Program PWSCF v.5.4.0 starts on 15Mar2017 at 12:38:22 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./KAg2SbS4.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 45 30 8 1467 774 117 Max 46 31 9 1470 805 119 Sum 3243 2161 599 105687 56935 8471 bravais-lattice index = 14 lattice parameter (alat) = 12.1749 a.u. unit-cell volume = 1350.0196 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 278.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.174949 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.428827 celldm(5)= -0.428827 celldm(6)= -0.142345 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.142345 0.989817 0.000000 ) a(3) = ( -0.428827 -0.494909 0.755760 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.143810 0.661586 ) b(2) = ( 0.000000 1.010288 0.661586 ) b(3) = ( 0.000000 0.000000 1.323172 ) PseudoPot. # 1 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 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. # 2 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 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 Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 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 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 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 K 9.00 39.09830 K( 1.00) S 6.00 32.06500 S( 1.00) Sb 5.00 121.76000 Sb( 1.00) Ag 11.00 107.86820 Ag( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E s 2 inv. 180 deg rotation - cart. axis [0,0,1] -s -2 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 266 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 2) = ( 0.0000000 0.0000000 0.0200481), wk = 0.0037594 k( 3) = ( 0.0000000 0.0000000 0.0400961), wk = 0.0037594 k( 4) = ( 0.0000000 0.0000000 0.0601442), wk = 0.0037594 k( 5) = ( 0.0000000 0.0000000 0.0801922), wk = 0.0037594 k( 6) = ( 0.0000000 0.0000000 0.1002403), wk = 0.0037594 k( 7) = ( 0.0000000 0.0000000 0.1202884), wk = 0.0037594 k( 8) = ( 0.0000000 0.0000000 0.1403364), wk = 0.0037594 k( 9) = ( 0.0000000 0.0000000 0.1603845), wk = 0.0037594 k( 10) = ( 0.0000000 0.0000000 0.1804325), wk = 0.0037594 k( 11) = ( 0.0000000 0.0000000 0.2004806), wk = 0.0037594 k( 12) = ( 0.0000000 0.0000000 0.2205287), wk = 0.0037594 k( 13) = ( 0.0000000 0.0000000 0.2405767), wk = 0.0037594 k( 14) = ( 0.0000000 0.0000000 0.2606248), wk = 0.0037594 k( 15) = ( 0.0000000 0.0000000 0.2806728), wk = 0.0037594 k( 16) = ( 0.0000000 0.0000000 0.3007209), wk = 0.0037594 k( 17) = ( 0.0000000 0.0000000 0.3207690), wk = 0.0037594 k( 18) = ( 0.0000000 0.0000000 0.3408170), wk = 0.0037594 k( 19) = ( 0.0000000 0.0000000 0.3608651), wk = 0.0037594 k( 20) = ( 0.0000000 0.0000000 0.3809131), wk = 0.0037594 k( 21) = ( 0.0000000 0.0000000 0.4009612), wk = 0.0037594 k( 22) = ( 0.0000000 0.0000000 0.4210093), wk = 0.0037594 k( 23) = ( 0.0000000 0.0000000 0.4410573), wk = 0.0037594 k( 24) = ( 0.0000000 0.0000000 0.4611054), wk = 0.0037594 k( 25) = ( 0.0000000 0.0000000 0.4811534), wk = 0.0037594 k( 26) = ( 0.0000000 0.0000000 0.5012015), wk = 0.0037594 k( 27) = ( 0.0000000 0.0000000 0.5212495), wk = 0.0037594 k( 28) = ( 0.0000000 0.0000000 0.5412976), wk = 0.0037594 k( 29) = ( 0.0000000 0.0000000 0.5613457), wk = 0.0037594 k( 30) = ( 0.0000000 0.0000000 0.5813937), wk = 0.0037594 k( 31) = ( 0.0000000 0.0000000 0.6014418), wk = 0.0037594 k( 32) = ( 0.0000000 0.0000000 0.6214899), wk = 0.0037594 k( 33) = ( 0.0000000 0.0000000 0.6415379), wk = 0.0037594 k( 34) = ( 0.0000000 0.0000000 0.6615860), wk = 0.0037594 k( 35) = ( 0.0000000 0.0000000 0.6615860), wk = 0.0037594 k( 36) = ( -0.0151357 0.0131147 0.6615860), wk = 0.0037594 k( 37) = ( -0.0302714 0.0262295 0.6615860), wk = 0.0037594 k( 38) = ( -0.0454071 0.0393442 0.6615860), wk = 0.0037594 k( 39) = ( -0.0605428 0.0524590 0.6615860), wk = 0.0037594 k( 40) = ( -0.0756785 0.0655737 0.6615860), wk = 0.0037594 k( 41) = ( -0.0908142 0.0786885 0.6615860), wk = 0.0037594 k( 42) = ( -0.1059498 0.0918032 0.6615860), wk = 0.0037594 k( 43) = ( -0.1210856 0.1049180 0.6615860), wk = 0.0037594 k( 44) = ( -0.1362212 0.1180327 0.6615860), wk = 0.0037594 k( 45) = ( -0.1513569 0.1311474 0.6615860), wk = 0.0037594 k( 46) = ( -0.1664926 0.1442622 0.6615860), wk = 0.0037594 k( 47) = ( -0.1816283 0.1573769 0.6615860), wk = 0.0037594 k( 48) = ( -0.1967640 0.1704917 0.6615860), wk = 0.0037594 k( 49) = ( -0.2118997 0.1836064 0.6615860), wk = 0.0037594 k( 50) = ( -0.2270354 0.1967212 0.6615860), wk = 0.0037594 k( 51) = ( -0.2421711 0.2098359 0.6615860), wk = 0.0037594 k( 52) = ( -0.2573068 0.2229507 0.6615860), wk = 0.0037594 k( 53) = ( -0.2724425 0.2360654 0.6615860), wk = 0.0037594 k( 54) = ( -0.2875782 0.2491801 0.6615860), wk = 0.0037594 k( 55) = ( -0.3027139 0.2622949 0.6615860), wk = 0.0037594 k( 56) = ( -0.3178496 0.2754096 0.6615860), wk = 0.0037594 k( 57) = ( -0.3329853 0.2885244 0.6615860), wk = 0.0037594 k( 58) = ( -0.3329853 0.2885244 0.6615860), wk = 0.0037594 k( 59) = ( -0.3434237 0.2975690 0.6477741), wk = 0.0037594 k( 60) = ( -0.3538621 0.3066137 0.6339623), wk = 0.0037594 k( 61) = ( -0.3643005 0.3156584 0.6201505), wk = 0.0037594 k( 62) = ( -0.3747389 0.3247030 0.6063387), wk = 0.0037594 k( 63) = ( -0.3851774 0.3337477 0.5925268), wk = 0.0037594 k( 64) = ( -0.3956158 0.3427923 0.5787150), wk = 0.0037594 k( 65) = ( -0.4060542 0.3518370 0.5649032), wk = 0.0037594 k( 66) = ( -0.4164926 0.3608817 0.5510914), wk = 0.0037594 k( 67) = ( -0.4164926 0.3608817 0.5510914), wk = 0.0037594 k( 68) = ( -0.4058133 0.3516283 0.5369608), wk = 0.0037594 k( 69) = ( -0.3951340 0.3423749 0.5228303), wk = 0.0037594 k( 70) = ( -0.3844547 0.3331215 0.5086997), wk = 0.0037594 k( 71) = ( -0.3737754 0.3238682 0.4945692), wk = 0.0037594 k( 72) = ( -0.3630961 0.3146148 0.4804386), wk = 0.0037594 k( 73) = ( -0.3524168 0.3053614 0.4663081), wk = 0.0037594 k( 74) = ( -0.3417375 0.2961080 0.4521775), wk = 0.0037594 k( 75) = ( -0.3310582 0.2868547 0.4380470), wk = 0.0037594 k( 76) = ( -0.3203789 0.2776013 0.4239164), wk = 0.0037594 k( 77) = ( -0.3096996 0.2683479 0.4097859), wk = 0.0037594 k( 78) = ( -0.2990203 0.2590945 0.3956553), wk = 0.0037594 k( 79) = ( -0.2883410 0.2498412 0.3815248), wk = 0.0037594 k( 80) = ( -0.2776617 0.2405878 0.3673942), wk = 0.0037594 k( 81) = ( -0.2669824 0.2313344 0.3532637), wk = 0.0037594 k( 82) = ( -0.2563031 0.2220810 0.3391331), wk = 0.0037594 k( 83) = ( -0.2456239 0.2128277 0.3250026), wk = 0.0037594 k( 84) = ( -0.2349446 0.2035743 0.3108721), wk = 0.0037594 k( 85) = ( -0.2242653 0.1943209 0.2967415), wk = 0.0037594 k( 86) = ( -0.2135860 0.1850675 0.2826110), wk = 0.0037594 k( 87) = ( -0.2029067 0.1758141 0.2684804), wk = 0.0037594 k( 88) = ( -0.1922274 0.1665608 0.2543499), wk = 0.0037594 k( 89) = ( -0.1815481 0.1573074 0.2402193), wk = 0.0037594 k( 90) = ( -0.1708688 0.1480540 0.2260888), wk = 0.0037594 k( 91) = ( -0.1601895 0.1388006 0.2119582), wk = 0.0037594 k( 92) = ( -0.1495102 0.1295473 0.1978277), wk = 0.0037594 k( 93) = ( -0.1388309 0.1202939 0.1836971), wk = 0.0037594 k( 94) = ( -0.1281516 0.1110405 0.1695666), wk = 0.0037594 k( 95) = ( -0.1174723 0.1017871 0.1554360), wk = 0.0037594 k( 96) = ( -0.1067930 0.0925338 0.1413055), wk = 0.0037594 k( 97) = ( -0.0961137 0.0832804 0.1271749), wk = 0.0037594 k( 98) = ( -0.0854344 0.0740270 0.1130444), wk = 0.0037594 k( 99) = ( -0.0747551 0.0647736 0.0989138), wk = 0.0037594 k( 100) = ( -0.0640758 0.0555203 0.0847833), wk = 0.0037594 k( 101) = ( -0.0533965 0.0462669 0.0706527), wk = 0.0037594 k( 102) = ( -0.0427172 0.0370135 0.0565222), wk = 0.0037594 k( 103) = ( -0.0320379 0.0277601 0.0423916), wk = 0.0037594 k( 104) = ( -0.0213586 0.0185068 0.0282611), wk = 0.0037594 k( 105) = ( -0.0106793 0.0092534 0.0141306), wk = 0.0037594 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 108) = ( 0.0131579 0.0151855 -0.0000000), wk = 0.0037594 k( 109) = ( 0.0263158 0.0303710 -0.0000000), wk = 0.0037594 k( 110) = ( 0.0394737 0.0455565 -0.0000000), wk = 0.0037594 k( 111) = ( 0.0526316 0.0607420 -0.0000000), wk = 0.0037594 k( 112) = ( 0.0657895 0.0759275 -0.0000000), wk = 0.0037594 k( 113) = ( 0.0789474 0.0911130 -0.0000000), wk = 0.0037594 k( 114) = ( 0.0921053 0.1062984 -0.0000000), wk = 0.0037594 k( 115) = ( 0.1052632 0.1214839 -0.0000000), wk = 0.0037594 k( 116) = ( 0.1184210 0.1366694 -0.0000000), wk = 0.0037594 k( 117) = ( 0.1315790 0.1518549 -0.0000000), wk = 0.0037594 k( 118) = ( 0.1447368 0.1670404 -0.0000000), wk = 0.0037594 k( 119) = ( 0.1578947 0.1822259 -0.0000000), wk = 0.0037594 k( 120) = ( 0.1710526 0.1974114 -0.0000000), wk = 0.0037594 k( 121) = ( 0.1842105 0.2125969 -0.0000000), wk = 0.0037594 k( 122) = ( 0.1973684 0.2277824 -0.0000000), wk = 0.0037594 k( 123) = ( 0.2105263 0.2429679 -0.0000000), wk = 0.0037594 k( 124) = ( 0.2236842 0.2581534 -0.0000000), wk = 0.0037594 k( 125) = ( 0.2368421 0.2733389 -0.0000000), wk = 0.0037594 k( 126) = ( 0.2500000 0.2885244 -0.0000000), wk = 0.0037594 k( 127) = ( 0.2631579 0.3037099 -0.0000000), wk = 0.0037594 k( 128) = ( 0.2763158 0.3188954 -0.0000000), wk = 0.0037594 k( 129) = ( 0.2894737 0.3340808 -0.0000000), wk = 0.0037594 k( 130) = ( 0.3026316 0.3492663 -0.0000000), wk = 0.0037594 k( 131) = ( 0.3157895 0.3644518 -0.0000000), wk = 0.0037594 k( 132) = ( 0.3289474 0.3796373 -0.0000000), wk = 0.0037594 k( 133) = ( 0.3421053 0.3948228 -0.0000000), wk = 0.0037594 k( 134) = ( 0.3552632 0.4100083 -0.0000000), wk = 0.0037594 k( 135) = ( 0.3684211 0.4251938 -0.0000000), wk = 0.0037594 k( 136) = ( 0.3815789 0.4403793 -0.0000000), wk = 0.0037594 k( 137) = ( 0.3947368 0.4555648 -0.0000000), wk = 0.0037594 k( 138) = ( 0.4078947 0.4707503 -0.0000000), wk = 0.0037594 k( 139) = ( 0.4210526 0.4859358 -0.0000000), wk = 0.0037594 k( 140) = ( 0.4342105 0.5011213 -0.0000000), wk = 0.0037594 k( 141) = ( 0.4473684 0.5163068 -0.0000000), wk = 0.0037594 k( 142) = ( 0.4605263 0.5314923 -0.0000000), wk = 0.0037594 k( 143) = ( 0.4736842 0.5466778 -0.0000000), wk = 0.0037594 k( 144) = ( 0.4868421 0.5618633 -0.0000000), wk = 0.0037594 k( 145) = ( 0.5000000 0.5770487 -0.0000000), wk = 0.0037594 k( 146) = ( 0.5000000 0.5770487 -0.0000000), wk = 0.0037594 k( 147) = ( 0.4895616 0.5860934 0.0138118), wk = 0.0037594 k( 148) = ( 0.4791232 0.5951381 0.0276236), wk = 0.0037594 k( 149) = ( 0.4686847 0.6041827 0.0414355), wk = 0.0037594 k( 150) = ( 0.4582463 0.6132274 0.0552473), wk = 0.0037594 k( 151) = ( 0.4478079 0.6222721 0.0690591), wk = 0.0037594 k( 152) = ( 0.4373695 0.6313167 0.0828710), wk = 0.0037594 k( 153) = ( 0.4269310 0.6403614 0.0966828), wk = 0.0037594 k( 154) = ( 0.4164926 0.6494060 0.1104946), wk = 0.0037594 k( 155) = ( 0.4164926 0.6494060 0.1104946), wk = 0.0037594 k( 156) = ( 0.3998329 0.6436356 0.1193066), wk = 0.0037594 k( 157) = ( 0.3831732 0.6378651 0.1281185), wk = 0.0037594 k( 158) = ( 0.3665135 0.6320946 0.1369304), wk = 0.0037594 k( 159) = ( 0.3498538 0.6263241 0.1457423), wk = 0.0037594 k( 160) = ( 0.3331941 0.6205536 0.1545543), wk = 0.0037594 k( 161) = ( 0.3165344 0.6147831 0.1633662), wk = 0.0037594 k( 162) = ( 0.2998747 0.6090126 0.1721782), wk = 0.0037594 k( 163) = ( 0.2832150 0.6032421 0.1809901), wk = 0.0037594 k( 164) = ( 0.2665553 0.5974717 0.1898020), wk = 0.0037594 k( 165) = ( 0.2498956 0.5917012 0.1986140), wk = 0.0037594 k( 166) = ( 0.2332359 0.5859307 0.2074259), wk = 0.0037594 k( 167) = ( 0.2165762 0.5801602 0.2162378), wk = 0.0037594 k( 168) = ( 0.1999165 0.5743897 0.2250498), wk = 0.0037594 k( 169) = ( 0.1832568 0.5686192 0.2338617), wk = 0.0037594 k( 170) = ( 0.1665970 0.5628487 0.2426736), wk = 0.0037594 k( 171) = ( 0.1499373 0.5570782 0.2514856), wk = 0.0037594 k( 172) = ( 0.1332776 0.5513078 0.2602975), wk = 0.0037594 k( 173) = ( 0.1166179 0.5455373 0.2691094), wk = 0.0037594 k( 174) = ( 0.0999582 0.5397668 0.2779214), wk = 0.0037594 k( 175) = ( 0.0832985 0.5339963 0.2867333), wk = 0.0037594 k( 176) = ( 0.0666388 0.5282258 0.2955452), wk = 0.0037594 k( 177) = ( 0.0499791 0.5224553 0.3043572), wk = 0.0037594 k( 178) = ( 0.0333194 0.5166848 0.3131691), wk = 0.0037594 k( 179) = ( 0.0166597 0.5109143 0.3219810), wk = 0.0037594 k( 180) = ( 0.0000000 0.5051439 0.3307930), wk = 0.0037594 k( 181) = ( 0.0000000 0.5051439 0.3307930), wk = 0.0037594 k( 182) = ( 0.0108696 0.4957256 0.3451753), wk = 0.0037594 k( 183) = ( 0.0217391 0.4863074 0.3595576), wk = 0.0037594 k( 184) = ( 0.0326087 0.4768891 0.3739399), wk = 0.0037594 k( 185) = ( 0.0434783 0.4674709 0.3883222), wk = 0.0037594 k( 186) = ( 0.0543478 0.4580527 0.4027045), wk = 0.0037594 k( 187) = ( 0.0652174 0.4486344 0.4170868), wk = 0.0037594 k( 188) = ( 0.0760870 0.4392162 0.4314691), wk = 0.0037594 k( 189) = ( 0.0869565 0.4297979 0.4458514), wk = 0.0037594 k( 190) = ( 0.0978261 0.4203797 0.4602337), wk = 0.0037594 k( 191) = ( 0.1086957 0.4109615 0.4746160), wk = 0.0037594 k( 192) = ( 0.1195652 0.4015432 0.4889983), wk = 0.0037594 k( 193) = ( 0.1304348 0.3921250 0.5033806), wk = 0.0037594 k( 194) = ( 0.1413043 0.3827068 0.5177629), wk = 0.0037594 k( 195) = ( 0.1521739 0.3732885 0.5321452), wk = 0.0037594 k( 196) = ( 0.1630435 0.3638703 0.5465275), wk = 0.0037594 k( 197) = ( 0.1739130 0.3544520 0.5609098), wk = 0.0037594 k( 198) = ( 0.1847826 0.3450338 0.5752922), wk = 0.0037594 k( 199) = ( 0.1956522 0.3356156 0.5896744), wk = 0.0037594 k( 200) = ( 0.2065217 0.3261973 0.6040568), wk = 0.0037594 k( 201) = ( 0.2173913 0.3167791 0.6184391), wk = 0.0037594 k( 202) = ( 0.2282609 0.3073608 0.6328214), wk = 0.0037594 k( 203) = ( 0.2391304 0.2979426 0.6472037), wk = 0.0037594 k( 204) = ( 0.2500000 0.2885244 0.6615860), wk = 0.0037594 k( 205) = ( 0.2500000 0.2885244 0.6615860), wk = 0.0037594 k( 206) = ( 0.2586207 0.2984735 0.6463930), wk = 0.0037594 k( 207) = ( 0.2672414 0.3084226 0.6312000), wk = 0.0037594 k( 208) = ( 0.2758621 0.3183717 0.6160070), wk = 0.0037594 k( 209) = ( 0.2844828 0.3283208 0.6008140), wk = 0.0037594 k( 210) = ( 0.2931034 0.3382700 0.5856210), wk = 0.0037594 k( 211) = ( 0.3017241 0.3482191 0.5704280), wk = 0.0037594 k( 212) = ( 0.3103448 0.3581682 0.5552350), wk = 0.0037594 k( 213) = ( 0.3189655 0.3681173 0.5400420), wk = 0.0037594 k( 214) = ( 0.3275862 0.3780664 0.5248491), wk = 0.0037594 k( 215) = ( 0.3362069 0.3880155 0.5096561), wk = 0.0037594 k( 216) = ( 0.3448276 0.3979647 0.4944631), wk = 0.0037594 k( 217) = ( 0.3534483 0.4079138 0.4792701), wk = 0.0037594 k( 218) = ( 0.3620690 0.4178629 0.4640771), wk = 0.0037594 k( 219) = ( 0.3706897 0.4278120 0.4488841), wk = 0.0037594 k( 220) = ( 0.3793103 0.4377611 0.4336911), wk = 0.0037594 k( 221) = ( 0.3879310 0.4477102 0.4184981), wk = 0.0037594 k( 222) = ( 0.3965517 0.4576593 0.4033051), wk = 0.0037594 k( 223) = ( 0.4051724 0.4676085 0.3881121), wk = 0.0037594 k( 224) = ( 0.4137931 0.4775576 0.3729191), wk = 0.0037594 k( 225) = ( 0.4224138 0.4875067 0.3577262), wk = 0.0037594 k( 226) = ( 0.4310345 0.4974558 0.3425332), wk = 0.0037594 k( 227) = ( 0.4396552 0.5074049 0.3273402), wk = 0.0037594 k( 228) = ( 0.4482759 0.5173540 0.3121472), wk = 0.0037594 k( 229) = ( 0.4568966 0.5273032 0.2969542), wk = 0.0037594 k( 230) = ( 0.4655172 0.5372523 0.2817612), wk = 0.0037594 k( 231) = ( 0.4741379 0.5472014 0.2665682), wk = 0.0037594 k( 232) = ( 0.4827586 0.5571505 0.2513752), wk = 0.0037594 k( 233) = ( 0.4913793 0.5670996 0.2361822), wk = 0.0037594 k( 234) = ( 0.5000000 0.5770487 0.2209892), wk = 0.0037594 k( 235) = ( 0.5000000 0.5770487 0.2209892), wk = 0.0037594 k( 236) = ( 0.5000000 0.5770487 0.2008993), wk = 0.0037594 k( 237) = ( 0.5000000 0.5770487 0.1808094), wk = 0.0037594 k( 238) = ( 0.5000000 0.5770487 0.1607194), wk = 0.0037594 k( 239) = ( 0.5000000 0.5770487 0.1406295), wk = 0.0037594 k( 240) = ( 0.5000000 0.5770487 0.1205396), wk = 0.0037594 k( 241) = ( 0.5000000 0.5770487 0.1004496), wk = 0.0037594 k( 242) = ( 0.5000000 0.5770487 0.0803597), wk = 0.0037594 k( 243) = ( 0.5000000 0.5770487 0.0602698), wk = 0.0037594 k( 244) = ( 0.5000000 0.5770487 0.0401799), wk = 0.0037594 k( 245) = ( 0.5000000 0.5770487 0.0200899), wk = 0.0037594 k( 246) = ( 0.5000000 0.5770487 -0.0000000), wk = 0.0037594 k( 247) = ( 0.0000000 0.0000000 0.6615860), wk = 0.0037594 k( 248) = ( 0.0131579 0.0151855 0.6615860), wk = 0.0037594 k( 249) = ( 0.0263158 0.0303710 0.6615860), wk = 0.0037594 k( 250) = ( 0.0394737 0.0455565 0.6615860), wk = 0.0037594 k( 251) = ( 0.0526316 0.0607420 0.6615860), wk = 0.0037594 k( 252) = ( 0.0657895 0.0759275 0.6615860), wk = 0.0037594 k( 253) = ( 0.0789474 0.0911130 0.6615860), wk = 0.0037594 k( 254) = ( 0.0921053 0.1062984 0.6615860), wk = 0.0037594 k( 255) = ( 0.1052632 0.1214839 0.6615860), wk = 0.0037594 k( 256) = ( 0.1184210 0.1366694 0.6615860), wk = 0.0037594 k( 257) = ( 0.1315790 0.1518549 0.6615860), wk = 0.0037594 k( 258) = ( 0.1447368 0.1670404 0.6615860), wk = 0.0037594 k( 259) = ( 0.1578947 0.1822259 0.6615860), wk = 0.0037594 k( 260) = ( 0.1710526 0.1974114 0.6615860), wk = 0.0037594 k( 261) = ( 0.1842105 0.2125969 0.6615860), wk = 0.0037594 k( 262) = ( 0.1973684 0.2277824 0.6615860), wk = 0.0037594 k( 263) = ( 0.2105263 0.2429679 0.6615860), wk = 0.0037594 k( 264) = ( 0.2236842 0.2581534 0.6615860), wk = 0.0037594 k( 265) = ( 0.2368421 0.2733389 0.6615860), wk = 0.0037594 k( 266) = ( 0.2500000 0.2885244 0.6615860), wk = 0.0037594 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 2) = ( 0.0000000 0.0000000 0.0151515), wk = 0.0037594 k( 3) = ( 0.0000000 0.0000000 0.0303030), wk = 0.0037594 k( 4) = ( 0.0000000 0.0000000 0.0454545), wk = 0.0037594 k( 5) = ( 0.0000000 0.0000000 0.0606061), wk = 0.0037594 k( 6) = ( 0.0000000 0.0000000 0.0757576), wk = 0.0037594 k( 7) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0037594 k( 8) = ( 0.0000000 0.0000000 0.1060606), wk = 0.0037594 k( 9) = ( 0.0000000 0.0000000 0.1212121), wk = 0.0037594 k( 10) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0037594 k( 11) = ( 0.0000000 0.0000000 0.1515151), wk = 0.0037594 k( 12) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0037594 k( 13) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0037594 k( 14) = ( 0.0000000 0.0000000 0.1969697), wk = 0.0037594 k( 15) = ( 0.0000000 0.0000000 0.2121212), wk = 0.0037594 k( 16) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0037594 k( 17) = ( 0.0000000 0.0000000 0.2424242), wk = 0.0037594 k( 18) = ( 0.0000000 0.0000000 0.2575758), wk = 0.0037594 k( 19) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0037594 k( 20) = ( 0.0000000 0.0000000 0.2878788), wk = 0.0037594 k( 21) = ( 0.0000000 0.0000000 0.3030303), wk = 0.0037594 k( 22) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0037594 k( 23) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0037594 k( 24) = ( 0.0000000 0.0000000 0.3484849), wk = 0.0037594 k( 25) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0037594 k( 26) = ( 0.0000000 0.0000000 0.3787879), wk = 0.0037594 k( 27) = ( 0.0000000 0.0000000 0.3939394), wk = 0.0037594 k( 28) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0037594 k( 29) = ( 0.0000000 0.0000000 0.4242424), wk = 0.0037594 k( 30) = ( 0.0000000 0.0000000 0.4393939), wk = 0.0037594 k( 31) = ( 0.0000000 0.0000000 0.4545454), wk = 0.0037594 k( 32) = ( 0.0000000 0.0000000 0.4696970), wk = 0.0037594 k( 33) = ( 0.0000000 0.0000000 0.4848485), wk = 0.0037594 k( 34) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 35) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 36) = ( -0.0151357 0.0151357 0.5000000), wk = 0.0037594 k( 37) = ( -0.0302714 0.0302714 0.5000000), wk = 0.0037594 k( 38) = ( -0.0454071 0.0454071 0.5000000), wk = 0.0037594 k( 39) = ( -0.0605428 0.0605428 0.5000000), wk = 0.0037594 k( 40) = ( -0.0756785 0.0756785 0.5000000), wk = 0.0037594 k( 41) = ( -0.0908142 0.0908142 0.5000000), wk = 0.0037594 k( 42) = ( -0.1059498 0.1059498 0.5000000), wk = 0.0037594 k( 43) = ( -0.1210856 0.1210856 0.5000000), wk = 0.0037594 k( 44) = ( -0.1362212 0.1362212 0.5000000), wk = 0.0037594 k( 45) = ( -0.1513569 0.1513569 0.5000000), wk = 0.0037594 k( 46) = ( -0.1664926 0.1664926 0.5000000), wk = 0.0037594 k( 47) = ( -0.1816283 0.1816283 0.5000000), wk = 0.0037594 k( 48) = ( -0.1967640 0.1967640 0.5000000), wk = 0.0037594 k( 49) = ( -0.2118997 0.2118997 0.5000000), wk = 0.0037594 k( 50) = ( -0.2270354 0.2270354 0.5000000), wk = 0.0037594 k( 51) = ( -0.2421711 0.2421711 0.5000000), wk = 0.0037594 k( 52) = ( -0.2573068 0.2573068 0.5000000), wk = 0.0037594 k( 53) = ( -0.2724425 0.2724425 0.5000000), wk = 0.0037594 k( 54) = ( -0.2875782 0.2875782 0.5000000), wk = 0.0037594 k( 55) = ( -0.3027139 0.3027139 0.5000000), wk = 0.0037594 k( 56) = ( -0.3178496 0.3178496 0.5000000), wk = 0.0037594 k( 57) = ( -0.3329853 0.3329853 0.5000000), wk = 0.0037594 k( 58) = ( -0.3329853 0.3329853 0.5000000), wk = 0.0037594 k( 59) = ( -0.3434237 0.3434237 0.4895616), wk = 0.0037594 k( 60) = ( -0.3538621 0.3538621 0.4791232), wk = 0.0037594 k( 61) = ( -0.3643005 0.3643005 0.4686847), wk = 0.0037594 k( 62) = ( -0.3747389 0.3747389 0.4582463), wk = 0.0037594 k( 63) = ( -0.3851774 0.3851774 0.4478079), wk = 0.0037594 k( 64) = ( -0.3956158 0.3956158 0.4373695), wk = 0.0037594 k( 65) = ( -0.4060542 0.4060542 0.4269310), wk = 0.0037594 k( 66) = ( -0.4164926 0.4164926 0.4164926), wk = 0.0037594 k( 67) = ( -0.4164926 0.4164926 0.4164926), wk = 0.0037594 k( 68) = ( -0.4058133 0.4058133 0.4058133), wk = 0.0037594 k( 69) = ( -0.3951340 0.3951340 0.3951340), wk = 0.0037594 k( 70) = ( -0.3844547 0.3844547 0.3844547), wk = 0.0037594 k( 71) = ( -0.3737754 0.3737754 0.3737754), wk = 0.0037594 k( 72) = ( -0.3630961 0.3630961 0.3630961), wk = 0.0037594 k( 73) = ( -0.3524168 0.3524168 0.3524168), wk = 0.0037594 k( 74) = ( -0.3417375 0.3417375 0.3417375), wk = 0.0037594 k( 75) = ( -0.3310582 0.3310582 0.3310582), wk = 0.0037594 k( 76) = ( -0.3203789 0.3203789 0.3203789), wk = 0.0037594 k( 77) = ( -0.3096996 0.3096996 0.3096996), wk = 0.0037594 k( 78) = ( -0.2990203 0.2990203 0.2990203), wk = 0.0037594 k( 79) = ( -0.2883410 0.2883410 0.2883410), wk = 0.0037594 k( 80) = ( -0.2776617 0.2776617 0.2776617), wk = 0.0037594 k( 81) = ( -0.2669824 0.2669824 0.2669824), wk = 0.0037594 k( 82) = ( -0.2563031 0.2563031 0.2563031), wk = 0.0037594 k( 83) = ( -0.2456239 0.2456239 0.2456239), wk = 0.0037594 k( 84) = ( -0.2349446 0.2349446 0.2349446), wk = 0.0037594 k( 85) = ( -0.2242653 0.2242653 0.2242653), wk = 0.0037594 k( 86) = ( -0.2135860 0.2135860 0.2135860), wk = 0.0037594 k( 87) = ( -0.2029067 0.2029067 0.2029067), wk = 0.0037594 k( 88) = ( -0.1922274 0.1922274 0.1922274), wk = 0.0037594 k( 89) = ( -0.1815481 0.1815481 0.1815481), wk = 0.0037594 k( 90) = ( -0.1708688 0.1708688 0.1708688), wk = 0.0037594 k( 91) = ( -0.1601895 0.1601895 0.1601895), wk = 0.0037594 k( 92) = ( -0.1495102 0.1495102 0.1495102), wk = 0.0037594 k( 93) = ( -0.1388309 0.1388309 0.1388309), wk = 0.0037594 k( 94) = ( -0.1281516 0.1281516 0.1281516), wk = 0.0037594 k( 95) = ( -0.1174723 0.1174723 0.1174723), wk = 0.0037594 k( 96) = ( -0.1067930 0.1067930 0.1067930), wk = 0.0037594 k( 97) = ( -0.0961137 0.0961137 0.0961137), wk = 0.0037594 k( 98) = ( -0.0854344 0.0854344 0.0854344), wk = 0.0037594 k( 99) = ( -0.0747551 0.0747551 0.0747551), wk = 0.0037594 k( 100) = ( -0.0640758 0.0640758 0.0640758), wk = 0.0037594 k( 101) = ( -0.0533965 0.0533965 0.0533965), wk = 0.0037594 k( 102) = ( -0.0427172 0.0427172 0.0427172), wk = 0.0037594 k( 103) = ( -0.0320379 0.0320379 0.0320379), wk = 0.0037594 k( 104) = ( -0.0213586 0.0213586 0.0213586), wk = 0.0037594 k( 105) = ( -0.0106793 0.0106793 0.0106793), wk = 0.0037594 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 108) = ( 0.0131579 0.0131579 -0.0131579), wk = 0.0037594 k( 109) = ( 0.0263158 0.0263158 -0.0263158), wk = 0.0037594 k( 110) = ( 0.0394737 0.0394737 -0.0394737), wk = 0.0037594 k( 111) = ( 0.0526316 0.0526316 -0.0526316), wk = 0.0037594 k( 112) = ( 0.0657895 0.0657895 -0.0657895), wk = 0.0037594 k( 113) = ( 0.0789474 0.0789474 -0.0789474), wk = 0.0037594 k( 114) = ( 0.0921053 0.0921053 -0.0921053), wk = 0.0037594 k( 115) = ( 0.1052632 0.1052632 -0.1052632), wk = 0.0037594 k( 116) = ( 0.1184210 0.1184210 -0.1184210), wk = 0.0037594 k( 117) = ( 0.1315790 0.1315790 -0.1315790), wk = 0.0037594 k( 118) = ( 0.1447368 0.1447368 -0.1447368), wk = 0.0037594 k( 119) = ( 0.1578947 0.1578947 -0.1578947), wk = 0.0037594 k( 120) = ( 0.1710526 0.1710526 -0.1710526), wk = 0.0037594 k( 121) = ( 0.1842105 0.1842105 -0.1842105), wk = 0.0037594 k( 122) = ( 0.1973684 0.1973684 -0.1973684), wk = 0.0037594 k( 123) = ( 0.2105263 0.2105263 -0.2105263), wk = 0.0037594 k( 124) = ( 0.2236842 0.2236842 -0.2236842), wk = 0.0037594 k( 125) = ( 0.2368421 0.2368421 -0.2368421), wk = 0.0037594 k( 126) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0037594 k( 127) = ( 0.2631579 0.2631579 -0.2631579), wk = 0.0037594 k( 128) = ( 0.2763158 0.2763158 -0.2763158), wk = 0.0037594 k( 129) = ( 0.2894737 0.2894737 -0.2894737), wk = 0.0037594 k( 130) = ( 0.3026316 0.3026316 -0.3026316), wk = 0.0037594 k( 131) = ( 0.3157895 0.3157895 -0.3157895), wk = 0.0037594 k( 132) = ( 0.3289474 0.3289474 -0.3289474), wk = 0.0037594 k( 133) = ( 0.3421053 0.3421053 -0.3421053), wk = 0.0037594 k( 134) = ( 0.3552632 0.3552632 -0.3552632), wk = 0.0037594 k( 135) = ( 0.3684211 0.3684211 -0.3684211), wk = 0.0037594 k( 136) = ( 0.3815789 0.3815789 -0.3815789), wk = 0.0037594 k( 137) = ( 0.3947368 0.3947368 -0.3947368), wk = 0.0037594 k( 138) = ( 0.4078947 0.4078947 -0.4078947), wk = 0.0037594 k( 139) = ( 0.4210526 0.4210526 -0.4210526), wk = 0.0037594 k( 140) = ( 0.4342105 0.4342105 -0.4342105), wk = 0.0037594 k( 141) = ( 0.4473684 0.4473684 -0.4473684), wk = 0.0037594 k( 142) = ( 0.4605263 0.4605263 -0.4605263), wk = 0.0037594 k( 143) = ( 0.4736842 0.4736842 -0.4736842), wk = 0.0037594 k( 144) = ( 0.4868421 0.4868421 -0.4868421), wk = 0.0037594 k( 145) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037594 k( 146) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037594 k( 147) = ( 0.4895616 0.5104384 -0.4895616), wk = 0.0037594 k( 148) = ( 0.4791232 0.5208768 -0.4791232), wk = 0.0037594 k( 149) = ( 0.4686847 0.5313153 -0.4686847), wk = 0.0037594 k( 150) = ( 0.4582463 0.5417537 -0.4582463), wk = 0.0037594 k( 151) = ( 0.4478079 0.5521921 -0.4478079), wk = 0.0037594 k( 152) = ( 0.4373695 0.5626305 -0.4373695), wk = 0.0037594 k( 153) = ( 0.4269310 0.5730690 -0.4269311), wk = 0.0037594 k( 154) = ( 0.4164926 0.5835074 -0.4164926), wk = 0.0037594 k( 155) = ( 0.4164926 0.5835074 -0.4164926), wk = 0.0037594 k( 156) = ( 0.3998329 0.5801671 -0.3998329), wk = 0.0037594 k( 157) = ( 0.3831732 0.5768268 -0.3831732), wk = 0.0037594 k( 158) = ( 0.3665135 0.5734865 -0.3665135), wk = 0.0037594 k( 159) = ( 0.3498538 0.5701462 -0.3498538), wk = 0.0037594 k( 160) = ( 0.3331941 0.5668059 -0.3331941), wk = 0.0037594 k( 161) = ( 0.3165344 0.5634656 -0.3165344), wk = 0.0037594 k( 162) = ( 0.2998747 0.5601253 -0.2998747), wk = 0.0037594 k( 163) = ( 0.2832150 0.5567850 -0.2832150), wk = 0.0037594 k( 164) = ( 0.2665553 0.5534447 -0.2665553), wk = 0.0037594 k( 165) = ( 0.2498956 0.5501044 -0.2498956), wk = 0.0037594 k( 166) = ( 0.2332359 0.5467641 -0.2332359), wk = 0.0037594 k( 167) = ( 0.2165762 0.5434238 -0.2165762), wk = 0.0037594 k( 168) = ( 0.1999165 0.5400835 -0.1999165), wk = 0.0037594 k( 169) = ( 0.1832568 0.5367432 -0.1832568), wk = 0.0037594 k( 170) = ( 0.1665970 0.5334030 -0.1665971), wk = 0.0037594 k( 171) = ( 0.1499373 0.5300626 -0.1499374), wk = 0.0037594 k( 172) = ( 0.1332776 0.5267224 -0.1332776), wk = 0.0037594 k( 173) = ( 0.1166179 0.5233821 -0.1166179), wk = 0.0037594 k( 174) = ( 0.0999582 0.5200418 -0.0999582), wk = 0.0037594 k( 175) = ( 0.0832985 0.5167015 -0.0832985), wk = 0.0037594 k( 176) = ( 0.0666388 0.5133612 -0.0666388), wk = 0.0037594 k( 177) = ( 0.0499791 0.5100209 -0.0499791), wk = 0.0037594 k( 178) = ( 0.0333194 0.5066806 -0.0333194), wk = 0.0037594 k( 179) = ( 0.0166597 0.5033403 -0.0166597), wk = 0.0037594 k( 180) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0037594 k( 181) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0037594 k( 182) = ( 0.0108696 0.4891304 0.0108696), wk = 0.0037594 k( 183) = ( 0.0217391 0.4782609 0.0217391), wk = 0.0037594 k( 184) = ( 0.0326087 0.4673913 0.0326087), wk = 0.0037594 k( 185) = ( 0.0434783 0.4565217 0.0434783), wk = 0.0037594 k( 186) = ( 0.0543478 0.4456522 0.0543478), wk = 0.0037594 k( 187) = ( 0.0652174 0.4347826 0.0652174), wk = 0.0037594 k( 188) = ( 0.0760870 0.4239130 0.0760870), wk = 0.0037594 k( 189) = ( 0.0869565 0.4130435 0.0869565), wk = 0.0037594 k( 190) = ( 0.0978261 0.4021739 0.0978261), wk = 0.0037594 k( 191) = ( 0.1086957 0.3913044 0.1086957), wk = 0.0037594 k( 192) = ( 0.1195652 0.3804348 0.1195652), wk = 0.0037594 k( 193) = ( 0.1304348 0.3695652 0.1304348), wk = 0.0037594 k( 194) = ( 0.1413043 0.3586956 0.1413043), wk = 0.0037594 k( 195) = ( 0.1521739 0.3478261 0.1521739), wk = 0.0037594 k( 196) = ( 0.1630435 0.3369565 0.1630435), wk = 0.0037594 k( 197) = ( 0.1739130 0.3260870 0.1739130), wk = 0.0037594 k( 198) = ( 0.1847826 0.3152174 0.1847826), wk = 0.0037594 k( 199) = ( 0.1956522 0.3043478 0.1956522), wk = 0.0037594 k( 200) = ( 0.2065217 0.2934783 0.2065217), wk = 0.0037594 k( 201) = ( 0.2173913 0.2826087 0.2173913), wk = 0.0037594 k( 202) = ( 0.2282609 0.2717391 0.2282609), wk = 0.0037594 k( 203) = ( 0.2391304 0.2608696 0.2391304), wk = 0.0037594 k( 204) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037594 k( 205) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037594 k( 206) = ( 0.2586207 0.2586207 0.2298971), wk = 0.0037594 k( 207) = ( 0.2672414 0.2672414 0.2097941), wk = 0.0037594 k( 208) = ( 0.2758621 0.2758621 0.1896912), wk = 0.0037594 k( 209) = ( 0.2844828 0.2844828 0.1695882), wk = 0.0037594 k( 210) = ( 0.2931034 0.2931034 0.1494853), wk = 0.0037594 k( 211) = ( 0.3017241 0.3017241 0.1293824), wk = 0.0037594 k( 212) = ( 0.3103448 0.3103448 0.1092794), wk = 0.0037594 k( 213) = ( 0.3189655 0.3189655 0.0891765), wk = 0.0037594 k( 214) = ( 0.3275862 0.3275862 0.0690735), wk = 0.0037594 k( 215) = ( 0.3362069 0.3362069 0.0489706), wk = 0.0037594 k( 216) = ( 0.3448276 0.3448276 0.0288677), wk = 0.0037594 k( 217) = ( 0.3534483 0.3534483 0.0087647), wk = 0.0037594 k( 218) = ( 0.3620690 0.3620690 -0.0113382), wk = 0.0037594 k( 219) = ( 0.3706897 0.3706897 -0.0314412), wk = 0.0037594 k( 220) = ( 0.3793103 0.3793103 -0.0515441), wk = 0.0037594 k( 221) = ( 0.3879310 0.3879310 -0.0716470), wk = 0.0037594 k( 222) = ( 0.3965517 0.3965517 -0.0917500), wk = 0.0037594 k( 223) = ( 0.4051724 0.4051724 -0.1118529), wk = 0.0037594 k( 224) = ( 0.4137931 0.4137931 -0.1319559), wk = 0.0037594 k( 225) = ( 0.4224138 0.4224138 -0.1520588), wk = 0.0037594 k( 226) = ( 0.4310345 0.4310345 -0.1721617), wk = 0.0037594 k( 227) = ( 0.4396552 0.4396552 -0.1922647), wk = 0.0037594 k( 228) = ( 0.4482759 0.4482759 -0.2123676), wk = 0.0037594 k( 229) = ( 0.4568966 0.4568966 -0.2324705), wk = 0.0037594 k( 230) = ( 0.4655172 0.4655172 -0.2525735), wk = 0.0037594 k( 231) = ( 0.4741379 0.4741379 -0.2726764), wk = 0.0037594 k( 232) = ( 0.4827586 0.4827586 -0.2927794), wk = 0.0037594 k( 233) = ( 0.4913793 0.4913793 -0.3128823), wk = 0.0037594 k( 234) = ( 0.5000000 0.5000000 -0.3329853), wk = 0.0037594 k( 235) = ( 0.5000000 0.5000000 -0.3329853), wk = 0.0037594 k( 236) = ( 0.5000000 0.5000000 -0.3481684), wk = 0.0037594 k( 237) = ( 0.5000000 0.5000000 -0.3633516), wk = 0.0037594 k( 238) = ( 0.5000000 0.5000000 -0.3785347), wk = 0.0037594 k( 239) = ( 0.5000000 0.5000000 -0.3937179), wk = 0.0037594 k( 240) = ( 0.5000000 0.5000000 -0.4089011), wk = 0.0037594 k( 241) = ( 0.5000000 0.5000000 -0.4240842), wk = 0.0037594 k( 242) = ( 0.5000000 0.5000000 -0.4392674), wk = 0.0037594 k( 243) = ( 0.5000000 0.5000000 -0.4544505), wk = 0.0037594 k( 244) = ( 0.5000000 0.5000000 -0.4696337), wk = 0.0037594 k( 245) = ( 0.5000000 0.5000000 -0.4848168), wk = 0.0037594 k( 246) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0037594 k( 247) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 248) = ( 0.0131579 0.0131579 0.4868421), wk = 0.0037594 k( 249) = ( 0.0263158 0.0263158 0.4736842), wk = 0.0037594 k( 250) = ( 0.0394737 0.0394737 0.4605263), wk = 0.0037594 k( 251) = ( 0.0526316 0.0526316 0.4473684), wk = 0.0037594 k( 252) = ( 0.0657895 0.0657895 0.4342105), wk = 0.0037594 k( 253) = ( 0.0789474 0.0789474 0.4210526), wk = 0.0037594 k( 254) = ( 0.0921053 0.0921053 0.4078947), wk = 0.0037594 k( 255) = ( 0.1052632 0.1052632 0.3947368), wk = 0.0037594 k( 256) = ( 0.1184210 0.1184210 0.3815789), wk = 0.0037594 k( 257) = ( 0.1315790 0.1315790 0.3684211), wk = 0.0037594 k( 258) = ( 0.1447368 0.1447368 0.3552632), wk = 0.0037594 k( 259) = ( 0.1578947 0.1578947 0.3421053), wk = 0.0037594 k( 260) = ( 0.1710526 0.1710526 0.3289474), wk = 0.0037594 k( 261) = ( 0.1842105 0.1842105 0.3157895), wk = 0.0037594 k( 262) = ( 0.1973684 0.1973684 0.3026316), wk = 0.0037594 k( 263) = ( 0.2105263 0.2105263 0.2894737), wk = 0.0037594 k( 264) = ( 0.2236842 0.2236842 0.2763158), wk = 0.0037594 k( 265) = ( 0.2368421 0.2368421 0.2631579), wk = 0.0037594 k( 266) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037594 Dense grid: 105687 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 56935 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.21 Mb ( 194, 72) NL pseudopotentials 0.40 Mb ( 97, 272) Each V/rho on FFT grid 0.08 Mb ( 5184) Each G-vector array 0.01 Mb ( 1468) G-vector shells 0.01 Mb ( 687) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.85 Mb ( 194, 288) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.60 Mb ( 272, 2, 72) The potential is recalculated from file : ./KAg2SbS4.save/charge-density.dat Starting wfc are 92 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 8.4 secs Computing kpt #: 2 total cpu time spent up to now is 11.6 secs Computing kpt #: 3 total cpu time spent up to now is 14.8 secs Computing kpt #: 4 total cpu time spent up to now is 18.3 secs Computing kpt #: 5 total cpu time spent up to now is 22.4 secs Computing kpt #: 6 total cpu time spent up to now is 26.1 secs Computing kpt #: 7 total cpu time spent up to now is 29.8 secs Computing kpt #: 8 total cpu time spent up to now is 34.3 secs Computing kpt #: 9 total cpu time spent up to now is 38.6 secs Computing kpt #: 10 total cpu time spent up to now is 42.4 secs Computing kpt #: 11 total cpu time spent up to now is 46.6 secs Computing kpt #: 12 total cpu time spent up to now is 51.4 secs Computing kpt #: 13 total cpu time spent up to now is 55.4 secs Computing kpt #: 14 total cpu time spent up to now is 59.0 secs Computing kpt #: 15 total cpu time spent up to now is 63.2 secs Computing kpt #: 16 total cpu time spent up to now is 67.2 secs Computing kpt #: 17 total cpu time spent up to now is 71.0 secs Computing kpt #: 18 total cpu time spent up to now is 76.1 secs Computing kpt #: 19 total cpu time spent up to now is 80.4 secs Computing kpt #: 20 total cpu time spent up to now is 84.1 secs Computing kpt #: 21 total cpu time spent up to now is 87.5 secs Computing kpt #: 22 total cpu time spent up to now is 91.2 secs Computing kpt #: 23 total cpu time spent up to now is 94.9 secs Computing kpt #: 24 total cpu time spent up to now is 98.5 secs Computing kpt #: 25 total cpu time spent up to now is 102.3 secs Computing kpt #: 26 total cpu time spent up to now is 105.7 secs Computing kpt #: 27 total cpu time spent up to now is 109.8 secs Computing kpt #: 28 total cpu time spent up to now is 113.4 secs Computing kpt #: 29 total cpu time spent up to now is 117.2 secs Computing kpt #: 30 total cpu time spent up to now is 121.6 secs Computing kpt #: 31 total cpu time spent up to now is 126.3 secs Computing kpt #: 32 total cpu time spent up to now is 130.6 secs Computing kpt #: 33 total cpu time spent up to now is 134.6 secs Computing kpt #: 34 total cpu time spent up to now is 138.8 secs Computing kpt #: 35 total cpu time spent up to now is 143.1 secs Computing kpt #: 36 total cpu time spent up to now is 147.0 secs Computing kpt #: 37 total cpu time spent up to now is 151.2 secs Computing kpt #: 38 total cpu time spent up to now is 154.7 secs Computing kpt #: 39 total cpu time spent up to now is 158.4 secs Computing kpt #: 40 total cpu time spent up to now is 162.1 secs Computing kpt #: 41 total cpu time spent up to now is 165.8 secs Computing kpt #: 42 total cpu time spent up to now is 169.9 secs Computing kpt #: 43 total cpu time spent up to now is 172.7 secs Computing kpt #: 44 total cpu time spent up to now is 175.9 secs Computing kpt #: 45 total cpu time spent up to now is 179.4 secs Computing kpt #: 46 total cpu time spent up to now is 183.1 secs Computing kpt #: 47 total cpu time spent up to now is 187.0 secs Computing kpt #: 48 total cpu time spent up to now is 190.8 secs Computing kpt #: 49 total cpu time spent up to now is 195.4 secs Computing kpt #: 50 total cpu time spent up to now is 200.1 secs Computing kpt #: 51 total cpu time spent up to now is 204.8 secs Computing kpt #: 52 total cpu time spent up to now is 209.2 secs Computing kpt #: 53 total cpu time spent up to now is 212.6 secs Computing kpt #: 54 total cpu time spent up to now is 215.8 secs Computing kpt #: 55 total cpu time spent up to now is 219.8 secs Computing kpt #: 56 total cpu time spent up to now is 224.1 secs Computing kpt #: 57 total cpu time spent up to now is 228.8 secs Computing kpt #: 58 total cpu time spent up to now is 233.1 secs Computing kpt #: 59 total cpu time spent up to now is 237.7 secs Computing kpt #: 60 total cpu time spent up to now is 241.2 secs Computing kpt #: 61 total cpu time spent up to now is 244.6 secs Computing kpt #: 62 total cpu time spent up to now is 248.3 secs Computing kpt #: 63 total cpu time spent up to now is 251.4 secs Computing kpt #: 64 total cpu time spent up to now is 254.6 secs Computing kpt #: 65 total cpu time spent up to now is 258.1 secs Computing kpt #: 66 total cpu time spent up to now is 261.1 secs Computing kpt #: 67 total cpu time spent up to now is 264.7 secs Computing kpt #: 68 total cpu time spent up to now is 268.5 secs Computing kpt #: 69 total cpu time spent up to now is 273.2 secs Computing kpt #: 70 total cpu time spent up to now is 277.9 secs Computing kpt #: 71 total cpu time spent up to now is 281.8 secs Computing kpt #: 72 total cpu time spent up to now is 285.8 secs Computing kpt #: 73 total cpu time spent up to now is 289.5 secs Computing kpt #: 74 total cpu time spent up to now is 293.6 secs Computing kpt #: 75 total cpu time spent up to now is 297.8 secs Computing kpt #: 76 total cpu time spent up to now is 302.2 secs Computing kpt #: 77 total cpu time spent up to now is 305.6 secs Computing kpt #: 78 total cpu time spent up to now is 309.4 secs Computing kpt #: 79 total cpu time spent up to now is 312.8 secs Computing kpt #: 80 total cpu time spent up to now is 316.5 secs Computing kpt #: 81 total cpu time spent up to now is 319.7 secs Computing kpt #: 82 total cpu time spent up to now is 323.1 secs Computing kpt #: 83 total cpu time spent up to now is 326.1 secs Computing kpt #: 84 total cpu time spent up to now is 329.6 secs Computing kpt #: 85 total cpu time spent up to now is 333.2 secs Computing kpt #: 86 total cpu time spent up to now is 336.8 secs Computing kpt #: 87 total cpu time spent up to now is 341.0 secs Computing kpt #: 88 total cpu time spent up to now is 347.3 secs Computing kpt #: 89 total cpu time spent up to now is 350.9 secs Computing kpt #: 90 total cpu time spent up to now is 354.3 secs Computing kpt #: 91 total cpu time spent up to now is 357.8 secs Computing kpt #: 92 total cpu time spent up to now is 361.1 secs Computing kpt #: 93 total cpu time spent up to now is 365.0 secs Computing kpt #: 94 total cpu time spent up to now is 368.7 secs Computing kpt #: 95 total cpu time spent up to now is 372.8 secs Computing kpt #: 96 total cpu time spent up to now is 376.1 secs Computing kpt #: 97 total cpu time spent up to now is 379.6 secs Computing kpt #: 98 total cpu time spent up to now is 383.2 secs Computing kpt #: 99 total cpu time spent up to now is 386.1 secs Computing kpt #: 100 total cpu time spent up to now is 389.6 secs Computing kpt #: 101 total cpu time spent up to now is 393.6 secs Computing kpt #: 102 total cpu time spent up to now is 397.2 secs Computing kpt #: 103 total cpu time spent up to now is 400.5 secs Computing kpt #: 104 total cpu time spent up to now is 404.1 secs Computing kpt #: 105 total cpu time spent up to now is 408.6 secs Computing kpt #: 106 total cpu time spent up to now is 413.0 secs Computing kpt #: 107 total cpu time spent up to now is 417.1 secs Computing kpt #: 108 total cpu time spent up to now is 421.0 secs Computing kpt #: 109 total cpu time spent up to now is 424.6 secs Computing kpt #: 110 total cpu time spent up to now is 427.8 secs Computing kpt #: 111 total cpu time spent up to now is 431.3 secs Computing kpt #: 112 total cpu time spent up to now is 435.8 secs Computing kpt #: 113 total cpu time spent up to now is 440.3 secs Computing kpt #: 114 total cpu time spent up to now is 444.8 secs Computing kpt #: 115 total cpu time spent up to now is 448.7 secs Computing kpt #: 116 total cpu time spent up to now is 452.3 secs Computing kpt #: 117 total cpu time spent up to now is 456.2 secs Computing kpt #: 118 total cpu time spent up to now is 461.4 secs Computing kpt #: 119 total cpu time spent up to now is 465.9 secs Computing kpt #: 120 total cpu time spent up to now is 469.8 secs Computing kpt #: 121 total cpu time spent up to now is 474.2 secs Computing kpt #: 122 total cpu time spent up to now is 478.3 secs Computing kpt #: 123 total cpu time spent up to now is 483.1 secs Computing kpt #: 124 total cpu time spent up to now is 488.4 secs Computing kpt #: 125 total cpu time spent up to now is 493.3 secs Computing kpt #: 126 total cpu time spent up to now is 497.5 secs Computing kpt #: 127 total cpu time spent up to now is 501.6 secs Computing kpt #: 128 total cpu time spent up to now is 505.9 secs Computing kpt #: 129 total cpu time spent up to now is 510.4 secs Computing kpt #: 130 total cpu time spent up to now is 515.3 secs Computing kpt #: 131 total cpu time spent up to now is 519.2 secs Computing kpt #: 132 total cpu time spent up to now is 523.7 secs Computing kpt #: 133 total cpu time spent up to now is 528.7 secs Computing kpt #: 134 total cpu time spent up to now is 532.1 secs Computing kpt #: 135 total cpu time spent up to now is 535.2 secs Computing kpt #: 136 total cpu time spent up to now is 538.3 secs Computing kpt #: 137 total cpu time spent up to now is 541.5 secs Computing kpt #: 138 total cpu time spent up to now is 545.1 secs Computing kpt #: 139 total cpu time spent up to now is 548.8 secs Computing kpt #: 140 total cpu time spent up to now is 552.3 secs Computing kpt #: 141 total cpu time spent up to now is 555.5 secs Computing kpt #: 142 total cpu time spent up to now is 558.9 secs Computing kpt #: 143 total cpu time spent up to now is 563.0 secs Computing kpt #: 144 total cpu time spent up to now is 567.7 secs Computing kpt #: 145 total cpu time spent up to now is 570.8 secs Computing kpt #: 146 total cpu time spent up to now is 574.1 secs Computing kpt #: 147 total cpu time spent up to now is 577.5 secs Computing kpt #: 148 total cpu time spent up to now is 581.3 secs Computing kpt #: 149 total cpu time spent up to now is 585.1 secs Computing kpt #: 150 total cpu time spent up to now is 588.9 secs Computing kpt #: 151 total cpu time spent up to now is 592.6 secs Computing kpt #: 152 total cpu time spent up to now is 596.5 secs Computing kpt #: 153 total cpu time spent up to now is 600.9 secs Computing kpt #: 154 total cpu time spent up to now is 604.0 secs Computing kpt #: 155 total cpu time spent up to now is 608.1 secs Computing kpt #: 156 total cpu time spent up to now is 611.4 secs Computing kpt #: 157 total cpu time spent up to now is 614.7 secs Computing kpt #: 158 total cpu time spent up to now is 618.9 secs Computing kpt #: 159 total cpu time spent up to now is 622.4 secs Computing kpt #: 160 total cpu time spent up to now is 626.9 secs Computing kpt #: 161 total cpu time spent up to now is 631.0 secs Computing kpt #: 162 total cpu time spent up to now is 636.2 secs Computing kpt #: 163 total cpu time spent up to now is 641.3 secs Computing kpt #: 164 total cpu time spent up to now is 645.2 secs Computing kpt #: 165 total cpu time spent up to now is 649.3 secs Computing kpt #: 166 total cpu time spent up to now is 653.6 secs Computing kpt #: 167 total cpu time spent up to now is 657.8 secs Computing kpt #: 168 total cpu time spent up to now is 661.3 secs Computing kpt #: 169 total cpu time spent up to now is 664.9 secs Computing kpt #: 170 total cpu time spent up to now is 668.2 secs Computing kpt #: 171 total cpu time spent up to now is 671.4 secs Computing kpt #: 172 total cpu time spent up to now is 675.7 secs Computing kpt #: 173 total cpu time spent up to now is 679.2 secs Computing kpt #: 174 total cpu time spent up to now is 682.8 secs Computing kpt #: 175 total cpu time spent up to now is 686.0 secs Computing kpt #: 176 total cpu time spent up to now is 690.0 secs Computing kpt #: 177 total cpu time spent up to now is 693.3 secs Computing kpt #: 178 total cpu time spent up to now is 696.6 secs Computing kpt #: 179 total cpu time spent up to now is 700.7 secs Computing kpt #: 180 total cpu time spent up to now is 704.3 secs Computing kpt #: 181 total cpu time spent up to now is 709.0 secs Computing kpt #: 182 total cpu time spent up to now is 713.6 secs Computing kpt #: 183 total cpu time spent up to now is 717.8 secs Computing kpt #: 184 total cpu time spent up to now is 722.2 secs Computing kpt #: 185 total cpu time spent up to now is 726.3 secs Computing kpt #: 186 total cpu time spent up to now is 729.9 secs Computing kpt #: 187 total cpu time spent up to now is 733.5 secs Computing kpt #: 188 total cpu time spent up to now is 736.7 secs Computing kpt #: 189 total cpu time spent up to now is 740.0 secs Computing kpt #: 190 total cpu time spent up to now is 743.6 secs Computing kpt #: 191 total cpu time spent up to now is 747.3 secs Computing kpt #: 192 total cpu time spent up to now is 750.5 secs Computing kpt #: 193 total cpu time spent up to now is 754.0 secs Computing kpt #: 194 total cpu time spent up to now is 757.6 secs Computing kpt #: 195 total cpu time spent up to now is 761.5 secs Computing kpt #: 196 total cpu time spent up to now is 765.4 secs Computing kpt #: 197 total cpu time spent up to now is 768.7 secs Computing kpt #: 198 total cpu time spent up to now is 772.1 secs Computing kpt #: 199 total cpu time spent up to now is 775.1 secs Computing kpt #: 200 total cpu time spent up to now is 779.6 secs Computing kpt #: 201 total cpu time spent up to now is 783.7 secs Computing kpt #: 202 total cpu time spent up to now is 787.8 secs Computing kpt #: 203 total cpu time spent up to now is 791.4 secs Computing kpt #: 204 total cpu time spent up to now is 795.3 secs Computing kpt #: 205 total cpu time spent up to now is 798.4 secs Computing kpt #: 206 total cpu time spent up to now is 801.6 secs Computing kpt #: 207 total cpu time spent up to now is 804.8 secs Computing kpt #: 208 total cpu time spent up to now is 808.3 secs Computing kpt #: 209 total cpu time spent up to now is 811.2 secs Computing kpt #: 210 total cpu time spent up to now is 814.2 secs Computing kpt #: 211 total cpu time spent up to now is 817.2 secs Computing kpt #: 212 total cpu time spent up to now is 820.1 secs Computing kpt #: 213 total cpu time spent up to now is 823.4 secs Computing kpt #: 214 total cpu time spent up to now is 827.3 secs Computing kpt #: 215 total cpu time spent up to now is 830.6 secs Computing kpt #: 216 total cpu time spent up to now is 834.4 secs Computing kpt #: 217 total cpu time spent up to now is 837.6 secs Computing kpt #: 218 total cpu time spent up to now is 840.8 secs Computing kpt #: 219 total cpu time spent up to now is 844.2 secs Computing kpt #: 220 total cpu time spent up to now is 848.3 secs Computing kpt #: 221 total cpu time spent up to now is 853.0 secs Computing kpt #: 222 total cpu time spent up to now is 857.5 secs Computing kpt #: 223 total cpu time spent up to now is 861.5 secs Computing kpt #: 224 total cpu time spent up to now is 865.9 secs Computing kpt #: 225 total cpu time spent up to now is 869.4 secs Computing kpt #: 226 total cpu time spent up to now is 873.1 secs Computing kpt #: 227 total cpu time spent up to now is 876.6 secs Computing kpt #: 228 total cpu time spent up to now is 879.6 secs Computing kpt #: 229 total cpu time spent up to now is 882.9 secs Computing kpt #: 230 total cpu time spent up to now is 886.2 secs Computing kpt #: 231 total cpu time spent up to now is 889.5 secs Computing kpt #: 232 total cpu time spent up to now is 893.2 secs Computing kpt #: 233 total cpu time spent up to now is 897.3 secs Computing kpt #: 234 total cpu time spent up to now is 901.1 secs Computing kpt #: 235 total cpu time spent up to now is 905.0 secs Computing kpt #: 236 total cpu time spent up to now is 908.2 secs Computing kpt #: 237 total cpu time spent up to now is 911.5 secs Computing kpt #: 238 total cpu time spent up to now is 915.3 secs Computing kpt #: 239 total cpu time spent up to now is 919.4 secs Computing kpt #: 240 total cpu time spent up to now is 923.7 secs Computing kpt #: 241 total cpu time spent up to now is 928.1 secs Computing kpt #: 242 total cpu time spent up to now is 932.4 secs Computing kpt #: 243 total cpu time spent up to now is 935.5 secs Computing kpt #: 244 total cpu time spent up to now is 938.3 secs Computing kpt #: 245 total cpu time spent up to now is 941.1 secs Computing kpt #: 246 total cpu time spent up to now is 944.9 secs Computing kpt #: 247 total cpu time spent up to now is 948.8 secs Computing kpt #: 248 total cpu time spent up to now is 951.8 secs Computing kpt #: 249 total cpu time spent up to now is 955.0 secs Computing kpt #: 250 total cpu time spent up to now is 958.2 secs Computing kpt #: 251 total cpu time spent up to now is 961.5 secs Computing kpt #: 252 total cpu time spent up to now is 964.8 secs Computing kpt #: 253 total cpu time spent up to now is 969.1 secs Computing kpt #: 254 total cpu time spent up to now is 972.1 secs Computing kpt #: 255 total cpu time spent up to now is 975.2 secs Computing kpt #: 256 total cpu time spent up to now is 978.6 secs Computing kpt #: 257 total cpu time spent up to now is 982.1 secs Computing kpt #: 258 total cpu time spent up to now is 985.3 secs Computing kpt #: 259 total cpu time spent up to now is 989.1 secs Computing kpt #: 260 total cpu time spent up to now is 993.4 secs Computing kpt #: 261 total cpu time spent up to now is 997.6 secs Computing kpt #: 262 total cpu time spent up to now is 1001.6 secs Computing kpt #: 263 total cpu time spent up to now is 1005.3 secs Computing kpt #: 264 total cpu time spent up to now is 1008.6 secs Computing kpt #: 265 total cpu time spent up to now is 1011.7 secs Computing kpt #: 266 total cpu time spent up to now is 1014.6 secs ethr = 1.67E-08, avg # of iterations = 17.3 total cpu time spent up to now is 1014.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7049 PWs) bands (ev): -23.9415 -23.9415 -8.7643 -8.7643 -7.6672 -7.6672 -7.4201 -7.4201 -7.4085 -7.4085 -6.8864 -6.8864 -6.8417 -6.8417 -6.8115 -6.8115 -3.0440 -3.0440 0.0691 0.0691 0.3945 0.3945 0.5067 0.5067 0.9007 0.9007 1.1215 1.1215 1.6707 1.6707 1.7838 1.7838 2.0092 2.0092 2.0219 2.0219 2.1290 2.1290 2.2710 2.2710 2.3375 2.3375 3.0188 3.0188 3.0420 3.0420 3.5618 3.5618 3.5999 3.5999 4.0357 4.0357 4.4579 4.4579 4.4625 4.4625 4.5108 4.5108 4.7213 4.7213 6.0283 6.0283 8.1998 8.1998 9.0452 9.0452 9.5909 9.5909 9.9187 9.9187 10.1284 10.1284 k = 0.0000 0.0000 0.0200 ( 7073 PWs) bands (ev): -23.9415 -23.9415 -8.7639 -8.7639 -7.6690 -7.6655 -7.4205 -7.4204 -7.4108 -7.4057 -6.8872 -6.8865 -6.8424 -6.8423 -6.8122 -6.8100 -3.0437 -3.0435 0.0648 0.0749 0.3886 0.3988 0.5059 0.5059 0.8989 0.9035 1.1219 1.1281 1.6576 1.6807 1.7803 1.7896 1.9909 2.0156 2.0166 2.0367 2.1199 2.1405 2.2685 2.2742 2.3327 2.3442 3.0159 3.0187 3.0357 3.0492 3.5592 3.5596 3.5972 3.5982 4.0321 4.0402 4.4479 4.4530 4.4581 4.4605 4.5128 4.5187 4.7207 4.7273 6.0351 6.0360 8.1990 8.1992 9.0288 9.0568 9.5691 9.6078 9.9132 9.9139 10.1244 10.1350 k = 0.0000 0.0000 0.0401 ( 7069 PWs) bands (ev): -23.9415 -23.9415 -8.7630 -8.7630 -7.6706 -7.6638 -7.4220 -7.4210 -7.4120 -7.4025 -6.8888 -6.8876 -6.8446 -6.8442 -6.8121 -6.8079 -3.0426 -3.0423 0.0620 0.0821 0.3814 0.4003 0.5033 0.5047 0.8981 0.9071 1.1292 1.1419 1.6418 1.6873 1.7789 1.7977 1.9694 2.0108 2.0186 2.0547 2.1136 2.1540 2.2672 2.2783 2.3303 2.3524 3.0118 3.0127 3.0337 3.0558 3.5518 3.5527 3.5902 3.5924 4.0293 4.0456 4.4213 4.4292 4.4524 4.4580 4.5241 4.5354 4.7247 4.7365 6.0559 6.0577 8.1968 8.1972 9.0081 9.0632 9.5436 9.6188 9.8973 9.9011 10.1222 10.1421 k = 0.0000 0.0000 0.0601 ( 7065 PWs) bands (ev): -23.9415 -23.9415 -8.7614 -8.7614 -7.6722 -7.6622 -7.4244 -7.4218 -7.4122 -7.3993 -6.8913 -6.8897 -6.8478 -6.8469 -6.8113 -6.8056 -3.0406 -3.0402 0.0608 0.0907 0.3726 0.3973 0.4999 0.5055 0.8984 0.9113 1.1424 1.1622 1.6238 1.6908 1.7788 1.8074 1.9475 2.0053 2.0191 2.0714 2.1101 2.1690 2.2675 2.2831 2.3308 2.3613 3.0019 3.0069 3.0351 3.0610 3.5400 3.5414 3.5792 3.5832 4.0270 4.0517 4.3828 4.3925 4.4456 4.4546 4.5430 4.5594 4.7303 4.7461 6.0896 6.0921 8.1933 8.1940 8.9838 9.0642 9.5155 9.6229 9.8732 9.8836 10.1190 10.1462 k = 0.0000 0.0000 0.0802 ( 7071 PWs) bands (ev): -23.9415 -23.9415 -8.7592 -8.7592 -7.6737 -7.6607 -7.4272 -7.4227 -7.4119 -7.3963 -6.8946 -6.8930 -6.8517 -6.8503 -6.8101 -6.8033 -3.0379 -3.0373 0.0611 0.1005 0.3615 0.3883 0.4975 0.5105 0.8995 0.9159 1.1605 1.1880 1.6043 1.6917 1.7794 1.8170 1.9268 1.9992 2.0192 2.0855 2.1092 2.1855 2.2699 2.2887 2.3345 2.3706 2.9888 3.0012 3.0375 3.0647 3.5242 3.5265 3.5646 3.5709 4.0245 4.0580 4.3367 4.3477 4.4378 4.4503 4.5682 4.5895 4.7351 4.7538 6.1345 6.1375 8.1889 8.1899 8.9565 9.0598 9.4859 9.6199 9.8435 9.8638 10.1109 10.1437 k = 0.0000 0.0000 0.1002 ( 7076 PWs) bands (ev): -23.9415 -23.9415 -8.7564 -8.7564 -7.6751 -7.6594 -7.4301 -7.4236 -7.4115 -7.3936 -6.8987 -6.8974 -6.8559 -6.8542 -6.8086 -6.8011 -3.0345 -3.0337 0.0629 0.1115 0.3476 0.3739 0.4973 0.5201 0.9014 0.9209 1.1824 1.2183 1.5836 1.6905 1.7802 1.8232 1.9104 1.9927 2.0194 2.0958 2.1106 2.2037 2.2748 2.2950 2.3416 2.3798 2.9742 2.9947 3.0404 3.0668 3.5054 3.5087 3.5469 3.5562 4.0206 4.0638 4.2867 4.2993 4.4288 4.4451 4.5989 4.6246 4.7374 4.7583 6.1886 6.1917 8.1839 8.1852 8.9268 9.0503 9.4555 9.6101 9.8102 9.8434 10.0945 10.1318 k = 0.0000 0.0000 0.1203 ( 7080 PWs) bands (ev): -23.9415 -23.9415 -8.7529 -8.7529 -7.6763 -7.6584 -7.4329 -7.4246 -7.4110 -7.3913 -6.9035 -6.9029 -6.8602 -6.8583 -6.8071 -6.7991 -3.0303 -3.0293 0.0662 0.1237 0.3309 0.3555 0.5001 0.5337 0.9039 0.9263 1.2069 1.2516 1.5620 1.6875 1.7807 1.8206 1.9039 1.9860 2.0199 2.1016 2.1141 2.2246 2.2820 2.3019 2.3523 2.3888 2.9585 2.9874 3.0437 3.0672 3.4845 3.4889 3.5264 3.5394 4.0135 4.0676 4.2365 4.2515 4.4187 4.4387 4.6340 4.6636 4.7367 4.7594 6.2495 6.2525 8.1788 8.1806 8.8956 9.0359 9.4252 9.5944 9.7749 9.8227 10.0676 10.1082 k = 0.0000 0.0000 0.1403 ( 7070 PWs) bands (ev): -23.9415 -23.9415 -8.7489 -8.7488 -7.6774 -7.6576 -7.4356 -7.4256 -7.4106 -7.3896 -6.9093 -6.9090 -6.8644 -6.8626 -6.8055 -6.7972 -3.0253 -3.0242 0.0708 0.1367 0.3120 0.3349 0.5062 0.5503 0.9071 0.9322 1.2330 1.2869 1.5398 1.6828 1.7804 1.8068 1.9098 1.9793 2.0211 2.1030 2.1194 2.2484 2.2906 2.3093 2.3669 2.3972 2.9421 2.9793 3.0476 3.0656 3.4626 3.4680 3.5036 3.5209 4.0006 4.0659 4.1912 4.2089 4.4074 4.4311 4.6724 4.7053 4.7330 4.7571 6.3151 6.3177 8.1744 8.1767 8.8632 9.0175 9.3954 9.5742 9.7386 9.8018 10.0288 10.0715 k = 0.0000 0.0000 0.1604 ( 7080 PWs) bands (ev): -23.9415 -23.9415 -8.7443 -8.7441 -7.6783 -7.6572 -7.4381 -7.4267 -7.4104 -7.3886 -6.9164 -6.9151 -6.8685 -6.8671 -6.8040 -6.7956 -3.0197 -3.0184 0.0764 0.1503 0.2920 0.3136 0.5153 0.5689 0.9109 0.9384 1.2598 1.3229 1.5172 1.6764 1.7789 1.7859 1.9241 1.9727 2.0230 2.1013 2.1261 2.2750 2.2995 2.3169 2.3856 2.4051 2.9250 2.9704 3.0523 3.0620 3.4406 3.4463 3.4789 3.5015 3.9790 4.0517 4.1594 4.1760 4.3947 4.4221 4.7096 4.7298 4.7420 4.7583 6.3833 6.3853 8.1714 8.1742 8.8304 8.9955 9.3665 9.5513 9.7018 9.7800 9.9781 10.0215 k = 0.0000 0.0000 0.1804 ( 7082 PWs) bands (ev): -23.9415 -23.9415 -8.7390 -8.7388 -7.6791 -7.6572 -7.4405 -7.4277 -7.4105 -7.3884 -6.9238 -6.9216 -6.8726 -6.8716 -6.8027 -6.7943 -3.0134 -3.0119 0.0824 0.1635 0.2723 0.2929 0.5268 0.5890 0.9153 0.9452 1.2864 1.3586 1.4945 1.6681 1.7622 1.7759 1.9432 1.9664 2.0252 2.0979 2.1339 2.3037 2.3078 2.3245 2.4090 2.4126 2.9076 2.9607 3.0563 3.0581 3.4187 3.4240 3.4533 3.4819 3.9481 4.0207 4.1463 4.1545 4.3808 4.4117 4.7112 4.7381 4.7608 4.7979 6.4519 6.4533 8.1708 8.1741 8.7975 8.9708 9.3389 9.5272 9.6648 9.7573 9.9166 9.9587 k = 0.0000 0.0000 0.2005 ( 7086 PWs) bands (ev): -23.9415 -23.9415 -8.7333 -8.7330 -7.6797 -7.6577 -7.4426 -7.4288 -7.4108 -7.3892 -6.9314 -6.9283 -6.8767 -6.8762 -6.8014 -6.7931 -3.0065 -3.0049 0.0881 0.1740 0.2561 0.2743 0.5402 0.6100 0.9202 0.9525 1.3124 1.3930 1.4717 1.6573 1.7381 1.7714 1.9587 1.9668 2.0265 2.0950 2.1427 2.3148 2.3313 2.3334 2.4203 2.4373 2.8903 2.9503 3.0486 3.0653 3.3963 3.4009 3.4286 3.4633 3.9106 3.9804 4.1428 4.1452 4.3655 4.3999 4.6981 4.7251 4.8044 4.8438 6.5192 6.5198 8.1734 8.1773 8.7649 8.9441 9.3128 9.5030 9.6272 9.7334 9.8465 9.8847 k = 0.0000 0.0000 0.2205 ( 7090 PWs) bands (ev): -23.9415 -23.9415 -8.7269 -8.7266 -7.6803 -7.6586 -7.4446 -7.4299 -7.4116 -7.3912 -6.9387 -6.9351 -6.8808 -6.8808 -6.8004 -6.7922 -2.9991 -2.9972 0.0923 0.1764 0.2491 0.2592 0.5549 0.6313 0.9258 0.9603 1.3371 1.4256 1.4492 1.6433 1.7152 1.7654 1.9533 1.9904 2.0254 2.0948 2.1522 2.3204 2.3365 2.3626 2.4289 2.4708 2.8731 2.9391 3.0391 3.0743 3.3710 3.3766 3.4084 3.4472 3.8707 3.9386 4.1373 4.1491 4.3489 4.3868 4.6814 4.7085 4.8490 4.8899 6.5833 6.5834 8.1803 8.1846 8.7327 8.9159 9.2885 9.4799 9.5878 9.7081 9.7712 9.8016 k = 0.0000 0.0000 0.2406 ( 7110 PWs) bands (ev): -23.9415 -23.9415 -8.7201 -8.7196 -7.6807 -7.6600 -7.4463 -7.4310 -7.4130 -7.3944 -6.9455 -6.9417 -6.8855 -6.8849 -6.7996 -6.7916 -2.9911 -2.9891 0.0935 0.1670 0.2495 0.2555 0.5705 0.6525 0.9319 0.9687 1.3602 1.4272 1.4558 1.6251 1.6949 1.7581 1.9473 2.0158 2.0206 2.0987 2.1624 2.3241 2.3392 2.3903 2.4394 2.5096 2.8565 2.9271 3.0287 3.0853 3.3421 3.3511 3.3944 3.4344 3.8316 3.8985 4.1354 4.1547 4.3309 4.3721 4.6618 4.6886 4.8932 4.9353 6.6422 6.6429 8.1924 8.1969 8.7013 8.8869 9.2658 9.4584 9.5431 9.6781 9.6968 9.7152 k = 0.0000 0.0000 0.2606 ( 7114 PWs) bands (ev): -23.9415 -23.9415 -8.7127 -8.7122 -7.6811 -7.6619 -7.4479 -7.4321 -7.4148 -7.3989 -6.9515 -6.9479 -6.8901 -6.8891 -6.7990 -6.7912 -2.9826 -2.9804 0.0903 0.1500 0.2465 0.2710 0.5865 0.6733 0.9386 0.9777 1.3802 1.4072 1.4831 1.6029 1.6775 1.7495 1.9413 2.0125 2.0416 2.1066 2.1731 2.3258 2.3387 2.4162 2.4527 2.5526 2.8407 2.9137 3.0188 3.0988 3.3114 3.3251 3.3861 3.4257 3.7948 3.8614 4.1352 4.1609 4.3116 4.3561 4.6396 4.6657 4.9365 4.9794 6.6954 6.6965 8.2105 8.2147 8.6706 8.8577 9.2446 9.4393 9.4869 9.6051 9.6326 9.6662 k = 0.0000 0.0000 0.2807 ( 7114 PWs) bands (ev): -23.9415 -23.9415 -8.7049 -8.7042 -7.6814 -7.6643 -7.4494 -7.4334 -7.4173 -7.4048 -6.9564 -6.9535 -6.8948 -6.8933 -6.7986 -6.7910 -2.9737 -2.9714 0.0825 0.1303 0.2506 0.2911 0.6023 0.6931 0.9459 0.9872 1.3797 1.4065 1.5075 1.5773 1.6627 1.7401 1.9354 2.0020 2.0663 2.1175 2.1843 2.3253 2.3350 2.4402 2.4691 2.5980 2.8258 2.8980 3.0120 3.1151 3.2810 3.2995 3.3826 3.4212 3.7615 3.8276 4.1357 4.1669 4.2909 4.3388 4.6151 4.6401 4.9780 5.0215 6.7419 6.7434 8.2349 8.2380 8.6409 8.8288 9.2235 9.4163 9.4225 9.5060 9.5854 9.6408 k = 0.0000 0.0000 0.3007 ( 7124 PWs) bands (ev): -23.9415 -23.9415 -8.6967 -8.6959 -7.6818 -7.6673 -7.4509 -7.4348 -7.4205 -7.4118 -6.9603 -6.9583 -6.8993 -6.8975 -6.7986 -6.7912 -2.9645 -2.9620 0.0711 0.1100 0.2609 0.3138 0.6177 0.7116 0.9538 0.9973 1.3611 1.4230 1.5281 1.5503 1.6494 1.7301 1.9297 1.9902 2.0889 2.1301 2.1960 2.3225 2.3285 2.4624 2.4882 2.6430 2.8120 2.8789 3.0116 3.1344 3.2525 3.2759 3.3835 3.4209 3.7316 3.7972 4.1358 4.1722 4.2689 4.3201 4.5887 4.6120 5.0171 5.0610 6.7813 6.7830 8.2657 8.2664 8.6120 8.8008 9.1972 9.3411 9.3932 9.4184 9.5531 9.6189 k = 0.0000 0.0000 0.3208 ( 7128 PWs) bands (ev): -23.9415 -23.9415 -8.6881 -8.6871 -7.6822 -7.6707 -7.4524 -7.4367 -7.4242 -7.4197 -6.9628 -6.9620 -6.9039 -6.9017 -6.7989 -6.7916 -2.9549 -2.9523 0.0574 0.0900 0.2757 0.3382 0.6322 0.7285 0.9621 1.0079 1.3418 1.4391 1.5187 1.5488 1.6374 1.7197 1.9242 1.9779 2.1083 2.1435 2.2077 2.3175 2.3202 2.4829 2.5096 2.6844 2.7994 2.8557 3.0215 3.1567 3.2274 3.2557 3.3885 3.4248 3.7053 3.7699 4.1350 4.1766 4.2455 4.3003 4.5609 4.5819 5.0532 5.0972 6.8136 6.8152 8.2984 8.3021 8.5842 8.7745 9.1510 9.2833 9.2932 9.4035 9.5308 9.6001 k = 0.0000 0.0000 0.3408 ( 7128 PWs) bands (ev): -23.9415 -23.9415 -8.6792 -8.6780 -7.6827 -7.6747 -7.4541 -7.4400 -7.4283 -7.4273 -6.9647 -6.9641 -6.9084 -6.9058 -6.7996 -6.7924 -2.9452 -2.9425 0.0427 0.0705 0.2940 0.3639 0.6455 0.7435 0.9710 1.0190 1.3233 1.4537 1.4892 1.5629 1.6270 1.7091 1.9190 1.9655 2.1240 2.1568 2.2183 2.3105 2.3114 2.5015 2.5324 2.7191 2.7879 2.8287 3.0444 3.1806 3.2066 3.2418 3.3975 3.4331 3.6821 3.7454 4.1325 4.1794 4.2208 4.2793 4.5321 4.5503 5.0857 5.1297 6.8390 6.8405 8.3321 8.3431 8.5578 8.7512 9.0758 9.1881 9.2571 9.3978 9.5159 9.5851 k = 0.0000 0.0000 0.3609 ( 7122 PWs) bands (ev): -23.9415 -23.9415 -8.6700 -8.6687 -7.6833 -7.6791 -7.4562 -7.4468 -7.4327 -7.4325 -6.9662 -6.9641 -6.9127 -6.9098 -6.8006 -6.7935 -2.9353 -2.9326 0.0276 0.0519 0.3145 0.3904 0.6575 0.7565 0.9803 1.0305 1.3057 1.4590 1.4666 1.5721 1.6198 1.6986 1.9142 1.9536 2.1360 2.1689 2.2262 2.3021 2.3039 2.5180 2.5557 2.7451 2.7774 2.7992 3.0808 3.1911 3.1994 3.2419 3.4106 3.4460 3.6618 3.7233 4.1274 4.1794 4.1955 4.2574 4.5032 4.5179 5.1141 5.1578 6.8582 6.8594 8.3644 8.3864 8.5335 8.7322 8.9860 9.0841 9.2514 9.3964 9.5076 9.5747 k = 0.0000 0.0000 0.3809 ( 7130 PWs) bands (ev): -23.9415 -23.9415 -8.6606 -8.6592 -7.6842 -7.6839 -7.4590 -7.4568 -7.4369 -7.4351 -6.9665 -6.9630 -6.9169 -6.9136 -6.8021 -6.7949 -2.9254 -2.9226 0.0128 0.0343 0.3367 0.4175 0.6679 0.7673 0.9900 1.0425 1.2891 1.4287 1.4778 1.5728 1.6191 1.6884 1.9098 1.9425 2.1445 2.1788 2.2293 2.2932 2.2999 2.5318 2.5786 2.7617 2.7678 2.7702 3.1279 3.1821 3.2042 3.2651 3.4279 3.4639 3.6440 3.7033 4.1188 4.1648 4.1805 4.2346 4.4750 4.4858 5.1378 5.1811 6.8719 6.8728 8.3914 8.4268 8.5148 8.7194 8.8930 8.9827 9.2574 9.3994 9.5056 9.5699 k = 0.0000 0.0000 0.4010 ( 7122 PWs) bands (ev): -23.9415 -23.9415 -8.6511 -8.6495 -7.6891 -7.6855 -7.4681 -7.4630 -7.4405 -7.4367 -6.9656 -6.9608 -6.9209 -6.9172 -6.8040 -6.7968 -2.9155 -2.9127 -0.0014 0.0178 0.3599 0.4448 0.6769 0.7762 1.0000 1.0547 1.2734 1.3985 1.4871 1.5655 1.6246 1.6787 1.9060 1.9325 2.1493 2.1847 2.2274 2.2854 2.3001 2.5418 2.6006 2.7391 2.7593 2.7757 3.1670 3.1945 3.2059 3.2999 3.4500 3.4875 3.6287 3.6852 4.1058 4.1365 4.1739 4.2111 4.4486 4.4552 5.1562 5.1990 6.8810 6.8816 8.4096 8.4468 8.5170 8.7142 8.8017 8.8856 9.2724 9.4065 9.5101 9.5716 k = 0.0000 0.0000 0.4210 ( 7120 PWs) bands (ev): -23.9415 -23.9415 -8.6415 -8.6399 -7.6945 -7.6872 -7.4799 -7.4682 -7.4432 -7.4380 -6.9636 -6.9579 -6.9247 -6.9203 -6.8063 -6.7990 -2.9058 -2.9030 -0.0148 0.0024 0.3837 0.4720 0.6846 0.7832 1.0102 1.0672 1.2586 1.3686 1.4944 1.5543 1.6324 1.6699 1.9027 1.9238 2.1499 2.1849 2.2233 2.2804 2.3029 2.5465 2.6210 2.7140 2.7519 2.7834 3.1732 3.2111 3.2488 3.3385 3.4777 3.5177 3.6161 3.6687 4.0877 4.1059 4.1629 4.1867 4.4250 4.4276 5.1691 5.2112 6.8865 6.8867 8.4167 8.4364 8.5473 8.7048 8.7265 8.7947 9.2955 9.4177 9.5214 9.5807 k = 0.0000 0.0000 0.4411 ( 7136 PWs) bands (ev): -23.9415 -23.9415 -8.6321 -8.6303 -7.7002 -7.6894 -7.4915 -7.4745 -7.4450 -7.4391 -6.9606 -6.9545 -6.9281 -6.9229 -6.8091 -6.8016 -2.8963 -2.8936 -0.0273 -0.0119 0.4076 0.4984 0.6913 0.7888 1.0205 1.0796 1.2444 1.3393 1.4997 1.5413 1.6404 1.6620 1.9000 1.9167 2.1460 2.1787 2.2203 2.2789 2.3063 2.5441 2.6396 2.6954 2.7459 2.7887 3.1806 3.2210 3.3063 3.3775 3.5114 3.5552 3.6073 3.6539 4.0643 4.0734 4.1461 4.1610 4.4045 4.4051 5.1760 5.2173 6.8890 6.8892 8.4127 8.4162 8.5790 8.6289 8.7155 8.7299 9.3257 9.4328 9.5403 9.5980 k = 0.0000 0.0000 0.4611 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.6228 -8.6209 -7.7059 -7.6921 -7.5025 -7.4815 -7.4462 -7.4401 -6.9569 -6.9511 -6.9311 -6.9245 -6.8124 -6.8046 -2.8872 -2.8845 -0.0387 -0.0250 0.4310 0.5233 0.6975 0.7933 1.0309 1.0920 1.2309 1.3107 1.5027 1.5276 1.6479 1.6555 1.8978 1.9113 2.1377 2.1671 2.2200 2.2802 2.3091 2.5334 2.6562 2.6850 2.7415 2.7923 3.1931 3.2354 3.3595 3.4152 3.5459 3.5999 3.6089 3.6413 4.0356 4.0390 4.1231 4.1338 4.3867 4.3893 5.1770 5.2172 6.8893 6.8897 8.3936 8.3992 8.5550 8.5785 8.6735 8.7422 9.3613 9.4515 9.5674 9.6236 k = 0.0000 0.0000 0.4812 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.6138 -8.6119 -7.7115 -7.6956 -7.5125 -7.4888 -7.4470 -7.4410 -6.9527 -6.9484 -6.9334 -6.9244 -6.8160 -6.8080 -2.8785 -2.8760 -0.0491 -0.0369 0.4537 0.5459 0.7043 0.7973 1.0410 1.1041 1.2180 1.2829 1.5032 1.5138 1.6507 1.6546 1.8963 1.9074 2.1263 2.1520 2.2226 2.2827 2.3109 2.5161 2.6705 2.6818 2.7393 2.7947 3.2110 3.2542 3.4059 3.4504 3.5612 3.6253 3.6410 3.6569 4.0023 4.0024 4.0946 4.1050 4.3741 4.3775 5.1719 5.2109 6.8881 6.8889 8.3696 8.3768 8.4917 8.5277 8.6861 8.7552 9.4000 9.4733 9.6034 9.6577 k = 0.0000 0.0000 0.5012 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.6052 -8.6033 -7.7170 -7.6996 -7.5213 -7.4962 -7.4475 -7.4418 -6.9491 -6.9471 -6.9341 -6.9223 -6.8201 -6.8119 -2.8704 -2.8680 -0.0584 -0.0477 0.4752 0.5650 0.7126 0.8012 1.0506 1.1154 1.2059 1.2562 1.5003 1.5013 1.6477 1.6604 1.8954 1.9052 2.1134 2.1351 2.2271 2.2850 2.3117 2.4950 2.6823 2.6833 2.7393 2.7962 3.2341 3.2771 3.4461 3.4830 3.5599 3.6167 3.6982 3.7136 3.9631 3.9652 4.0622 4.0749 4.3659 4.3690 5.1612 5.1986 6.8861 6.8870 8.3433 8.3447 8.4429 8.4706 8.7100 8.7670 9.4393 9.4975 9.6485 9.6993 k = 0.0000 0.0000 0.5212 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5971 -8.5954 -7.7222 -7.7043 -7.5287 -7.5034 -7.4478 -7.4427 -6.9475 -6.9472 -6.9320 -6.9183 -6.8246 -6.8161 -2.8629 -2.8607 -0.0665 -0.0572 0.4950 0.5795 0.7235 0.8055 1.0592 1.1254 1.1948 1.2310 1.4874 1.4971 1.6466 1.6651 1.8950 1.9042 2.1000 2.1176 2.2331 2.2866 2.3118 2.4725 2.6872 2.6915 2.7419 2.7970 3.2621 3.3036 3.4819 3.5123 3.5554 3.6096 3.7636 3.7746 3.9213 3.9251 4.0278 4.0441 4.3608 4.3633 5.1455 5.1810 6.8836 6.8846 8.3049 8.3133 8.4087 8.4230 8.7321 8.7767 9.4777 9.5234 9.7016 9.7473 k = 0.0000 0.0000 0.5413 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5898 -8.5881 -7.7268 -7.7094 -7.5345 -7.5103 -7.4479 -7.4434 -6.9480 -6.9477 -6.9273 -6.9131 -6.8294 -6.8206 -2.8561 -2.8542 -0.0735 -0.0656 0.5128 0.5890 0.7373 0.8103 1.0664 1.1331 1.1854 1.2084 1.4756 1.4911 1.6472 1.6688 1.8953 1.9044 2.0870 2.1005 2.2400 2.2870 2.3118 2.4501 2.6919 2.6981 2.7466 2.7970 3.2947 3.3336 3.5143 3.5363 3.5511 3.6076 3.8295 3.8359 3.8769 3.8834 3.9935 4.0132 4.3580 4.3595 5.1257 5.1587 6.8810 6.8820 8.2636 8.2792 8.3844 8.3880 8.7504 8.7844 9.5141 9.5501 9.7604 9.7997 k = 0.0000 0.0000 0.5613 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5832 -8.5817 -7.7307 -7.7147 -7.5388 -7.5168 -7.4480 -7.4441 -6.9491 -6.9488 -6.9211 -6.9073 -6.8343 -6.8254 -2.8502 -2.8485 -0.0793 -0.0727 0.5286 0.5938 0.7535 0.8158 1.0715 1.1363 1.1783 1.1904 1.4653 1.4836 1.6492 1.6713 1.8963 1.9053 2.0749 2.0845 2.2473 2.2864 2.3123 2.4288 2.6968 2.7028 2.7528 2.7963 3.3314 3.3665 3.5404 3.5504 3.5516 3.6150 3.8300 3.8375 3.8934 3.8946 3.9624 3.9841 4.3565 4.3571 5.1033 5.1332 6.8784 6.8794 8.2260 8.2439 8.3637 8.3657 8.7649 8.7902 9.5480 9.5762 9.8217 9.8540 k = 0.0000 0.0000 0.5814 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5776 -8.5764 -7.7337 -7.7199 -7.5415 -7.5228 -7.4479 -7.4448 -6.9502 -6.9500 -6.9145 -6.9016 -6.8391 -6.8305 -2.8452 -2.8438 -0.0840 -0.0787 0.5422 0.5950 0.7709 0.8213 1.0744 1.1314 1.1741 1.1806 1.4570 1.4755 1.6522 1.6725 1.8978 1.9065 2.0641 2.0702 2.2545 2.2849 2.3139 2.4088 2.7012 2.7062 2.7595 2.7950 3.3716 3.4021 3.5422 3.5539 3.5745 3.6320 3.7825 3.7950 3.9147 3.9320 3.9647 3.9743 4.3558 4.3559 5.0803 5.1063 6.8762 6.8771 8.1944 8.2112 8.3468 8.3510 8.7760 8.7942 9.5786 9.6005 9.8821 9.9072 k = 0.0000 0.0000 0.6014 ( 7106 PWs) bands (ev): -23.9414 -23.9414 -8.5731 -8.5721 -7.7358 -7.7249 -7.5429 -7.5281 -7.4478 -7.4454 -6.9512 -6.9511 -6.9078 -6.8965 -6.8435 -6.8355 -2.8412 -2.8402 -0.0874 -0.0835 0.5538 0.5935 0.7881 0.8261 1.0756 1.1195 1.1728 1.1782 1.4510 1.4673 1.6558 1.6727 1.8999 1.9076 2.0551 2.0585 2.2610 2.2828 2.3176 2.3902 2.7050 2.7086 2.7661 2.7930 3.4148 3.4396 3.5407 3.5523 3.5968 3.6499 3.7371 3.7552 3.8908 3.9134 4.0080 4.0134 4.3550 4.3556 5.0591 5.0800 6.8744 6.8751 8.1699 8.1836 8.3352 8.3395 8.7843 8.7968 9.6049 9.6212 9.9375 9.9558 k = 0.0000 0.0000 0.6215 ( 7100 PWs) bands (ev): -23.9414 -23.9414 -8.5697 -8.5690 -7.7368 -7.7292 -7.5430 -7.5328 -7.4475 -7.4459 -6.9520 -6.9519 -6.9015 -6.8928 -6.8469 -6.8404 -2.8383 -2.8375 -0.0897 -0.0871 0.5637 0.5900 0.8035 0.8290 1.0766 1.1057 1.1736 1.1784 1.4476 1.4597 1.6596 1.6717 1.9023 1.9082 2.0481 2.0497 2.2665 2.2802 2.3239 2.3733 2.7079 2.7101 2.7723 2.7903 3.4601 3.4779 3.5398 3.5495 3.6084 3.6495 3.7084 3.7246 3.8676 3.8876 4.0458 4.0504 4.3547 4.3554 5.0423 5.0571 6.8730 6.8735 8.1530 8.1626 8.3277 8.3310 8.7904 8.7981 9.6259 9.6368 9.9834 9.9953 k = 0.0000 0.0000 0.6415 ( 7104 PWs) bands (ev): -23.9414 -23.9414 -8.5676 -8.5672 -7.7366 -7.7327 -7.5419 -7.5367 -7.4472 -7.4464 -6.9524 -6.9524 -6.8962 -6.8912 -6.8484 -6.8446 -2.8364 -2.8360 -0.0908 -0.0895 0.5721 0.5852 0.8160 0.8288 1.0790 1.0935 1.1755 1.1784 1.4470 1.4534 1.6634 1.6697 1.9047 1.9079 2.0437 2.0442 2.2708 2.2774 2.3329 2.3579 2.7098 2.7109 2.7779 2.7869 3.5054 3.5141 3.5394 3.5469 3.6008 3.6163 3.7087 3.7119 3.8531 3.8655 4.0710 4.0738 4.3547 4.3552 5.0326 5.0403 6.8723 6.8725 8.1439 8.1488 8.3238 8.3255 8.7945 8.7982 9.6402 9.6457 10.0149 10.0208 k = 0.0000 0.0000 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5667 -8.5667 -7.7352 -7.7352 -7.5398 -7.5398 -7.4469 -7.4469 -6.9526 -6.9526 -6.8925 -6.8925 -6.8476 -6.8476 -2.8357 -2.8357 -0.0908 -0.0908 0.5792 0.5792 0.8245 0.8245 1.0845 1.0845 1.1773 1.1773 1.4490 1.4490 1.6669 1.6669 1.9066 1.9066 2.0422 2.0422 2.2743 2.2743 2.3443 2.3443 2.7108 2.7108 2.7827 2.7827 3.5360 3.5360 3.5410 3.5410 3.5885 3.5885 3.7112 3.7112 3.8524 3.8524 4.0808 4.0808 4.3549 4.3549 5.0317 5.0317 6.8721 6.8721 8.1425 8.1425 8.3231 8.3231 8.7970 8.7970 9.6469 9.6469 10.0280 10.0280 k = 0.0000 0.0000 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5667 -8.5667 -7.7352 -7.7352 -7.5398 -7.5398 -7.4469 -7.4469 -6.9526 -6.9526 -6.8925 -6.8925 -6.8476 -6.8476 -2.8357 -2.8357 -0.0908 -0.0908 0.5792 0.5792 0.8245 0.8245 1.0845 1.0845 1.1773 1.1773 1.4490 1.4490 1.6669 1.6669 1.9066 1.9066 2.0422 2.0422 2.2743 2.2743 2.3443 2.3443 2.7108 2.7108 2.7827 2.7827 3.5360 3.5360 3.5410 3.5410 3.5885 3.5885 3.7112 3.7112 3.8524 3.8524 4.0808 4.0808 4.3549 4.3549 5.0317 5.0317 6.8721 6.8721 8.1425 8.1425 8.3231 8.3231 8.7970 8.7970 9.6469 9.6469 10.0280 10.0280 k =-0.0151 0.0131 0.6616 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.5667 -8.5665 -7.7376 -7.7329 -7.5444 -7.5354 -7.4552 -7.4381 -6.9537 -6.9521 -6.8925 -6.8922 -6.8486 -6.8467 -2.8362 -2.8361 -0.0907 -0.0869 0.5789 0.5805 0.8212 0.8289 1.0824 1.0864 1.1712 1.1844 1.4467 1.4525 1.6624 1.6695 1.9029 1.9106 2.0352 2.0489 2.2722 2.2776 2.3427 2.3472 2.7060 2.7141 2.7773 2.7870 3.5119 3.5346 3.5361 3.5427 3.5559 3.6264 3.6746 3.7581 3.8540 3.8559 4.0713 4.0818 4.3601 4.3622 5.0280 5.0327 6.8729 6.8733 8.1396 8.1471 8.3249 8.3268 8.7890 8.8046 9.6324 9.6497 10.0252 10.0255 k =-0.0303 0.0262 0.6616 ( 7100 PWs) bands (ev): -23.9414 -23.9414 -8.5664 -8.5659 -7.7400 -7.7307 -7.5490 -7.5315 -7.4630 -7.4294 -6.9556 -6.9525 -6.8923 -6.8916 -6.8496 -6.8458 -2.8376 -2.8374 -0.0868 -0.0792 0.5795 0.5827 0.8189 0.8342 1.0806 1.0878 1.1657 1.1926 1.4456 1.4571 1.6562 1.6702 1.8995 1.9148 2.0280 2.0548 2.2717 2.2812 2.3431 2.3506 2.6998 2.7160 2.7706 2.7900 3.4565 3.5244 3.5297 3.5390 3.5479 3.5982 3.7020 3.8026 3.8614 3.8642 4.0556 4.0750 4.3773 4.3803 5.0216 5.0311 6.8755 6.8763 8.1386 8.1534 8.3323 8.3361 8.7807 8.8117 9.6068 9.6410 10.0175 10.0180 k =-0.0454 0.0393 0.6616 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5658 -8.5651 -7.7425 -7.7286 -7.5535 -7.5287 -7.4695 -7.4208 -6.9581 -6.9535 -6.8919 -6.8906 -6.8505 -6.8451 -2.8400 -2.8396 -0.0792 -0.0676 0.5811 0.5858 0.8179 0.8403 1.0792 1.0881 1.1608 1.2024 1.4458 1.4628 1.6483 1.6688 1.8965 1.9189 2.0208 2.0599 2.2729 2.2842 2.3465 2.3542 2.6921 2.7163 2.7627 2.7916 3.3949 3.5065 3.5139 3.5278 3.5465 3.5576 3.7435 3.8401 3.8739 3.8778 4.0375 4.0631 4.4045 4.4067 5.0126 5.0267 6.8799 6.8812 8.1394 8.1612 8.3450 8.3510 8.7720 8.8181 9.5715 9.6222 10.0050 10.0057 k =-0.0605 0.0525 0.6616 ( 7132 PWs) bands (ev): -23.9414 -23.9414 -8.5650 -8.5641 -7.7450 -7.7267 -7.5577 -7.5275 -7.4743 -7.4125 -6.9611 -6.9552 -6.8913 -6.8894 -6.8514 -6.8446 -2.8432 -2.8428 -0.0677 -0.0522 0.5836 0.5899 0.8182 0.8471 1.0779 1.0868 1.1570 1.2139 1.4473 1.4693 1.6390 1.6652 1.8940 1.9229 2.0136 2.0639 2.2762 2.2860 2.3540 2.3577 2.6832 2.7152 2.7537 2.7919 3.3316 3.4833 3.4833 3.4932 3.5467 3.5469 3.7780 3.8648 3.8885 3.8980 4.0227 4.0514 4.4394 4.4396 5.0009 5.0196 6.8861 6.8878 8.1419 8.1701 8.3626 8.3711 8.7630 8.8235 9.5285 9.5950 9.9882 9.9888 k =-0.0757 0.0656 0.6616 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.5638 -8.5627 -7.7475 -7.7250 -7.5617 -7.5286 -7.4767 -7.4048 -6.9645 -6.9574 -6.8906 -6.8878 -6.8522 -6.8443 -2.8473 -2.8468 -0.0527 -0.0330 0.5872 0.5949 0.8200 0.8548 1.0762 1.0840 1.1549 1.2272 1.4500 1.4769 1.6284 1.6594 1.8920 1.9266 2.0068 2.0665 2.2816 2.2865 2.3610 2.3655 2.6730 2.7126 2.7436 2.7909 3.2680 3.4312 3.4565 3.4656 3.5450 3.5479 3.8037 3.8795 3.8959 3.9150 4.0204 4.0474 4.4776 4.4801 4.9868 5.0100 6.8940 6.8961 8.1461 8.1800 8.3844 8.3962 8.7538 8.8275 9.4804 9.5618 9.9676 9.9680 k =-0.0908 0.0787 0.6616 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5624 -8.5611 -7.7500 -7.7234 -7.5655 -7.5320 -7.4768 -7.3979 -6.9681 -6.9600 -6.8897 -6.8858 -6.8529 -6.8442 -2.8522 -2.8516 -0.0342 -0.0103 0.5917 0.6009 0.8235 0.8634 1.0729 1.0793 1.1555 1.2421 1.4541 1.4852 1.6165 1.6514 1.8904 1.9298 2.0004 2.0677 2.2863 2.2890 2.3639 2.3808 2.6616 2.7085 2.7327 2.7886 3.2046 3.3773 3.4270 3.4350 3.5443 3.5491 3.8220 3.8879 3.8899 3.9159 4.0372 4.0586 4.5200 4.5251 4.9701 4.9978 6.9033 6.9060 8.1515 8.1904 8.4097 8.4258 8.7446 8.8294 9.4298 9.5251 9.9439 9.9439 k =-0.1059 0.0918 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5606 -8.5592 -7.7525 -7.7221 -7.5689 -7.5372 -7.4752 -7.3919 -6.9717 -6.9628 -6.8888 -6.8836 -6.8534 -6.8442 -2.8578 -2.8572 -0.0124 0.0158 0.5971 0.6077 0.8285 0.8729 1.0673 1.0730 1.1595 1.2583 1.4592 1.4943 1.6035 1.6412 1.8891 1.9324 1.9946 2.0675 2.2858 2.2983 2.3665 2.3990 2.6491 2.7031 2.7210 2.7850 3.1420 3.3235 3.3956 3.4019 3.5434 3.5504 3.8331 3.8698 3.8943 3.9049 4.0670 4.0827 4.5660 4.5736 4.9511 4.9830 6.9140 6.9172 8.1579 8.2007 8.4369 8.4591 8.7363 8.8287 9.3796 9.4871 9.9172 9.9178 k =-0.1211 0.1049 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5585 -8.5569 -7.7550 -7.7211 -7.5721 -7.5435 -7.4727 -7.3871 -6.9751 -6.9657 -6.8878 -6.8811 -6.8537 -6.8445 -2.8642 -2.8635 0.0125 0.0453 0.6036 0.6155 0.8353 0.8834 1.0590 1.0651 1.1673 1.2757 1.4655 1.5041 1.5896 1.6291 1.8876 1.9340 1.9897 2.0659 2.2855 2.3092 2.3687 2.4198 2.6357 2.6961 2.7090 2.7801 3.0804 3.2703 3.3628 3.3670 3.5420 3.5515 3.8273 3.8593 3.8747 3.9072 4.1019 4.1127 4.6153 4.6247 4.9298 4.9660 6.9259 6.9296 8.1646 8.2102 8.4645 8.4955 8.7301 8.8247 9.3328 9.4501 9.8889 9.8904 k =-0.1362 0.1180 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5560 -8.5544 -7.7576 -7.7204 -7.5749 -7.5504 -7.4700 -7.3837 -6.9781 -6.9685 -6.8868 -6.8783 -6.8537 -6.8449 -2.8712 -2.8705 0.0404 0.0779 0.6110 0.6242 0.8439 0.8952 1.0485 1.0558 1.1786 1.2938 1.4724 1.5144 1.5751 1.6153 1.8858 1.9343 1.9860 2.0634 2.2857 2.3213 2.3706 2.4423 2.6214 2.6875 2.6972 2.7741 3.0203 3.2181 3.3290 3.3308 3.5399 3.5523 3.8015 3.8468 3.8634 3.9118 4.1378 4.1445 4.6675 4.6780 4.9066 4.9468 6.9386 6.9430 8.1708 8.2178 8.4902 8.5337 8.7281 8.8169 9.2922 9.4159 9.8601 9.8626 k =-0.1514 0.1311 0.6616 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.5532 -8.5516 -7.7601 -7.7200 -7.5774 -7.5573 -7.4675 -7.3819 -6.9804 -6.9710 -6.8858 -6.8752 -6.8534 -6.8454 -2.8788 -2.8781 0.0710 0.1135 0.6194 0.6337 0.8541 0.9082 1.0360 1.0451 1.1929 1.3124 1.4797 1.5249 1.5605 1.6004 1.8833 1.9329 1.9837 2.0602 2.2864 2.3339 2.3723 2.4660 2.6066 2.6772 2.6863 2.7672 2.9620 3.1671 3.2940 3.2947 3.5368 3.5526 3.7706 3.8162 3.8694 3.9150 4.1730 4.1762 4.7218 4.7328 4.8818 4.9257 6.9520 6.9570 8.1756 8.2220 8.5121 8.5724 8.7322 8.8057 9.2599 9.3859 9.8320 9.8358 k =-0.1665 0.1443 0.6616 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.5501 -8.5484 -7.7626 -7.7200 -7.5797 -7.5642 -7.4657 -7.3818 -6.9818 -6.9731 -6.8850 -6.8720 -6.8527 -6.8460 -2.8870 -2.8862 0.1041 0.1518 0.6288 0.6441 0.8659 0.9223 1.0223 1.0333 1.2097 1.3312 1.4858 1.5344 1.5471 1.5858 1.8796 1.9296 1.9831 2.0569 2.2876 2.3457 2.3745 2.4899 2.5915 2.6658 2.6764 2.7600 2.9058 3.1175 3.2568 3.2599 3.5326 3.5523 3.7383 3.7841 3.8744 3.9165 4.2068 4.2073 4.7773 4.7884 4.8563 4.9035 6.9658 6.9714 8.1777 8.2214 8.5295 8.6097 8.7434 8.7926 9.2370 9.3611 9.8063 9.8115 k =-0.1816 0.1574 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5466 -8.5449 -7.7650 -7.7205 -7.5818 -7.5708 -7.4646 -7.3836 -6.9823 -6.9746 -6.8842 -6.8688 -6.8515 -6.8465 -2.8956 -2.8948 0.1395 0.1926 0.6391 0.6554 0.8792 0.9370 1.0082 1.0207 1.2286 1.3497 1.4878 1.5383 1.5387 1.5762 1.8747 1.9239 1.9841 2.0538 2.2892 2.3546 2.3782 2.5124 2.5766 2.6542 2.6677 2.7531 2.8519 3.0694 3.2194 3.2249 3.5271 3.5510 3.7055 3.7510 3.8783 3.9166 4.2374 4.2390 4.8168 4.8407 4.8471 4.8841 6.9796 6.9857 8.1757 8.2146 8.5437 8.6435 8.7603 8.7805 9.2236 9.3420 9.7848 9.7913 k =-0.1968 0.1705 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5428 -8.5411 -7.7675 -7.7215 -7.5836 -7.5771 -7.4646 -7.3873 -6.9818 -6.9755 -6.8835 -6.8655 -6.8499 -6.8469 -2.9045 -2.9038 0.1768 0.2357 0.6503 0.6676 0.8935 0.9499 0.9966 1.0077 1.2493 1.3675 1.4813 1.5309 1.5382 1.5789 1.8686 1.9159 1.9868 2.0512 2.2912 2.3587 2.3840 2.5299 2.5644 2.6426 2.6611 2.7479 2.8007 3.0229 3.1823 3.1897 3.5203 3.5488 3.6727 3.7175 3.8809 3.9151 4.2663 4.2695 4.7950 4.8458 4.8994 4.9113 6.9930 6.9997 8.1685 8.2012 8.5573 8.6708 8.7732 8.7796 9.2187 9.3290 9.7694 9.7773 k =-0.2119 0.1836 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5386 -8.5370 -7.7699 -7.7230 -7.5852 -7.5829 -7.4656 -7.3928 -6.9802 -6.9756 -6.8829 -6.8625 -6.8478 -6.8467 -2.9138 -2.9130 0.2159 0.2808 0.6625 0.6806 0.9079 0.9525 0.9952 0.9961 1.2715 1.3837 1.4675 1.5158 1.5457 1.5899 1.8614 1.9054 1.9909 2.0492 2.2934 2.3591 2.3898 2.5317 2.5634 2.6308 2.6581 2.7465 2.7527 2.9782 3.1454 3.1545 3.5119 3.5455 3.6404 3.6838 3.8822 3.9120 4.2940 4.2983 4.7666 4.8218 4.9587 4.9674 7.0057 7.0128 8.1556 8.1822 8.5720 8.6891 8.7737 8.7975 9.2210 9.3219 9.7624 9.7715 k =-0.2270 0.1967 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5341 -8.5326 -7.7723 -7.7251 -7.5882 -7.5867 -7.4678 -7.4001 -6.9777 -6.9750 -6.8823 -6.8601 -6.8459 -6.8453 -2.9233 -2.9226 0.2565 0.3276 0.6756 0.6944 0.9202 0.9415 0.9855 1.0102 1.2949 1.3966 1.4502 1.5005 1.5571 1.6036 1.8534 1.8928 1.9960 2.0477 2.2958 2.3573 2.3928 2.5198 2.5695 2.6185 2.6589 2.7092 2.7510 2.9351 3.1088 3.1192 3.5018 3.5408 3.6092 3.6503 3.8818 3.9074 4.3206 4.3254 4.7378 4.7956 5.0189 5.0255 7.0171 7.0246 8.1375 8.1592 8.5880 8.6990 8.7811 8.8110 9.2290 9.3207 9.7655 9.7757 k =-0.2422 0.2098 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5293 -8.5279 -7.7747 -7.7276 -7.5931 -7.5880 -7.4711 -7.4090 -6.9744 -6.9737 -6.8815 -6.8584 -6.8440 -6.8424 -2.9329 -2.9322 0.2983 0.3759 0.6895 0.7090 0.9248 0.9252 0.9840 1.0306 1.3192 1.4031 1.4315 1.4898 1.5705 1.6185 1.8448 1.8784 2.0019 2.0465 2.2981 2.3537 2.3920 2.5049 2.5707 2.6057 2.6519 2.6830 2.7629 2.8939 3.0727 3.0839 3.4897 3.5345 3.5798 3.6175 3.8795 3.9010 4.3458 4.3511 4.7094 4.7691 5.0792 5.0838 7.0268 7.0346 8.1157 8.1344 8.6042 8.7037 8.7911 8.8186 9.2417 9.3249 9.7803 9.7910 k =-0.2573 0.2230 0.6616 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.5243 -8.5230 -7.7771 -7.7307 -7.5974 -7.5892 -7.4754 -7.4193 -6.9717 -6.9706 -6.8805 -6.8575 -6.8411 -6.8392 -2.9426 -2.9420 0.3410 0.4254 0.7042 0.7243 0.9074 0.9184 0.9941 1.0536 1.3440 1.3993 1.4125 1.4878 1.5852 1.6338 1.8361 1.8625 2.0084 2.0454 2.3003 2.3486 2.3872 2.4896 2.5652 2.5925 2.6201 2.6910 2.7812 2.8548 3.0370 3.0487 3.4748 3.5258 3.5532 3.5866 3.8751 3.8927 4.3699 4.3752 4.6822 4.7431 5.1392 5.1419 7.0343 7.0422 8.0922 8.1103 8.6189 8.7039 8.8015 8.8201 9.2585 9.3344 9.8070 9.8178 k =-0.2724 0.2361 0.6616 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5190 -8.5178 -7.7794 -7.7343 -7.6013 -7.5903 -7.4807 -7.4306 -6.9692 -6.9666 -6.8791 -6.8569 -6.8374 -6.8357 -2.9523 -2.9517 0.3844 0.4756 0.7198 0.7402 0.8893 0.9055 1.0112 1.0778 1.3665 1.3859 1.3963 1.4942 1.6008 1.6491 1.8277 1.8454 2.0151 2.0442 2.3022 2.3418 2.3795 2.4742 2.5547 2.5775 2.5883 2.7094 2.8002 2.8214 3.0021 3.0135 3.4567 3.5128 3.5304 3.5596 3.8681 3.8824 4.3926 4.3978 4.6567 4.7183 5.1986 5.1994 7.0392 7.0470 8.0694 8.0888 8.6294 8.6980 8.8125 8.8171 9.2793 9.3487 9.8450 9.8556 k =-0.2876 0.2492 0.6616 ( 7100 PWs) bands (ev): -23.9414 -23.9414 -8.5134 -8.5124 -7.7816 -7.7383 -7.6047 -7.5913 -7.4867 -7.4427 -6.9663 -6.9625 -6.8773 -6.8565 -6.8334 -6.8320 -2.9618 -2.9613 0.4282 0.5263 0.7362 0.7566 0.8716 0.8901 1.0312 1.1027 1.3654 1.3671 1.4043 1.5049 1.6171 1.6637 1.8203 1.8275 2.0218 2.0429 2.3037 2.3329 2.3702 2.4588 2.5413 2.5524 2.5698 2.7322 2.7775 2.8334 2.9686 2.9789 3.4353 3.4929 3.5118 3.5396 3.8582 3.8697 4.4140 4.4191 4.6334 4.6949 5.2560 5.2569 7.0410 7.0487 8.0492 8.0718 8.6328 8.6844 8.8124 8.8251 9.3040 9.3674 9.8930 9.9032 k =-0.3027 0.2623 0.6616 ( 7094 PWs) bands (ev): -23.9414 -23.9414 -8.5078 -8.5069 -7.7838 -7.7427 -7.6077 -7.5924 -7.4933 -7.4554 -6.9633 -6.9586 -6.8751 -6.8559 -6.8291 -6.8282 -2.9712 -2.9707 0.4721 0.5769 0.7533 0.7727 0.8552 0.8741 1.0521 1.1273 1.3459 1.3479 1.4296 1.5168 1.6338 1.6765 1.8091 1.8150 2.0284 2.0411 2.3045 2.3217 2.3603 2.4434 2.5257 2.5269 2.5572 2.7436 2.7568 2.8557 2.9398 2.9457 3.4116 3.4669 3.4969 3.5259 3.8450 3.8546 4.4341 4.4389 4.6129 4.6735 5.3114 5.3139 7.0396 7.0470 8.0336 8.0605 8.6267 8.6633 8.8088 8.8388 9.3323 9.3899 9.9489 9.9587 k =-0.3178 0.2754 0.6616 ( 7102 PWs) bands (ev): -23.9414 -23.9414 -8.5020 -8.5014 -7.7859 -7.7474 -7.6105 -7.5936 -7.5002 -7.4682 -6.9601 -6.9551 -6.8723 -6.8551 -6.8247 -6.8242 -2.9802 -2.9799 0.5158 0.6268 0.7705 0.7866 0.8424 0.8591 1.0728 1.1507 1.3239 1.3295 1.4570 1.5286 1.6507 1.6866 1.7906 1.8132 2.0346 2.0390 2.3045 2.3078 2.3511 2.4276 2.5020 2.5127 2.5459 2.7108 2.7800 2.8616 2.9163 2.9292 3.3870 3.4385 3.4847 3.5154 3.8284 3.8367 4.4528 4.4573 4.5955 4.6543 5.3653 5.3691 7.0350 7.0419 8.0236 8.0557 8.6105 8.6362 8.8074 8.8525 9.3638 9.4154 10.0096 10.0206 k =-0.3330 0.2885 0.6616 ( 7098 PWs) bands (ev): -23.9414 -23.9414 -8.4963 -8.4958 -7.7879 -7.7523 -7.6130 -7.5948 -7.5072 -7.4809 -6.9571 -6.9520 -6.8691 -6.8540 -6.8203 -6.8202 -2.9890 -2.9886 0.5591 0.6750 0.7861 0.7921 0.8395 0.8479 1.0920 1.1715 1.3022 1.3126 1.4848 1.5391 1.6677 1.6931 1.7726 1.8161 2.0365 2.0402 2.2919 2.3036 2.3430 2.4112 2.4815 2.4999 2.5358 2.6794 2.7943 2.8407 2.8980 2.9465 3.3625 3.4099 3.4746 3.5062 3.8083 3.8161 4.4702 4.4743 4.5813 4.6376 5.4173 5.4223 7.0272 7.0338 8.0203 8.0580 8.5861 8.6050 8.8074 8.8646 9.3972 9.4427 10.0490 10.0867 k =-0.3330 0.2885 0.6616 ( 7098 PWs) bands (ev): -23.9414 -23.9414 -8.4963 -8.4958 -7.7879 -7.7523 -7.6130 -7.5948 -7.5072 -7.4809 -6.9571 -6.9520 -6.8691 -6.8540 -6.8203 -6.8202 -2.9890 -2.9886 0.5591 0.6750 0.7861 0.7921 0.8395 0.8479 1.0920 1.1715 1.3022 1.3126 1.4848 1.5391 1.6677 1.6931 1.7726 1.8161 2.0365 2.0402 2.2919 2.3036 2.3430 2.4112 2.4815 2.4999 2.5358 2.6794 2.7943 2.8407 2.8980 2.9465 3.3625 3.4099 3.4746 3.5062 3.8083 3.8161 4.4702 4.4743 4.5813 4.6376 5.4173 5.4223 7.0272 7.0338 8.0203 8.0580 8.5861 8.6050 8.8074 8.8646 9.3972 9.4427 10.0490 10.0867 k =-0.3434 0.2976 0.6478 ( 7106 PWs) bands (ev): -23.9414 -23.9414 -8.4926 -8.4921 -7.7891 -7.7556 -7.6145 -7.5954 -7.5119 -7.4894 -6.9551 -6.9502 -6.8671 -6.8537 -6.8172 -6.8170 -2.9946 -2.9943 0.5875 0.7045 0.7894 0.7940 0.8453 0.8483 1.1022 1.1827 1.2864 1.3030 1.5021 1.5453 1.6785 1.6961 1.7615 1.8223 2.0348 2.0443 2.2796 2.3028 2.3390 2.4001 2.4694 2.4929 2.5293 2.6586 2.7923 2.8214 2.8971 2.9637 3.3461 3.3914 3.4681 3.5015 3.7933 3.8012 4.4760 4.4824 4.5776 4.6307 5.4507 5.4562 7.0210 7.0273 8.0233 8.0652 8.5590 8.5830 8.8071 8.8757 9.4206 9.4633 9.9952 10.0568 k =-0.3539 0.3066 0.6340 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.4893 -8.4890 -7.7900 -7.7586 -7.6159 -7.5951 -7.5162 -7.4975 -6.9533 -6.9486 -6.8658 -6.8541 -6.8139 -6.8136 -2.9998 -2.9995 0.6132 0.7266 0.7851 0.7971 0.8514 0.8659 1.1064 1.1908 1.2670 1.2977 1.5157 1.5512 1.6866 1.6982 1.7532 1.8325 2.0338 2.0486 2.2665 2.3022 2.3373 2.3899 2.4591 2.4876 2.5235 2.6387 2.7802 2.8038 2.9047 2.9795 3.3307 3.3755 3.4619 3.4988 3.7788 3.7867 4.4733 4.4831 4.5830 4.6310 5.4802 5.4861 7.0150 7.0212 8.0320 8.0787 8.5242 8.5560 8.8089 8.8894 9.4440 9.4869 9.9296 9.9913 k =-0.3643 0.3157 0.6202 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.4866 -8.4863 -7.7907 -7.7613 -7.6170 -7.5943 -7.5199 -7.5051 -6.9516 -6.9473 -6.8650 -6.8548 -6.8106 -6.8102 -3.0043 -3.0041 0.6354 0.7409 0.7804 0.7962 0.8645 0.8927 1.1031 1.1969 1.2441 1.2970 1.5259 1.5567 1.6909 1.6990 1.7490 1.8452 2.0334 2.0527 2.2533 2.3022 2.3381 2.3809 2.4508 2.4827 2.5194 2.6196 2.7632 2.7883 2.9167 2.9926 3.3171 3.3623 3.4563 3.4975 3.7654 3.7730 4.4662 4.4780 4.5934 4.6363 5.5055 5.5117 7.0094 7.0156 8.0461 8.0979 8.4871 8.5226 8.8130 8.9024 9.4678 9.5130 9.8667 9.9295 k =-0.3747 0.3247 0.6063 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4844 -8.4841 -7.7911 -7.7636 -7.6180 -7.5930 -7.5231 -7.5118 -6.9501 -6.9462 -6.8644 -6.8558 -6.8075 -6.8072 -3.0081 -3.0079 0.6537 0.7490 0.7760 0.7941 0.8828 0.9254 1.0925 1.2017 1.2188 1.2994 1.5333 1.5615 1.6918 1.6980 1.7493 1.8587 2.0339 2.0562 2.2409 2.3027 2.3407 2.3733 2.4444 2.4771 2.5181 2.6015 2.7461 2.7745 2.9299 3.0021 3.3060 3.3518 3.4517 3.4971 3.7536 3.7606 4.4583 4.4704 4.6048 4.6438 5.5265 5.5328 7.0045 7.0108 8.0645 8.1221 8.4495 8.4852 8.8181 8.9135 9.4928 9.5413 9.8081 9.8720 k =-0.3852 0.3337 0.5925 ( 7113 PWs) bands (ev): -23.9414 -23.9414 -8.4827 -8.4824 -7.7914 -7.7654 -7.6187 -7.5915 -7.5256 -7.5176 -6.9488 -6.9454 -6.8639 -6.8568 -6.8050 -6.8047 -3.0112 -3.0110 0.6678 0.7531 0.7719 0.7924 0.9042 0.9606 1.0766 1.1869 1.2100 1.3032 1.5385 1.5652 1.6907 1.6956 1.7525 1.8713 2.0353 2.0585 2.2302 2.3036 2.3444 2.3670 2.4399 2.4706 2.5203 2.5848 2.7309 2.7629 2.9424 3.0079 3.2977 3.3440 3.4481 3.4973 3.7439 3.7499 4.4513 4.4626 4.6150 4.6512 5.5429 5.5492 7.0004 7.0068 8.0855 8.1499 8.4134 8.4463 8.8229 8.9223 9.5197 9.5714 9.7542 9.8189 k =-0.3956 0.3428 0.5787 ( 7109 PWs) bands (ev): -23.9414 -23.9414 -8.4814 -8.4812 -7.7916 -7.7668 -7.6192 -7.5901 -7.5274 -7.5221 -6.9478 -6.9449 -6.8635 -6.8577 -6.8031 -6.8029 -3.0134 -3.0133 0.6777 0.7556 0.7678 0.7916 0.9270 0.9945 1.0597 1.1564 1.2139 1.3068 1.5421 1.5678 1.6887 1.6933 1.7562 1.8814 2.0372 2.0594 2.2223 2.3048 2.3484 2.3622 2.4373 2.4639 2.5256 2.5695 2.7191 2.7541 2.9528 3.0106 3.2922 3.3387 3.4455 3.4977 3.7370 3.7414 4.4462 4.4561 4.6228 4.6573 5.5546 5.5610 6.9973 7.0038 8.1066 8.1788 8.3817 8.4091 8.8269 8.9287 9.5491 9.6031 9.7055 9.7704 k =-0.4061 0.3518 0.5649 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.4807 -8.4804 -7.7916 -7.7677 -7.6195 -7.5891 -7.5284 -7.5251 -6.9472 -6.9447 -6.8633 -6.8583 -6.8020 -6.8017 -3.0147 -3.0147 0.6836 0.7578 0.7639 0.7913 0.9480 1.0144 1.0556 1.1249 1.2168 1.3093 1.5443 1.5692 1.6870 1.6919 1.7589 1.8881 2.0391 2.0591 2.2174 2.3058 2.3518 2.3586 2.4364 2.4585 2.5335 2.5557 2.7115 2.7487 2.9600 3.0112 3.2891 3.3356 3.4439 3.4980 3.7331 3.7356 4.4431 4.4518 4.6277 4.6611 5.5617 5.5680 6.9954 7.0020 8.1232 8.2038 8.3587 8.3791 8.8294 8.9325 9.5814 9.6329 9.6647 9.7271 k =-0.4165 0.3609 0.5511 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4805 -8.4802 -7.7916 -7.7679 -7.6196 -7.5887 -7.5286 -7.5262 -6.9470 -6.9446 -6.8631 -6.8585 -6.8016 -6.8014 -3.0152 -3.0151 0.6856 0.7603 0.7608 0.7913 0.9582 1.0130 1.0692 1.1042 1.2178 1.3102 1.5450 1.5696 1.6863 1.6915 1.7599 1.8904 2.0399 2.0589 2.2157 2.3062 2.3537 2.3567 2.4363 2.4564 2.5434 2.5439 2.7090 2.7469 2.9626 3.0112 3.2881 3.3346 3.4434 3.4981 3.7321 3.7333 4.4421 4.4502 4.6293 4.6625 5.5640 5.5704 6.9947 7.0014 8.1298 8.2146 8.3501 8.3665 8.8302 8.9337 9.6162 9.6164 9.6662 9.7001 k =-0.4165 0.3609 0.5511 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4805 -8.4802 -7.7916 -7.7679 -7.6196 -7.5887 -7.5286 -7.5262 -6.9470 -6.9446 -6.8631 -6.8585 -6.8016 -6.8014 -3.0152 -3.0151 0.6856 0.7603 0.7608 0.7913 0.9582 1.0130 1.0692 1.1042 1.2178 1.3102 1.5450 1.5696 1.6863 1.6915 1.7599 1.8904 2.0399 2.0589 2.2157 2.3062 2.3537 2.3567 2.4363 2.4564 2.5434 2.5439 2.7090 2.7469 2.9626 3.0112 3.2881 3.3346 3.4434 3.4981 3.7321 3.7333 4.4421 4.4502 4.6293 4.6625 5.5640 5.5704 6.9947 7.0014 8.1298 8.2146 8.3501 8.3665 8.8302 8.9337 9.6162 9.6164 9.6662 9.7001 k =-0.4058 0.3516 0.5370 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.4867 -8.4864 -7.7893 -7.7625 -7.6171 -7.5815 -7.5227 -7.5193 -6.9480 -6.9451 -6.8703 -6.8651 -6.8027 -6.8026 -3.0090 -3.0089 0.6483 0.7300 0.7742 0.8021 0.9395 1.0017 1.0613 1.0995 1.2151 1.2988 1.5141 1.5669 1.6844 1.6976 1.7591 1.8850 2.0439 2.0647 2.2263 2.3140 2.3668 2.3722 2.4496 2.4597 2.5531 2.5626 2.7346 2.7787 2.9265 2.9781 3.3011 3.3563 3.4467 3.5117 3.7630 3.7685 4.4120 4.4211 4.6493 4.6854 5.5199 5.5256 7.0131 7.0203 8.1285 8.2136 8.3510 8.3661 8.8496 8.9501 9.5792 9.6576 9.6885 9.7223 k =-0.3951 0.3424 0.5228 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4935 -8.4932 -7.7866 -7.7567 -7.6142 -7.5737 -7.5161 -7.5117 -6.9491 -6.9456 -6.8783 -6.8725 -6.8036 -6.8032 -3.0026 -3.0025 0.6112 0.6930 0.7897 0.8191 0.9211 0.9870 1.0533 1.0913 1.2128 1.2856 1.4786 1.5530 1.6885 1.7124 1.7626 1.8814 2.0478 2.0709 2.2378 2.3218 2.3760 2.3889 2.4618 2.4647 2.5652 2.5837 2.7611 2.8111 2.8914 2.9449 3.3144 3.3769 3.4517 3.5269 3.7930 3.8028 4.3796 4.3897 4.6718 4.7106 5.4732 5.4776 7.0321 7.0398 8.1313 8.2172 8.3523 8.3665 8.8656 8.9625 9.5340 9.6175 9.7616 9.7903 k =-0.3845 0.3331 0.5087 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.5009 -8.5006 -7.7836 -7.7507 -7.6110 -7.5656 -7.5090 -7.5034 -6.9505 -6.9462 -6.8872 -6.8806 -6.8043 -6.8034 -2.9960 -2.9958 0.5744 0.6547 0.8063 0.8363 0.9045 0.9701 1.0437 1.0796 1.2112 1.2718 1.4414 1.5306 1.7017 1.7272 1.7711 1.8792 2.0517 2.0774 2.2500 2.3298 2.3843 2.4027 2.4633 2.4816 2.5799 2.6063 2.7881 2.8423 2.8577 2.9135 3.3271 3.3947 3.4590 3.5437 3.8221 3.8357 4.3453 4.3564 4.6968 4.7378 5.4248 5.4273 7.0511 7.0594 8.1377 8.2249 8.3542 8.3680 8.8786 8.9721 9.4885 9.5749 9.8393 9.8622 k =-0.3738 0.3239 0.4946 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5088 -8.5084 -7.7803 -7.7444 -7.6075 -7.5570 -7.5014 -7.4945 -6.9521 -6.9468 -6.8967 -6.8891 -6.8046 -6.8033 -2.9894 -2.9891 0.5384 0.6159 0.8238 0.8472 0.8955 0.9517 1.0313 1.0644 1.2107 1.2590 1.4040 1.5037 1.7202 1.7396 1.7854 1.8783 2.0551 2.0842 2.2629 2.3379 2.3917 2.4135 2.4647 2.4999 2.5971 2.6295 2.8149 2.8264 2.8593 2.8969 3.3387 3.4080 3.4699 3.5618 3.8499 3.8671 4.3096 4.3216 4.7241 4.7668 5.3756 5.3757 7.0696 7.0782 8.1470 8.2358 8.3575 8.3710 8.8892 8.9799 9.4443 9.5318 9.9182 9.9360 k =-0.3631 0.3146 0.4804 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5171 -8.5167 -7.7768 -7.7380 -7.6037 -7.5482 -7.4934 -7.4851 -6.9539 -6.9473 -6.9066 -6.8977 -6.8047 -6.8028 -2.9829 -2.9826 0.5032 0.5774 0.8410 0.8411 0.9044 0.9329 1.0156 1.0463 1.2113 1.2481 1.3672 1.4752 1.7415 1.7495 1.8046 1.8787 2.0581 2.0911 2.2762 2.3463 2.3979 2.4214 2.4664 2.5190 2.6163 2.6527 2.7966 2.8383 2.8428 2.9195 3.3489 3.4156 3.4847 3.5807 3.8763 3.8967 4.2728 4.2856 4.7535 4.7974 5.3236 5.3265 7.0866 7.0954 8.1582 8.2484 8.3635 8.3764 8.8978 8.9870 9.4022 9.4886 9.9942 10.0102 k =-0.3524 0.3054 0.4663 ( 7106 PWs) bands (ev): -23.9414 -23.9414 -8.5258 -8.5254 -7.7731 -7.7314 -7.5997 -7.5392 -7.4850 -7.4753 -6.9562 -6.9477 -6.9169 -6.9061 -6.8046 -6.8022 -2.9766 -2.9762 0.4692 0.5394 0.8240 0.8555 0.9161 0.9241 0.9970 1.0266 1.2129 1.2398 1.3317 1.4466 1.7581 1.7639 1.8271 1.8806 2.0605 2.0981 2.2899 2.3547 2.4026 2.4269 2.4689 2.5383 2.6366 2.6751 2.7707 2.8100 2.8699 2.9511 3.3573 3.4180 3.5021 3.6001 3.9012 3.9244 4.2356 4.2489 4.7845 4.8293 5.2721 5.2784 7.1014 7.1104 8.1704 8.2609 8.3743 8.3850 8.9052 8.9941 9.3622 9.4454 10.0341 10.0356 k =-0.3417 0.2961 0.4522 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5348 -8.5345 -7.7692 -7.7247 -7.5954 -7.5300 -7.4763 -7.4653 -6.9591 -6.9481 -6.9271 -6.9139 -6.8043 -6.8014 -2.9707 -2.9702 0.4364 0.5022 0.8034 0.8582 0.9082 0.9435 0.9774 1.0091 1.2155 1.2338 1.2978 1.4190 1.7661 1.7858 1.8513 1.8846 2.0622 2.1051 2.3036 2.3628 2.4054 2.4307 2.4728 2.5571 2.6569 2.6955 2.7489 2.7832 2.8969 2.9837 3.3638 3.4160 3.5209 3.6196 3.9245 3.9500 4.1985 4.2119 4.8168 4.8621 5.2221 5.2323 7.1131 7.1221 8.1831 8.2719 8.3913 8.3976 8.9118 9.0022 9.3236 9.4014 9.9826 10.0024 k =-0.3311 0.2869 0.4380 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5441 -8.5438 -7.7652 -7.7180 -7.5909 -7.5208 -7.4674 -7.4551 -6.9628 -6.9485 -6.9373 -6.9206 -6.8039 -6.8004 -2.9652 -2.9646 0.4052 0.4661 0.7812 0.8433 0.9097 0.9476 0.9633 1.0074 1.2189 1.2295 1.2661 1.3934 1.7739 1.8053 1.8765 1.8919 2.0633 2.1119 2.3170 2.3701 2.4065 2.4331 2.4783 2.5746 2.6760 2.7117 2.7326 2.7610 2.9239 3.0165 3.3681 3.4096 3.5402 3.6387 3.9461 3.9734 4.1622 4.1754 4.8500 4.8953 5.1744 5.1889 7.1209 7.1300 8.1962 8.2817 8.4143 8.4149 8.9184 9.0121 9.2853 9.3555 9.9331 9.9647 k =-0.3204 0.2776 0.4239 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5537 -8.5534 -7.7610 -7.7114 -7.5862 -7.5115 -7.4585 -7.4449 -6.9672 -6.9486 -6.9471 -6.9262 -6.8034 -6.7993 -2.9603 -2.9596 0.3755 0.4313 0.7581 0.8193 0.9001 0.9299 0.9667 1.0277 1.2223 1.2260 1.2374 1.3707 1.7815 1.8205 1.9022 1.9038 2.0643 2.1185 2.3295 2.3753 2.4065 2.4346 2.4855 2.5897 2.6922 2.7156 2.7241 2.7519 2.9510 3.0494 3.3702 3.3987 3.5596 3.6569 3.9658 3.9946 4.1276 4.1399 4.8834 4.9285 5.1298 5.1488 7.1243 7.1332 8.2101 8.2916 8.4350 8.4438 8.9256 9.0245 9.2454 9.3065 9.8890 9.9316 k =-0.3097 0.2683 0.4098 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.5635 -8.5632 -7.7568 -7.7049 -7.5812 -7.5023 -7.4497 -7.4349 -6.9724 -6.9564 -6.9486 -6.9303 -6.8029 -6.7981 -2.9561 -2.9552 0.3476 0.3979 0.7341 0.7914 0.8790 0.9043 0.9842 1.0559 1.2075 1.2219 1.2301 1.3519 1.7889 1.8305 1.9200 1.9279 2.0656 2.1249 2.3407 2.3761 2.4072 2.4357 2.4943 2.6009 2.7039 2.7045 2.7260 2.7585 2.9783 3.0826 3.3700 3.3831 3.5789 3.6739 3.9835 4.0135 4.0957 4.1064 4.9163 4.9611 5.0889 5.1125 7.1227 7.1315 8.2257 8.3036 8.4587 8.4763 8.9342 9.0401 9.2021 9.2533 9.8523 9.9054 k =-0.2990 0.2591 0.3957 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.5735 -8.5732 -7.7525 -7.6985 -7.5760 -7.4932 -7.4412 -7.4252 -6.9779 -6.9649 -6.9485 -6.9332 -6.8022 -6.7968 -2.9525 -2.9516 0.3216 0.3661 0.7095 0.7607 0.8545 0.8762 1.0065 1.0861 1.1840 1.2159 1.2356 1.3382 1.7961 1.8361 1.9383 1.9533 2.0686 2.1309 2.3497 2.3710 2.4097 2.4366 2.5050 2.6082 2.6915 2.7142 2.7349 2.7678 3.0064 3.1161 3.3624 3.3675 3.5978 3.6891 3.9986 4.0290 4.0676 4.0768 4.9481 4.9923 5.0523 5.0803 7.1162 7.1249 8.2437 8.3193 8.4847 8.5108 8.9448 9.0595 9.1540 9.1954 9.8243 9.8871 k =-0.2883 0.2498 0.3815 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5835 -8.5833 -7.7481 -7.6923 -7.5707 -7.4842 -7.4331 -7.4160 -6.9832 -6.9726 -6.9481 -6.9351 -6.8016 -6.7955 -2.9498 -2.9488 0.2977 0.3361 0.6845 0.7280 0.8294 0.8474 1.0307 1.1129 1.1668 1.2070 1.2423 1.3304 1.8030 1.8390 1.9552 1.9777 2.0751 2.1367 2.3560 2.3609 2.4125 2.4379 2.5177 2.6132 2.6810 2.7276 2.7442 2.7751 3.0355 3.1502 3.3370 3.3629 3.6160 3.7021 4.0088 4.0335 4.0466 4.0596 4.9777 5.0206 5.0216 5.0525 7.1050 7.1135 8.2646 8.3394 8.5119 8.5459 8.9583 9.0832 9.1002 9.1331 9.8059 9.8767 k =-0.2777 0.2406 0.3674 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5937 -8.5934 -7.7437 -7.6864 -7.5651 -7.4754 -7.4255 -7.4075 -6.9880 -6.9792 -6.9475 -6.9361 -6.8009 -6.7942 -2.9479 -2.9467 0.2758 0.3078 0.6591 0.6940 0.8047 0.8185 1.0557 1.1191 1.1730 1.1953 1.2500 1.3281 1.8096 1.8401 1.9673 2.0008 2.0871 2.1423 2.3471 2.3593 2.4142 2.4393 2.5328 2.6184 2.6734 2.7435 2.7512 2.7797 3.0661 3.1851 3.3074 3.3564 3.6330 3.7121 4.0064 4.0177 4.0412 4.0657 4.9891 5.0090 5.0278 5.0491 7.0896 7.0980 8.2885 8.3643 8.5395 8.5800 8.9753 9.0412 9.0662 9.1123 9.7969 9.8737 k =-0.2670 0.2313 0.3533 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6038 -8.6036 -7.7393 -7.6808 -7.5594 -7.4668 -7.4187 -7.3998 -6.9919 -6.9845 -6.9465 -6.9366 -6.8003 -6.7929 -2.9468 -2.9456 0.2562 0.2813 0.6337 0.6590 0.7805 0.7898 1.0809 1.1054 1.1813 1.2011 1.2588 1.3304 1.8159 1.8401 1.9731 2.0219 2.1054 2.1478 2.3302 2.3599 2.4140 2.4404 2.5503 2.6254 2.6677 2.7531 2.7627 2.7822 3.0987 3.2210 3.2744 3.3485 3.6484 3.7184 3.9954 4.0016 4.0479 4.0761 4.9675 5.0081 5.0314 5.0723 7.0708 7.0790 8.3148 8.3935 8.5668 8.6123 8.9748 8.9979 8.9999 9.1452 9.7964 9.8771 k =-0.2563 0.2221 0.3391 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.6140 -8.6138 -7.7349 -7.6756 -7.5536 -7.4585 -7.4128 -7.3930 -6.9947 -6.9884 -6.9453 -6.9365 -6.7997 -6.7916 -2.9466 -2.9453 0.2388 0.2567 0.6084 0.6235 0.7569 0.7618 1.0884 1.1059 1.1663 1.2325 1.2702 1.3362 1.8218 1.8392 1.9735 2.0404 2.1284 2.1534 2.3110 2.3586 2.4118 2.4406 2.5702 2.6349 2.6622 2.7523 2.7811 2.7837 3.1336 3.2397 3.2578 3.3399 3.6615 3.7205 3.9867 3.9912 4.0565 4.0857 4.9484 4.9917 5.0514 5.0918 7.0494 7.0574 8.3430 8.4262 8.5928 8.6420 8.9105 8.9300 9.0249 9.1827 9.8031 9.8860 k =-0.2456 0.2128 0.3250 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.6241 -8.6239 -7.7306 -7.6708 -7.5475 -7.4506 -7.4078 -7.3873 -6.9961 -6.9909 -6.9437 -6.9359 -6.7991 -6.7903 -2.9473 -2.9459 0.2238 0.2340 0.5834 0.5880 0.7340 0.7347 1.0717 1.1298 1.1515 1.2585 1.2889 1.3444 1.8273 1.8377 1.9703 2.0554 2.1537 2.1594 2.2900 2.3562 2.4077 2.4394 2.5917 2.6466 2.6554 2.7467 2.7866 2.8001 3.1691 3.2066 3.2938 3.3328 3.6716 3.7184 3.9832 3.9877 4.0646 4.0940 4.9328 4.9783 5.0669 5.1066 7.0261 7.0339 8.3718 8.4602 8.6145 8.6688 8.8457 8.8673 9.0561 9.2241 9.8156 9.8991 k =-0.2349 0.2036 0.3109 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6341 -8.6339 -7.7263 -7.6664 -7.5413 -7.4430 -7.4039 -7.3827 -6.9961 -6.9918 -6.9418 -6.9349 -6.7986 -6.7892 -2.9488 -2.9473 0.2112 0.2132 0.5527 0.5589 0.7086 0.7118 1.0558 1.1326 1.1571 1.2742 1.3187 1.3543 1.8322 1.8358 1.9648 2.0664 2.1659 2.1790 2.2676 2.3539 2.4017 2.4364 2.6105 2.6494 2.6592 2.7372 2.7927 2.8195 3.1648 3.2176 3.3097 3.3469 3.6784 3.7126 3.9854 3.9906 4.0717 4.1009 4.9202 4.9675 5.0773 5.1164 7.0016 7.0090 8.3998 8.4909 8.6244 8.6927 8.7870 8.8202 9.0918 9.2689 9.8325 9.9154 k =-0.2243 0.1943 0.2967 ( 7104 PWs) bands (ev): -23.9414 -23.9414 -8.6440 -8.6438 -7.7221 -7.6625 -7.5350 -7.4359 -7.4010 -7.3793 -6.9946 -6.9913 -6.9394 -6.9334 -6.7982 -6.7881 -2.9512 -2.9496 0.1943 0.2010 0.5179 0.5353 0.6836 0.6905 1.0409 1.1178 1.1800 1.2856 1.3534 1.3652 1.8335 1.8364 1.9581 2.0730 2.1728 2.2021 2.2442 2.3528 2.3942 2.4316 2.6105 2.6594 2.6684 2.7270 2.8034 2.8398 3.1340 3.2610 3.3019 3.3864 3.6821 3.7043 3.9932 3.9992 4.0776 4.1065 4.9102 4.9587 5.0820 5.1206 6.9762 6.9831 8.4249 8.5088 8.6101 8.7144 8.7453 8.8040 9.1311 9.3161 9.8525 9.9338 k =-0.2136 0.1851 0.2826 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.6537 -8.6536 -7.7181 -7.6591 -7.5286 -7.4292 -7.3991 -7.3771 -6.9916 -6.9893 -6.9366 -6.9316 -6.7979 -6.7871 -2.9543 -2.9527 0.1772 0.1934 0.4838 0.5128 0.6599 0.6700 1.0268 1.1025 1.2026 1.2958 1.3769 1.3893 1.8309 1.8398 1.9507 2.0749 2.1797 2.2203 2.2205 2.3543 2.3850 2.4247 2.5928 2.6645 2.6843 2.7260 2.8192 2.8615 3.1053 3.2908 3.3089 3.4309 3.6828 3.6945 4.0059 4.0123 4.0826 4.1108 4.9022 4.9514 5.0808 5.1190 6.9498 6.9560 8.4421 8.4997 8.5770 8.7334 8.7366 8.8200 9.1731 9.3650 9.8747 9.9536 k =-0.2029 0.1758 0.2685 ( 7084 PWs) bands (ev): -23.9414 -23.9414 -8.6632 -8.6631 -7.7141 -7.6562 -7.5221 -7.4230 -7.3982 -7.3759 -6.9873 -6.9860 -6.9334 -6.9293 -6.7977 -6.7863 -2.9581 -2.9564 0.1618 0.1882 0.4506 0.4916 0.6375 0.6504 1.0137 1.0875 1.2243 1.3056 1.3888 1.4253 1.8282 1.8421 1.9432 2.0725 2.1837 2.1988 2.2326 2.3597 2.3744 2.4157 2.5697 2.6442 2.7128 2.7375 2.8403 2.8853 3.0804 3.2787 3.3603 3.4784 3.6813 3.6844 4.0226 4.0289 4.0866 4.1139 4.8957 4.9450 5.0736 5.1115 6.9222 6.9276 8.4381 8.4637 8.5530 8.7526 8.7595 8.8545 9.2167 9.4147 9.8982 9.9740 k =-0.1922 0.1666 0.2543 ( 7100 PWs) bands (ev): -23.9414 -23.9414 -8.6724 -8.6723 -7.7104 -7.6539 -7.5156 -7.4175 -7.3981 -7.3757 -6.9818 -6.9815 -6.9297 -6.9267 -6.7976 -6.7857 -2.9625 -2.9608 0.1481 0.1855 0.4184 0.4721 0.6165 0.6317 1.0012 1.0727 1.2447 1.3150 1.4007 1.4611 1.8255 1.8428 1.9356 2.0656 2.1681 2.1966 2.2373 2.3624 2.3688 2.4047 2.5448 2.6154 2.7418 2.7546 2.8667 2.9119 3.0595 3.2659 3.4148 3.5283 3.6744 3.6780 4.0423 4.0480 4.0898 4.1159 4.8899 4.9391 5.0605 5.0981 6.8926 6.8971 8.4050 8.4154 8.5560 8.7723 8.8004 8.8986 9.2612 9.4644 9.9221 9.9944 k =-0.1815 0.1573 0.2402 ( 7100 PWs) bands (ev): -23.9415 -23.9415 -8.6814 -8.6813 -7.7067 -7.6520 -7.5090 -7.4126 -7.3986 -7.3763 -6.9759 -6.9753 -6.9255 -6.9236 -6.7977 -6.7852 -2.9675 -2.9658 0.1358 0.1852 0.3874 0.4544 0.5969 0.6141 0.9895 1.0584 1.2634 1.3237 1.4123 1.4965 1.8230 1.8415 1.9282 2.0545 2.1455 2.2017 2.2356 2.3492 2.3788 2.3926 2.5201 2.5832 2.7697 2.7735 2.8986 2.9418 3.0424 3.2525 3.4720 3.5808 3.6650 3.6736 4.0641 4.0690 4.0928 4.1171 4.8845 4.9333 5.0418 5.0792 6.8605 6.8639 8.3598 8.3654 8.5740 8.7918 8.8507 8.9485 9.3058 9.5131 9.9460 10.0144 k =-0.1709 0.1481 0.2261 ( 7108 PWs) bands (ev): -23.9415 -23.9415 -8.6901 -8.6900 -7.7033 -7.6507 -7.5024 -7.4086 -7.3994 -7.3776 -6.9696 -6.9681 -6.9209 -6.9202 -6.7979 -6.7850 -2.9729 -2.9712 0.1249 0.1872 0.3577 0.4388 0.5787 0.5975 0.9785 1.0443 1.2801 1.3317 1.4235 1.5312 1.8210 1.8373 1.9210 2.0395 2.1244 2.2067 2.2291 2.3349 2.3735 2.3939 2.4966 2.5505 2.7930 2.7960 2.9358 2.9752 3.0286 3.2387 3.5317 3.6352 3.6567 3.6683 4.0848 4.0908 4.0981 4.1183 4.8791 4.9270 5.0180 5.0551 6.8247 6.8270 8.3149 8.3186 8.5971 8.8118 8.9055 9.0024 9.3501 9.5603 9.9692 10.0335 k =-0.1602 0.1388 0.2120 ( 7094 PWs) bands (ev): -23.9415 -23.9415 -8.6984 -8.6984 -7.7000 -7.6498 -7.4958 -7.4062 -7.3996 -7.3795 -6.9627 -6.9604 -6.9162 -6.9158 -6.7982 -6.7850 -2.9787 -2.9771 0.1152 0.1914 0.3297 0.4256 0.5620 0.5820 0.9681 1.0307 1.2941 1.3384 1.4343 1.5650 1.8198 1.8293 1.9142 2.0222 2.1057 2.2113 2.2191 2.3197 2.3569 2.4031 2.4749 2.5191 2.8126 2.8206 2.9775 3.0121 3.0179 3.2247 3.5934 3.6480 3.6625 3.6931 4.0927 4.1076 4.1172 4.1249 4.8732 4.9201 4.9895 5.0264 6.7847 6.7857 8.2750 8.2775 8.6225 8.8327 8.9626 9.0590 9.3935 9.6051 9.9916 10.0516 k =-0.1495 0.1295 0.1978 ( 7092 PWs) bands (ev): -23.9415 -23.9415 -8.7063 -8.7063 -7.6968 -7.6494 -7.4892 -7.4063 -7.3982 -7.3818 -6.9554 -6.9524 -6.9117 -6.9103 -6.7987 -6.7852 -2.9848 -2.9832 0.1064 0.1973 0.3036 0.4148 0.5467 0.5677 0.9583 1.0175 1.3042 1.3434 1.4451 1.5978 1.8167 1.8196 1.9078 2.0046 2.0895 2.2063 2.2155 2.3038 2.3386 2.4101 2.4551 2.4901 2.8323 2.8437 3.0093 3.0228 3.0525 3.2105 3.6408 3.6525 3.6605 3.7520 4.0952 4.1104 4.1428 4.1460 4.8664 4.9122 4.9570 4.9935 6.7395 6.7397 8.2415 8.2433 8.6494 8.8547 9.0205 9.1175 9.4360 9.6470 10.0127 10.0684 k =-0.1388 0.1203 0.1837 ( 7092 PWs) bands (ev): -23.9415 -23.9415 -8.7139 -8.7139 -7.6939 -7.6493 -7.4827 -7.4079 -7.3962 -7.3845 -6.9479 -6.9445 -6.9068 -6.9045 -6.7994 -6.7857 -2.9910 -2.9895 0.0986 0.2039 0.2803 0.4067 0.5330 0.5546 0.9492 1.0047 1.3097 1.3459 1.4564 1.6295 1.7994 1.8207 1.9017 1.9887 2.0756 2.1915 2.2193 2.2873 2.3198 2.4134 2.4371 2.4645 2.8519 2.8655 3.0031 3.0704 3.0955 3.1967 3.6341 3.6494 3.7211 3.8128 4.0975 4.1090 4.1697 4.1716 4.8586 4.9031 4.9212 4.9572 6.6882 6.6895 8.2152 8.2163 8.6776 8.8776 9.0782 9.1770 9.4776 9.6854 10.0323 10.0840 k =-0.1282 0.1110 0.1696 ( 7082 PWs) bands (ev): -23.9415 -23.9415 -8.7210 -8.7210 -7.6911 -7.6497 -7.4762 -7.4099 -7.3943 -7.3873 -6.9404 -6.9368 -6.9013 -6.8984 -6.8002 -6.7865 -2.9973 -2.9958 0.0915 0.2086 0.2627 0.4011 0.5208 0.5428 0.9407 0.9924 1.3095 1.3451 1.4689 1.6596 1.7785 1.8232 1.8961 1.9757 2.0640 2.1754 2.2228 2.2705 2.3014 2.4113 2.4208 2.4437 2.8713 2.8861 2.9988 3.1185 3.1409 3.1845 3.6277 3.6429 3.7847 3.8748 4.1010 4.1068 4.1972 4.1985 4.8490 4.8834 4.8925 4.9184 6.6320 6.6343 8.1959 8.1965 8.7070 8.9014 9.1350 9.2369 9.5184 9.7198 10.0504 10.0982 k =-0.1175 0.1018 0.1554 ( 7094 PWs) bands (ev): -23.9415 -23.9415 -8.7276 -8.7276 -7.6886 -7.6503 -7.4699 -7.4120 -7.3929 -7.3903 -6.9330 -6.9296 -6.8953 -6.8921 -6.8012 -6.7876 -3.0036 -3.0022 0.0850 0.2047 0.2569 0.3981 0.5103 0.5322 0.9328 0.9806 1.3032 1.3400 1.4829 1.6878 1.7565 1.8269 1.8913 1.9652 2.0548 2.1587 2.2254 2.2541 2.2838 2.4009 2.4057 2.4306 2.8904 2.9057 2.9962 3.1526 3.1875 3.1879 3.6217 3.6363 3.8463 3.9372 4.1045 4.1070 4.2250 4.2261 4.8329 4.8488 4.8738 4.8840 6.5715 6.5746 8.1830 8.1831 8.7375 8.9257 9.1900 9.2964 9.5586 9.7500 10.0668 10.1111 k =-0.1068 0.0925 0.1413 ( 7096 PWs) bands (ev): -23.9415 -23.9415 -8.7338 -8.7338 -7.6861 -7.6513 -7.4637 -7.4140 -7.3933 -7.3921 -6.9258 -6.9229 -6.8888 -6.8856 -6.8024 -6.7890 -3.0097 -3.0084 0.0792 0.1913 0.2639 0.3972 0.5015 0.5229 0.9256 0.9694 1.2912 1.3299 1.4984 1.7124 1.7372 1.8311 1.8879 1.9569 2.0481 2.1422 2.2238 2.2417 2.2673 2.3843 2.3918 2.4229 2.9089 2.9241 2.9952 3.1478 3.2301 3.2359 3.6160 3.6296 3.9030 3.9979 4.1039 4.1179 4.2530 4.2541 4.7967 4.8318 4.8328 4.8690 6.5076 6.5114 8.1753 8.1756 8.7689 8.9501 9.2424 9.3548 9.5987 9.7758 10.0814 10.1228 k =-0.0961 0.0833 0.1272 ( 7084 PWs) bands (ev): -23.9415 -23.9415 -8.7394 -8.7394 -7.6839 -7.6524 -7.4576 -7.4158 -7.3963 -7.3918 -6.9189 -6.9168 -6.8821 -6.8793 -6.8036 -6.7906 -3.0155 -3.0143 0.0740 0.1745 0.2771 0.3981 0.4946 0.5151 0.9192 0.9588 1.2742 1.3143 1.5153 1.7148 1.7406 1.8345 1.8872 1.9504 2.0441 2.1266 2.2113 2.2401 2.2516 2.3664 2.3789 2.4160 2.9267 2.9415 2.9955 3.1358 3.2802 3.2842 3.6106 3.6231 3.9503 4.0490 4.1125 4.1377 4.2808 4.2824 4.7551 4.7894 4.8186 4.8544 6.4415 6.4457 8.1721 8.1727 8.8009 8.9741 9.2918 9.4111 9.6390 9.7973 10.0940 10.1330 k =-0.0854 0.0740 0.1130 ( 7078 PWs) bands (ev): -23.9415 -23.9415 -8.7445 -8.7445 -7.6817 -7.6538 -7.4517 -7.4174 -7.3992 -7.3920 -6.9124 -6.9112 -6.8754 -6.8730 -6.8050 -6.7925 -3.0211 -3.0200 0.0695 0.1576 0.2929 0.4002 0.4899 0.5087 0.9135 0.9490 1.2535 1.2934 1.5331 1.7031 1.7588 1.8352 1.8906 1.9461 2.0426 2.1122 2.1940 2.2367 2.2432 2.3491 2.3671 2.4084 2.9435 2.9575 2.9972 3.1233 3.3302 3.3321 3.6054 3.6167 3.9841 4.0698 4.1503 4.1699 4.3084 4.3105 4.7133 4.7459 4.8049 4.8386 6.3745 6.3790 8.1724 8.1731 8.8333 8.9969 9.3376 9.4641 9.6798 9.8149 10.1047 10.1416 k =-0.0748 0.0648 0.0989 ( 7084 PWs) bands (ev): -23.9415 -23.9415 -8.7491 -8.7491 -7.6797 -7.6553 -7.4460 -7.4187 -7.4020 -7.3927 -6.9065 -6.9062 -6.8689 -6.8670 -6.8064 -6.7947 -3.0262 -3.0252 0.0657 0.1415 0.3098 0.4027 0.4876 0.5039 0.9087 0.9399 1.2303 1.2683 1.5515 1.6951 1.7730 1.8326 1.8986 1.9451 2.0431 2.0991 2.1760 2.2223 2.2472 2.3329 2.3565 2.3999 2.9590 2.9721 3.0000 3.1110 3.3786 3.3787 3.6007 3.6107 4.0044 4.0709 4.2055 4.2134 4.3355 4.3382 4.6725 4.7031 4.7905 4.8218 6.3084 6.3129 8.1751 8.1759 8.8656 9.0177 9.3796 9.5125 9.7209 9.8295 10.1131 10.1484 k =-0.0641 0.0555 0.0848 ( 7078 PWs) bands (ev): -23.9415 -23.9415 -8.7531 -8.7530 -7.6778 -7.6569 -7.4405 -7.4197 -7.4046 -7.3939 -6.9016 -6.9011 -6.8626 -6.8613 -6.8078 -6.7972 -3.0307 -3.0299 0.0628 0.1267 0.3268 0.4047 0.4878 0.5008 0.9046 0.9316 1.2061 1.2405 1.5703 1.6911 1.7818 1.8274 1.9103 1.9483 2.0451 2.0871 2.1582 2.2081 2.2515 2.3183 2.3471 2.3906 2.9730 2.9851 3.0040 3.0992 3.4230 3.4243 3.5965 3.6051 4.0154 4.0674 4.2620 4.2629 4.3616 4.3650 4.6338 4.6620 4.7757 4.8043 6.2447 6.2491 8.1793 8.1802 8.8974 9.0356 9.4181 9.5541 9.7618 9.8424 10.1191 10.1529 k =-0.0534 0.0463 0.0707 ( 7086 PWs) bands (ev): -23.9415 -23.9415 -8.7565 -8.7564 -7.6759 -7.6586 -7.4354 -7.4204 -7.4069 -7.3955 -6.8976 -6.8965 -6.8570 -6.8561 -6.8092 -6.7998 -3.0347 -3.0340 0.0609 0.1133 0.3430 0.4058 0.4903 0.4995 0.9015 0.9241 1.1824 1.2121 1.5891 1.6897 1.7851 1.8205 1.9246 1.9558 2.0476 2.0761 2.1414 2.1941 2.2558 2.3054 2.3394 2.3809 2.9851 2.9963 3.0091 3.0880 3.4638 3.4660 3.5930 3.6004 4.0214 4.0625 4.3129 4.3154 4.3865 4.3903 4.5984 4.6236 4.7609 4.7865 6.1855 6.1895 8.1842 8.1850 8.9282 9.0498 9.4534 9.5869 9.8015 9.8553 10.1227 10.1547 k =-0.0427 0.0370 0.0565 ( 7076 PWs) bands (ev): -23.9415 -23.9415 -8.7593 -8.7592 -7.6742 -7.6603 -7.4305 -7.4208 -7.4090 -7.3976 -6.8940 -6.8926 -6.8519 -6.8515 -6.8105 -6.8025 -3.0381 -3.0375 0.0600 0.1014 0.3577 0.4058 0.4944 0.4998 0.8994 0.9176 1.1608 1.1850 1.6076 1.6897 1.7844 1.8127 1.9405 1.9667 2.0491 2.0655 2.1271 2.1802 2.2598 2.2946 2.3338 2.3711 2.9953 3.0055 3.0151 3.0773 3.4997 3.5023 3.5908 3.5968 4.0248 4.0569 4.3594 4.3631 4.4095 4.4134 4.5674 4.5888 4.7470 4.7690 6.1328 6.1363 8.1890 8.1898 8.9573 9.0594 9.4860 9.6087 9.8387 9.8696 10.1241 10.1534 k =-0.0320 0.0278 0.0424 ( 7070 PWs) bands (ev): -23.9415 -23.9415 -8.7614 -8.7614 -7.6724 -7.6620 -7.4262 -7.4208 -7.4106 -7.4000 -6.8911 -6.8896 -6.8477 -6.8475 -6.8116 -6.8053 -3.0407 -3.0402 0.0603 0.0910 0.3703 0.4046 0.4990 0.5014 0.8982 0.9120 1.1426 1.1609 1.6255 1.6893 1.7820 1.8046 1.9576 1.9797 2.0472 2.0551 2.1178 2.1665 2.2632 2.2858 2.3307 2.3615 3.0037 3.0125 3.0217 3.0674 3.5287 3.5311 3.5904 3.5949 4.0272 4.0511 4.3993 4.4032 4.4299 4.4332 4.5421 4.5590 4.7348 4.7525 6.0888 6.0916 8.1934 8.1940 8.9843 9.0640 9.5162 9.6186 9.8714 9.8856 10.1239 10.1492 k =-0.0214 0.0185 0.0283 ( 7073 PWs) bands (ev): -23.9415 -23.9415 -8.7630 -8.7630 -7.6707 -7.6638 -7.4227 -7.4206 -7.4114 -7.4028 -6.8888 -6.8876 -6.8445 -6.8443 -6.8122 -6.8078 -3.0426 -3.0423 0.0619 0.0822 0.3805 0.4023 0.5032 0.5037 0.8980 0.9072 1.1292 1.1415 1.6424 1.6867 1.7801 1.7966 1.9751 1.9934 2.0397 2.0443 2.1157 2.1530 2.2660 2.2791 2.3303 2.3524 3.0105 3.0172 3.0284 3.0581 3.5488 3.5502 3.5930 3.5956 4.0294 4.0454 4.4301 4.4339 4.4466 4.4485 4.5236 4.5352 4.7256 4.7382 6.0556 6.0575 8.1968 8.1972 9.0084 9.0631 9.5441 9.6176 9.8971 9.9015 10.1234 10.1426 k =-0.0107 0.0093 0.0141 ( 7077 PWs) bands (ev): -23.9415 -23.9415 -8.7639 -8.7639 -7.6690 -7.6655 -7.4206 -7.4203 -7.4107 -7.4057 -6.8872 -6.8865 -6.8424 -6.8423 -6.8123 -6.8100 -3.0437 -3.0435 0.0648 0.0749 0.3885 0.3990 0.5058 0.5059 0.8989 0.9035 1.1219 1.1281 1.6577 1.6806 1.7805 1.7894 1.9928 2.0067 2.0272 2.0331 2.1201 2.1403 2.2684 2.2743 2.3327 2.3442 3.0157 3.0193 3.0350 3.0496 3.5589 3.5595 3.5974 3.5985 4.0321 4.0402 4.4498 4.4536 4.4577 4.4584 4.5127 4.5186 4.7208 4.7274 6.0350 6.0360 8.1990 8.1992 9.0289 9.0568 9.5693 9.6077 9.9134 9.9138 10.1245 10.1350 k = 0.0000 0.0000 0.0000 ( 7049 PWs) bands (ev): -23.9415 -23.9415 -8.7643 -8.7643 -7.6672 -7.6672 -7.4201 -7.4201 -7.4085 -7.4085 -6.8864 -6.8864 -6.8417 -6.8417 -6.8115 -6.8115 -3.0440 -3.0440 0.0691 0.0691 0.3945 0.3945 0.5067 0.5067 0.9007 0.9007 1.1215 1.1215 1.6707 1.6707 1.7838 1.7838 2.0092 2.0092 2.0219 2.0219 2.1290 2.1290 2.2710 2.2710 2.3375 2.3375 3.0188 3.0188 3.0420 3.0420 3.5618 3.5618 3.5999 3.5999 4.0357 4.0357 4.4579 4.4579 4.4625 4.4625 4.5108 4.5108 4.7213 4.7213 6.0283 6.0283 8.1998 8.1998 9.0452 9.0452 9.5909 9.5909 9.9187 9.9187 10.1284 10.1284 k = 0.0000 0.0000 0.0000 ( 7049 PWs) bands (ev): -23.9415 -23.9415 -8.7643 -8.7643 -7.6672 -7.6672 -7.4201 -7.4201 -7.4085 -7.4085 -6.8864 -6.8864 -6.8417 -6.8417 -6.8115 -6.8115 -3.0440 -3.0440 0.0691 0.0691 0.3945 0.3945 0.5067 0.5067 0.9007 0.9007 1.1215 1.1215 1.6707 1.6707 1.7838 1.7838 2.0092 2.0092 2.0219 2.0219 2.1290 2.1290 2.2710 2.2710 2.3375 2.3375 3.0188 3.0188 3.0420 3.0420 3.5618 3.5618 3.5999 3.5999 4.0357 4.0357 4.4579 4.4579 4.4625 4.4625 4.5108 4.5108 4.7213 4.7213 6.0283 6.0283 8.1998 8.1998 9.0452 9.0452 9.5909 9.5909 9.9187 9.9187 10.1284 10.1284 k = 0.0132 0.0152-0.0000 ( 7081 PWs) bands (ev): -23.9415 -23.9415 -8.7640 -8.7640 -7.6673 -7.6673 -7.4203 -7.4203 -7.4085 -7.4085 -6.8864 -6.8864 -6.8416 -6.8416 -6.8122 -6.8122 -3.0441 -3.0441 0.0706 0.0706 0.3956 0.3956 0.5077 0.5077 0.9005 0.9005 1.1211 1.1211 1.6708 1.6708 1.7836 1.7836 2.0088 2.0088 2.0218 2.0218 2.1292 2.1292 2.2711 2.2711 2.3373 2.3373 3.0162 3.0162 3.0418 3.0418 3.5618 3.5618 3.5999 3.5999 4.0347 4.0347 4.4576 4.4576 4.4621 4.4621 4.5140 4.5140 4.7161 4.7161 6.0341 6.0341 8.1991 8.1991 9.0457 9.0457 9.5874 9.5874 9.9138 9.9138 10.1301 10.1301 k = 0.0263 0.0304-0.0000 ( 7081 PWs) bands (ev): -23.9415 -23.9415 -8.7631 -8.7631 -7.6673 -7.6673 -7.4211 -7.4211 -7.4081 -7.4081 -6.8862 -6.8862 -6.8413 -6.8413 -6.8141 -6.8141 -3.0443 -3.0443 0.0749 0.0749 0.3988 0.3988 0.5107 0.5107 0.9000 0.9000 1.1202 1.1202 1.6709 1.6709 1.7832 1.7832 2.0077 2.0077 2.0220 2.0220 2.1299 2.1299 2.2716 2.2716 2.3367 2.3367 3.0091 3.0091 3.0412 3.0412 3.5618 3.5618 3.5999 3.5999 4.0319 4.0319 4.4567 4.4567 4.4612 4.4612 4.5236 4.5236 4.7009 4.7009 6.0511 6.0511 8.1969 8.1969 9.0471 9.0471 9.5771 9.5771 9.8994 9.8994 10.1353 10.1353 k = 0.0395 0.0456-0.0000 ( 7077 PWs) bands (ev): -23.9415 -23.9415 -8.7617 -8.7617 -7.6675 -7.6675 -7.4223 -7.4223 -7.4076 -7.4076 -6.8860 -6.8860 -6.8409 -6.8409 -6.8172 -6.8172 -3.0446 -3.0446 0.0820 0.0820 0.4041 0.4041 0.5156 0.5156 0.8991 0.8991 1.1188 1.1188 1.6711 1.6711 1.7825 1.7825 2.0058 2.0058 2.0221 2.0222 2.1309 2.1309 2.2724 2.2724 2.3358 2.3358 2.9980 2.9980 3.0397 3.0397 3.5618 3.5618 3.5999 3.5999 4.0271 4.0271 4.4551 4.4551 4.4596 4.4596 4.5392 4.5392 4.6766 4.6766 6.0785 6.0785 8.1933 8.1933 9.0495 9.0495 9.5605 9.5605 9.8759 9.8759 10.1438 10.1438 k = 0.0526 0.0607-0.0000 ( 7065 PWs) bands (ev): -23.9415 -23.9415 -8.7596 -8.7596 -7.6676 -7.6676 -7.4240 -7.4240 -7.4068 -7.4068 -6.8858 -6.8858 -6.8404 -6.8404 -6.8215 -6.8215 -3.0451 -3.0451 0.0920 0.0920 0.4114 0.4114 0.5225 0.5225 0.8979 0.8979 1.1167 1.1167 1.6714 1.6714 1.7815 1.7815 2.0032 2.0032 2.0224 2.0224 2.1324 2.1324 2.2735 2.2735 2.3346 2.3346 2.9835 2.9835 3.0369 3.0369 3.5617 3.5617 3.5998 3.5998 4.0204 4.0204 4.4529 4.4529 4.4577 4.4577 4.5603 4.5603 4.6447 4.6447 6.1149 6.1150 8.1883 8.1883 9.0526 9.0526 9.5381 9.5381 9.8444 9.8444 10.1557 10.1557 k = 0.0658 0.0759-0.0000 ( 7057 PWs) bands (ev): -23.9415 -23.9415 -8.7570 -8.7570 -7.6679 -7.6679 -7.4262 -7.4262 -7.4058 -7.4058 -6.8856 -6.8856 -6.8396 -6.8396 -6.8268 -6.8268 -3.0457 -3.0457 0.1047 0.1047 0.4208 0.4208 0.5312 0.5312 0.8963 0.8963 1.1142 1.1142 1.6717 1.6717 1.7802 1.7802 1.9998 1.9998 2.0228 2.0228 2.1343 2.1343 2.2749 2.2749 2.3330 2.3330 2.9661 2.9661 3.0330 3.0330 3.5615 3.5615 3.5996 3.5996 4.0120 4.0120 4.4500 4.4500 4.4553 4.4553 4.5829 4.5829 4.6101 4.6101 6.1590 6.1590 8.1820 8.1820 9.0563 9.0563 9.5109 9.5109 9.8057 9.8057 10.1709 10.1709 k = 0.0789 0.0911-0.0000 ( 7069 PWs) bands (ev): -23.9415 -23.9415 -8.7538 -8.7538 -7.6683 -7.6683 -7.4288 -7.4288 -7.4048 -7.4048 -6.8855 -6.8855 -6.8388 -6.8388 -6.8330 -6.8330 -3.0463 -3.0463 0.1201 0.1202 0.4322 0.4322 0.5418 0.5418 0.8943 0.8943 1.1111 1.1111 1.6721 1.6721 1.7786 1.7786 1.9957 1.9957 2.0231 2.0231 2.1366 2.1366 2.2766 2.2766 2.3311 2.3311 2.9461 2.9461 3.0280 3.0280 3.5612 3.5613 3.5992 3.5992 4.0017 4.0017 4.4461 4.4461 4.4525 4.4526 4.5588 4.5588 4.6222 4.6222 6.2093 6.2093 8.1745 8.1745 9.0602 9.0602 9.4799 9.4799 9.7611 9.7611 10.1894 10.1894 k = 0.0921 0.1063-0.0000 ( 7073 PWs) bands (ev): -23.9415 -23.9415 -8.7500 -8.7500 -7.6689 -7.6689 -7.4319 -7.4319 -7.4036 -7.4036 -6.8858 -6.8858 -6.8398 -6.8398 -6.8377 -6.8377 -3.0470 -3.0470 0.1381 0.1381 0.4456 0.4456 0.5542 0.5542 0.8919 0.8919 1.1076 1.1076 1.6726 1.6726 1.7767 1.7767 1.9908 1.9909 2.0235 2.0235 2.1392 2.1392 2.2786 2.2786 2.3289 2.3289 2.9241 2.9241 3.0218 3.0218 3.5607 3.5607 3.5985 3.5985 3.9897 3.9897 4.4405 4.4405 4.4493 4.4493 4.5141 4.5141 4.6569 4.6569 6.2644 6.2644 8.1660 8.1660 9.0637 9.0637 9.4465 9.4466 9.7115 9.7115 10.2110 10.2110 k = 0.1053 0.1215-0.0000 ( 7073 PWs) bands (ev): -23.9415 -23.9415 -8.7456 -8.7456 -7.6697 -7.6697 -7.4353 -7.4353 -7.4025 -7.4025 -6.8866 -6.8866 -6.8468 -6.8468 -6.8365 -6.8365 -3.0478 -3.0478 0.1586 0.1586 0.4609 0.4609 0.5683 0.5683 0.8891 0.8891 1.1037 1.1037 1.6732 1.6732 1.7745 1.7745 1.9853 1.9853 2.0239 2.0239 2.1421 2.1421 2.2809 2.2809 2.3265 2.3265 2.9004 2.9004 3.0147 3.0147 3.5599 3.5599 3.5974 3.5974 3.9761 3.9761 4.4278 4.4278 4.4453 4.4453 4.4730 4.4730 4.6960 4.6960 6.3231 6.3231 8.1565 8.1565 9.0659 9.0659 9.4122 9.4122 9.6581 9.6581 10.2355 10.2355 k = 0.1184 0.1367-0.0000 ( 7057 PWs) bands (ev): -23.9415 -23.9415 -8.7406 -8.7406 -7.6706 -7.6706 -7.4391 -7.4391 -7.4014 -7.4014 -6.8885 -6.8885 -6.8533 -6.8533 -6.8352 -6.8352 -3.0486 -3.0486 0.1815 0.1815 0.4780 0.4780 0.5841 0.5841 0.8859 0.8859 1.0994 1.0994 1.6740 1.6740 1.7721 1.7721 1.9791 1.9791 2.0244 2.0244 2.1453 2.1453 2.2833 2.2833 2.3240 2.3240 2.8756 2.8756 3.0066 3.0066 3.5587 3.5587 3.5958 3.5958 3.9609 3.9609 4.3926 4.3926 4.4406 4.4406 4.4531 4.4531 4.7383 4.7383 6.3843 6.3843 8.1464 8.1464 9.0655 9.0655 9.3787 9.3788 9.6018 9.6018 10.2629 10.2629 k = 0.1316 0.1519-0.0000 ( 7061 PWs) bands (ev): -23.9415 -23.9415 -8.7349 -8.7349 -7.6718 -7.6718 -7.4432 -7.4432 -7.4006 -7.4006 -6.8923 -6.8923 -6.8586 -6.8585 -6.8337 -6.8337 -3.0493 -3.0493 0.2066 0.2066 0.4968 0.4968 0.6015 0.6015 0.8823 0.8823 1.0949 1.0949 1.6748 1.6748 1.7694 1.7694 1.9723 1.9723 2.0249 2.0249 2.1487 2.1487 2.2859 2.2859 2.3214 2.3214 2.8501 2.8501 2.9975 2.9975 3.5569 3.5569 3.5935 3.5935 3.9442 3.9442 4.3428 4.3428 4.4360 4.4360 4.4467 4.4467 4.7831 4.7831 6.4469 6.4469 8.1358 8.1358 9.0608 9.0608 9.3482 9.3482 9.5434 9.5434 10.2927 10.2927 k = 0.1447 0.1670-0.0000 ( 7073 PWs) bands (ev): -23.9415 -23.9415 -8.7287 -8.7287 -7.6733 -7.6733 -7.4476 -7.4476 -7.4000 -7.4000 -6.8982 -6.8982 -6.8620 -6.8620 -6.8321 -6.8321 -3.0500 -3.0500 0.2338 0.2338 0.5173 0.5173 0.6203 0.6203 0.8781 0.8781 1.0902 1.0902 1.6759 1.6759 1.7664 1.7664 1.9648 1.9648 2.0253 2.0253 2.1524 2.1524 2.2885 2.2885 2.3188 2.3188 2.8242 2.8242 2.9875 2.9875 3.5544 3.5544 3.5905 3.5905 3.9263 3.9263 4.2894 4.2894 4.4318 4.4318 4.4431 4.4431 4.8300 4.8300 6.5103 6.5103 8.1251 8.1251 9.0499 9.0499 9.3225 9.3226 9.4837 9.4837 10.2709 10.2709 k = 0.1579 0.1822-0.0000 ( 7085 PWs) bands (ev): -23.9415 -23.9415 -8.7217 -8.7217 -7.6750 -7.6750 -7.4523 -7.4523 -7.4000 -7.4000 -6.9060 -6.9059 -6.8637 -6.8637 -6.8304 -6.8304 -3.0507 -3.0507 0.2630 0.2630 0.5393 0.5393 0.6404 0.6404 0.8735 0.8735 1.0853 1.0853 1.6771 1.6771 1.7630 1.7630 1.9568 1.9568 2.0257 2.0257 2.1563 2.1563 2.2909 2.2909 2.3166 2.3166 2.7984 2.7984 2.9766 2.9766 3.5511 3.5511 3.5866 3.5866 3.9071 3.9071 4.2354 4.2354 4.4282 4.4282 4.4405 4.4405 4.8784 4.8784 6.5734 6.5734 8.1147 8.1147 9.0313 9.0313 9.3031 9.3032 9.4234 9.4234 10.2425 10.2425 k = 0.1711 0.1974-0.0000 ( 7085 PWs) bands (ev): -23.9415 -23.9415 -8.7142 -8.7142 -7.6770 -7.6770 -7.4572 -7.4572 -7.4006 -7.4006 -6.9148 -6.9148 -6.8642 -6.8642 -6.8286 -6.8285 -3.0513 -3.0513 0.2939 0.2939 0.5629 0.5629 0.6619 0.6619 0.8684 0.8684 1.0804 1.0804 1.6786 1.6786 1.7594 1.7594 1.9483 1.9483 2.0260 2.0260 2.1603 2.1603 2.2928 2.2928 2.3150 2.3150 2.7728 2.7728 2.9649 2.9649 3.5467 3.5467 3.5816 3.5816 3.8869 3.8869 4.1816 4.1816 4.4252 4.4252 4.4386 4.4386 4.9279 4.9279 6.6355 6.6355 8.1050 8.1050 9.0050 9.0050 9.2894 9.2894 9.3637 9.3637 10.2179 10.2179 k = 0.1842 0.2126-0.0000 ( 7093 PWs) bands (ev): -23.9415 -23.9415 -8.7060 -8.7060 -7.6793 -7.6793 -7.4622 -7.4622 -7.4020 -7.4020 -6.9242 -6.9242 -6.8639 -6.8639 -6.8266 -6.8266 -3.0518 -3.0518 0.3264 0.3264 0.5878 0.5878 0.6844 0.6844 0.8628 0.8628 1.0754 1.0754 1.6803 1.6803 1.7554 1.7554 1.9394 1.9394 2.0263 2.0263 2.1645 2.1645 2.2936 2.2936 2.3146 2.3146 2.7478 2.7478 2.9524 2.9524 3.5411 3.5411 3.5755 3.5755 3.8658 3.8658 4.1285 4.1285 4.4229 4.4229 4.4375 4.4375 4.9782 4.9782 6.6957 6.6957 8.0967 8.0967 8.9720 8.9720 9.2749 9.2749 9.3099 9.3099 10.1977 10.1977 k = 0.1974 0.2278-0.0000 ( 7101 PWs) bands (ev): -23.9414 -23.9414 -8.6972 -8.6972 -7.6819 -7.6819 -7.4675 -7.4675 -7.4045 -7.4045 -6.9334 -6.9334 -6.8633 -6.8633 -6.8246 -6.8246 -3.0522 -3.0522 0.3603 0.3603 0.6140 0.6140 0.7079 0.7079 0.8567 0.8567 1.0706 1.0706 1.6823 1.6823 1.7510 1.7510 1.9303 1.9303 2.0265 2.0265 2.1687 2.1687 2.2930 2.2930 2.3158 2.3158 2.7236 2.7236 2.9392 2.9392 3.5342 3.5342 3.5681 3.5681 3.8440 3.8440 4.0767 4.0767 4.4214 4.4214 4.4371 4.4371 5.0287 5.0287 6.7533 6.7533 8.0903 8.0903 8.9344 8.9344 9.2329 9.2329 9.2872 9.2872 10.1824 10.1824 k = 0.2105 0.2430-0.0000 ( 7089 PWs) bands (ev): -23.9414 -23.9414 -8.6878 -8.6878 -7.6848 -7.6848 -7.4728 -7.4728 -7.4081 -7.4081 -6.9421 -6.9421 -6.8623 -6.8623 -6.8225 -6.8225 -3.0524 -3.0524 0.3953 0.3953 0.6413 0.6413 0.7322 0.7322 0.8502 0.8502 1.0660 1.0660 1.6845 1.6845 1.7462 1.7462 1.9211 1.9211 2.0266 2.0266 2.1730 2.1730 2.2912 2.2912 2.3184 2.3184 2.7005 2.7005 2.9252 2.9252 3.5257 3.5257 3.5594 3.5594 3.8215 3.8215 4.0265 4.0265 4.4210 4.4210 4.4375 4.4375 5.0793 5.0793 6.8073 6.8073 8.0866 8.0867 8.8937 8.8937 9.1758 9.1758 9.2813 9.2813 10.1720 10.1720 k = 0.2237 0.2582-0.0000 ( 7093 PWs) bands (ev): -23.9414 -23.9414 -8.6778 -8.6778 -7.6880 -7.6880 -7.4782 -7.4782 -7.4131 -7.4131 -6.9501 -6.9501 -6.8612 -6.8612 -6.8204 -6.8204 -3.0526 -3.0526 0.4312 0.4312 0.6696 0.6696 0.7572 0.7572 0.8432 0.8432 1.0615 1.0615 1.6871 1.6871 1.7408 1.7408 1.9120 1.9120 2.0266 2.0266 2.1772 2.1772 2.2886 2.2886 2.3220 2.3220 2.6784 2.6784 2.9105 2.9105 3.5156 3.5156 3.5493 3.5493 3.7986 3.7986 3.9780 3.9780 4.4216 4.4216 4.4389 4.4389 5.1295 5.1295 6.8569 6.8569 8.0864 8.0864 8.8513 8.8513 9.1178 9.1178 9.2770 9.2771 10.1666 10.1666 k = 0.2368 0.2733-0.0000 ( 7093 PWs) bands (ev): -23.9414 -23.9414 -8.6671 -8.6671 -7.6915 -7.6915 -7.4836 -7.4836 -7.4196 -7.4196 -6.9570 -6.9570 -6.8600 -6.8600 -6.8182 -6.8182 -3.0526 -3.0526 0.4678 0.4678 0.6988 0.6988 0.7828 0.7828 0.8359 0.8359 1.0574 1.0574 1.6900 1.6900 1.7348 1.7348 1.9032 1.9032 2.0265 2.0265 2.1814 2.1814 2.2856 2.2856 2.3261 2.3261 2.6577 2.6577 2.8951 2.8951 3.5037 3.5037 3.5379 3.5379 3.7754 3.7755 3.9317 3.9317 4.4234 4.4234 4.4413 4.4413 5.1791 5.1791 6.9012 6.9012 8.0904 8.0904 8.8083 8.8083 9.0606 9.0606 9.2721 9.2721 10.1656 10.1656 k = 0.2500 0.2885-0.0000 ( 7109 PWs) bands (ev): -23.9414 -23.9414 -8.6560 -8.6560 -7.6953 -7.6953 -7.4891 -7.4891 -7.4277 -7.4277 -6.9627 -6.9627 -6.8587 -6.8587 -6.8160 -6.8160 -3.0524 -3.0524 0.5047 0.5047 0.7287 0.7287 0.8084 0.8084 0.8284 0.8284 1.0536 1.0537 1.6932 1.6932 1.7281 1.7281 1.8949 1.8949 2.0262 2.0262 2.1856 2.1856 2.2824 2.2824 2.3306 2.3306 2.6382 2.6382 2.8791 2.8791 3.4899 3.4899 3.5252 3.5252 3.7521 3.7521 3.8877 3.8877 4.4264 4.4264 4.4447 4.4447 5.2279 5.2279 6.9395 6.9395 8.0994 8.0994 8.7653 8.7653 9.0046 9.0046 9.2658 9.2658 10.1684 10.1684 k = 0.2632 0.3037-0.0000 ( 7093 PWs) bands (ev): -23.9414 -23.9414 -8.6442 -8.6442 -7.6993 -7.6993 -7.4944 -7.4944 -7.4373 -7.4373 -6.9671 -6.9671 -6.8574 -6.8574 -6.8138 -6.8138 -3.0522 -3.0522 0.5416 0.5416 0.7593 0.7593 0.8195 0.8195 0.8355 0.8355 1.0504 1.0504 1.6967 1.6967 1.7207 1.7207 1.8874 1.8874 2.0260 2.0260 2.1896 2.1896 2.2792 2.2792 2.3355 2.3355 2.6203 2.6203 2.8625 2.8625 3.4742 3.4742 3.5112 3.5112 3.7286 3.7286 3.8462 3.8462 4.4307 4.4307 4.4492 4.4492 5.2755 5.2755 6.9712 6.9712 8.1138 8.1138 8.7229 8.7229 8.9500 8.9500 9.2581 9.2581 10.1738 10.1738 k = 0.2763 0.3189-0.0000 ( 7101 PWs) bands (ev): -23.9414 -23.9414 -8.6320 -8.6320 -7.7036 -7.7036 -7.4998 -7.4998 -7.4483 -7.4483 -6.9702 -6.9702 -6.8560 -6.8560 -6.8116 -6.8116 -3.0518 -3.0518 0.5782 0.5782 0.7901 0.7901 0.8119 0.8119 0.8612 0.8612 1.0477 1.0477 1.7005 1.7005 1.7125 1.7125 1.8809 1.8809 2.0255 2.0255 2.1934 2.1934 2.2760 2.2760 2.3405 2.3405 2.6037 2.6037 2.8454 2.8454 3.4567 3.4567 3.4960 3.4960 3.7051 3.7051 3.8074 3.8074 4.4361 4.4361 4.4547 4.4547 5.3217 5.3217 6.9960 6.9960 8.1339 8.1339 8.6815 8.6815 8.8972 8.8972 9.2491 9.2491 10.1806 10.1806 k = 0.2895 0.3341-0.0000 ( 7101 PWs) bands (ev): -23.9414 -23.9414 -8.6194 -8.6194 -7.7082 -7.7082 -7.5050 -7.5050 -7.4607 -7.4607 -6.9720 -6.9720 -6.8547 -6.8547 -6.8095 -6.8095 -3.0513 -3.0513 0.6142 0.6142 0.8033 0.8033 0.8218 0.8218 0.8870 0.8871 1.0457 1.0457 1.7019 1.7019 1.7059 1.7059 1.8755 1.8755 2.0250 2.0250 2.1971 2.1971 2.2729 2.2729 2.3457 2.3457 2.5887 2.5887 2.8278 2.8278 3.4375 3.4375 3.4798 3.4798 3.6817 3.6817 3.7716 3.7716 4.4426 4.4426 4.4611 4.4611 5.3664 5.3664 7.0137 7.0137 8.1596 8.1596 8.6416 8.6416 8.8461 8.8461 9.2394 9.2394 10.1873 10.1873 k = 0.3026 0.3493-0.0000 ( 7113 PWs) bands (ev): -23.9414 -23.9414 -8.6064 -8.6064 -7.7132 -7.7132 -7.5100 -7.5100 -7.4742 -7.4742 -6.9727 -6.9727 -6.8533 -6.8533 -6.8074 -6.8074 -3.0506 -3.0506 0.6490 0.6490 0.7954 0.7954 0.8526 0.8526 0.9125 0.9125 1.0446 1.0446 1.6926 1.6926 1.7095 1.7095 1.8715 1.8715 2.0244 2.0244 2.2004 2.2004 2.2701 2.2701 2.3509 2.3509 2.5751 2.5751 2.8097 2.8097 3.4167 3.4167 3.4625 3.4625 3.6584 3.6584 3.7387 3.7387 4.4502 4.4502 4.4683 4.4683 5.4093 5.4093 7.0248 7.0248 8.1903 8.1903 8.6037 8.6037 8.7970 8.7970 9.2296 9.2296 10.1924 10.1924 k = 0.3158 0.3645-0.0000 ( 7129 PWs) bands (ev): -23.9414 -23.9414 -8.5931 -8.5931 -7.7184 -7.7184 -7.5149 -7.5149 -7.4885 -7.4885 -6.9723 -6.9723 -6.8519 -6.8519 -6.8054 -6.8054 -3.0499 -3.0499 0.6822 0.6822 0.7879 0.7879 0.8829 0.8829 0.9374 0.9374 1.0450 1.0450 1.6816 1.6816 1.7140 1.7140 1.8689 1.8689 2.0238 2.0238 2.2035 2.2035 2.2675 2.2675 2.3562 2.3562 2.5631 2.5631 2.7912 2.7912 3.3946 3.3946 3.4445 3.4445 3.6354 3.6354 3.7088 3.7088 4.4586 4.4586 4.4763 4.4763 5.4503 5.4503 7.0299 7.0299 8.2248 8.2248 8.5683 8.5683 8.7501 8.7501 9.2203 9.2203 10.1945 10.1945 k = 0.3289 0.3796-0.0000 ( 7121 PWs) bands (ev): -23.9414 -23.9414 -8.5796 -8.5796 -7.7239 -7.7239 -7.5197 -7.5197 -7.5034 -7.5034 -6.9710 -6.9710 -6.8506 -6.8506 -6.8034 -6.8034 -3.0492 -3.0492 0.7127 0.7127 0.7815 0.7815 0.9118 0.9118 0.9614 0.9614 1.0474 1.0474 1.6698 1.6698 1.7187 1.7187 1.8677 1.8677 2.0232 2.0232 2.2063 2.2063 2.2653 2.2653 2.3614 2.3614 2.5524 2.5524 2.7725 2.7725 3.3715 3.3715 3.4260 3.4260 3.6128 3.6128 3.6820 3.6820 4.4678 4.4678 4.4850 4.4850 5.4891 5.4891 7.0297 7.0297 8.2613 8.2613 8.5367 8.5367 8.7054 8.7054 9.2123 9.2123 10.1923 10.1923 k = 0.3421 0.3948-0.0000 ( 7113 PWs) bands (ev): -23.9414 -23.9414 -8.5659 -8.5659 -7.7297 -7.7297 -7.5243 -7.5243 -7.5183 -7.5183 -6.9690 -6.9690 -6.8493 -6.8493 -6.8015 -6.8015 -3.0484 -3.0484 0.7376 0.7376 0.7792 0.7792 0.9379 0.9379 0.9843 0.9843 1.0532 1.0532 1.6574 1.6574 1.7235 1.7235 1.8680 1.8680 2.0227 2.0227 2.2088 2.2088 2.2634 2.2634 2.3666 2.3666 2.5431 2.5431 2.7537 2.7537 3.3477 3.3477 3.4071 3.4071 3.5908 3.5908 3.6580 3.6580 4.4775 4.4775 4.4940 4.4940 5.5256 5.5256 7.0252 7.0252 8.2966 8.2966 8.5108 8.5108 8.6631 8.6631 9.2063 9.2063 10.1851 10.1851 k = 0.3553 0.4100-0.0000 ( 7129 PWs) bands (ev): -23.9414 -23.9414 -8.5523 -8.5523 -7.7359 -7.7359 -7.5339 -7.5339 -7.5279 -7.5279 -6.9665 -6.9665 -6.8480 -6.8480 -6.7998 -6.7998 -3.0475 -3.0475 0.7483 0.7483 0.7892 0.7892 0.9593 0.9593 1.0057 1.0057 1.0639 1.0639 1.6444 1.6444 1.7283 1.7283 1.8696 1.8696 2.0223 2.0223 2.2109 2.2109 2.2621 2.2621 2.3716 2.3716 2.5351 2.5351 2.7348 2.7348 3.3237 3.3237 3.3881 3.3881 3.5698 3.5698 3.6366 3.6366 4.4876 4.4876 4.5033 4.5033 5.5597 5.5597 7.0173 7.0173 8.3253 8.3253 8.4950 8.4950 8.6235 8.6235 9.2031 9.2031 10.1721 10.1721 k = 0.3684 0.4252-0.0000 ( 7149 PWs) bands (ev): -23.9414 -23.9414 -8.5389 -8.5389 -7.7425 -7.7425 -7.5483 -7.5483 -7.5320 -7.5320 -6.9637 -6.9637 -6.8468 -6.8468 -6.7981 -6.7981 -3.0467 -3.0467 0.7465 0.7465 0.8100 0.8100 0.9746 0.9746 1.0259 1.0259 1.0807 1.0807 1.6310 1.6310 1.7330 1.7330 1.8723 1.8723 2.0219 2.0219 2.2127 2.2127 2.2612 2.2612 2.3764 2.3764 2.5282 2.5282 2.7161 2.7161 3.2997 3.2997 3.3693 3.3693 3.5501 3.5501 3.6175 3.6175 4.4977 4.4977 4.5127 4.5127 5.5913 5.5913 7.0070 7.0070 8.3397 8.3397 8.4956 8.4956 8.5867 8.5867 9.2035 9.2035 10.1532 10.1532 k = 0.3816 0.4404-0.0000 ( 7149 PWs) bands (ev): -23.9414 -23.9414 -8.5258 -8.5258 -7.7493 -7.7493 -7.5620 -7.5620 -7.5356 -7.5356 -6.9606 -6.9606 -6.8457 -6.8457 -6.7966 -6.7966 -3.0458 -3.0458 0.7414 0.7414 0.8320 0.8320 0.9839 0.9839 1.0450 1.0450 1.1025 1.1025 1.6174 1.6174 1.7375 1.7375 1.8761 1.8761 2.0218 2.0218 2.2142 2.2142 2.2609 2.2609 2.3809 2.3809 2.5226 2.5226 2.6978 2.6978 3.2762 3.2762 3.3510 3.3510 3.5318 3.5318 3.6006 3.6006 4.5078 4.5078 4.5219 4.5219 5.6202 5.6202 6.9952 6.9952 8.3374 8.3374 8.5130 8.5130 8.5537 8.5537 9.2081 9.2081 10.1284 10.1284 k = 0.3947 0.4556-0.0000 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5132 -8.5132 -7.7563 -7.7563 -7.5747 -7.5747 -7.5389 -7.5389 -6.9575 -6.9575 -6.8446 -6.8446 -6.7952 -6.7952 -3.0450 -3.0450 0.7358 0.7358 0.8527 0.8527 0.9892 0.9892 1.0628 1.0628 1.1273 1.1273 1.6038 1.6038 1.7418 1.7418 1.8806 1.8806 2.0218 2.0218 2.2154 2.2154 2.2613 2.2613 2.3850 2.3850 2.5179 2.5179 2.6802 2.6802 3.2537 3.2537 3.3336 3.3336 3.5151 3.5151 3.5858 3.5858 4.5176 4.5176 4.5308 4.5308 5.6464 5.6464 6.9826 6.9826 8.3248 8.3248 8.5173 8.5173 8.5469 8.5469 9.2178 9.2178 10.0983 10.0983 k = 0.4079 0.4708-0.0000 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5013 -8.5013 -7.7634 -7.7634 -7.5861 -7.5861 -7.5419 -7.5419 -6.9545 -6.9545 -6.8436 -6.8436 -6.7940 -6.7940 -3.0442 -3.0442 0.7304 0.7304 0.8712 0.8712 0.9920 0.9920 1.0789 1.0789 1.1531 1.1531 1.5903 1.5903 1.7457 1.7457 1.8857 1.8857 2.0219 2.0219 2.2163 2.2163 2.2621 2.2621 2.3886 2.3886 2.5142 2.5142 2.6635 2.6635 3.2325 3.2325 3.3173 3.3173 3.5002 3.5002 3.5728 3.5728 4.5268 4.5268 4.5392 4.5392 5.6697 5.6697 6.9699 6.9699 8.3085 8.3085 8.4914 8.4914 8.5758 8.5758 9.2328 9.2328 10.0636 10.0636 k = 0.4211 0.4859-0.0000 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.4903 -8.4903 -7.7704 -7.7704 -7.5961 -7.5961 -7.5445 -7.5445 -6.9517 -6.9517 -6.8427 -6.8427 -6.7929 -6.7929 -3.0435 -3.0435 0.7254 0.7254 0.8874 0.8874 0.9935 0.9935 1.0930 1.0931 1.1785 1.1785 1.5771 1.5771 1.7492 1.7493 1.8908 1.8908 2.0222 2.0222 2.2170 2.2170 2.2634 2.2634 2.3917 2.3917 2.5112 2.5112 2.6481 2.6481 3.2130 3.2130 3.3024 3.3024 3.4872 3.4872 3.5616 3.5616 4.5353 4.5353 4.5468 4.5468 5.6900 5.6900 6.9578 6.9578 8.2919 8.2919 8.4671 8.4671 8.6045 8.6045 9.2532 9.2532 10.0253 10.0253 k = 0.4342 0.5011-0.0000 ( 7130 PWs) bands (ev): -23.9414 -23.9414 -8.4805 -8.4805 -7.7771 -7.7771 -7.6045 -7.6045 -7.5467 -7.5467 -6.9491 -6.9491 -6.8419 -6.8419 -6.7920 -6.7920 -3.0429 -3.0429 0.7211 0.7211 0.9012 0.9012 0.9942 0.9942 1.1052 1.1052 1.2024 1.2024 1.5646 1.5646 1.7524 1.7524 1.8959 1.8959 2.0226 2.0226 2.2175 2.2175 2.2650 2.2650 2.3940 2.3940 2.5089 2.5089 2.6344 2.6344 3.1956 3.1956 3.2892 3.2892 3.4761 3.4761 3.5521 3.5521 4.5429 4.5429 4.5536 4.5536 5.7073 5.7073 6.9467 6.9467 8.2766 8.2766 8.4461 8.4461 8.6296 8.6296 9.2782 9.2782 9.9851 9.9851 k = 0.4474 0.5163-0.0000 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.4721 -8.4721 -7.7831 -7.7831 -7.6114 -7.6114 -7.5485 -7.5485 -6.9469 -6.9469 -6.8412 -6.8412 -6.7912 -6.7912 -3.0423 -3.0423 0.7174 0.7174 0.9125 0.9125 0.9945 0.9945 1.1153 1.1153 1.2238 1.2238 1.5530 1.5530 1.7551 1.7551 1.9006 1.9006 2.0230 2.0230 2.2180 2.2180 2.2668 2.2668 2.3957 2.3957 2.5072 2.5072 2.6226 2.6226 3.1808 3.1808 3.2780 3.2780 3.4670 3.4670 3.5445 3.5445 4.5494 4.5494 4.5593 4.5593 5.7216 5.7216 6.9371 6.9371 8.2635 8.2635 8.4287 8.4287 8.6500 8.6500 9.3064 9.3064 9.9446 9.9446 k = 0.4605 0.5315-0.0000 ( 7150 PWs) bands (ev): -23.9414 -23.9414 -8.4652 -8.4652 -7.7882 -7.7882 -7.6167 -7.6167 -7.5499 -7.5499 -6.9452 -6.9452 -6.8407 -6.8407 -6.7906 -6.7906 -3.0419 -3.0419 0.7145 0.7145 0.9213 0.9213 0.9945 0.9945 1.1232 1.1232 1.2419 1.2419 1.5430 1.5430 1.7572 1.7572 1.9045 1.9045 2.0233 2.0233 2.2183 2.2183 2.2685 2.2685 2.3967 2.3967 2.5059 2.5059 2.6131 2.6131 3.1689 3.1689 3.2690 3.2690 3.4599 3.4599 3.5385 3.5385 4.5546 4.5546 4.5639 4.5639 5.7327 5.7327 6.9292 6.9292 8.2529 8.2529 8.4149 8.4149 8.6655 8.6655 9.3352 9.3352 9.9066 9.9066 k = 0.4737 0.5467-0.0000 ( 7154 PWs) bands (ev): -23.9414 -23.9414 -8.4602 -8.4602 -7.7920 -7.7920 -7.6205 -7.6205 -7.5510 -7.5510 -6.9439 -6.9439 -6.8403 -6.8403 -6.7902 -6.7902 -3.0416 -3.0416 0.7124 0.7124 0.9276 0.9276 0.9945 0.9945 1.1289 1.1289 1.2558 1.2558 1.5351 1.5351 1.7588 1.7588 1.9075 1.9075 2.0237 2.0237 2.2185 2.2185 2.2700 2.2700 2.3973 2.3973 2.5051 2.5051 2.6061 2.6061 3.1601 3.1601 3.2625 3.2625 3.4548 3.4548 3.5342 3.5342 4.5584 4.5584 4.5673 4.5673 5.7407 5.7407 6.9235 6.9235 8.2452 8.2452 8.4050 8.4050 8.6763 8.6763 9.3610 9.3610 9.8745 9.8745 k = 0.4868 0.5619-0.0000 ( 7174 PWs) bands (ev): -23.9414 -23.9414 -8.4571 -8.4571 -7.7945 -7.7945 -7.6227 -7.6227 -7.5516 -7.5516 -6.9431 -6.9431 -6.8401 -6.8401 -6.7899 -6.7899 -3.0414 -3.0414 0.7112 0.7112 0.9314 0.9314 0.9944 0.9944 1.1322 1.1322 1.2645 1.2645 1.5299 1.5299 1.7597 1.7597 1.9093 1.9093 2.0239 2.0239 2.2186 2.2186 2.2710 2.2710 2.3976 2.3976 2.5046 2.5046 2.6019 2.6019 3.1547 3.1547 3.2584 3.2584 3.4518 3.4518 3.5316 3.5316 4.5608 4.5608 4.5693 4.5693 5.7455 5.7455 6.9199 6.9199 8.2405 8.2405 8.3991 8.3991 8.6826 8.6826 9.3794 9.3794 9.8525 9.8525 k = 0.5000 0.5770-0.0000 ( 7182 PWs) bands (ev): -23.9414 -23.9414 -8.4561 -8.4561 -7.7953 -7.7953 -7.6235 -7.6235 -7.5518 -7.5518 -6.9428 -6.9428 -6.8400 -6.8400 -6.7898 -6.7898 -3.0413 -3.0413 0.7107 0.7107 0.9327 0.9327 0.9944 0.9944 1.1334 1.1334 1.2675 1.2675 1.5282 1.5282 1.7600 1.7600 1.9099 1.9099 2.0240 2.0240 2.2187 2.2187 2.2714 2.2714 2.3976 2.3976 2.5045 2.5045 2.6004 2.6004 3.1529 3.1529 3.2571 3.2571 3.4507 3.4507 3.5307 3.5307 4.5615 4.5615 4.5699 4.5699 5.7471 5.7471 6.9187 6.9187 8.2389 8.2389 8.3971 8.3971 8.6846 8.6846 9.3861 9.3861 9.8445 9.8445 k = 0.5000 0.5770-0.0000 ( 7182 PWs) bands (ev): -23.9414 -23.9414 -8.4561 -8.4561 -7.7953 -7.7953 -7.6235 -7.6235 -7.5518 -7.5518 -6.9428 -6.9428 -6.8400 -6.8400 -6.7898 -6.7898 -3.0413 -3.0413 0.7107 0.7107 0.9327 0.9327 0.9944 0.9944 1.1334 1.1334 1.2675 1.2675 1.5282 1.5282 1.7600 1.7600 1.9099 1.9099 2.0240 2.0240 2.2187 2.2187 2.2714 2.2714 2.3976 2.3976 2.5045 2.5045 2.6004 2.6004 3.1529 3.1529 3.2571 3.2571 3.4507 3.4507 3.5307 3.5307 4.5615 4.5615 4.5699 4.5699 5.7471 5.7471 6.9187 6.9187 8.2389 8.2389 8.3971 8.3971 8.6846 8.6846 9.3861 9.3861 9.8445 9.8445 k = 0.4896 0.5861 0.0138 ( 7172 PWs) bands (ev): -23.9414 -23.9414 -8.4565 -8.4564 -7.7965 -7.7936 -7.6249 -7.6214 -7.5514 -7.5514 -6.9430 -6.9428 -6.8405 -6.8400 -6.7902 -6.7901 -3.0409 -3.0409 0.7105 0.7129 0.9147 0.9377 0.9968 0.9989 1.1304 1.1324 1.2543 1.2821 1.5259 1.5334 1.7546 1.7627 1.8883 1.9252 2.0221 2.0272 2.2048 2.2343 2.2700 2.2761 2.3952 2.4023 2.5023 2.5076 2.6009 2.6044 3.1495 3.1520 3.2506 3.2612 3.4475 3.4530 3.5329 3.5404 4.5600 4.5615 4.5674 4.5726 5.7434 5.7448 6.9196 6.9206 8.2261 8.2478 8.3938 8.3943 8.6762 8.7075 9.3846 9.3946 9.8371 9.8461 k = 0.4791 0.5951 0.0276 ( 7156 PWs) bands (ev): -23.9414 -23.9414 -8.4577 -8.4576 -7.7972 -7.7913 -7.6257 -7.6187 -7.5503 -7.5502 -6.9433 -6.9428 -6.8415 -6.8404 -6.7911 -6.7909 -3.0395 -3.0395 0.7121 0.7170 0.8893 0.9295 1.0051 1.0057 1.1240 1.1278 1.2436 1.2963 1.5267 1.5411 1.7466 1.7622 1.8627 1.9323 2.0223 2.0309 2.1947 2.2494 2.2722 2.2841 2.3951 2.4091 2.5014 2.5113 2.6056 2.6127 3.1430 3.1434 3.2468 3.2612 3.4442 3.4548 3.5468 3.5589 4.5546 4.5582 4.5668 4.5775 5.7338 5.7366 6.9232 6.9251 8.2102 8.2522 8.3843 8.3882 8.6830 8.7406 9.3905 9.4098 9.8237 9.8417 k = 0.4687 0.6042 0.0414 ( 7152 PWs) bands (ev): -23.9414 -23.9414 -8.4597 -8.4595 -7.7974 -7.7886 -7.6259 -7.6154 -7.5483 -7.5483 -6.9436 -6.9429 -6.8431 -6.8414 -6.7926 -6.7923 -3.0373 -3.0373 0.7156 0.7229 0.8598 0.9133 1.0119 1.0124 1.1162 1.1203 1.2358 1.3084 1.5305 1.5507 1.7361 1.7580 1.8358 1.9314 2.0242 2.0350 2.1894 2.2624 2.2781 2.2952 2.3973 2.4175 2.5019 2.5154 2.6145 2.6256 3.1251 3.1328 3.2499 3.2591 3.4416 3.4576 3.5695 3.5831 4.5449 4.5492 4.5705 4.5854 5.7184 5.7224 6.9295 6.9322 8.1925 8.2517 8.3721 8.3817 8.7015 8.7788 9.4046 9.4320 9.8044 9.8315 k = 0.4582 0.6132 0.0552 ( 7132 PWs) bands (ev): -23.9414 -23.9414 -8.4624 -8.4623 -7.7971 -7.7854 -7.6255 -7.6113 -7.5457 -7.5455 -6.9441 -6.9431 -6.8454 -6.8431 -6.7944 -6.7940 -3.0342 -3.0342 0.7208 0.7307 0.8277 0.8921 1.0124 1.0178 1.1101 1.1107 1.2305 1.3173 1.5369 1.5611 1.7227 1.7499 1.8104 1.9249 2.0270 2.0393 2.1888 2.2731 2.2878 2.3081 2.4015 2.4268 2.5044 2.5197 2.6274 2.6428 3.0988 3.1175 3.2581 3.2600 3.4400 3.4621 3.5980 3.6107 4.5312 4.5360 4.5771 4.5959 5.6974 5.7025 6.9383 6.9419 8.1748 8.2464 8.3614 8.3762 8.7268 8.8179 9.4276 9.4614 9.7794 9.8155 k = 0.4478 0.6223 0.0691 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.4659 -8.4657 -7.7963 -7.7817 -7.6247 -7.6066 -7.5424 -7.5419 -6.9446 -6.9434 -6.8484 -6.8455 -6.7964 -6.7959 -3.0304 -3.0304 0.7278 0.7402 0.7940 0.8670 1.0053 1.0213 1.0999 1.1073 1.2266 1.3220 1.5454 1.5700 1.7066 1.7379 1.7893 1.9156 2.0299 2.0437 2.1922 2.2824 2.3010 2.3214 2.4076 2.4363 2.5092 2.5243 2.6439 2.6642 3.0675 3.0968 3.2606 3.2750 3.4395 3.4685 3.6299 3.6402 4.5138 4.5193 4.5863 4.6089 5.6710 5.6770 6.9494 6.9539 8.1585 8.2377 8.3544 8.3721 8.7548 8.8545 9.4604 9.4980 9.7491 9.7938 k = 0.4374 0.6313 0.0829 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.4701 -8.4699 -7.7952 -7.7775 -7.6234 -7.6012 -7.5385 -7.5375 -6.9453 -6.9437 -6.8523 -6.8488 -6.7984 -6.7979 -3.0259 -3.0259 0.7359 0.7512 0.7597 0.8386 0.9923 1.0223 1.0887 1.1067 1.2235 1.3223 1.5550 1.5736 1.6911 1.7226 1.7742 1.9060 2.0330 2.0485 2.1983 2.2907 2.3171 2.3341 2.4156 2.4448 2.5171 2.5296 2.6633 2.6892 3.0334 3.0713 3.2669 3.2932 3.4399 3.4767 3.6637 3.6707 4.4929 4.4993 4.5980 4.6244 5.6397 5.6461 6.9628 6.9680 8.1451 8.2279 8.3509 8.3693 8.7824 8.8864 9.5032 9.5417 9.7142 9.7670 k = 0.4269 0.6404 0.0967 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.4750 -8.4747 -7.7936 -7.7729 -7.6217 -7.5953 -7.5339 -7.5322 -6.9461 -6.9441 -6.8572 -6.8532 -6.8001 -6.7998 -3.0208 -3.0208 0.7213 0.7488 0.7623 0.8089 0.9760 1.0197 1.0782 1.1063 1.2206 1.3182 1.5641 1.5660 1.6831 1.7059 1.7648 1.8973 2.0363 2.0535 2.2064 2.2986 2.3350 2.3459 2.4251 2.4516 2.5287 2.5358 2.6852 2.7170 2.9982 3.0423 3.2765 3.3134 3.4412 3.4866 3.6985 3.7015 4.4689 4.4762 4.6124 4.6423 5.6038 5.6105 6.9780 6.9839 8.1354 8.2197 8.3498 8.3675 8.8079 8.9129 9.5556 9.5903 9.6772 9.7354 k = 0.4165 0.6494 0.1105 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4805 -8.4802 -7.7916 -7.7679 -7.6196 -7.5887 -7.5286 -7.5262 -6.9470 -6.9446 -6.8631 -6.8585 -6.8016 -6.8014 -3.0152 -3.0151 0.6856 0.7603 0.7608 0.7913 0.9582 1.0130 1.0692 1.1042 1.2178 1.3102 1.5450 1.5696 1.6863 1.6915 1.7599 1.8904 2.0399 2.0589 2.2157 2.3062 2.3537 2.3567 2.4363 2.4564 2.5434 2.5439 2.7090 2.7469 2.9626 3.0112 3.2881 3.3346 3.4434 3.4981 3.7321 3.7333 4.4421 4.4502 4.6293 4.6625 5.5640 5.5704 6.9947 7.0014 8.1298 8.2146 8.3501 8.3665 8.8302 8.9337 9.6162 9.6164 9.6662 9.7001 k = 0.4165 0.6494 0.1105 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4805 -8.4802 -7.7916 -7.7679 -7.6196 -7.5887 -7.5286 -7.5262 -6.9470 -6.9446 -6.8631 -6.8585 -6.8016 -6.8014 -3.0152 -3.0151 0.6856 0.7603 0.7608 0.7913 0.9582 1.0130 1.0692 1.1042 1.2178 1.3102 1.5450 1.5696 1.6863 1.6915 1.7599 1.8904 2.0399 2.0589 2.2157 2.3062 2.3537 2.3567 2.4363 2.4564 2.5434 2.5439 2.7090 2.7469 2.9626 3.0112 3.2881 3.3346 3.4434 3.4981 3.7321 3.7333 4.4421 4.4502 4.6293 4.6625 5.5640 5.5704 6.9947 7.0014 8.1298 8.2146 8.3501 8.3665 8.8302 8.9337 9.6162 9.6164 9.6662 9.7001 k = 0.3998 0.6436 0.1193 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.4848 -8.4845 -7.7898 -7.7642 -7.6177 -7.5839 -7.5249 -7.5219 -6.9479 -6.9451 -6.8679 -6.8620 -6.8034 -6.8011 -3.0114 -3.0113 0.6617 0.7423 0.7693 0.7970 0.9446 1.0047 1.0642 1.1026 1.2160 1.3034 1.5264 1.5692 1.6851 1.6941 1.7588 1.8874 2.0422 2.0628 2.2220 2.3107 2.3629 2.3656 2.4440 2.4589 2.5485 2.5558 2.7240 2.7671 2.9407 2.9914 3.2967 3.3487 3.4459 3.5069 3.7521 3.7561 4.4232 4.4320 4.6409 4.6760 5.5365 5.5425 7.0065 7.0135 8.1274 8.2136 8.3481 8.3705 8.8432 8.9451 9.5821 9.6460 9.6798 9.7220 k = 0.3832 0.6379 0.1281 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.4902 -8.4899 -7.7870 -7.7596 -7.6149 -7.5782 -7.5207 -7.5170 -6.9497 -6.9460 -6.8737 -6.8649 -6.8054 -6.8005 -3.0075 -3.0075 0.6365 0.7189 0.7790 0.8073 0.9269 0.9905 1.0609 1.1016 1.2147 1.2964 1.5058 1.5642 1.6831 1.7047 1.7587 1.8866 2.0442 2.0676 2.2280 2.3146 2.3685 2.3771 2.4512 2.4619 2.5547 2.5683 2.7378 2.7881 2.9206 2.9730 3.3064 3.3632 3.4502 3.5175 3.7731 3.7800 4.4024 4.4119 4.6521 4.6892 5.5076 5.5130 7.0193 7.0267 8.1238 8.2145 8.3438 8.3812 8.8558 8.9559 9.5471 9.6182 9.7294 9.7719 k = 0.3665 0.6321 0.1369 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.4967 -8.4964 -7.7833 -7.7543 -7.6113 -7.5718 -7.5161 -7.5116 -6.9525 -6.9475 -6.8800 -6.8675 -6.8073 -6.7998 -3.0036 -3.0035 0.6105 0.6935 0.7891 0.8190 0.9054 0.9703 1.0597 1.1010 1.2142 1.2899 1.4848 1.5549 1.6841 1.7175 1.7590 1.8887 2.0463 2.0731 2.2337 2.3179 2.3736 2.3876 2.4572 2.4663 2.5621 2.5811 2.7504 2.8089 2.9024 2.9560 3.3169 3.3774 3.4563 3.5296 3.7951 3.8048 4.3799 4.3901 4.6629 4.7018 5.4778 5.4828 7.0329 7.0404 8.1184 8.2164 8.3404 8.3960 8.8685 8.9662 9.5175 9.5903 9.7798 9.8217 k = 0.3499 0.6263 0.1457 ( 7115 PWs) bands (ev): -23.9414 -23.9414 -8.5040 -8.5037 -7.7789 -7.7484 -7.6069 -7.5645 -7.5111 -7.5057 -6.9563 -6.9497 -6.8866 -6.8699 -6.8090 -6.7988 -2.9996 -2.9995 0.5838 0.6670 0.7982 0.8301 0.8829 0.9446 1.0603 1.1010 1.2149 1.2845 1.4643 1.5424 1.6863 1.7319 1.7597 1.8941 2.0484 2.0792 2.2392 2.3208 2.3781 2.3967 2.4616 2.4726 2.5705 2.5939 2.7619 2.8288 2.8863 2.9405 3.3276 3.3905 3.4642 3.5431 3.8179 3.8304 4.3559 4.3667 4.6728 4.7135 5.4480 5.4527 7.0468 7.0544 8.1108 8.2180 8.3397 8.4136 8.8814 8.9761 9.4944 9.5670 9.8269 9.8690 k = 0.3332 0.6206 0.1546 ( 7111 PWs) bands (ev): -23.9414 -23.9414 -8.5121 -8.5117 -7.7738 -7.7420 -7.6018 -7.5567 -7.5057 -7.4994 -6.9612 -6.9527 -6.8930 -6.8722 -6.8104 -6.7977 -2.9956 -2.9955 0.5566 0.6399 0.8013 0.8357 0.8695 0.9145 1.0619 1.1015 1.2167 1.2807 1.4449 1.5281 1.6883 1.7454 1.7627 1.9030 2.0510 2.0857 2.2445 2.3232 2.3819 2.4047 2.4651 2.4802 2.5798 2.6065 2.7723 2.8463 2.8734 2.9269 3.3380 3.4018 3.4742 3.5578 3.8415 3.8566 4.3305 4.3420 4.6816 4.7239 5.4189 5.4240 7.0605 7.0682 8.1015 8.2176 8.3431 8.4333 8.8948 8.9857 9.4787 9.5489 9.8692 9.9125 k = 0.3165 0.6148 0.1634 ( 7113 PWs) bands (ev): -23.9414 -23.9414 -8.5207 -8.5203 -7.7681 -7.7352 -7.5961 -7.5482 -7.5000 -7.4926 -6.9672 -6.9569 -6.8991 -6.8745 -6.8114 -6.7964 -2.9916 -2.9915 0.5293 0.6125 0.7850 0.8396 0.8739 0.8823 1.0642 1.1026 1.2195 1.2784 1.4269 1.5130 1.6893 1.7505 1.7750 1.9149 2.0538 2.0926 2.2493 2.3251 2.3850 2.4116 2.4684 2.4885 2.5898 2.6186 2.7815 2.8542 2.8700 2.9161 3.3476 3.4105 3.4862 3.5733 3.8655 3.8829 4.3040 4.3161 4.6888 4.7325 5.3913 5.3975 7.0737 7.0812 8.0909 8.2144 8.3508 8.4541 8.9091 8.9953 9.4705 9.5361 9.9053 9.9505 k = 0.2999 0.6090 0.1722 ( 7119 PWs) bands (ev): -23.9414 -23.9414 -8.5297 -8.5293 -7.7621 -7.7283 -7.5896 -7.5393 -7.4940 -7.4856 -6.9742 -6.9624 -6.9046 -6.8769 -6.8119 -6.7950 -2.9876 -2.9874 0.5021 0.5850 0.7534 0.8421 0.8511 0.8900 1.0669 1.1042 1.2231 1.2773 1.4106 1.4977 1.6893 1.7496 1.7939 1.9295 2.0572 2.0998 2.2538 2.3264 2.3871 2.4181 2.4715 2.4972 2.6002 2.6303 2.7888 2.8494 2.8766 2.9116 3.3558 3.4165 3.4998 3.5896 3.8896 3.9090 4.2767 4.2893 4.6940 4.7389 5.3664 5.3741 7.0858 7.0931 8.0799 8.2087 8.3620 8.4752 8.9245 9.0054 9.4692 9.5285 9.9337 9.9814 k = 0.2832 0.6032 0.1810 ( 7111 PWs) bands (ev): -23.9414 -23.9414 -8.5390 -8.5385 -7.7557 -7.7213 -7.5826 -7.5300 -7.4877 -7.4782 -6.9821 -6.9691 -6.9093 -6.8794 -6.8118 -6.7934 -2.9836 -2.9834 0.4750 0.5576 0.7165 0.8044 0.8627 0.9060 1.0700 1.1063 1.2270 1.2772 1.3960 1.4826 1.6884 1.7471 1.8148 1.9459 2.0610 2.1072 2.2580 2.3273 2.3883 2.4244 2.4747 2.5065 2.6105 2.6415 2.7931 2.8470 2.8754 2.9177 3.3621 3.4195 3.5146 3.6061 3.9134 3.9345 4.2489 4.2620 4.6968 4.7425 5.3453 5.3547 7.0965 7.1035 8.0691 8.2014 8.3752 8.4954 8.9416 9.0168 9.4740 9.5254 9.9538 10.0033 k = 0.2666 0.5975 0.1898 ( 7107 PWs) bands (ev): -23.9414 -23.9414 -8.5484 -8.5479 -7.7490 -7.7144 -7.5750 -7.5204 -7.4812 -7.4706 -6.9909 -6.9771 -6.9132 -6.8821 -6.8112 -6.7918 -2.9797 -2.9794 0.4484 0.5307 0.6776 0.7647 0.8762 0.9230 1.0734 1.1088 1.2311 1.2778 1.3832 1.4680 1.6867 1.7440 1.8366 1.9637 2.0653 2.1146 2.2617 2.3278 2.3885 2.4306 2.4780 2.5165 2.6206 2.6521 2.7933 2.8502 2.8687 2.9300 3.3661 3.4195 3.5301 3.6227 3.9364 3.9588 4.2212 4.2345 4.6970 4.7429 5.3289 5.3400 7.1054 7.1121 8.0593 8.1938 8.3885 8.5137 8.9609 9.0305 9.4832 9.5262 9.9664 10.0164 k = 0.2499 0.5917 0.1986 ( 7105 PWs) bands (ev): -23.9414 -23.9414 -8.5578 -8.5573 -7.7422 -7.7076 -7.5670 -7.5107 -7.4745 -7.4629 -7.0004 -6.9862 -6.9165 -6.8850 -6.8101 -6.7901 -2.9758 -2.9755 0.4223 0.5043 0.6380 0.7245 0.8902 0.9405 1.0769 1.1116 1.2346 1.2789 1.3723 1.4540 1.6846 1.7406 1.8587 1.9824 2.0702 2.1221 2.2651 2.3278 2.3879 2.4369 2.4818 2.5272 2.6301 2.6623 2.7902 2.8583 2.8612 2.9438 3.3674 3.4164 3.5457 3.6389 3.9580 3.9813 4.1941 4.2076 4.6943 4.7397 5.3177 5.3303 7.1122 7.1185 8.0511 8.1868 8.4006 8.5293 8.9828 9.0473 9.4949 9.5299 9.9746 10.0235 k = 0.2332 0.5859 0.2074 ( 7105 PWs) bands (ev): -23.9414 -23.9414 -8.5671 -8.5666 -7.7354 -7.7011 -7.5584 -7.5009 -7.4677 -7.4551 -7.0105 -6.9960 -6.9193 -6.8882 -6.8084 -6.7882 -2.9720 -2.9717 0.3970 0.4785 0.5988 0.6845 0.9044 0.9582 1.0804 1.1146 1.2369 1.2805 1.3632 1.4410 1.6823 1.7372 1.8808 2.0015 2.0756 2.1294 2.2679 2.3274 2.3865 2.4427 2.4866 2.5386 2.6391 2.6719 2.7858 2.8532 2.8706 2.9579 3.3656 3.4101 3.5608 3.6545 3.9773 4.0012 4.1684 4.1822 4.6888 4.7332 5.3121 5.3258 7.1168 7.1228 8.0451 8.1813 8.4101 8.5413 9.0076 9.0676 9.5066 9.5359 9.9817 10.0289 k = 0.2166 0.5802 0.2162 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.5761 -8.5757 -7.7285 -7.6949 -7.5495 -7.4913 -7.4608 -7.4473 -7.0212 -7.0065 -6.9217 -6.8915 -6.8064 -6.7864 -2.9683 -2.9680 0.3725 0.4534 0.5606 0.6455 0.9186 0.9758 1.0840 1.1178 1.2372 1.2829 1.3559 1.4291 1.6799 1.7338 1.9026 2.0208 2.0815 2.1366 2.2703 2.3270 2.3847 2.4477 2.4929 2.5507 2.6476 2.6810 2.7809 2.8461 2.8848 2.9721 3.3606 3.4005 3.5750 3.6688 3.9933 4.0174 4.1453 4.1598 4.6809 4.7235 5.3119 5.3264 7.1191 7.1247 8.0418 8.1779 8.4163 8.5493 9.0354 9.0916 9.5160 9.5432 9.9910 10.0360 k = 0.1999 0.5744 0.2250 ( 7106 PWs) bands (ev): -23.9414 -23.9414 -8.5849 -8.5844 -7.7218 -7.6892 -7.5403 -7.4819 -7.4537 -7.4395 -7.0321 -7.0174 -6.9238 -6.8950 -6.8039 -6.7845 -2.9647 -2.9644 0.3491 0.4288 0.5243 0.6078 0.9328 0.9934 1.0876 1.1211 1.2353 1.2860 1.3498 1.4186 1.6776 1.7303 1.9238 2.0399 2.0878 2.1436 2.2720 2.3265 2.3825 2.4513 2.5012 2.5635 2.6557 2.6897 2.7763 2.8398 2.9008 2.9863 3.3523 3.3876 3.5878 3.6814 4.0043 4.0283 4.1264 4.1426 4.6711 4.7113 5.3167 5.3315 7.1193 7.1246 8.0414 8.1770 8.4187 8.5533 9.0659 9.1187 9.5220 9.5504 10.0046 10.0469 k = 0.1833 0.5686 0.2339 ( 7112 PWs) bands (ev): -23.9414 -23.9414 -8.5932 -8.5928 -7.7151 -7.6839 -7.5309 -7.4731 -7.4465 -7.4319 -7.0432 -7.0285 -6.9256 -6.8985 -6.8012 -6.7827 -2.9613 -2.9610 0.3269 0.4048 0.4904 0.5719 0.9468 1.0106 1.0910 1.1246 1.2310 1.2897 1.3446 1.4096 1.6757 1.7269 1.9441 2.0584 2.0944 2.1505 2.2729 2.3263 2.3802 2.4536 2.5115 2.5769 2.6637 2.6979 2.7722 2.8341 2.9182 3.0005 3.3405 3.3715 3.5985 3.6916 4.0088 4.0320 4.1142 4.1327 4.6600 4.6974 5.3257 5.3404 7.1175 7.1224 8.0440 8.1789 8.4173 8.5531 9.0985 9.1483 9.5245 9.5557 10.0235 10.0625 k = 0.1666 0.5628 0.2427 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.6010 -8.6006 -7.7087 -7.6791 -7.5213 -7.4650 -7.4390 -7.4245 -7.0544 -7.0397 -6.9272 -6.9021 -6.7983 -6.7809 -2.9580 -2.9577 0.3061 0.3810 0.4598 0.5381 0.9607 1.0274 1.0941 1.1283 1.2249 1.2932 1.3399 1.4025 1.6742 1.7235 1.9633 2.0760 2.1009 2.1578 2.2728 2.3264 2.3781 2.4546 2.5236 2.5908 2.6719 2.7057 2.7688 2.8291 2.9367 3.0147 3.3254 3.3524 3.6067 3.6986 4.0066 4.0282 4.1101 4.1303 4.6482 4.6826 5.3379 5.3523 7.1141 7.1186 8.0496 8.1836 8.4122 8.5492 9.1326 9.1794 9.5241 9.5581 10.0474 10.0829 k = 0.1499 0.5571 0.2515 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.6083 -8.6079 -7.7024 -7.6749 -7.5117 -7.4579 -7.4314 -7.4174 -7.0653 -7.0508 -6.9286 -6.9057 -6.7953 -6.7792 -2.9550 -2.9547 0.2868 0.3574 0.4330 0.5067 0.9744 1.0435 1.0969 1.1322 1.2176 1.2954 1.3361 1.3971 1.6733 1.7201 1.9813 2.0923 2.1069 2.1660 2.2715 2.3269 2.3766 2.4546 2.5369 2.6046 2.6805 2.7134 2.7664 2.8249 2.9562 3.0285 3.3072 3.3307 3.6120 3.7017 4.0005 4.0199 4.1123 4.1327 4.6366 4.6676 5.3524 5.3663 7.1093 7.1135 8.0582 8.1911 8.4038 8.5417 9.1671 9.2107 9.5215 9.5573 10.0750 10.1071 k = 0.1333 0.5513 0.2603 ( 7111 PWs) bands (ev): -23.9414 -23.9414 -8.6150 -8.6146 -7.6965 -7.6713 -7.5021 -7.4518 -7.4238 -7.4107 -7.0758 -7.0617 -6.9297 -6.9092 -6.7923 -6.7777 -2.9521 -2.9519 0.2692 0.3340 0.4103 0.4779 0.9878 1.0588 1.0993 1.1364 1.2096 1.2947 1.3343 1.3931 1.6729 1.7167 1.9979 2.1068 2.1119 2.1754 2.2692 2.3273 2.3761 2.4536 2.5508 2.6178 2.6899 2.7213 2.7650 2.8213 2.9762 3.0418 3.2863 3.3070 3.6141 3.7004 3.9937 4.0110 4.1175 4.1370 4.6255 4.6531 5.3683 5.3813 7.1037 7.1075 8.0695 8.2012 8.3926 8.5311 9.2011 9.2411 9.5175 9.5539 10.1043 10.1338 k = 0.1166 0.5455 0.2691 ( 7115 PWs) bands (ev): -23.9414 -23.9414 -8.6210 -8.6207 -7.6909 -7.6682 -7.4928 -7.4469 -7.4161 -7.4044 -7.0858 -7.0723 -6.9307 -6.9125 -6.7894 -6.7763 -2.9496 -2.9494 0.2534 0.3112 0.3916 0.4518 1.0009 1.0730 1.1010 1.1410 1.2014 1.2903 1.3355 1.3901 1.6731 1.7132 2.0132 2.1139 2.1211 2.1861 2.2660 2.3273 2.3770 2.4518 2.5646 2.6295 2.7003 2.7302 2.7649 2.8186 2.9965 3.0539 3.2632 3.2820 3.6133 3.6945 3.9885 4.0039 4.1233 4.1415 4.6153 4.6395 5.3846 5.3966 7.0977 7.1011 8.0831 8.2135 8.3793 8.5178 9.2335 9.2697 9.5129 9.5487 10.1333 10.1609 k = 0.1000 0.5398 0.2779 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.6263 -8.6260 -7.6858 -7.6658 -7.4838 -7.4431 -7.4088 -7.3987 -7.0949 -7.0823 -6.9314 -6.9157 -6.7865 -6.7752 -2.9473 -2.9471 0.2398 0.2897 0.3766 0.4287 1.0136 1.0857 1.1021 1.1459 1.1936 1.2828 1.3388 1.3875 1.6739 1.7097 2.0271 2.1149 2.1333 2.1971 2.2627 2.3261 2.3797 2.4492 2.5780 2.6385 2.7118 2.7407 2.7658 2.8170 3.0166 3.0641 3.2389 3.2568 3.6102 3.6846 3.9857 3.9993 4.1287 4.1452 4.6065 4.6271 5.4006 5.4113 7.0916 7.0946 8.0988 8.2274 8.3646 8.5020 9.2635 9.2953 9.5084 9.5424 10.1601 10.1861 k = 0.0833 0.5340 0.2867 ( 7125 PWs) bands (ev): -23.9414 -23.9414 -8.6308 -8.6305 -7.6810 -7.6641 -7.4752 -7.4404 -7.4020 -7.3936 -7.1029 -7.0915 -6.9318 -6.9187 -6.7839 -6.7743 -2.9453 -2.9451 0.2284 0.2701 0.3650 0.4085 1.0259 1.0957 1.1034 1.1507 1.1873 1.2733 1.3435 1.3850 1.6752 1.7061 2.0398 2.1138 2.1448 2.2070 2.2604 2.3235 2.3843 2.4459 2.5904 2.6443 2.7239 2.7533 2.7675 2.8170 3.0356 3.0714 3.2142 3.2327 3.6058 3.6716 3.9853 3.9970 4.1334 4.1478 4.5991 4.6162 5.4155 5.4248 7.0859 7.0885 8.1163 8.2417 8.3499 8.4842 9.2900 9.3172 9.5047 9.5358 10.1837 10.2075 k = 0.0666 0.5282 0.2955 ( 7111 PWs) bands (ev): -23.9414 -23.9414 -8.6345 -8.6343 -7.6767 -7.6629 -7.4673 -7.4389 -7.3960 -7.3893 -7.1096 -7.0998 -6.9320 -6.9214 -6.7815 -6.7737 -2.9437 -2.9435 0.2195 0.2527 0.3565 0.3912 1.0378 1.0980 1.1095 1.1535 1.1845 1.2627 1.3486 1.3824 1.6771 1.7025 2.0514 2.1111 2.1558 2.2131 2.2609 2.3195 2.3902 2.4419 2.6017 2.6468 2.7354 2.7678 2.7695 2.8189 3.0526 3.0752 3.1910 3.2114 3.6012 3.6567 3.9867 3.9964 4.1373 4.1493 4.5933 4.6069 5.4288 5.4364 7.0808 7.0829 8.1352 8.2538 8.3378 8.4647 9.3125 9.3347 9.5026 9.5295 10.2035 10.2239 k = 0.0500 0.5225 0.3044 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6374 -8.6373 -7.6729 -7.6625 -7.4601 -7.4385 -7.3908 -7.3859 -7.1147 -7.1070 -6.9318 -6.9239 -6.7793 -6.7735 -2.9423 -2.9422 0.2133 0.2381 0.3509 0.3768 1.0491 1.0957 1.1174 1.1523 1.1874 1.2514 1.3538 1.3795 1.6794 1.6989 2.0620 2.1070 2.1664 2.2138 2.2657 2.3142 2.3971 2.4372 2.6116 2.6464 2.7452 2.7699 2.7845 2.8227 3.0652 3.0754 3.1718 3.1940 3.5979 3.6414 3.9891 3.9967 4.1405 4.1498 4.5891 4.5993 5.4399 5.4458 7.0766 7.0782 8.1552 8.2583 8.3337 8.4438 9.3306 9.3475 9.5022 9.5237 10.2192 10.2352 k = 0.0333 0.5167 0.3132 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.6395 -8.6394 -7.6697 -7.6627 -7.4539 -7.4393 -7.3868 -7.3836 -7.1181 -7.1127 -6.9313 -6.9261 -6.7775 -6.7735 -2.9414 -2.9413 0.2099 0.2263 0.3482 0.3654 1.0597 1.0915 1.1245 1.1480 1.1950 1.2397 1.3590 1.3762 1.6821 1.6953 2.0716 2.1018 2.1765 2.2099 2.2735 2.3076 2.4044 2.4317 2.6204 2.6440 2.7530 2.7692 2.8007 2.8266 3.0697 3.0750 3.1600 3.1807 3.5969 3.6269 3.9919 3.9971 4.1431 4.1495 4.5866 4.5934 5.4485 5.4524 7.0736 7.0747 8.1758 8.2512 8.3416 8.4221 9.3442 9.3555 9.5036 9.5186 10.2310 10.2420 k = 0.0167 0.5109 0.3220 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.6408 -8.6408 -7.6670 -7.6635 -7.4486 -7.4412 -7.3841 -7.3825 -7.1196 -7.1168 -6.9305 -6.9279 -6.7759 -6.7740 -2.9408 -2.9408 0.2094 0.2176 0.3483 0.3569 1.0694 1.0855 1.1308 1.1426 1.2050 1.2279 1.3638 1.3725 1.6851 1.6918 2.0804 2.0955 2.1862 2.2033 2.2826 2.3001 2.4117 2.4256 2.6280 2.6399 2.7590 2.7671 2.8146 2.8280 3.0690 3.0735 3.1576 3.1703 3.5992 3.6145 3.9943 3.9970 4.1452 4.1485 4.5858 4.5892 5.4541 5.4561 7.0718 7.0724 8.1966 8.2359 8.3580 8.3999 9.3533 9.3590 9.5063 9.5140 10.2391 10.2446 k = 0.0000 0.5051 0.3308 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6412 -8.6412 -7.6649 -7.6649 -7.4443 -7.4443 -7.3826 -7.3826 -7.1191 -7.1191 -6.9294 -6.9294 -6.7748 -6.7748 -2.9406 -2.9406 0.2119 0.2119 0.3512 0.3512 1.0781 1.0781 1.1368 1.1368 1.2162 1.2162 1.3684 1.3684 1.6884 1.6884 2.0884 2.0884 2.1952 2.1952 2.2917 2.2917 2.4189 2.4189 2.6345 2.6345 2.7637 2.7637 2.8242 2.8242 3.0702 3.0702 3.1623 3.1623 3.6051 3.6051 3.9961 3.9961 4.1471 4.1471 4.5867 4.5867 5.4567 5.4567 7.0714 7.0714 8.2170 8.2170 8.3782 8.3782 9.3582 9.3582 9.5099 9.5099 10.2436 10.2436 k = 0.0000 0.5051 0.3308 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6412 -8.6412 -7.6649 -7.6649 -7.4443 -7.4443 -7.3826 -7.3826 -7.1191 -7.1191 -6.9294 -6.9294 -6.7748 -6.7748 -2.9406 -2.9406 0.2119 0.2119 0.3512 0.3512 1.0781 1.0781 1.1368 1.1368 1.2162 1.2162 1.3684 1.3684 1.6884 1.6884 2.0884 2.0884 2.1952 2.1952 2.2917 2.2917 2.4189 2.4189 2.6345 2.6345 2.7637 2.7637 2.8242 2.8242 3.0702 3.0702 3.1623 3.1623 3.6051 3.6051 3.9961 3.9961 4.1471 4.1471 4.5867 4.5867 5.4567 5.4567 7.0714 7.0714 8.2170 8.2170 8.3782 8.3782 9.3582 9.3582 9.5099 9.5099 10.2436 10.2436 k = 0.0109 0.4957 0.3452 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.6411 -8.6409 -7.6669 -7.6633 -7.4464 -7.4425 -7.3883 -7.3776 -7.1192 -7.1180 -6.9308 -6.9279 -6.7754 -6.7748 -2.9402 -2.9399 0.2092 0.2143 0.3502 0.3517 1.0671 1.0830 1.1281 1.1399 1.2106 1.2267 1.3716 1.3717 1.6867 1.6878 2.0841 2.0874 2.1912 2.2010 2.2833 2.2942 2.4105 2.4329 2.6289 2.6395 2.7570 2.7581 2.8185 2.8456 3.0669 3.0805 3.1575 3.1699 3.6034 3.6086 3.9941 3.9978 4.1445 4.1485 4.5862 4.5882 5.4539 5.4539 7.0680 7.0686 8.2166 8.2200 8.3786 8.3796 9.3356 9.3629 9.5002 9.5310 10.2340 10.2432 k = 0.0217 0.4863 0.3596 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.6405 -8.6401 -7.6691 -7.6619 -7.4489 -7.4411 -7.3945 -7.3732 -7.1182 -7.1158 -6.9321 -6.9263 -6.7767 -6.7755 -2.9387 -2.9381 0.2062 0.2162 0.3489 0.3519 1.0515 1.0776 1.1179 1.1395 1.2108 1.2374 1.3805 1.3821 1.6828 1.6850 2.0751 2.0817 2.1886 2.2071 2.2699 2.2928 2.4079 2.4509 2.6241 2.6419 2.7385 2.7493 2.8298 2.8728 3.0708 3.0967 3.1559 3.1802 3.6038 3.6139 3.9920 3.9992 4.1408 4.1487 4.5868 4.5909 5.4455 5.4455 7.0584 7.0596 8.2187 8.2257 8.3807 8.3826 9.3027 9.3466 9.5055 9.5563 10.2166 10.2332 k = 0.0326 0.4769 0.3739 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.6395 -8.6390 -7.6716 -7.6609 -7.4516 -7.4399 -7.4013 -7.3696 -7.1162 -7.1126 -6.9332 -6.9247 -6.7787 -6.7768 -2.9361 -2.9353 0.2030 0.2178 0.3473 0.3517 1.0326 1.0590 1.1135 1.1382 1.2141 1.2449 1.3935 1.3993 1.6768 1.6799 2.0629 2.0725 2.1863 2.2101 2.2551 2.2896 2.4095 2.4706 2.6209 2.6385 2.7197 2.7410 2.8498 2.9020 3.0819 3.1172 3.1585 3.1931 3.6060 3.6203 3.9899 4.0004 4.1360 4.1477 4.5884 4.5945 5.4317 5.4318 7.0433 7.0450 8.2230 8.2336 8.3843 8.3870 9.2639 9.3160 9.5193 9.5812 10.1939 10.2159 k = 0.0435 0.4675 0.3883 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.6382 -8.6374 -7.6742 -7.6602 -7.4547 -7.4391 -7.4083 -7.3668 -7.1131 -7.1085 -6.9342 -6.9231 -6.7813 -6.7788 -2.9324 -2.9314 0.1995 0.2188 0.3454 0.3511 1.0116 1.0328 1.1126 1.1370 1.2178 1.2488 1.4095 1.4214 1.6689 1.6727 2.0490 2.0610 2.1831 2.2038 2.2463 2.2865 2.4135 2.4903 2.6197 2.6263 2.7072 2.7340 2.8750 2.9322 3.0996 3.1380 3.1690 3.2089 3.6100 3.6276 3.9878 4.0015 4.1301 4.1455 4.5909 4.5989 5.4125 5.4127 7.0233 7.0255 8.2289 8.2434 8.3893 8.3927 9.2217 9.2785 9.5349 9.6039 10.1683 10.1939 k = 0.0543 0.4581 0.4027 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.6364 -8.6354 -7.6770 -7.6600 -7.4582 -7.4387 -7.4154 -7.3646 -7.1090 -7.1034 -6.9349 -6.9216 -6.7846 -6.7815 -2.9278 -2.9266 0.1958 0.2194 0.3433 0.3501 0.9894 1.0041 1.1125 1.1360 1.2210 1.2495 1.4275 1.4462 1.6591 1.6634 2.0346 2.0480 2.1782 2.1868 2.2456 2.2843 2.4187 2.5083 2.6067 2.6208 2.7016 2.7284 2.9048 2.9633 3.1227 3.1529 3.1928 3.2279 3.6153 3.6352 3.9862 4.0026 4.1230 4.1420 4.5939 4.6038 5.3880 5.3886 6.9995 7.0020 8.2357 8.2543 8.3953 8.3991 9.1774 9.2377 9.5494 9.6236 10.1410 10.1691 k = 0.0652 0.4486 0.4171 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.6342 -8.6331 -7.6799 -7.6601 -7.4619 -7.4394 -7.4219 -7.3632 -7.1040 -7.0974 -6.9354 -6.9201 -6.7885 -6.7847 -2.9224 -2.9209 0.1920 0.2194 0.3409 0.3487 0.9670 0.9750 1.1123 1.1353 1.2232 1.2480 1.4463 1.4719 1.6478 1.6522 2.0206 2.0345 2.1654 2.1719 2.2474 2.2833 2.4241 2.5215 2.5861 2.6239 2.7000 2.7242 2.9387 2.9955 3.1498 3.1650 3.2263 3.2507 3.6216 3.6425 3.9849 4.0037 4.1148 4.1370 4.5974 4.6091 5.3585 5.3596 6.9727 6.9756 8.2428 8.2658 8.4018 8.4058 9.1320 9.1955 9.5621 9.6403 10.1131 10.1427 k = 0.0761 0.4392 0.4315 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.6318 -8.6305 -7.6829 -7.6606 -7.4658 -7.4422 -7.4265 -7.3624 -7.0982 -7.0907 -6.9357 -6.9188 -6.7930 -6.7886 -2.9161 -2.9145 0.1881 0.2188 0.3383 0.3469 0.9450 0.9466 1.1118 1.1348 1.2243 1.2446 1.4651 1.4971 1.6352 1.6394 2.0076 2.0208 2.1433 2.1644 2.2491 2.2833 2.4290 2.5213 2.5757 2.6289 2.7003 2.7214 2.9764 3.0291 3.1785 3.1792 3.2651 3.2781 3.6282 3.6491 3.9843 4.0051 4.1054 4.1306 4.6009 4.6144 5.3244 5.3260 6.9441 6.9472 8.2497 8.2772 8.4084 8.4125 9.0864 9.1529 9.5730 9.6541 10.0850 10.1156 k = 0.0870 0.4298 0.4459 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.6290 -8.6277 -7.6859 -7.6615 -7.4700 -7.4478 -7.4284 -7.3623 -7.0915 -7.0832 -6.9358 -6.9175 -6.7982 -6.7932 -2.9092 -2.9074 0.1841 0.2176 0.3355 0.3446 0.9195 0.9238 1.1109 1.1344 1.2244 1.2397 1.4832 1.5209 1.6218 1.6254 1.9959 2.0075 2.1219 2.1564 2.2498 2.2839 2.4332 2.5039 2.5809 2.6351 2.7018 2.7199 3.0174 3.0643 3.1946 3.2092 3.3072 3.3107 3.6347 3.6545 3.9843 4.0066 4.0949 4.1227 4.6043 4.6194 5.2858 5.2882 6.9147 6.9180 8.2560 8.2880 8.4144 8.4186 9.0410 9.1105 9.5827 9.6658 10.0572 10.0884 k = 0.0978 0.4204 0.4602 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.6260 -8.6245 -7.6889 -7.6628 -7.4744 -7.4550 -7.4285 -7.3627 -7.0840 -7.0751 -6.9356 -6.9164 -6.8039 -6.7983 -2.9017 -2.8998 0.1801 0.2158 0.3326 0.3421 0.8942 0.9037 1.1097 1.1341 1.2236 1.2335 1.5000 1.5424 1.6081 1.6105 1.9857 1.9948 2.1017 2.1482 2.2496 2.2845 2.4364 2.4801 2.5916 2.6420 2.7044 2.7199 3.0614 3.1012 3.2138 3.2390 3.3487 3.3521 3.6408 3.6587 3.9846 4.0081 4.0832 4.1131 4.6072 4.6239 5.2431 5.2464 6.8854 6.8889 8.2611 8.2975 8.4195 8.4237 8.9966 9.0687 9.5922 9.6758 10.0302 10.0614 k = 0.1087 0.4110 0.4746 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.6228 -8.6213 -7.6919 -7.6644 -7.4788 -7.4628 -7.4280 -7.3637 -7.0759 -7.0663 -6.9353 -6.9155 -6.8102 -6.8040 -2.8938 -2.8918 0.1762 0.2134 0.3296 0.3391 0.8710 0.8850 1.1080 1.1337 1.2220 1.2261 1.5150 1.5603 1.5954 1.5955 1.9771 1.9832 2.0833 2.1400 2.2484 2.2846 2.4383 2.4557 2.6029 2.6491 2.7081 2.7213 3.1078 3.1398 3.2362 3.2685 3.3915 3.3990 3.6461 3.6614 3.9851 4.0092 4.0705 4.1018 4.6094 4.6277 5.1967 5.2011 6.8572 6.8607 8.2650 8.3054 8.4232 8.4275 8.9535 9.0278 9.6021 9.6852 10.0044 10.0351 k = 0.1196 0.4015 0.4890 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.6195 -8.6179 -7.6947 -7.6665 -7.4833 -7.4706 -7.4270 -7.3651 -7.0672 -7.0571 -6.9347 -6.9147 -6.8170 -6.8102 -2.8856 -2.8836 0.1724 0.2104 0.3265 0.3359 0.8500 0.8678 1.1059 1.1333 1.2176 1.2197 1.5274 1.5674 1.5814 1.5912 1.9702 1.9727 2.0667 2.1319 2.2465 2.2839 2.4330 2.4390 2.6135 2.6561 2.7129 2.7239 3.1562 3.1800 3.2620 3.2981 3.4380 3.4474 3.6506 3.6630 3.9851 4.0095 4.0569 4.0888 4.6108 4.6304 5.1472 5.1527 6.8308 6.8342 8.2675 8.3114 8.4252 8.4296 8.9122 8.9879 9.6132 9.6944 9.9802 10.0101 k = 0.1304 0.3921 0.5034 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.6161 -8.6144 -7.6973 -7.6689 -7.4879 -7.4782 -7.4257 -7.3670 -7.0579 -7.0474 -6.9340 -6.9141 -6.8244 -6.8170 -2.8773 -2.8753 0.1688 0.2068 0.3233 0.3324 0.8314 0.8522 1.1034 1.1327 1.2083 1.2166 1.5346 1.5582 1.5711 1.6009 1.9638 1.9648 2.0521 2.1238 2.2441 2.2818 2.4130 2.4385 2.6231 2.6625 2.7185 2.7277 3.2062 3.2215 3.2912 3.3281 3.4870 3.4969 3.6543 3.6639 3.9843 4.0079 4.0428 4.0739 4.6111 4.6321 5.0948 5.1017 6.8067 6.8100 8.2687 8.3152 8.4254 8.4299 8.8731 8.9493 9.6262 9.7042 9.9582 9.9867 k = 0.1413 0.3827 0.5178 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.6126 -8.6110 -7.6998 -7.6716 -7.4923 -7.4854 -7.4242 -7.3692 -7.0482 -7.0374 -6.9331 -6.9137 -6.8322 -6.8243 -2.8690 -2.8670 0.1654 0.2028 0.3201 0.3287 0.8154 0.8383 1.1007 1.1318 1.1986 1.2129 1.5321 1.5453 1.5699 1.6124 1.9564 1.9607 2.0395 2.1156 2.2411 2.2778 2.3965 2.4368 2.6319 2.6684 2.7246 2.7323 3.2573 3.2642 3.3237 3.3590 3.5368 3.5465 3.6578 3.6650 3.9818 4.0029 4.0294 4.0572 4.6105 4.6325 5.0403 5.0485 6.7854 6.7885 8.2687 8.3169 8.4235 8.4284 8.8364 8.9120 9.6412 9.7147 9.9388 9.9653 k = 0.1522 0.3733 0.5321 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.6092 -8.6077 -7.7020 -7.6747 -7.4966 -7.4921 -7.4225 -7.3717 -7.0381 -7.0270 -6.9321 -6.9134 -6.8405 -6.8320 -2.8609 -2.8590 0.1624 0.1983 0.3169 0.3249 0.8018 0.8259 1.0978 1.1304 1.1887 1.2086 1.5220 1.5324 1.5758 1.6223 1.9508 1.9579 2.0287 2.1071 2.2376 2.2717 2.3843 2.4340 2.6400 2.6736 2.7310 2.7374 3.3075 3.3090 3.3592 3.3908 3.5842 3.5946 3.6625 3.6693 3.9771 3.9927 4.0180 4.0387 4.6089 4.6318 4.9841 4.9938 6.7671 6.7701 8.2678 8.3164 8.4199 8.4252 8.8024 8.8763 9.6582 9.7260 9.9225 9.9464 k = 0.1630 0.3639 0.5465 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.6060 -8.6045 -7.7038 -7.6779 -7.5008 -7.4982 -7.4206 -7.3745 -7.0276 -7.0164 -6.9310 -6.9134 -6.8492 -6.8402 -2.8531 -2.8513 0.1598 0.1936 0.3138 0.3210 0.7906 0.8151 1.0948 1.1284 1.1794 1.2038 1.5103 1.5201 1.5835 1.6302 1.9470 1.9561 2.0198 2.0980 2.2339 2.2636 2.3761 2.4304 2.6474 2.6782 2.7374 2.7427 3.3510 3.3606 3.3971 3.4237 3.6198 3.6344 3.6749 3.6858 3.9695 3.9777 4.0076 4.0185 4.6065 4.6300 4.9271 4.9381 6.7520 6.7547 8.2663 8.3139 8.4148 8.4205 8.7716 8.8423 9.6769 9.7377 9.9097 9.9302 k = 0.1739 0.3545 0.5609 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6029 -8.6015 -7.7053 -7.6813 -7.5047 -7.5036 -7.4185 -7.3774 -7.0169 -7.0057 -6.9298 -6.9135 -6.8582 -6.8487 -2.8458 -2.8441 0.1577 0.1888 0.3108 0.3173 0.7818 0.8057 1.0918 1.1253 1.1712 1.1987 1.4991 1.5087 1.5914 1.6361 1.9451 1.9552 2.0125 2.0885 2.2301 2.2544 2.3717 2.4260 2.6544 2.6820 2.7436 2.7478 3.3944 3.4110 3.4366 3.4581 3.6344 3.6517 3.7087 3.7234 3.9583 3.9607 3.9959 3.9970 4.6035 4.6272 4.8700 4.8825 6.7399 6.7423 8.2646 8.3097 8.4085 8.4148 8.7441 8.8104 9.6964 9.7491 9.9006 9.9171 k = 0.1848 0.3450 0.5753 ( 7114 PWs) bands (ev): -23.9414 -23.9414 -8.6000 -8.5988 -7.7064 -7.6848 -7.5083 -7.5083 -7.4162 -7.3805 -7.0059 -6.9949 -6.9286 -6.9138 -6.8676 -6.8576 -2.8392 -2.8377 0.1560 0.1838 0.3080 0.3137 0.7752 0.7976 1.0891 1.1210 1.1649 1.1933 1.4892 1.4984 1.5989 1.6401 1.9449 1.9549 2.0069 2.0783 2.2261 2.2449 2.3700 2.4210 2.6609 2.6852 2.7492 2.7526 3.4370 3.4585 3.4764 3.4941 3.6391 3.6590 3.7505 3.7707 3.9428 3.9439 3.9748 3.9813 4.6000 4.6236 4.8141 4.8279 6.7307 6.7328 8.2629 8.3043 8.4016 8.4083 8.7204 8.7808 9.7157 9.7593 9.8956 9.9074 k = 0.1957 0.3356 0.5897 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5975 -8.5964 -7.7071 -7.6883 -7.5122 -7.5115 -7.4138 -7.3836 -6.9949 -6.9841 -6.9275 -6.9142 -6.8771 -6.8667 -2.8333 -2.8320 0.1550 0.1790 0.3055 0.3103 0.7705 0.7907 1.0868 1.1154 1.1608 1.1877 1.4807 1.4893 1.6059 1.6423 1.9462 1.9550 2.0030 2.0677 2.2224 2.2360 2.3705 2.4157 2.6669 2.6875 2.7541 2.7568 3.4779 3.5006 3.5151 3.5320 3.6434 3.6667 3.7872 3.8181 3.9225 3.9303 3.9530 3.9637 4.5961 4.6193 4.7608 4.7758 6.7240 6.7257 8.2617 8.2979 8.3946 8.4015 8.7008 8.7539 9.7338 9.7676 9.8943 9.9011 k = 0.2065 0.3262 0.6041 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5953 -8.5944 -7.7072 -7.6917 -7.5153 -7.5143 -7.4112 -7.3869 -6.9839 -6.9736 -6.9264 -6.9150 -6.8865 -6.8759 -2.8282 -2.8272 0.1546 0.1743 0.3035 0.3073 0.7676 0.7847 1.0852 1.1091 1.1587 1.1822 1.4741 1.4815 1.6126 1.6430 1.9485 1.9555 2.0009 2.0567 2.2190 2.2283 2.3724 2.4102 2.6723 2.6891 2.7583 2.7604 3.5153 3.5361 3.5511 3.5678 3.6532 3.6784 3.8104 3.8589 3.8983 3.9219 3.9346 3.9475 4.5918 4.6140 4.7122 4.7282 6.7193 6.7207 8.2610 8.2911 8.3882 8.3948 8.6856 8.7300 9.7493 9.7737 9.8960 9.8982 k = 0.2174 0.3168 0.6184 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.5935 -8.5928 -7.7069 -7.6950 -7.5176 -7.5166 -7.4085 -7.3901 -6.9731 -6.9635 -6.9255 -6.9161 -6.8955 -6.8850 -2.8242 -2.8234 0.1548 0.1699 0.3019 0.3048 0.7662 0.7797 1.0843 1.1028 1.1582 1.1769 1.4691 1.4751 1.6187 1.6423 1.9512 1.9560 2.0010 2.0456 2.2161 2.2220 2.3754 2.4046 2.6771 2.6899 2.7617 2.7632 3.5459 3.5643 3.5837 3.5947 3.6754 3.6964 3.8150 3.8674 3.8794 3.9046 3.9342 3.9506 4.5865 4.6067 4.6721 4.6878 6.7163 6.7174 8.2612 8.2844 8.3830 8.3887 8.6749 8.7095 9.7616 9.7775 9.8984 9.8992 k = 0.2283 0.3074 0.6328 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.5921 -8.5917 -7.7061 -7.6980 -7.5192 -7.5184 -7.4057 -7.3934 -6.9628 -6.9546 -6.9250 -6.9182 -6.9027 -6.8936 -2.8212 -2.8206 0.1558 0.1660 0.3008 0.3028 0.7662 0.7754 1.0845 1.0969 1.1591 1.1720 1.4660 1.4702 1.6243 1.6405 1.9538 1.9565 2.0034 2.0347 2.2140 2.2174 2.3791 2.3990 2.6812 2.6898 2.7642 2.7652 3.5669 3.5812 3.6122 3.6146 3.7095 3.7208 3.8077 3.8395 3.8639 3.8770 3.9570 3.9677 4.5800 4.5951 4.6457 4.6580 6.7145 6.7153 8.2624 8.2781 8.3793 8.3836 8.6690 8.6927 9.7702 9.7795 9.9004 9.9025 k = 0.2391 0.2979 0.6472 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5913 -8.5910 -7.7047 -7.7007 -7.5200 -7.5196 -7.4027 -7.3966 -6.9536 -6.9483 -6.9249 -6.9218 -6.9063 -6.9008 -2.8193 -2.8190 0.1574 0.1625 0.3004 0.3014 0.7672 0.7719 1.0858 1.0920 1.1611 1.1677 1.4646 1.4667 1.6294 1.6376 1.9555 1.9567 2.0083 2.0245 2.2129 2.2144 2.3835 2.3935 2.6846 2.6889 2.7658 2.7663 3.5793 3.5867 3.6314 3.6326 3.7471 3.7495 3.7976 3.8098 3.8440 3.8485 3.9773 3.9821 4.5741 4.5814 4.6344 4.6404 6.7137 6.7141 8.2647 8.2726 8.3775 8.3798 8.6680 8.6800 9.7758 9.7800 9.9030 9.9045 k = 0.2500 0.2885 0.6616 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5909 -8.5909 -7.7029 -7.7029 -7.5201 -7.5201 -7.3997 -7.3997 -6.9477 -6.9477 -6.9245 -6.9245 -6.9055 -6.9055 -2.8186 -2.8186 0.1596 0.1596 0.3006 0.3006 0.7691 0.7691 1.0883 1.0883 1.1640 1.1640 1.4648 1.4648 1.6339 1.6339 1.9565 1.9565 2.0155 2.0155 2.2129 2.2129 2.3884 2.3884 2.6871 2.6871 2.7665 2.7665 3.5855 3.5855 3.6393 3.6393 3.7764 3.7764 3.7832 3.7832 3.8342 3.8342 3.9862 3.9862 4.5734 4.5734 4.6333 4.6333 6.7136 6.7136 8.2681 8.2681 8.3777 8.3777 8.6717 8.6717 9.7788 9.7788 9.9046 9.9046 k = 0.2500 0.2885 0.6616 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5909 -8.5909 -7.7029 -7.7029 -7.5201 -7.5201 -7.3997 -7.3997 -6.9477 -6.9477 -6.9245 -6.9245 -6.9055 -6.9055 -2.8186 -2.8186 0.1596 0.1596 0.3006 0.3006 0.7691 0.7691 1.0883 1.0883 1.1640 1.1640 1.4648 1.4648 1.6339 1.6339 1.9565 1.9565 2.0155 2.0155 2.2129 2.2129 2.3884 2.3884 2.6871 2.6871 2.7665 2.7665 3.5855 3.5855 3.6393 3.6393 3.7764 3.7764 3.7832 3.7832 3.8342 3.8342 3.9862 3.9862 4.5734 4.5734 4.6333 4.6333 6.7136 6.7136 8.2681 8.2681 8.3777 8.3777 8.6717 8.6717 9.7788 9.7788 9.9046 9.9046 k = 0.2586 0.2985 0.6464 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5910 -8.5909 -7.7044 -7.7014 -7.5202 -7.5196 -7.4024 -7.3975 -6.9518 -6.9473 -6.9246 -6.9226 -6.9064 -6.9024 -2.8191 -2.8189 0.1556 0.1598 0.3029 0.3032 0.7677 0.7713 1.0863 1.0908 1.1617 1.1668 1.4645 1.4659 1.6307 1.6368 1.9558 1.9565 2.0098 2.0224 2.2130 2.2138 2.3848 2.3920 2.6854 2.6885 2.7662 2.7665 3.5808 3.5870 3.6349 3.6355 3.7492 3.7586 3.7961 3.8045 3.8407 3.8413 3.9811 3.9849 4.5691 4.5752 4.6381 4.6414 6.7141 6.7143 8.2653 8.2713 8.3770 8.3789 8.6687 8.6777 9.7733 9.7776 9.9061 9.9086 k = 0.2672 0.3084 0.6312 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.5913 -8.5909 -7.7059 -7.6998 -7.5202 -7.5184 -7.4060 -7.3954 -6.9579 -6.9508 -6.9223 -6.9196 -6.9055 -6.8978 -2.8203 -2.8199 0.1479 0.1566 0.3101 0.3103 0.7671 0.7742 1.0849 1.0936 1.1599 1.1706 1.4653 1.4674 1.6273 1.6394 1.9546 1.9558 2.0048 2.0303 2.2143 2.2156 2.3817 2.3954 2.6835 2.6893 2.7655 2.7661 3.5710 3.5858 3.6241 3.6267 3.7107 3.7321 3.8108 3.8286 3.8553 3.8570 3.9703 3.9786 4.5677 4.5795 4.6505 4.6566 6.7158 6.7163 8.2626 8.2750 8.3767 8.3813 8.6683 8.6858 9.7635 9.7733 9.9102 9.9164 k = 0.2759 0.3184 0.6160 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5915 -8.5910 -7.7075 -7.6984 -7.5201 -7.5164 -7.4104 -7.3934 -6.9647 -6.9569 -6.9185 -6.9165 -6.9032 -6.8923 -2.8222 -2.8216 0.1381 0.1512 0.3208 0.3216 0.7673 0.7779 1.0837 1.0961 1.1589 1.1757 1.4670 1.4692 1.6237 1.6415 1.9533 1.9546 2.0004 2.0387 2.2166 2.2183 2.3789 2.3985 2.6814 2.6896 2.7644 2.7653 3.5544 3.5789 3.6110 3.6167 3.6691 3.6998 3.8261 3.8517 3.8727 3.8754 3.9563 3.9691 4.5728 4.5892 4.6653 4.6742 6.7189 6.7196 8.2600 8.2789 8.3772 8.3856 8.6698 8.6946 9.7537 9.7690 9.9146 9.9245 k = 0.2845 0.3283 0.6008 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5917 -8.5910 -7.7091 -7.6972 -7.5202 -7.5138 -7.4156 -7.3914 -6.9717 -6.9640 -6.9147 -6.9135 -6.8997 -6.8861 -2.8248 -2.8241 0.1275 0.1446 0.3345 0.3359 0.7685 0.7824 1.0823 1.0977 1.1591 1.1825 1.4697 1.4713 1.6199 1.6430 1.9520 1.9531 1.9964 2.0473 2.2200 2.2221 2.3765 2.4014 2.6792 2.6892 2.7631 2.7640 3.5310 3.5619 3.5951 3.6026 3.6374 3.6627 3.8411 3.8731 3.8906 3.8928 3.9428 3.9585 4.5843 4.6040 4.6807 4.6927 6.7235 6.7243 8.2570 8.2825 8.3792 8.3924 8.6725 8.7030 9.7462 9.7663 9.9177 9.9310 k = 0.2931 0.3383 0.5856 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5917 -8.5909 -7.7108 -7.6961 -7.5205 -7.5106 -7.4217 -7.3895 -6.9783 -6.9714 -6.9112 -6.9107 -6.8953 -6.8798 -2.8281 -2.8272 0.1174 0.1381 0.3502 0.3522 0.7706 0.7876 1.0803 1.0980 1.1608 1.1911 1.4733 1.4735 1.6159 1.6438 1.9507 1.9513 1.9928 2.0556 2.2242 2.2270 2.3745 2.4043 2.6769 2.6880 2.7614 2.7622 3.5002 3.5366 3.5539 3.5957 3.6241 3.6266 3.8544 3.8913 3.9027 3.9078 3.9376 3.9493 4.6009 4.6227 4.6958 4.7111 6.7296 6.7305 8.2536 8.2845 8.3841 8.4022 8.6758 8.7103 9.7416 9.7656 9.9189 9.9351 k = 0.3017 0.3482 0.5704 ( 7115 PWs) bands (ev): -23.9414 -23.9414 -8.5915 -8.5906 -7.7127 -7.6954 -7.5211 -7.5068 -7.4285 -7.3875 -6.9846 -6.9787 -6.9080 -6.9079 -6.8904 -6.8736 -2.8320 -2.8310 0.1084 0.1324 0.3674 0.3700 0.7736 0.7936 1.0772 1.0967 1.1642 1.2016 1.4758 1.4776 1.6116 1.6436 1.9495 1.9495 1.9895 2.0633 2.2291 2.2328 2.3729 2.4072 2.6745 2.6861 2.7594 2.7599 3.4584 3.5062 3.5118 3.5683 3.6048 3.6227 3.8639 3.8996 3.9030 3.9213 3.9478 3.9487 4.6214 4.6442 4.7101 4.7289 6.7373 6.7383 8.2494 8.2841 8.3928 8.4153 8.6797 8.7160 9.7396 9.7662 9.9178 9.9364 k = 0.3103 0.3582 0.5552 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5911 -8.5900 -7.7147 -7.6949 -7.5222 -7.5026 -7.4361 -7.3854 -6.9902 -6.9858 -6.9051 -6.9050 -6.8853 -6.8677 -2.8364 -2.8353 0.1011 0.1282 0.3858 0.3888 0.7777 0.8004 1.0730 1.0940 1.1693 1.2139 1.4781 1.4827 1.6070 1.6424 1.9475 1.9482 1.9865 2.0703 2.2346 2.2394 2.3716 2.4105 2.6720 2.6833 2.7571 2.7572 3.4053 3.4705 3.4763 3.5259 3.6011 3.6205 3.8651 3.8968 3.9023 3.9309 3.9603 3.9670 4.6445 4.6675 4.7235 4.7458 6.7468 6.7478 8.2446 8.2809 8.4058 8.4313 8.6839 8.7201 9.7391 9.7671 9.9142 9.9348 k = 0.3190 0.3681 0.5400 ( 7108 PWs) bands (ev): -23.9414 -23.9414 -8.5904 -8.5892 -7.7168 -7.6947 -7.5237 -7.4981 -7.4443 -7.3833 -6.9952 -6.9923 -6.9023 -6.9022 -6.8802 -6.8621 -2.8414 -2.8402 0.0962 0.1261 0.4049 0.4085 0.7829 0.8080 1.0678 1.0900 1.1761 1.2275 1.4804 1.4883 1.6021 1.6401 1.9455 1.9471 1.9840 2.0763 2.2406 2.2465 2.3707 2.4144 2.6693 2.6794 2.7538 2.7547 3.3461 3.4284 3.4445 3.4853 3.5991 3.6187 3.8568 3.8928 3.9004 3.9402 3.9795 3.9873 4.6693 4.6920 4.7357 4.7616 6.7580 6.7590 8.2392 8.2749 8.4226 8.4501 8.6888 8.7228 9.7385 9.7664 9.9080 9.9301 k = 0.3276 0.3781 0.5248 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5893 -8.5880 -7.7192 -7.6949 -7.5259 -7.4935 -7.4531 -7.3812 -6.9995 -6.9982 -6.8996 -6.8993 -6.8755 -6.8571 -2.8468 -2.8456 0.0937 0.1264 0.4246 0.4288 0.7891 0.8166 1.0615 1.0848 1.1843 1.2422 1.4826 1.4944 1.5969 1.6366 1.9432 1.9458 1.9818 2.0812 2.2471 2.2537 2.3701 2.4194 2.6664 2.6743 2.7500 2.7521 3.2846 3.3807 3.4141 3.4487 3.5970 3.6168 3.8445 3.8804 3.9058 3.9480 4.0008 4.0087 4.6946 4.7167 4.7468 4.7763 6.7711 6.7720 8.2332 8.2668 8.4426 8.4711 8.6945 8.7247 9.7363 9.7626 9.8993 9.9224 k = 0.3362 0.3880 0.5097 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5878 -8.5865 -7.7217 -7.6953 -7.5285 -7.4890 -7.4624 -7.3792 -7.0034 -7.0030 -6.8969 -6.8963 -6.8711 -6.8527 -2.8527 -2.8514 0.0940 0.1293 0.4446 0.4496 0.7963 0.8261 1.0543 1.0786 1.1935 1.2577 1.4846 1.5010 1.5913 1.6318 1.9407 1.9445 1.9802 2.0851 2.2541 2.2604 2.3699 2.4259 2.6632 2.6680 2.7457 2.7494 3.2226 3.3301 3.3842 3.4148 3.5945 3.6147 3.8304 3.8665 3.9106 3.9539 4.0234 4.0311 4.7190 4.7408 4.7580 4.7905 6.7861 6.7867 8.2267 8.2569 8.4651 8.4936 8.7012 8.7263 9.7307 9.7539 9.8881 9.9118 k = 0.3448 0.3980 0.4945 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.5859 -8.5845 -7.7245 -7.6960 -7.5317 -7.4852 -7.4715 -7.3776 -7.0077 -7.0056 -6.8943 -6.8932 -6.8671 -6.8489 -2.8589 -2.8576 0.0973 0.1352 0.4649 0.4707 0.8046 0.8366 1.0464 1.0716 1.2037 1.2735 1.4864 1.5080 1.5855 1.6258 1.9377 1.9430 1.9792 2.0879 2.2614 2.2663 2.3701 2.4342 2.6596 2.6602 2.7409 2.7465 3.1612 3.2789 3.3548 3.3824 3.5914 3.6122 3.8151 3.8513 3.9142 3.9578 4.0469 4.0545 4.7382 4.7622 4.7729 4.8056 6.8028 6.8031 8.2198 8.2458 8.4891 8.5168 8.7092 8.7284 9.7206 9.7390 9.8747 9.8985 k = 0.3534 0.4079 0.4793 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5835 -8.5821 -7.7274 -7.6969 -7.5354 -7.4861 -7.4764 -7.3763 -7.0109 -7.0074 -6.8916 -6.8902 -6.8636 -6.8458 -2.8655 -2.8642 0.1035 0.1442 0.4853 0.4919 0.8139 0.8481 1.0377 1.0639 1.2146 1.2895 1.4878 1.5151 1.5797 1.6186 1.9341 1.9412 1.9788 2.0894 2.2693 2.2711 2.3706 2.4446 2.6511 2.6555 2.7357 2.7437 3.1011 3.2286 3.3258 3.3509 3.5876 3.6092 3.7986 3.8348 3.9166 3.9597 4.0714 4.0788 4.7484 4.7781 4.7953 4.8243 6.8210 6.8212 8.2124 8.2338 8.5140 8.5397 8.7186 8.7317 9.7048 9.7172 9.8597 9.8831 k = 0.3621 0.4179 0.4641 ( 7122 PWs) bands (ev): -23.9414 -23.9414 -8.5807 -8.5793 -7.7305 -7.6981 -7.5395 -7.4949 -7.4742 -7.3756 -7.0131 -7.0083 -6.8891 -6.8870 -6.8605 -6.8432 -2.8723 -2.8711 0.1129 0.1563 0.5057 0.5133 0.8241 0.8606 1.0285 1.0556 1.2261 1.3056 1.4884 1.5222 1.5741 1.6104 1.9298 1.9390 1.9790 2.0899 2.2747 2.2775 2.3714 2.4570 2.6405 2.6510 2.7300 2.7408 3.0428 3.1801 3.2972 3.3199 3.5829 3.6058 3.7808 3.8170 3.9177 3.9600 4.0969 4.1042 4.7520 4.7876 4.8226 4.8476 6.8404 6.8410 8.2046 8.2211 8.5389 8.5611 8.7294 8.7371 9.6831 9.6882 9.8438 9.8664 k = 0.3707 0.4278 0.4489 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5774 -8.5760 -7.7339 -7.6996 -7.5439 -7.5052 -7.4712 -7.3757 -7.0141 -7.0083 -6.8866 -6.8838 -6.8579 -6.8413 -2.8794 -2.8782 0.1253 0.1717 0.5260 0.5346 0.8352 0.8742 1.0187 1.0468 1.2380 1.3214 1.4879 1.5289 1.5691 1.6018 1.9247 1.9363 1.9798 2.0891 2.2774 2.2861 2.3725 2.4712 2.6286 2.6459 2.7241 2.7379 2.9868 3.1339 3.2690 3.2893 3.5774 3.6018 3.7615 3.7978 3.9179 3.9587 4.1232 4.1305 4.7516 4.7919 4.8523 4.8742 6.8608 6.8620 8.1963 8.2080 8.5632 8.5799 8.7416 8.7451 9.6526 9.6557 9.8279 9.8494 k = 0.3793 0.4378 0.4337 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5737 -8.5722 -7.7374 -7.7014 -7.5485 -7.5158 -7.4686 -7.3767 -7.0139 -7.0075 -6.8843 -6.8806 -6.8555 -6.8399 -2.8867 -2.8854 0.1407 0.1902 0.5462 0.5559 0.8471 0.8888 1.0085 1.0375 1.2504 1.3368 1.4859 1.5340 1.5653 1.5936 1.9187 1.9329 1.9813 2.0873 2.2793 2.2951 2.3738 2.4866 2.6156 2.6403 2.7180 2.7353 2.9333 3.0903 3.2413 3.2592 3.5708 3.5972 3.7410 3.7773 3.9171 3.9561 4.1502 4.1575 4.7482 4.7924 4.8833 4.9027 6.8821 6.8839 8.1874 8.1946 8.5862 8.5952 8.7547 8.7560 9.6119 9.6234 9.8129 9.8332 k = 0.3879 0.4477 0.4185 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.5695 -8.5680 -7.7411 -7.7034 -7.5532 -7.5264 -7.4667 -7.3787 -7.0126 -7.0059 -6.8823 -6.8774 -6.8535 -6.8390 -2.8940 -2.8929 0.1591 0.2119 0.5662 0.5770 0.8597 0.9043 0.9979 1.0279 1.2631 1.3518 1.4818 1.5358 1.5631 1.5882 1.9118 1.9286 1.9833 2.0844 2.2808 2.3040 2.3754 2.5025 2.6016 2.6341 2.7120 2.7331 2.8825 3.0493 3.2142 3.2295 3.5633 3.5919 3.7191 3.7554 3.9155 3.9523 4.1778 4.1851 4.7423 4.7899 4.9155 4.9327 6.9037 6.9063 8.1779 8.1808 8.6068 8.6075 8.7682 8.7694 9.5680 9.5877 9.7996 9.8188 k = 0.3966 0.4577 0.4033 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5648 -8.5634 -7.7450 -7.7057 -7.5579 -7.5368 -7.4655 -7.3818 -7.0101 -7.0035 -6.8805 -6.8743 -6.8516 -6.8386 -2.9015 -2.9005 0.1802 0.2366 0.5859 0.5978 0.8727 0.9205 0.9873 1.0181 1.2762 1.3661 1.4754 1.5321 1.5630 1.5877 1.9041 1.9233 1.9858 2.0806 2.2822 2.3126 2.3771 2.5178 2.5873 2.6275 2.7062 2.7319 2.8347 3.0111 3.1875 3.2002 3.5546 3.5860 3.6962 3.7322 3.9132 3.9474 4.2056 4.2129 4.7343 4.7848 4.9489 4.9639 6.9253 6.9286 8.1668 8.1677 8.6152 8.6269 8.7815 8.7841 9.5230 9.5505 9.7891 9.8073 k = 0.4052 0.4676 0.3881 ( 7119 PWs) bands (ev): -23.9414 -23.9414 -8.5598 -8.5584 -7.7490 -7.7083 -7.5625 -7.5468 -7.4653 -7.3860 -7.0065 -7.0005 -6.8790 -6.8712 -6.8497 -6.8384 -2.9091 -2.9081 0.2040 0.2642 0.6053 0.6184 0.8857 0.9361 0.9777 1.0085 1.2896 1.3795 1.4668 1.5232 1.5650 1.5922 1.8955 1.9168 1.9889 2.0762 2.2838 2.3205 2.3790 2.5306 2.5736 2.6204 2.7011 2.7322 2.7900 2.9754 3.1613 3.1713 3.5450 3.5794 3.6725 3.7080 3.9102 3.9415 4.2334 4.2407 4.7243 4.7775 4.9834 4.9964 6.9464 6.9504 8.1523 8.1567 8.6213 8.6444 8.7935 8.7985 9.4792 9.5137 9.7822 9.7996 k = 0.4138 0.4776 0.3729 ( 7115 PWs) bands (ev): -23.9414 -23.9414 -8.5544 -8.5530 -7.7531 -7.7112 -7.5670 -7.5564 -7.4659 -7.3913 -7.0021 -6.9968 -6.8779 -6.8682 -6.8477 -6.8383 -2.9167 -2.9158 0.2302 0.2945 0.6243 0.6385 0.8983 0.9453 0.9751 0.9996 1.3035 1.3914 1.4564 1.5115 1.5688 1.5999 1.8862 1.9089 1.9925 2.0715 2.2856 2.3272 2.3810 2.5366 2.5642 2.6130 2.6969 2.7349 2.7487 2.9421 3.1355 3.1428 3.5342 3.5721 3.6481 3.6830 3.9066 3.9348 4.2610 4.2682 4.7127 4.7682 5.0191 5.0301 6.9664 6.9711 8.1373 8.1447 8.6259 8.6600 8.8034 8.8112 9.4384 9.4791 9.7800 9.7966 k = 0.4224 0.4875 0.3577 ( 7113 PWs) bands (ev): -23.9414 -23.9414 -8.5487 -8.5473 -7.7573 -7.7145 -7.5713 -7.5655 -7.4674 -7.3976 -6.9969 -6.9927 -6.8772 -6.8654 -6.8456 -6.8383 -2.9243 -2.9234 0.2585 0.3274 0.6429 0.6582 0.9091 0.9402 0.9873 0.9926 1.3177 1.4010 1.4445 1.4997 1.5742 1.6093 1.8763 1.8994 1.9965 2.0666 2.2878 2.3321 2.3826 2.5300 2.5636 2.6052 2.6928 2.7123 2.7409 2.9108 3.1100 3.1146 3.5223 3.5640 3.6236 3.6573 3.9021 3.9272 4.2881 4.2951 4.6999 4.7573 5.0560 5.0650 6.9847 6.9902 8.1219 8.1320 8.6298 8.6735 8.8107 8.8208 9.4025 9.4484 9.7833 9.7991 k = 0.4310 0.4975 0.3425 ( 7115 PWs) bands (ev): -23.9414 -23.9414 -8.5427 -8.5414 -7.7616 -7.7181 -7.5753 -7.5739 -7.4697 -7.4050 -6.9912 -6.9883 -6.8767 -6.8629 -6.8433 -6.8381 -2.9319 -2.9311 0.2888 0.3625 0.6610 0.6774 0.9160 0.9288 0.9895 1.0063 1.3323 1.4066 1.4317 1.4902 1.5810 1.6197 1.8660 1.8885 2.0009 2.0618 2.2903 2.3351 2.3836 2.5171 2.5653 2.5969 2.6715 2.6989 2.7507 2.8814 3.0846 3.0867 3.5093 3.5551 3.5994 3.6315 3.8967 3.9187 4.3142 4.3210 4.6860 4.7451 5.0942 5.1012 7.0010 7.0071 8.1061 8.1186 8.6334 8.6847 8.8154 8.8267 9.3727 9.4228 9.7929 9.8078 k = 0.4397 0.5074 0.3273 ( 7109 PWs) bands (ev): -23.9414 -23.9414 -8.5365 -8.5353 -7.7658 -7.7220 -7.5816 -7.5790 -7.4728 -7.4131 -6.9852 -6.9837 -6.8765 -6.8608 -6.8408 -6.8375 -2.9395 -2.9387 0.3207 0.3995 0.6788 0.6961 0.9157 0.9169 0.9925 1.0273 1.3471 1.4059 1.4185 1.4860 1.5890 1.6306 1.8555 1.8762 2.0056 2.0574 2.2929 2.3361 2.3832 2.5029 2.5641 2.5880 2.6408 2.7014 2.7644 2.8536 3.0590 3.0592 3.4949 3.5450 3.5762 3.6062 3.8904 3.9093 4.3393 4.3458 4.6716 4.7320 5.1336 5.1386 7.0148 7.0214 8.0902 8.1050 8.6366 8.6928 8.8182 8.8286 9.3499 9.4032 9.8090 9.8230 k = 0.4483 0.5174 0.3121 ( 7119 PWs) bands (ev): -23.9414 -23.9414 -8.5303 -8.5291 -7.7699 -7.7261 -7.5885 -7.5823 -7.4766 -7.4219 -6.9791 -6.9790 -6.8763 -6.8591 -6.8382 -6.8364 -2.9469 -2.9463 0.3538 0.4381 0.6960 0.7142 0.9020 0.9116 1.0016 1.0493 1.3613 1.3981 1.4061 1.4880 1.5981 1.6417 1.8452 1.8627 2.0106 2.0533 2.2956 2.3352 2.3811 2.4887 2.5593 2.5779 2.6129 2.7084 2.7809 2.8275 3.0316 3.0337 3.4789 3.5331 3.5546 3.5823 3.8829 3.8990 4.3630 4.3691 4.6570 4.7182 5.1739 5.1771 7.0256 7.0326 8.0747 8.0918 8.6391 8.6964 8.8205 8.8270 9.3347 9.3901 9.8317 9.8447 k = 0.4569 0.5273 0.2970 ( 7123 PWs) bands (ev): -23.9414 -23.9414 -8.5240 -8.5230 -7.7738 -7.7305 -7.5946 -7.5853 -7.4809 -7.4313 -6.9745 -6.9730 -6.8760 -6.8579 -6.8354 -6.8347 -2.9543 -2.9537 0.3878 0.4778 0.7128 0.7316 0.8880 0.9024 1.0146 1.0717 1.3701 1.3853 1.3995 1.4944 1.6080 1.6528 1.8354 1.8481 2.0158 2.0496 2.2982 2.3325 2.3770 2.4750 2.5517 2.5656 2.5899 2.7192 2.7929 2.8092 3.0046 3.0082 3.4612 3.5183 3.5353 3.5614 3.8740 3.8877 4.3852 4.3910 4.6425 4.7041 5.2151 5.2166 7.0333 7.0406 8.0600 8.0797 8.6400 8.6941 8.8229 8.8242 9.3274 9.3840 9.8608 9.8727 k = 0.4655 0.5373 0.2818 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5178 -8.5169 -7.7775 -7.7350 -7.5998 -7.5880 -7.4858 -7.4411 -6.9702 -6.9674 -6.8755 -6.8570 -6.8325 -6.8324 -2.9616 -2.9610 0.4225 0.5183 0.7291 0.7483 0.8741 0.8912 1.0297 1.0941 1.3647 1.3697 1.4080 1.5032 1.6188 1.6635 1.8267 1.8329 2.0210 2.0464 2.3006 2.3281 2.3711 2.4617 2.5420 2.5494 2.5734 2.7332 2.7739 2.8238 2.9783 2.9825 3.4421 3.4995 3.5185 3.5448 3.8638 3.8754 4.4057 4.4111 4.6285 4.6899 5.2567 5.2569 7.0378 7.0451 8.0468 8.0694 8.6380 8.6854 8.8176 8.8299 9.3280 9.3847 9.8956 9.9066 k = 0.4741 0.5472 0.2666 ( 7116 PWs) bands (ev): -23.9414 -23.9414 -8.5119 -8.5110 -7.7808 -7.7396 -7.6043 -7.5902 -7.4910 -7.4511 -6.9662 -6.9623 -6.8747 -6.8563 -6.8298 -6.8294 -2.9687 -2.9682 0.4573 0.5589 0.7449 0.7640 0.8609 0.8791 1.0457 1.1159 1.3523 1.3529 1.4246 1.5127 1.6303 1.6734 1.8173 1.8197 2.0262 2.0435 2.3025 2.3219 2.3640 2.4489 2.5310 2.5313 2.5616 2.7498 2.7501 2.8431 2.9541 2.9570 3.4219 3.4778 3.5042 3.5321 3.8521 3.8621 4.4245 4.4295 4.6151 4.6760 5.2973 5.2990 7.0391 7.0464 8.0357 8.0615 8.6320 8.6708 8.8128 8.8378 9.3363 9.3918 9.9354 9.9457 k = 0.4828 0.5572 0.2514 ( 7100 PWs) bands (ev): -23.9414 -23.9414 -8.5062 -8.5054 -7.7837 -7.7441 -7.6079 -7.5921 -7.4963 -7.4612 -6.9627 -6.9580 -6.8733 -6.8556 -6.8268 -6.8264 -2.9756 -2.9752 0.4919 0.5990 0.7601 0.7780 0.8490 0.8670 1.0618 1.1366 1.3357 1.3386 1.4436 1.5222 1.6424 1.6819 1.8017 1.8151 2.0312 2.0410 2.3037 2.3139 2.3565 2.4363 2.5132 2.5202 2.5520 2.7263 2.7677 2.8575 2.9326 2.9357 3.4015 3.4549 3.4923 3.5220 3.8389 3.8477 4.4415 4.4462 4.6027 4.6626 5.3379 5.3409 7.0375 7.0446 8.0273 8.0568 8.6212 8.6516 8.8094 8.8467 9.3515 9.4048 9.9791 9.9892 k = 0.4914 0.5671 0.2362 ( 7102 PWs) bands (ev): -23.9414 -23.9414 -8.5010 -8.5003 -7.7861 -7.7484 -7.6108 -7.5936 -7.5018 -7.4712 -6.9596 -6.9546 -6.8714 -6.8549 -6.8236 -6.8233 -2.9824 -2.9820 0.5259 0.6380 0.7742 0.7885 0.8407 0.8560 1.0774 1.1555 1.3187 1.3251 1.4639 1.5312 1.6550 1.6886 1.7866 1.8138 2.0359 2.0386 2.3038 2.3042 2.3493 2.4238 2.4966 2.5096 2.5434 2.7027 2.7843 2.8573 2.9112 2.9327 3.3815 3.4320 3.4825 3.5134 3.8242 3.8324 4.4567 4.4611 4.5914 4.6497 5.3780 5.3821 7.0333 7.0402 8.0221 8.0555 8.6056 8.6292 8.8078 8.8559 9.3725 9.4223 10.0244 10.0366 k = 0.5000 0.5770 0.2210 ( 7098 PWs) bands (ev): -23.9414 -23.9414 -8.4963 -8.4958 -7.7879 -7.7523 -7.6130 -7.5948 -7.5072 -7.4809 -6.9571 -6.9520 -6.8691 -6.8540 -6.8203 -6.8202 -2.9890 -2.9886 0.5591 0.6750 0.7861 0.7921 0.8396 0.8479 1.0920 1.1715 1.3022 1.3126 1.4848 1.5390 1.6678 1.6931 1.7726 1.8161 2.0365 2.0402 2.2919 2.3036 2.3430 2.4112 2.4816 2.4999 2.5358 2.6794 2.7943 2.8407 2.8980 2.9464 3.3625 3.4099 3.4745 3.5062 3.8083 3.8161 4.4702 4.4743 4.5813 4.6376 5.4173 5.4223 7.0272 7.0338 8.0203 8.0580 8.5861 8.6050 8.8074 8.8647 9.3972 9.4427 10.0490 10.0867 k = 0.5000 0.5770 0.2210 ( 7098 PWs) bands (ev): -23.9414 -23.9414 -8.4963 -8.4958 -7.7879 -7.7523 -7.6130 -7.5948 -7.5072 -7.4809 -6.9571 -6.9520 -6.8691 -6.8540 -6.8203 -6.8202 -2.9890 -2.9886 0.5591 0.6750 0.7861 0.7921 0.8396 0.8479 1.0920 1.1715 1.3022 1.3126 1.4848 1.5390 1.6678 1.6931 1.7726 1.8161 2.0365 2.0402 2.2919 2.3036 2.3430 2.4112 2.4816 2.4999 2.5358 2.6794 2.7943 2.8407 2.8980 2.9464 3.3625 3.4099 3.4745 3.5062 3.8083 3.8161 4.4702 4.4743 4.5813 4.6376 5.4173 5.4223 7.0272 7.0338 8.0203 8.0580 8.5861 8.6050 8.8074 8.8647 9.3972 9.4427 10.0490 10.0867 k = 0.5000 0.5770 0.2009 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.4906 -8.4902 -7.7898 -7.7574 -7.6153 -7.5963 -7.5142 -7.4933 -6.9543 -6.9495 -6.8655 -6.8527 -6.8161 -6.8160 -2.9973 -2.9970 0.6017 0.7205 0.7854 0.7934 0.8484 0.8506 1.1086 1.1874 1.2818 1.2991 1.5123 1.5474 1.6845 1.6962 1.7559 1.8243 2.0337 2.0452 2.2743 2.3016 2.3360 2.3944 2.4640 2.4888 2.5268 2.6496 2.7880 2.8100 2.9020 2.9740 3.3391 3.3819 3.4660 3.4977 3.7846 3.7928 4.4861 4.4900 4.5703 4.6233 5.4672 5.4731 7.0168 7.0230 8.0237 8.0673 8.5562 8.5713 8.8067 8.8741 9.4310 9.4700 9.9728 10.0383 k = 0.5000 0.5770 0.1808 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.4850 -8.4847 -7.7916 -7.7624 -7.6175 -7.5980 -7.5209 -7.5049 -6.9518 -6.9475 -6.8617 -6.8511 -6.8121 -6.8117 -3.0051 -3.0048 0.6434 0.7614 0.7736 0.7879 0.8666 0.8686 1.1208 1.1952 1.2642 1.2919 1.5381 1.5529 1.6976 1.7001 1.7424 1.8370 2.0308 2.0494 2.2562 2.2985 2.3300 2.3774 2.4489 2.4792 2.5192 2.6217 2.7648 2.7778 2.9247 3.0037 3.3173 3.3551 3.4588 3.4899 3.7577 3.7670 4.5006 4.5042 4.5623 4.6115 5.5144 5.5209 7.0044 7.0102 8.0339 8.0834 8.5233 8.5370 8.8036 8.8795 9.4620 9.4943 9.8895 9.9579 k = 0.5000 0.5770 0.1607 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.4796 -8.4795 -7.7932 -7.7674 -7.6195 -7.6001 -7.5272 -7.5155 -6.9496 -6.9460 -6.8580 -6.8494 -6.8082 -6.8077 -3.0123 -3.0121 0.6838 0.7611 0.7763 0.7965 0.8892 0.8964 1.1263 1.1929 1.2511 1.2923 1.5548 1.5599 1.6994 1.7118 1.7372 1.8528 2.0278 2.0525 2.2382 2.2942 2.3246 2.3606 2.4358 2.4707 2.5130 2.5959 2.7357 2.7461 2.9554 3.0335 3.2979 3.3301 3.4529 3.4826 3.7282 3.7390 4.5136 4.5170 4.5572 4.6019 5.5586 5.5654 6.9907 6.9962 8.0502 8.1055 8.4896 8.5034 8.7968 8.8797 9.4851 9.5116 9.8211 9.8922 k = 0.5000 0.5770 0.1406 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.4746 -8.4746 -7.7946 -7.7723 -7.6213 -7.6026 -7.5328 -7.5249 -6.9478 -6.9449 -6.8543 -6.8475 -6.8044 -6.8039 -3.0188 -3.0186 0.7226 0.7492 0.7638 0.8259 0.9109 0.9322 1.1239 1.1830 1.2437 1.2977 1.5530 1.5743 1.7032 1.7172 1.7457 1.8703 2.0250 2.0543 2.2214 2.2887 2.3193 2.3443 2.4246 2.4622 2.5081 2.5729 2.7060 2.7160 2.9890 3.0621 3.2815 3.3072 3.4481 3.4760 3.6966 3.7093 4.5252 4.5283 4.5543 4.5943 5.5992 5.6061 6.9766 6.9817 8.0718 8.1326 8.4570 8.4720 8.7854 8.8737 9.4928 9.5168 9.7765 9.8463 k = 0.5000 0.5770 0.1205 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.4701 -8.4700 -7.7958 -7.7768 -7.6229 -7.6055 -7.5378 -7.5328 -6.9463 -6.9441 -6.8509 -6.8457 -6.8010 -6.8004 -3.0246 -3.0245 0.7382 0.7517 0.7601 0.8513 0.9328 0.9699 1.1145 1.1695 1.2410 1.3038 1.5482 1.5786 1.7094 1.7249 1.7617 1.8882 2.0226 2.0543 2.2069 2.2824 2.3137 2.3287 2.4149 2.4529 2.5046 2.5535 2.6780 2.6883 3.0234 3.0886 3.2688 3.2868 3.4446 3.4701 3.6637 3.6783 4.5352 4.5381 4.5535 4.5884 5.6358 5.6424 6.9629 6.9675 8.0977 8.1632 8.4272 8.4441 8.7693 8.8604 9.4808 9.5069 9.7606 9.8228 k = 0.5000 0.5770 0.1004 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.4660 -8.4660 -7.7967 -7.7811 -7.6243 -7.6087 -7.5420 -7.5392 -6.9452 -6.9435 -6.8479 -6.8440 -6.7978 -6.7973 -3.0296 -3.0295 0.7291 0.7407 0.7954 0.8740 0.9537 1.0049 1.1021 1.1554 1.2408 1.3078 1.5419 1.5738 1.7178 1.7370 1.7817 1.9052 2.0209 2.0520 2.1958 2.2754 2.3073 2.3135 2.4070 2.4424 2.5022 2.5380 2.6532 2.6638 3.0573 3.1116 3.2606 3.2694 3.4422 3.4650 3.6308 3.6469 4.5436 4.5464 4.5541 4.5837 5.6679 5.6740 6.9501 6.9542 8.1262 8.1949 8.4022 8.4210 8.7488 8.8394 9.4556 9.4849 9.7672 9.8181 k = 0.5000 0.5770 0.0804 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.4626 -8.4625 -7.7973 -7.7849 -7.6252 -7.6121 -7.5455 -7.5442 -6.9444 -6.9431 -6.8453 -6.8424 -6.7951 -6.7946 -3.0338 -3.0337 0.7217 0.7312 0.8287 0.8948 0.9722 1.0289 1.0950 1.1428 1.2412 1.3081 1.5353 1.5639 1.7274 1.7488 1.8059 1.9197 2.0199 2.0472 2.1895 2.2681 2.2985 2.2998 2.4010 2.4309 2.5008 2.5265 2.6326 2.6428 3.0890 3.1297 3.2560 3.2574 3.4412 3.4607 3.5990 3.6160 4.5505 4.5527 4.5563 4.5800 5.6951 5.7003 6.9390 6.9425 8.1555 8.2238 8.3849 8.4040 8.7255 8.8111 9.4282 9.4579 9.7848 9.8241 k = 0.5000 0.5770 0.0603 ( 7142 PWs) bands (ev): -23.9414 -23.9414 -8.4598 -8.4597 -7.7975 -7.7883 -7.6257 -7.6155 -7.5482 -7.5477 -6.9437 -6.9429 -6.8432 -6.8412 -6.7929 -6.7925 -3.0370 -3.0370 0.7160 0.7233 0.8600 0.9135 0.9861 1.0298 1.1045 1.1339 1.2422 1.3038 1.5299 1.5525 1.7373 1.7574 1.8331 1.9295 2.0198 2.0404 2.1889 2.2602 2.2844 2.2916 2.3969 2.4196 2.5004 2.5182 2.6169 2.6258 3.1165 3.1420 3.2477 3.2585 3.4417 3.4574 3.5703 3.5867 4.5557 4.5562 4.5603 4.5770 5.7170 5.7211 6.9300 6.9327 8.1832 8.2439 8.3788 8.3942 8.7023 8.7772 9.4059 9.4319 9.8051 9.8337 k = 0.5000 0.5770 0.0402 ( 7150 PWs) bands (ev): -23.9414 -23.9414 -8.4578 -8.4577 -7.7972 -7.7912 -7.6256 -7.6187 -7.5502 -7.5501 -6.9433 -6.9428 -6.8416 -6.8404 -6.7912 -6.7910 -3.0394 -3.0394 0.7123 0.7172 0.8889 0.9290 0.9936 1.0159 1.1210 1.1302 1.2458 1.2950 1.5266 1.5420 1.7466 1.7620 1.8612 1.9321 2.0205 2.0332 2.1941 2.2495 2.2741 2.2833 2.3950 2.4100 2.5009 2.5122 2.6064 2.6130 3.1369 3.1493 3.2459 3.2610 3.4439 3.4550 3.5473 3.5608 4.5587 4.5593 4.5643 4.5745 5.7331 5.7360 6.9235 6.9254 8.2070 8.2511 8.3842 8.3920 8.6838 8.7412 9.3912 9.4104 9.8232 9.8419 k = 0.5000 0.5770 0.0201 ( 7170 PWs) bands (ev): -23.9414 -23.9414 -8.4565 -8.4565 -7.7965 -7.7935 -7.6249 -7.6214 -7.5514 -7.5514 -6.9430 -6.9428 -6.8406 -6.8400 -6.7902 -6.7901 -3.0409 -3.0408 0.7105 0.7130 0.9142 0.9376 0.9948 1.0011 1.1312 1.1313 1.2543 1.2822 1.5259 1.5336 1.7544 1.7627 1.8876 1.9255 2.0218 2.0275 2.2045 2.2347 2.2702 2.2761 2.3951 2.4025 2.5022 2.5078 2.6010 2.6045 3.1486 3.1527 3.2503 3.2613 3.4473 3.4531 3.5331 3.5409 4.5605 4.5612 4.5675 4.5722 5.7432 5.7447 6.9197 6.9206 8.2254 8.2480 8.3933 8.3948 8.6763 8.7081 9.3847 9.3948 9.8368 9.8461 k = 0.5000 0.5770-0.0000 ( 7182 PWs) bands (ev): -23.9414 -23.9414 -8.4561 -8.4561 -7.7953 -7.7953 -7.6235 -7.6235 -7.5518 -7.5518 -6.9428 -6.9428 -6.8400 -6.8400 -6.7898 -6.7898 -3.0413 -3.0413 0.7107 0.7107 0.9327 0.9327 0.9944 0.9944 1.1334 1.1334 1.2675 1.2675 1.5282 1.5282 1.7600 1.7600 1.9099 1.9099 2.0240 2.0240 2.2187 2.2187 2.2714 2.2714 2.3976 2.3976 2.5045 2.5045 2.6004 2.6004 3.1529 3.1529 3.2571 3.2571 3.4507 3.4507 3.5307 3.5307 4.5615 4.5615 4.5699 4.5699 5.7471 5.7471 6.9187 6.9187 8.2389 8.2389 8.3971 8.3971 8.6846 8.6846 9.3861 9.3861 9.8445 9.8445 k = 0.0000 0.0000 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5667 -8.5667 -7.7352 -7.7352 -7.5398 -7.5398 -7.4469 -7.4469 -6.9526 -6.9526 -6.8925 -6.8925 -6.8476 -6.8476 -2.8357 -2.8357 -0.0908 -0.0908 0.5792 0.5792 0.8245 0.8245 1.0845 1.0845 1.1773 1.1773 1.4490 1.4490 1.6669 1.6669 1.9066 1.9066 2.0422 2.0422 2.2743 2.2743 2.3443 2.3443 2.7108 2.7108 2.7827 2.7827 3.5360 3.5360 3.5410 3.5410 3.5885 3.5885 3.7112 3.7112 3.8524 3.8524 4.0808 4.0808 4.3549 4.3549 5.0317 5.0317 6.8721 6.8721 8.1425 8.1425 8.3231 8.3231 8.7970 8.7970 9.6469 9.6469 10.0280 10.0280 k = 0.0132 0.0152 0.6616 ( 7102 PWs) bands (ev): -23.9414 -23.9414 -8.5669 -8.5669 -7.7350 -7.7350 -7.5394 -7.5394 -7.4468 -7.4468 -6.9525 -6.9525 -6.8926 -6.8926 -6.8481 -6.8481 -2.8355 -2.8355 -0.0898 -0.0898 0.5780 0.5780 0.8242 0.8242 1.0845 1.0845 1.1773 1.1773 1.4491 1.4491 1.6666 1.6666 1.9069 1.9069 2.0421 2.0421 2.2735 2.2735 2.3451 2.3451 2.7105 2.7105 2.7828 2.7828 3.5364 3.5364 3.5416 3.5416 3.5896 3.5896 3.7117 3.7117 3.8524 3.8524 4.0803 4.0803 4.3554 4.3554 5.0300 5.0300 6.8709 6.8710 8.1439 8.1439 8.3230 8.3230 8.7962 8.7962 9.6464 9.6464 10.0291 10.0291 k = 0.0263 0.0304 0.6616 ( 7098 PWs) bands (ev): -23.9414 -23.9414 -8.5674 -8.5674 -7.7343 -7.7343 -7.5384 -7.5384 -7.4467 -7.4467 -6.9522 -6.9522 -6.8928 -6.8928 -6.8496 -6.8496 -2.8352 -2.8352 -0.0868 -0.0868 0.5745 0.5745 0.8230 0.8230 1.0845 1.0845 1.1770 1.1770 1.4494 1.4494 1.6659 1.6659 1.9079 1.9079 2.0418 2.0418 2.2709 2.2709 2.3473 2.3473 2.7097 2.7097 2.7827 2.7827 3.5376 3.5376 3.5434 3.5435 3.5927 3.5927 3.7132 3.7132 3.8525 3.8525 4.0787 4.0787 4.3569 4.3569 5.0247 5.0247 6.8675 6.8675 8.1482 8.1482 8.3227 8.3227 8.7937 8.7937 9.6448 9.6448 10.0323 10.0323 k = 0.0395 0.0456 0.6616 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5682 -8.5682 -7.7333 -7.7333 -7.5368 -7.5368 -7.4465 -7.4465 -6.9518 -6.9518 -6.8931 -6.8931 -6.8521 -6.8521 -2.8346 -2.8346 -0.0818 -0.0818 0.5686 0.5686 0.8211 0.8211 1.0846 1.0846 1.1765 1.1765 1.4498 1.4498 1.6648 1.6648 1.9094 1.9094 2.0412 2.0412 2.2671 2.2671 2.3504 2.3504 2.7085 2.7085 2.7825 2.7825 3.5394 3.5394 3.5465 3.5465 3.5977 3.5977 3.7157 3.7157 3.8526 3.8526 4.0762 4.0762 4.3594 4.3594 5.0160 5.0160 6.8619 6.8619 8.1551 8.1551 8.3225 8.3225 8.7895 8.7895 9.6423 9.6423 10.0372 10.0372 k = 0.0526 0.0607 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5694 -8.5694 -7.7318 -7.7318 -7.5346 -7.5346 -7.4460 -7.4460 -6.9512 -6.9512 -6.8936 -6.8936 -6.8555 -6.8555 -2.8339 -2.8339 -0.0749 -0.0749 0.5605 0.5605 0.8186 0.8186 1.0847 1.0847 1.1759 1.1759 1.4505 1.4505 1.6632 1.6632 1.9114 1.9114 2.0403 2.0403 2.2624 2.2624 2.3542 2.3542 2.7068 2.7068 2.7822 2.7822 3.5418 3.5418 3.5507 3.5507 3.6047 3.6047 3.7191 3.7191 3.8527 3.8527 4.0727 4.0727 4.3629 4.3629 5.0039 5.0039 6.8542 6.8542 8.1643 8.1643 8.3223 8.3223 8.7839 8.7839 9.6392 9.6392 10.0435 10.0435 k = 0.0658 0.0759 0.6616 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5708 -8.5708 -7.7301 -7.7301 -7.5321 -7.5321 -7.4453 -7.4453 -6.9505 -6.9505 -6.8943 -6.8943 -6.8598 -6.8598 -2.8329 -2.8329 -0.0660 -0.0660 0.5502 0.5502 0.8154 0.8154 1.0848 1.0848 1.1751 1.1751 1.4513 1.4513 1.6613 1.6613 1.9140 1.9140 2.0392 2.0392 2.2572 2.2572 2.3583 2.3583 2.7049 2.7049 2.7818 2.7818 3.5447 3.5447 3.5560 3.5560 3.6133 3.6133 3.7234 3.7234 3.8527 3.8527 4.0683 4.0683 4.3676 4.3676 4.9888 4.9888 6.8449 6.8449 8.1753 8.1753 8.3225 8.3225 8.7769 8.7769 9.6361 9.6361 10.0503 10.0503 k = 0.0789 0.0911 0.6616 ( 7126 PWs) bands (ev): -23.9414 -23.9414 -8.5724 -8.5724 -7.7280 -7.7280 -7.5294 -7.5294 -7.4441 -7.4441 -6.9497 -6.9497 -6.8950 -6.8950 -6.8649 -6.8649 -2.8318 -2.8318 -0.0554 -0.0554 0.5377 0.5377 0.8117 0.8117 1.0850 1.0850 1.1743 1.1743 1.4522 1.4522 1.6591 1.6591 1.9169 1.9169 2.0379 2.0379 2.2519 2.2519 2.3625 2.3625 2.7027 2.7027 2.7812 2.7812 3.5480 3.5480 3.5623 3.5623 3.6234 3.6234 3.7284 3.7284 3.8527 3.8527 4.0630 4.0630 4.3736 4.3736 4.9708 4.9708 6.8340 6.8340 8.1875 8.1875 8.3232 8.3232 8.7687 8.7687 9.6333 9.6333 10.0568 10.0568 k = 0.0921 0.1063 0.6616 ( 7130 PWs) bands (ev): -23.9414 -23.9414 -8.5742 -8.5742 -7.7257 -7.7257 -7.5267 -7.5267 -7.4424 -7.4424 -6.9487 -6.9487 -6.8960 -6.8960 -6.8706 -6.8706 -2.8306 -2.8306 -0.0429 -0.0429 0.5233 0.5233 0.8077 0.8077 1.0852 1.0852 1.1733 1.1733 1.4533 1.4533 1.6567 1.6567 1.9202 1.9202 2.0364 2.0364 2.2465 2.2465 2.3664 2.3664 2.7005 2.7005 2.7803 2.7803 3.5515 3.5515 3.5695 3.5695 3.6347 3.6347 3.7342 3.7342 3.8526 3.8526 4.0570 4.0570 4.3808 4.3808 4.9501 4.9501 6.8221 6.8221 8.2001 8.2001 8.3248 8.3248 8.7595 8.7595 9.6314 9.6314 10.0622 10.0622 k = 0.1053 0.1215 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5761 -8.5761 -7.7232 -7.7232 -7.5242 -7.5242 -7.4400 -7.4400 -6.9477 -6.9477 -6.8971 -6.8971 -6.8767 -6.8767 -2.8292 -2.8292 -0.0288 -0.0288 0.5070 0.5070 0.8033 0.8033 1.0855 1.0855 1.1722 1.1722 1.4544 1.4544 1.6542 1.6542 1.9239 1.9239 2.0347 2.0347 2.2414 2.2414 2.3702 2.3702 2.6984 2.6984 2.7793 2.7793 3.5553 3.5553 3.5772 3.5772 3.6471 3.6471 3.7405 3.7405 3.8524 3.8524 4.0504 4.0504 4.3895 4.3895 4.9271 4.9271 6.8095 6.8095 8.2125 8.2125 8.3275 8.3275 8.7496 8.7496 9.6311 9.6311 10.0654 10.0654 k = 0.1184 0.1367 0.6616 ( 7096 PWs) bands (ev): -23.9414 -23.9414 -8.5781 -8.5781 -7.7206 -7.7206 -7.5221 -7.5221 -7.4369 -7.4369 -6.9466 -6.9466 -6.8984 -6.8984 -6.8831 -6.8831 -2.8278 -2.8278 -0.0131 -0.0131 0.4890 0.4890 0.7988 0.7988 1.0858 1.0858 1.1712 1.1712 1.4557 1.4557 1.6515 1.6515 1.9277 1.9277 2.0328 2.0328 2.2366 2.2366 2.3737 2.3737 2.6964 2.6964 2.7781 2.7781 3.5593 3.5593 3.5853 3.5853 3.6602 3.6602 3.7473 3.7473 3.8519 3.8519 4.0432 4.0432 4.3997 4.3997 4.9021 4.9021 6.7964 6.7964 8.2239 8.2239 8.3315 8.3315 8.7393 8.7393 9.6328 9.6328 10.0657 10.0657 k = 0.1316 0.1519 0.6616 ( 7092 PWs) bands (ev): -23.9414 -23.9414 -8.5801 -8.5801 -7.7179 -7.7179 -7.5205 -7.5205 -7.4330 -7.4330 -6.9456 -6.9456 -6.9001 -6.9001 -6.8893 -6.8893 -2.8264 -2.8264 0.0041 0.0041 0.4695 0.4695 0.7942 0.7942 1.0861 1.0861 1.1701 1.1701 1.4570 1.4570 1.6488 1.6488 1.9317 1.9317 2.0307 2.0308 2.2321 2.2321 2.3767 2.3767 2.6945 2.6945 2.7767 2.7767 3.5632 3.5632 3.5935 3.5935 3.6738 3.6738 3.7543 3.7543 3.8511 3.8511 4.0357 4.0357 4.4116 4.4116 4.8754 4.8754 6.7833 6.7833 8.2340 8.2340 8.3368 8.3368 8.7289 8.7289 9.6372 9.6372 10.0622 10.0622 k = 0.1447 0.1670 0.6616 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5820 -8.5820 -7.7153 -7.7153 -7.5194 -7.5194 -7.4286 -7.4286 -6.9447 -6.9447 -6.9028 -6.9028 -6.8947 -6.8946 -2.8250 -2.8250 0.0225 0.0225 0.4488 0.4488 0.7897 0.7897 1.0864 1.0864 1.1690 1.1690 1.4583 1.4583 1.6462 1.6462 1.9356 1.9356 2.0286 2.0286 2.2280 2.2280 2.3793 2.3793 2.6928 2.6928 2.7752 2.7752 3.5671 3.5671 3.6017 3.6017 3.6876 3.6876 3.7613 3.7613 3.8499 3.8499 4.0279 4.0279 4.4252 4.4252 4.8472 4.8472 6.7706 6.7706 8.2423 8.2423 8.3431 8.3431 8.7186 8.7186 9.6446 9.6446 10.0545 10.0545 k = 0.1579 0.1822 0.6616 ( 7110 PWs) bands (ev): -23.9414 -23.9414 -8.5839 -8.5839 -7.7128 -7.7128 -7.5189 -7.5189 -7.4237 -7.4237 -6.9439 -6.9439 -6.9070 -6.9070 -6.8981 -6.8981 -2.8237 -2.8237 0.0421 0.0421 0.4270 0.4270 0.7854 0.7854 1.0868 1.0868 1.1679 1.1679 1.4596 1.4596 1.6436 1.6436 1.9396 1.9396 2.0263 2.0263 2.2245 2.2245 2.3816 2.3816 2.6913 2.6913 2.7736 2.7736 3.5709 3.5709 3.6095 3.6095 3.7015 3.7015 3.7680 3.7680 3.8483 3.8483 4.0201 4.0201 4.4406 4.4406 4.8179 4.8179 6.7585 6.7585 8.2491 8.2491 8.3499 8.3499 8.7088 8.7088 9.6554 9.6554 10.0423 10.0423 k = 0.1711 0.1974 0.6616 ( 7118 PWs) bands (ev): -23.9414 -23.9414 -8.5856 -8.5856 -7.7104 -7.7104 -7.5187 -7.5187 -7.4186 -7.4186 -6.9435 -6.9435 -6.9119 -6.9119 -6.9003 -6.9003 -2.8225 -2.8225 0.0624 0.0624 0.4045 0.4045 0.7815 0.7815 1.0871 1.0871 1.1670 1.1670 1.4608 1.4608 1.6413 1.6413 1.9433 1.9433 2.0241 2.0241 2.2214 2.2214 2.3835 2.3835 2.6901 2.6901 2.7720 2.7720 3.5744 3.5744 3.6167 3.6167 3.7151 3.7151 3.7743 3.7743 3.8463 3.8463 4.0125 4.0125 4.4578 4.4578 4.7880 4.7880 6.7474 6.7474 8.2545 8.2545 8.3567 8.3567 8.6997 8.6997 9.6697 9.6697 10.0258 10.0258 k = 0.1842 0.2126 0.6616 ( 7128 PWs) bands (ev): -23.9414 -23.9414 -8.5871 -8.5871 -7.7083 -7.7083 -7.5188 -7.5188 -7.4136 -7.4136 -6.9435 -6.9435 -6.9165 -6.9165 -6.9018 -6.9018 -2.8214 -2.8214 0.0833 0.0833 0.3817 0.3817 0.7779 0.7779 1.0874 1.0874 1.1661 1.1661 1.4619 1.4619 1.6391 1.6391 1.9469 1.9469 2.0219 2.0219 2.2188 2.2188 2.3851 2.3851 2.6891 2.6891 2.7705 2.7705 3.5776 3.5776 3.6233 3.6233 3.7284 3.7284 3.7798 3.7798 3.8439 3.8439 4.0053 4.0053 4.4767 4.4767 4.7577 4.7577 6.7376 6.7376 8.2588 8.2588 8.3630 8.3630 8.6916 8.6916 9.6874 9.6874 10.0055 10.0055 k = 0.1974 0.2278 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5884 -8.5884 -7.7065 -7.7064 -7.5191 -7.5191 -7.4090 -7.4090 -6.9441 -6.9441 -6.9200 -6.9200 -6.9030 -6.9030 -2.8204 -2.8204 0.1041 0.1041 0.3592 0.3592 0.7748 0.7749 1.0877 1.0877 1.1654 1.1654 1.4629 1.4629 1.6373 1.6373 1.9500 1.9500 2.0199 2.0199 2.2167 2.2167 2.3863 2.3863 2.6884 2.6884 2.7692 2.7692 3.5803 3.5803 3.6288 3.6288 3.7410 3.7410 3.7841 3.7841 3.8413 3.8413 3.9990 3.9990 4.4973 4.4973 4.7274 4.7274 6.7292 6.7292 8.2622 8.2622 8.3683 8.3683 8.6846 8.6846 9.7079 9.7079 9.9822 9.9822 k = 0.2105 0.2430 0.6616 ( 7120 PWs) bands (ev): -23.9414 -23.9414 -8.5895 -8.5895 -7.7049 -7.7049 -7.5195 -7.5195 -7.4051 -7.4051 -6.9452 -6.9452 -6.9224 -6.9224 -6.9041 -6.9041 -2.8196 -2.8196 0.1241 0.1241 0.3379 0.3379 0.7724 0.7724 1.0880 1.0880 1.1648 1.1648 1.4638 1.4638 1.6359 1.6359 1.9527 1.9527 2.0181 2.0181 2.2150 2.2150 2.3872 2.3872 2.6878 2.6878 2.7681 2.7681 3.5825 3.5825 3.6334 3.6334 3.7527 3.7527 3.7867 3.7867 3.8386 3.8386 3.9936 3.9936 4.5192 4.5192 4.6977 4.6977 6.7225 6.7225 8.2647 8.2647 8.3724 8.3724 8.6791 8.6791 9.7302 9.7302 9.9571 9.9571 k = 0.2237 0.2582 0.6616 ( 7124 PWs) bands (ev): -23.9414 -23.9414 -8.5903 -8.5903 -7.7038 -7.7038 -7.5198 -7.5198 -7.4022 -7.4022 -6.9464 -6.9464 -6.9237 -6.9237 -6.9048 -6.9048 -2.8191 -2.8191 0.1418 0.1418 0.3192 0.3192 0.7706 0.7706 1.0881 1.0881 1.1643 1.1643 1.4644 1.4644 1.6348 1.6348 1.9548 1.9548 2.0167 2.0167 2.2139 2.2139 2.3879 2.3879 2.6874 2.6874 2.7672 2.7672 3.5841 3.5842 3.6367 3.6367 3.7631 3.7631 3.7872 3.7872 3.8363 3.8363 3.9896 3.9896 4.5418 4.5418 4.6695 4.6695 6.7176 6.7176 8.2666 8.2666 8.3754 8.3754 8.6750 8.6750 9.7526 9.7526 9.9327 9.9327 k = 0.2368 0.2733 0.6616 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5907 -8.5907 -7.7032 -7.7032 -7.5200 -7.5200 -7.4003 -7.4003 -6.9474 -6.9474 -6.9244 -6.9243 -6.9053 -6.9053 -2.8187 -2.8187 0.1547 0.1547 0.3057 0.3057 0.7695 0.7695 1.0882 1.0882 1.1641 1.1641 1.4647 1.4647 1.6341 1.6341 1.9560 1.9560 2.0158 2.0158 2.2131 2.2131 2.3882 2.3882 2.6872 2.6872 2.7667 2.7667 3.5851 3.5851 3.6387 3.6387 3.7717 3.7717 3.7854 3.7854 3.8347 3.8347 3.9870 3.9870 4.5627 4.5627 4.6451 4.6451 6.7146 6.7146 8.2677 8.2677 8.3771 8.3771 8.6725 8.6725 9.7711 9.7711 9.9128 9.9128 k = 0.2500 0.2885 0.6616 ( 7136 PWs) bands (ev): -23.9414 -23.9414 -8.5909 -8.5909 -7.7029 -7.7029 -7.5201 -7.5201 -7.3997 -7.3997 -6.9477 -6.9477 -6.9245 -6.9245 -6.9055 -6.9055 -2.8186 -2.8186 0.1596 0.1596 0.3006 0.3006 0.7691 0.7691 1.0883 1.0883 1.1640 1.1640 1.4648 1.4648 1.6339 1.6339 1.9565 1.9565 2.0155 2.0155 2.2129 2.2129 2.3884 2.3884 2.6871 2.6871 2.7665 2.7665 3.5855 3.5855 3.6393 3.6393 3.7764 3.7764 3.7832 3.7832 3.8342 3.8342 3.9862 3.9862 4.5734 4.5734 4.6333 4.6333 6.7136 6.7136 8.2681 8.2681 8.3777 8.3777 8.6717 8.6717 9.7788 9.7788 9.9046 9.9046 Writing output data file KAg2SbS4.save init_run : 1.76s CPU 1.08s WALL ( 1 calls) electrons : 1101.15s CPU 1010.34s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.23s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 1101.14s CPU 1010.33s WALL ( 1 calls) v_of_rho : 0.09s CPU 0.05s WALL ( 1 calls) v_h : 0.02s CPU 0.01s WALL ( 1 calls) v_xc : 0.07s CPU 0.03s WALL ( 1 calls) newd : 0.51s CPU 0.27s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.27s CPU 0.32s WALL ( 266 calls) cegterg : 936.34s CPU 913.71s WALL ( 292 calls) Called by sum_band: Called by *egterg: h_psi : 675.14s CPU 589.77s WALL ( 5153 calls) s_psi : 16.94s CPU 15.85s WALL ( 5153 calls) g_psi : 0.22s CPU 0.21s WALL ( 4595 calls) cdiaghg : 340.92s CPU 338.14s WALL ( 4861 calls) cegterg:over : 30.28s CPU 30.35s WALL ( 4595 calls) cegterg:upda : 11.22s CPU 11.43s WALL ( 4595 calls) cegterg:last : 7.53s CPU 7.60s WALL ( 824 calls) cdiaghg:chol : 11.64s CPU 11.62s WALL ( 4861 calls) cdiaghg:inve : 9.24s CPU 9.19s WALL ( 4861 calls) cdiaghg:para : 35.95s CPU 35.63s WALL ( 9722 calls) Called by h_psi: h_psi:vloc : 642.17s CPU 559.13s WALL ( 5153 calls) h_psi:vnl : 32.74s CPU 30.44s WALL ( 5153 calls) add_vuspsi : 15.45s CPU 14.08s WALL ( 5153 calls) General routines calbec : 17.26s CPU 16.34s WALL ( 5153 calls) fft : 0.17s CPU 0.12s WALL ( 19 calls) ffts : 0.05s CPU 0.03s WALL ( 4 calls) fftw : 636.36s CPU 553.88s WALL ( 840152 calls) interpolate : 0.09s CPU 0.05s WALL ( 4 calls) davcio : 0.38s CPU 0.75s WALL ( 532 calls) Parallel routines fft_scatter : 529.58s CPU 488.76s WALL ( 840175 calls) PWSCF : 19m59.72s CPU 18m42.92s WALL This run was terminated on: 12:57: 5 15Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=