6377 17.6377 k = 0.5000 0.2336 0.0631 ( 4568 PWs) bands (ev): -71.2824 -71.2824 -71.2481 -71.2481 -39.7453 -39.7453 -39.6418 -39.6418 -27.8075 -27.8075 -27.5357 -27.5357 -27.4723 -27.4723 -27.4072 -27.4072 -13.4885 -13.4885 -0.2397 -0.2397 1.1533 1.1533 2.0123 2.0123 2.9684 2.9684 3.0175 3.0175 8.1949 8.1949 8.8920 8.8920 9.0451 9.0451 9.1881 9.1881 9.7438 9.7438 10.9796 10.9796 11.1473 11.1473 12.1985 12.1985 13.2224 13.2224 14.2068 14.2068 14.6544 14.6544 15.0503 15.0503 15.3080 15.3080 16.2843 16.2843 16.7870 16.7870 17.4304 17.4304 17.6573 17.6573 k = 0.5000 0.2336 0.0421 ( 4568 PWs) bands (ev): -71.2825 -71.2825 -71.2481 -71.2481 -39.7455 -39.7455 -39.6416 -39.6416 -27.8082 -27.8082 -27.5359 -27.5359 -27.4721 -27.4721 -27.4064 -27.4064 -13.4889 -13.4889 -0.2401 -0.2401 1.1522 1.1522 2.0204 2.0204 2.9706 2.9706 3.0059 3.0059 8.1859 8.1859 8.9150 8.9150 9.0507 9.0507 9.1524 9.1524 9.7352 9.7352 10.9962 10.9962 11.1632 11.1632 12.1815 12.1815 13.2297 13.2297 14.2055 14.2055 14.6667 14.6667 15.0555 15.0555 15.3207 15.3207 16.2788 16.2788 16.7955 16.7955 17.4611 17.4611 17.6776 17.6776 k = 0.5000 0.2336 0.0210 ( 4558 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7456 -39.7456 -39.6415 -39.6415 -27.8086 -27.8086 -27.5359 -27.5359 -27.4720 -27.4720 -27.4058 -27.4058 -13.4892 -13.4892 -0.2403 -0.2403 1.1515 1.1515 2.0254 2.0254 2.9728 2.9728 2.9979 2.9979 8.1805 8.1805 8.9300 8.9300 9.0645 9.0645 9.1195 9.1195 9.7300 9.7300 11.0062 11.0062 11.1732 11.1732 12.1709 12.1709 13.2341 13.2341 14.2046 14.2046 14.6741 14.6741 15.0586 15.0586 15.3285 15.3285 16.2755 16.2755 16.8008 16.8008 17.4783 17.4783 17.6932 17.6932 k = 0.5000 0.2336 0.0000 ( 4580 PWs) bands (ev): -71.2825 -71.2825 -71.2480 -71.2480 -39.7457 -39.7457 -39.6414 -39.6414 -27.8088 -27.8088 -27.5360 -27.5360 -27.4720 -27.4720 -27.4057 -27.4057 -13.4893 -13.4893 -0.2403 -0.2403 1.1513 1.1513 2.0270 2.0270 2.9740 2.9740 2.9949 2.9949 8.1786 8.1786 8.9350 8.9350 9.0806 9.0806 9.0968 9.0968 9.7283 9.7283 11.0095 11.0095 11.1767 11.1767 12.1673 12.1673 13.2355 13.2355 14.2043 14.2043 14.6766 14.6766 15.0596 15.0596 15.3311 15.3311 16.2744 16.2744 16.8025 16.8025 17.4837 17.4837 17.6990 17.6990 k = 0.0000 0.0000 1.1813 ( 4632 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2027 3.2027 3.5714 3.5714 7.4500 7.4500 7.8061 7.8061 10.1412 10.1412 10.2353 10.2353 10.6613 10.6613 11.1010 11.1010 11.3826 11.3826 11.4931 11.4931 11.9328 11.9328 12.6136 12.6136 13.1054 13.1054 13.7974 13.7974 14.0817 14.0817 14.1665 14.1665 16.7939 16.7939 16.8638 16.8638 19.2653 19.2653 k = 0.0192 0.0090 1.1813 ( 4618 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2028 3.2028 3.5714 3.5714 7.4512 7.4512 7.8047 7.8047 10.1419 10.1419 10.2363 10.2363 10.6592 10.6592 11.1027 11.1027 11.3823 11.3823 11.4922 11.4922 11.9330 11.9330 12.6133 12.6133 13.1080 13.1080 13.7952 13.7952 14.0819 14.0819 14.1659 14.1659 16.7942 16.7942 16.8638 16.8638 19.2675 19.2675 k = 0.0385 0.0180 1.1813 ( 4618 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2028 3.2028 3.5714 3.5714 7.4546 7.4546 7.8002 7.8002 10.1437 10.1437 10.2392 10.2392 10.6529 10.6529 11.1075 11.1075 11.3814 11.3814 11.4896 11.4896 11.9339 11.9339 12.6124 12.6124 13.1157 13.1157 13.7887 13.7887 14.0822 14.0822 14.1643 14.1643 16.7948 16.7948 16.8638 16.8638 19.2740 19.2740 k = 0.0577 0.0270 1.1813 ( 4620 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3802 -0.3802 1.3312 1.3312 1.7832 1.7832 3.2029 3.2029 3.5713 3.5713 7.4602 7.4602 7.7930 7.7930 10.1465 10.1465 10.2441 10.2441 10.6428 10.6428 11.1152 11.1152 11.3800 11.3800 11.4853 11.4853 11.9352 11.9352 12.6111 12.6111 13.1283 13.1283 13.7778 13.7778 14.0826 14.0826 14.1617 14.1617 16.7958 16.7958 16.8639 16.8639 19.2847 19.2847 k = 0.0769 0.0359 1.1813 ( 4620 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7831 1.7831 3.2030 3.2030 3.5712 3.5712 7.4681 7.4681 7.7830 7.7830 10.1500 10.1500 10.2513 10.2513 10.6293 10.6293 11.1252 11.1252 11.3783 11.3783 11.4794 11.4794 11.9370 11.9370 12.6093 12.6093 13.1456 13.1456 13.7626 13.7626 14.0833 14.0833 14.1583 14.1583 16.7971 16.7971 16.8640 16.8640 19.2993 19.2993 k = 0.0962 0.0449 1.1813 ( 4616 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7831 1.7831 3.2031 3.2031 3.5710 3.5710 7.4780 7.4780 7.7706 7.7706 10.1537 10.1537 10.2610 10.2610 10.6130 10.6130 11.1370 11.1370 11.3764 11.3764 11.4719 11.4719 11.9391 11.9391 12.6072 12.6072 13.1671 13.1671 13.7434 13.7434 14.0841 14.0841 14.1545 14.1545 16.7987 16.7987 16.8642 16.8642 19.3176 19.3176 k = 0.1154 0.0539 1.1813 ( 4610 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7831 1.7831 3.2033 3.2033 3.5709 3.5709 7.4900 7.4900 7.7560 7.7560 10.1574 10.1574 10.2730 10.2730 10.5944 10.5944 11.1499 11.1499 11.3745 11.3745 11.4632 11.4632 11.9414 11.9414 12.6050 12.6050 13.1925 13.1925 13.7203 13.7203 14.0850 14.0850 14.1505 14.1505 16.8003 16.8003 16.8644 16.8644 19.3391 19.3391 k = 0.1346 0.0629 1.1813 ( 4606 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4056 -27.4056 -27.4049 -27.4049 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7830 1.7830 3.2034 3.2034 3.5707 3.5707 7.5037 7.5037 7.7395 7.7395 10.1607 10.1607 10.2874 10.2874 10.5739 10.5739 11.1633 11.1633 11.3730 11.3730 11.4533 11.4533 11.9439 11.9439 12.6028 12.6028 13.2212 13.2212 13.6937 13.6937 14.0860 14.0860 14.1464 14.1464 16.8020 16.8020 16.8645 16.8645 19.3636 19.3636 k = 0.1538 0.0719 1.1813 ( 4616 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7168 -27.7168 -27.4057 -27.4057 -27.4049 -27.4049 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7830 1.7830 3.2036 3.2036 3.5706 3.5706 7.5192 7.5192 7.7213 7.7213 10.1636 10.1636 10.3038 10.3038 10.5522 10.5522 11.1766 11.1766 11.3721 11.3721 11.4426 11.4426 11.9463 11.9463 12.6007 12.6007 13.2525 13.2525 13.6643 13.6643 14.0871 14.0871 14.1426 14.1426 16.8037 16.8037 16.8647 16.8647 19.3905 19.3905 k = 0.1731 0.0809 1.1813 ( 4624 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6957 -39.6957 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4049 -27.4049 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7830 1.7830 3.2037 3.2037 3.5705 3.5705 7.5362 7.5362 7.7019 7.7019 10.1660 10.1660 10.3219 10.3219 10.5298 10.5298 11.1891 11.1891 11.3721 11.3721 11.4314 11.4314 11.9486 11.9486 12.5987 12.5987 13.2856 13.2856 13.6327 13.6327 14.0881 14.0881 14.1391 14.1391 16.8051 16.8051 16.8648 16.8648 19.4194 19.4194 k = 0.1923 0.0898 1.1813 ( 4632 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4049 -27.4049 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7829 1.7829 3.2038 3.2038 3.5703 3.5703 7.5544 7.5544 7.6816 7.6816 10.1678 10.1678 10.3409 10.3409 10.5074 10.5074 11.2000 11.2000 11.3735 11.3735 11.4201 11.4201 11.9504 11.9504 12.5971 12.5971 13.3192 13.3192 13.6002 13.6002 14.0890 14.0890 14.1362 14.1362 16.8063 16.8063 16.8650 16.8650 19.4494 19.4494 k = 0.2115 0.0988 1.1813 ( 4638 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4049 -27.4049 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7829 1.7829 3.2039 3.2039 3.5703 3.5703 7.5735 7.5735 7.6609 7.6609 10.1690 10.1690 10.3597 10.3597 10.4863 10.4863 11.2085 11.2085 11.3763 11.3763 11.4094 11.4094 11.9519 11.9519 12.5959 12.5959 13.3511 13.3511 13.5690 13.5690 14.0898 14.0898 14.1340 14.1340 16.8072 16.8072 16.8651 16.8651 19.4790 19.4790 k = 0.2308 0.1078 1.1813 ( 4636 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3312 1.3312 1.7829 1.7829 3.2039 3.2039 3.5702 3.5702 7.5928 7.5928 7.6407 7.6407 10.1698 10.1698 10.3755 10.3755 10.4692 10.4692 11.2140 11.2140 11.3806 11.3806 11.4000 11.4000 11.9528 11.9528 12.5951 12.5951 13.3770 13.3770 13.5436 13.5436 14.0904 14.0904 14.1326 14.1326 16.8078 16.8078 16.8652 16.8652 19.5045 19.5045 k = 0.2500 0.1168 1.1813 ( 4640 PWs) bands (ev): -71.2652 -71.2652 -71.2652 -71.2652 -39.6958 -39.6958 -39.6958 -39.6958 -27.7176 -27.7176 -27.7169 -27.7169 -27.4057 -27.4057 -27.4050 -27.4050 -13.3795 -13.3795 -0.3801 -0.3801 1.3311 1.3311 1.7829 1.7829 3.2039 3.2039 3.5702 3.5702 7.6060 7.6060 7.6272 7.6272 10.1700 10.1700 10.3823 10.3823 10.4619 10.4619 11.2159 11.2159 11.3840 11.3840 11.3948 11.3948 11.9531 11.9531 12.5949 12.5949 13.3877 13.3877 13.5329 13.5329 14.0906 14.0906 14.1321 14.1321 16.8079 16.8079 16.8652 16.8652 19.5161 19.5161 Writing output data file BaxPOsx2.save init_run : 0.38s CPU 0.58s WALL ( 1 calls) electrons : 297.14s CPU 300.45s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 297.13s CPU 300.43s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.09s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.10s WALL ( 345 calls) cegterg : 270.80s CPU 273.39s WALL ( 403 calls) Called by sum_band: Called by *egterg: h_psi : 201.12s CPU 203.10s WALL ( 6797 calls) s_psi : 8.64s CPU 8.75s WALL ( 6797 calls) g_psi : 0.30s CPU 0.30s WALL ( 6049 calls) cdiaghg : 62.15s CPU 63.11s WALL ( 6394 calls) cegterg:over : 8.28s CPU 8.15s WALL ( 6049 calls) cegterg:upda : 6.86s CPU 6.67s WALL ( 6049 calls) cegterg:last : 3.47s CPU 3.49s WALL ( 1093 calls) cdiaghg:chol : 3.48s CPU 3.61s WALL ( 6394 calls) cdiaghg:inve : 2.46s CPU 2.57s WALL ( 6394 calls) cdiaghg:para : 4.21s CPU 4.20s WALL ( 12788 calls) Called by h_psi: h_psi:vloc : 184.20s CPU 186.12s WALL ( 6797 calls) h_psi:vnl : 16.63s CPU 16.69s WALL ( 6797 calls) add_vuspsi : 9.14s CPU 9.09s WALL ( 6797 calls) General routines calbec : 7.45s CPU 7.58s WALL ( 6797 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 174.15s CPU 176.05s WALL ( 896896 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.38s WALL ( 690 calls) Parallel routines fft_scatter : 49.05s CPU 49.70s WALL ( 896919 calls) PWSCF : 5m20.18s CPU 5m42.98s WALL This run was terminated on: 14:12:58 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=