Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 14:44:40 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaxAgSnx2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 76 58 16 1643 1098 169 Max 77 59 17 1646 1119 171 Sum 2753 2111 603 59193 39871 6129 bravais-lattice index = 14 lattice parameter (alat) = 12.5027 a.u. unit-cell volume = 886.0384 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 250.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.502744 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.735730 celldm(5)= -0.735730 celldm(6)= 0.471461 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.471461 0.881887 0.000000 ) a(3) = ( -0.735730 -0.440943 0.514072 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.534605 0.972627 ) b(2) = ( 0.000000 1.133932 0.972627 ) b(3) = ( 0.000000 0.000000 1.945254 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sn read from file: /users/gautes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 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. # 3 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 Ba 10.00 137.32700 Ba( 1.00) Sn 14.00 118.71000 Sn( 1.00) Ag 11.00 107.86820 Ag( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 306 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 2) = ( 0.0000000 0.0000000 0.0206942), wk = 0.0032680 k( 3) = ( 0.0000000 0.0000000 0.0413884), wk = 0.0032680 k( 4) = ( 0.0000000 0.0000000 0.0620826), wk = 0.0032680 k( 5) = ( 0.0000000 0.0000000 0.0827768), wk = 0.0032680 k( 6) = ( 0.0000000 0.0000000 0.1034710), wk = 0.0032680 k( 7) = ( 0.0000000 0.0000000 0.1241652), wk = 0.0032680 k( 8) = ( 0.0000000 0.0000000 0.1448594), wk = 0.0032680 k( 9) = ( 0.0000000 0.0000000 0.1655536), wk = 0.0032680 k( 10) = ( 0.0000000 0.0000000 0.1862478), wk = 0.0032680 k( 11) = ( 0.0000000 0.0000000 0.2069420), wk = 0.0032680 k( 12) = ( 0.0000000 0.0000000 0.2276362), wk = 0.0032680 k( 13) = ( 0.0000000 0.0000000 0.2483304), wk = 0.0032680 k( 14) = ( 0.0000000 0.0000000 0.2690246), wk = 0.0032680 k( 15) = ( 0.0000000 0.0000000 0.2897188), wk = 0.0032680 k( 16) = ( 0.0000000 0.0000000 0.3104130), wk = 0.0032680 k( 17) = ( 0.0000000 0.0000000 0.3311072), wk = 0.0032680 k( 18) = ( 0.0000000 0.0000000 0.3518013), wk = 0.0032680 k( 19) = ( 0.0000000 0.0000000 0.3724955), wk = 0.0032680 k( 20) = ( 0.0000000 0.0000000 0.3931897), wk = 0.0032680 k( 21) = ( 0.0000000 0.0000000 0.4138839), wk = 0.0032680 k( 22) = ( 0.0000000 0.0000000 0.4345781), wk = 0.0032680 k( 23) = ( 0.0000000 0.0000000 0.4552723), wk = 0.0032680 k( 24) = ( 0.0000000 0.0000000 0.4759665), wk = 0.0032680 k( 25) = ( 0.0000000 0.0000000 0.4966607), wk = 0.0032680 k( 26) = ( 0.0000000 0.0000000 0.5173549), wk = 0.0032680 k( 27) = ( 0.0000000 0.0000000 0.5380491), wk = 0.0032680 k( 28) = ( 0.0000000 0.0000000 0.5587433), wk = 0.0032680 k( 29) = ( 0.0000000 0.0000000 0.5794375), wk = 0.0032680 k( 30) = ( 0.0000000 0.0000000 0.6001317), wk = 0.0032680 k( 31) = ( 0.0000000 0.0000000 0.6208259), wk = 0.0032680 k( 32) = ( 0.0000000 0.0000000 0.6415201), wk = 0.0032680 k( 33) = ( 0.0000000 0.0000000 0.6622143), wk = 0.0032680 k( 34) = ( 0.0000000 0.0000000 0.6829085), wk = 0.0032680 k( 35) = ( 0.0000000 0.0000000 0.7036027), wk = 0.0032680 k( 36) = ( 0.0000000 0.0000000 0.7242969), wk = 0.0032680 k( 37) = ( 0.0000000 0.0000000 0.7449911), wk = 0.0032680 k( 38) = ( 0.0000000 0.0000000 0.7656853), wk = 0.0032680 k( 39) = ( 0.0000000 0.0000000 0.7863795), wk = 0.0032680 k( 40) = ( 0.0000000 0.0000000 0.8070737), wk = 0.0032680 k( 41) = ( 0.0000000 0.0000000 0.8277679), wk = 0.0032680 k( 42) = ( 0.0000000 0.0000000 0.8484621), wk = 0.0032680 k( 43) = ( 0.0000000 0.0000000 0.8691563), wk = 0.0032680 k( 44) = ( 0.0000000 0.0000000 0.8898505), wk = 0.0032680 k( 45) = ( 0.0000000 0.0000000 0.9105447), wk = 0.0032680 k( 46) = ( 0.0000000 0.0000000 0.9312388), wk = 0.0032680 k( 47) = ( 0.0000000 0.0000000 0.9519330), wk = 0.0032680 k( 48) = ( 0.0000000 0.0000000 0.9726272), wk = 0.0032680 k( 49) = ( 0.0000000 0.0000000 0.9726272), wk = 0.0032680 k( 50) = ( -0.0099776 0.0166480 0.9726272), wk = 0.0032680 k( 51) = ( -0.0199552 0.0332960 0.9726272), wk = 0.0032680 k( 52) = ( -0.0299328 0.0499440 0.9726272), wk = 0.0032680 k( 53) = ( -0.0399104 0.0665919 0.9726272), wk = 0.0032680 k( 54) = ( -0.0498880 0.0832399 0.9726272), wk = 0.0032680 k( 55) = ( -0.0598656 0.0998879 0.9726272), wk = 0.0032680 k( 56) = ( -0.0698432 0.1165359 0.9726272), wk = 0.0032680 k( 57) = ( -0.0798208 0.1331839 0.9726272), wk = 0.0032680 k( 58) = ( -0.0897984 0.1498319 0.9726272), wk = 0.0032680 k( 59) = ( -0.0897984 0.1498319 0.9726272), wk = 0.0032680 k( 60) = ( -0.0973947 0.1625066 0.9578504), wk = 0.0032680 k( 61) = ( -0.1049910 0.1751814 0.9430737), wk = 0.0032680 k( 62) = ( -0.1125874 0.1878561 0.9282969), wk = 0.0032680 k( 63) = ( -0.1201837 0.2005309 0.9135201), wk = 0.0032680 k( 64) = ( -0.1277800 0.2132056 0.8987433), wk = 0.0032680 k( 65) = ( -0.1353763 0.2258804 0.8839665), wk = 0.0032680 k( 66) = ( -0.1429727 0.2385551 0.8691897), wk = 0.0032680 k( 67) = ( -0.1505690 0.2512299 0.8544129), wk = 0.0032680 k( 68) = ( -0.1581653 0.2639046 0.8396361), wk = 0.0032680 k( 69) = ( -0.1657616 0.2765794 0.8248594), wk = 0.0032680 k( 70) = ( -0.1733580 0.2892541 0.8100826), wk = 0.0032680 k( 71) = ( -0.1809543 0.3019289 0.7953058), wk = 0.0032680 k( 72) = ( -0.1885506 0.3146036 0.7805290), wk = 0.0032680 k( 73) = ( -0.1961469 0.3272784 0.7657522), wk = 0.0032680 k( 74) = ( -0.2037433 0.3399531 0.7509754), wk = 0.0032680 k( 75) = ( -0.2113396 0.3526279 0.7361986), wk = 0.0032680 k( 76) = ( -0.2189359 0.3653026 0.7214218), wk = 0.0032680 k( 77) = ( -0.2265322 0.3779774 0.7066451), wk = 0.0032680 k( 78) = ( -0.2341286 0.3906521 0.6918683), wk = 0.0032680 k( 79) = ( -0.2417249 0.4033269 0.6770915), wk = 0.0032680 k( 80) = ( -0.2493212 0.4160016 0.6623147), wk = 0.0032680 k( 81) = ( -0.2569175 0.4286764 0.6475379), wk = 0.0032680 k( 82) = ( -0.2645139 0.4413511 0.6327611), wk = 0.0032680 k( 83) = ( -0.2721102 0.4540259 0.6179843), wk = 0.0032680 k( 84) = ( -0.2797065 0.4667006 0.6032075), wk = 0.0032680 k( 85) = ( -0.2873029 0.4793754 0.5884307), wk = 0.0032680 k( 86) = ( -0.2948992 0.4920501 0.5736540), wk = 0.0032680 k( 87) = ( -0.2948992 0.4920501 0.5736540), wk = 0.0032680 k( 88) = ( -0.2873377 0.4794335 0.5589449), wk = 0.0032680 k( 89) = ( -0.2797762 0.4668168 0.5442358), wk = 0.0032680 k( 90) = ( -0.2722146 0.4542001 0.5295267), wk = 0.0032680 k( 91) = ( -0.2646531 0.4415835 0.5148177), wk = 0.0032680 k( 92) = ( -0.2570916 0.4289668 0.5001086), wk = 0.0032680 k( 93) = ( -0.2495301 0.4163501 0.4853995), wk = 0.0032680 k( 94) = ( -0.2419686 0.4037334 0.4706904), wk = 0.0032680 k( 95) = ( -0.2344070 0.3911168 0.4559813), wk = 0.0032680 k( 96) = ( -0.2268455 0.3785001 0.4412723), wk = 0.0032680 k( 97) = ( -0.2192840 0.3658834 0.4265632), wk = 0.0032680 k( 98) = ( -0.2117225 0.3532668 0.4118541), wk = 0.0032680 k( 99) = ( -0.2041610 0.3406501 0.3971450), wk = 0.0032680 k( 100) = ( -0.1965995 0.3280334 0.3824360), wk = 0.0032680 k( 101) = ( -0.1890379 0.3154168 0.3677269), wk = 0.0032680 k( 102) = ( -0.1814764 0.3028001 0.3530178), wk = 0.0032680 k( 103) = ( -0.1739149 0.2901834 0.3383087), wk = 0.0032680 k( 104) = ( -0.1663534 0.2775668 0.3235997), wk = 0.0032680 k( 105) = ( -0.1587919 0.2649501 0.3088906), wk = 0.0032680 k( 106) = ( -0.1512304 0.2523334 0.2941815), wk = 0.0032680 k( 107) = ( -0.1436688 0.2397167 0.2794724), wk = 0.0032680 k( 108) = ( -0.1361073 0.2271001 0.2647634), wk = 0.0032680 k( 109) = ( -0.1285458 0.2144834 0.2500543), wk = 0.0032680 k( 110) = ( -0.1209843 0.2018667 0.2353452), wk = 0.0032680 k( 111) = ( -0.1134228 0.1892500 0.2206361), wk = 0.0032680 k( 112) = ( -0.1058613 0.1766334 0.2059271), wk = 0.0032680 k( 113) = ( -0.0982997 0.1640167 0.1912180), wk = 0.0032680 k( 114) = ( -0.0907382 0.1514000 0.1765089), wk = 0.0032680 k( 115) = ( -0.0831767 0.1387834 0.1617998), wk = 0.0032680 k( 116) = ( -0.0756152 0.1261667 0.1470908), wk = 0.0032680 k( 117) = ( -0.0680537 0.1135500 0.1323817), wk = 0.0032680 k( 118) = ( -0.0604921 0.1009334 0.1176726), wk = 0.0032680 k( 119) = ( -0.0529306 0.0883167 0.1029635), wk = 0.0032680 k( 120) = ( -0.0453691 0.0757000 0.0882545), wk = 0.0032680 k( 121) = ( -0.0378076 0.0630834 0.0735454), wk = 0.0032680 k( 122) = ( -0.0302461 0.0504667 0.0588363), wk = 0.0032680 k( 123) = ( -0.0226846 0.0378500 0.0441272), wk = 0.0032680 k( 124) = ( -0.0151230 0.0252333 0.0294182), wk = 0.0032680 k( 125) = ( -0.0075615 0.0126167 0.0147091), wk = 0.0032680 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 128) = ( 0.0178571 0.0107023 0.0000000), wk = 0.0032680 k( 129) = ( 0.0357143 0.0214046 0.0000000), wk = 0.0032680 k( 130) = ( 0.0535714 0.0321068 0.0000000), wk = 0.0032680 k( 131) = ( 0.0714286 0.0428091 0.0000000), wk = 0.0032680 k( 132) = ( 0.0892857 0.0535114 0.0000000), wk = 0.0032680 k( 133) = ( 0.1071429 0.0642137 0.0000000), wk = 0.0032680 k( 134) = ( 0.1250000 0.0749159 0.0000000), wk = 0.0032680 k( 135) = ( 0.1428571 0.0856182 0.0000000), wk = 0.0032680 k( 136) = ( 0.1607143 0.0963205 0.0000000), wk = 0.0032680 k( 137) = ( 0.1785714 0.1070228 0.0000000), wk = 0.0032680 k( 138) = ( 0.1964286 0.1177250 0.0000000), wk = 0.0032680 k( 139) = ( 0.2142857 0.1284273 0.0000000), wk = 0.0032680 k( 140) = ( 0.2321429 0.1391296 0.0000000), wk = 0.0032680 k( 141) = ( 0.2500000 0.1498319 0.0000000), wk = 0.0032680 k( 142) = ( 0.2678571 0.1605342 0.0000000), wk = 0.0032680 k( 143) = ( 0.2857143 0.1712364 0.0000000), wk = 0.0032680 k( 144) = ( 0.3035714 0.1819387 0.0000000), wk = 0.0032680 k( 145) = ( 0.3214286 0.1926410 0.0000000), wk = 0.0032680 k( 146) = ( 0.3392857 0.2033433 0.0000000), wk = 0.0032680 k( 147) = ( 0.3571429 0.2140455 0.0000000), wk = 0.0032680 k( 148) = ( 0.3750000 0.2247478 0.0000000), wk = 0.0032680 k( 149) = ( 0.3928571 0.2354501 0.0000000), wk = 0.0032680 k( 150) = ( 0.4107143 0.2461524 0.0000000), wk = 0.0032680 k( 151) = ( 0.4285714 0.2568546 0.0000000), wk = 0.0032680 k( 152) = ( 0.4464286 0.2675569 0.0000000), wk = 0.0032680 k( 153) = ( 0.4642857 0.2782592 0.0000000), wk = 0.0032680 k( 154) = ( 0.4821429 0.2889615 0.0000000), wk = 0.0032680 k( 155) = ( 0.5000000 0.2996638 0.0000000), wk = 0.0032680 k( 156) = ( 0.5000000 0.2996638 0.0000000), wk = 0.0032680 k( 157) = ( 0.4924037 0.3123385 0.0147768), wk = 0.0032680 k( 158) = ( 0.4848074 0.3250133 0.0295536), wk = 0.0032680 k( 159) = ( 0.4772110 0.3376880 0.0443304), wk = 0.0032680 k( 160) = ( 0.4696147 0.3503628 0.0591072), wk = 0.0032680 k( 161) = ( 0.4620184 0.3630375 0.0738839), wk = 0.0032680 k( 162) = ( 0.4544220 0.3757123 0.0886607), wk = 0.0032680 k( 163) = ( 0.4468257 0.3883870 0.1034375), wk = 0.0032680 k( 164) = ( 0.4392294 0.4010618 0.1182143), wk = 0.0032680 k( 165) = ( 0.4316331 0.4137365 0.1329911), wk = 0.0032680 k( 166) = ( 0.4240367 0.4264113 0.1477679), wk = 0.0032680 k( 167) = ( 0.4164404 0.4390860 0.1625447), wk = 0.0032680 k( 168) = ( 0.4088441 0.4517608 0.1773215), wk = 0.0032680 k( 169) = ( 0.4012478 0.4644355 0.1920983), wk = 0.0032680 k( 170) = ( 0.3936514 0.4771103 0.2068750), wk = 0.0032680 k( 171) = ( 0.3860551 0.4897850 0.2216518), wk = 0.0032680 k( 172) = ( 0.3784588 0.5024598 0.2364286), wk = 0.0032680 k( 173) = ( 0.3708625 0.5151345 0.2512054), wk = 0.0032680 k( 174) = ( 0.3632661 0.5278093 0.2659822), wk = 0.0032680 k( 175) = ( 0.3556698 0.5404840 0.2807590), wk = 0.0032680 k( 176) = ( 0.3480735 0.5531588 0.2955358), wk = 0.0032680 k( 177) = ( 0.3404771 0.5658335 0.3103126), wk = 0.0032680 k( 178) = ( 0.3328808 0.5785083 0.3250893), wk = 0.0032680 k( 179) = ( 0.3252845 0.5911830 0.3398661), wk = 0.0032680 k( 180) = ( 0.3176882 0.6038578 0.3546429), wk = 0.0032680 k( 181) = ( 0.3100918 0.6165325 0.3694197), wk = 0.0032680 k( 182) = ( 0.3024955 0.6292073 0.3841965), wk = 0.0032680 k( 183) = ( 0.2948992 0.6418820 0.3989733), wk = 0.0032680 k( 184) = ( 0.2948992 0.6418820 0.3989733), wk = 0.0032680 k( 185) = ( 0.2764680 0.6371998 0.4044321), wk = 0.0032680 k( 186) = ( 0.2580368 0.6325175 0.4098908), wk = 0.0032680 k( 187) = ( 0.2396056 0.6278353 0.4153496), wk = 0.0032680 k( 188) = ( 0.2211744 0.6231530 0.4208084), wk = 0.0032680 k( 189) = ( 0.2027432 0.6184708 0.4262671), wk = 0.0032680 k( 190) = ( 0.1843120 0.6137885 0.4317259), wk = 0.0032680 k( 191) = ( 0.1658808 0.6091063 0.4371847), wk = 0.0032680 k( 192) = ( 0.1474496 0.6044240 0.4426435), wk = 0.0032680 k( 193) = ( 0.1290184 0.5997418 0.4481022), wk = 0.0032680 k( 194) = ( 0.1105872 0.5950596 0.4535610), wk = 0.0032680 k( 195) = ( 0.0921560 0.5903773 0.4590198), wk = 0.0032680 k( 196) = ( 0.0737248 0.5856951 0.4644785), wk = 0.0032680 k( 197) = ( 0.0552936 0.5810128 0.4699373), wk = 0.0032680 k( 198) = ( 0.0368624 0.5763306 0.4753961), wk = 0.0032680 k( 199) = ( 0.0184312 0.5716483 0.4808548), wk = 0.0032680 k( 200) = ( 0.0000000 0.5669661 0.4863136), wk = 0.0032680 k( 201) = ( 0.0000000 0.5669661 0.4863136), wk = 0.0032680 k( 202) = ( 0.0075758 0.5543256 0.5010504), wk = 0.0032680 k( 203) = ( 0.0151515 0.5416852 0.5157872), wk = 0.0032680 k( 204) = ( 0.0227273 0.5290448 0.5305239), wk = 0.0032680 k( 205) = ( 0.0303030 0.5164044 0.5452607), wk = 0.0032680 k( 206) = ( 0.0378788 0.5037639 0.5599975), wk = 0.0032680 k( 207) = ( 0.0454546 0.4911235 0.5747343), wk = 0.0032680 k( 208) = ( 0.0530303 0.4784831 0.5894711), wk = 0.0032680 k( 209) = ( 0.0606061 0.4658426 0.6042078), wk = 0.0032680 k( 210) = ( 0.0681818 0.4532022 0.6189446), wk = 0.0032680 k( 211) = ( 0.0757576 0.4405618 0.6336814), wk = 0.0032680 k( 212) = ( 0.0833333 0.4279213 0.6484182), wk = 0.0032680 k( 213) = ( 0.0909091 0.4152809 0.6631549), wk = 0.0032680 k( 214) = ( 0.0984848 0.4026405 0.6778917), wk = 0.0032680 k( 215) = ( 0.1060606 0.3900000 0.6926285), wk = 0.0032680 k( 216) = ( 0.1136364 0.3773596 0.7073653), wk = 0.0032680 k( 217) = ( 0.1212121 0.3647192 0.7221020), wk = 0.0032680 k( 218) = ( 0.1287879 0.3520788 0.7368388), wk = 0.0032680 k( 219) = ( 0.1363636 0.3394383 0.7515756), wk = 0.0032680 k( 220) = ( 0.1439394 0.3267979 0.7663124), wk = 0.0032680 k( 221) = ( 0.1515151 0.3141575 0.7810491), wk = 0.0032680 k( 222) = ( 0.1590909 0.3015170 0.7957859), wk = 0.0032680 k( 223) = ( 0.1666667 0.2888766 0.8105227), wk = 0.0032680 k( 224) = ( 0.1742424 0.2762362 0.8252595), wk = 0.0032680 k( 225) = ( 0.1818182 0.2635958 0.8399963), wk = 0.0032680 k( 226) = ( 0.1893939 0.2509553 0.8547330), wk = 0.0032680 k( 227) = ( 0.1969697 0.2383149 0.8694698), wk = 0.0032680 k( 228) = ( 0.2045454 0.2256745 0.8842066), wk = 0.0032680 k( 229) = ( 0.2121212 0.2130340 0.8989434), wk = 0.0032680 k( 230) = ( 0.2196970 0.2003936 0.9136801), wk = 0.0032680 k( 231) = ( 0.2272727 0.1877532 0.9284169), wk = 0.0032680 k( 232) = ( 0.2348485 0.1751127 0.9431537), wk = 0.0032680 k( 233) = ( 0.2424242 0.1624723 0.9578905), wk = 0.0032680 k( 234) = ( 0.2500000 0.1498319 0.9726272), wk = 0.0032680 k( 235) = ( 0.2500000 0.1498319 0.9726272), wk = 0.0032680 k( 236) = ( 0.2647059 0.1586455 0.9623519), wk = 0.0032680 k( 237) = ( 0.2794118 0.1674592 0.9520766), wk = 0.0032680 k( 238) = ( 0.2941177 0.1762728 0.9418012), wk = 0.0032680 k( 239) = ( 0.3088235 0.1850864 0.9315259), wk = 0.0032680 k( 240) = ( 0.3235294 0.1939001 0.9212506), wk = 0.0032680 k( 241) = ( 0.3382353 0.2027137 0.9109752), wk = 0.0032680 k( 242) = ( 0.3529412 0.2115274 0.9006999), wk = 0.0032680 k( 243) = ( 0.3676471 0.2203410 0.8904246), wk = 0.0032680 k( 244) = ( 0.3823529 0.2291546 0.8801492), wk = 0.0032680 k( 245) = ( 0.3970588 0.2379683 0.8698739), wk = 0.0032680 k( 246) = ( 0.4117647 0.2467819 0.8595986), wk = 0.0032680 k( 247) = ( 0.4264706 0.2555956 0.8493232), wk = 0.0032680 k( 248) = ( 0.4411765 0.2644092 0.8390479), wk = 0.0032680 k( 249) = ( 0.4558823 0.2732228 0.8287726), wk = 0.0032680 k( 250) = ( 0.4705882 0.2820365 0.8184972), wk = 0.0032680 k( 251) = ( 0.4852941 0.2908501 0.8082219), wk = 0.0032680 k( 252) = ( 0.5000000 0.2996638 0.7979466), wk = 0.0032680 k( 253) = ( 0.5000000 0.2996638 0.7979466), wk = 0.0032680 k( 254) = ( 0.5000000 0.2996638 0.7769480), wk = 0.0032680 k( 255) = ( 0.5000000 0.2996638 0.7559494), wk = 0.0032680 k( 256) = ( 0.5000000 0.2996638 0.7349508), wk = 0.0032680 k( 257) = ( 0.5000000 0.2996638 0.7139522), wk = 0.0032680 k( 258) = ( 0.5000000 0.2996638 0.6929536), wk = 0.0032680 k( 259) = ( 0.5000000 0.2996638 0.6719550), wk = 0.0032680 k( 260) = ( 0.5000000 0.2996638 0.6509564), wk = 0.0032680 k( 261) = ( 0.5000000 0.2996638 0.6299578), wk = 0.0032680 k( 262) = ( 0.5000000 0.2996638 0.6089592), wk = 0.0032680 k( 263) = ( 0.5000000 0.2996638 0.5879606), wk = 0.0032680 k( 264) = ( 0.5000000 0.2996638 0.5669620), wk = 0.0032680 k( 265) = ( 0.5000000 0.2996638 0.5459635), wk = 0.0032680 k( 266) = ( 0.5000000 0.2996638 0.5249649), wk = 0.0032680 k( 267) = ( 0.5000000 0.2996638 0.5039663), wk = 0.0032680 k( 268) = ( 0.5000000 0.2996638 0.4829677), wk = 0.0032680 k( 269) = ( 0.5000000 0.2996638 0.4619691), wk = 0.0032680 k( 270) = ( 0.5000000 0.2996638 0.4409705), wk = 0.0032680 k( 271) = ( 0.5000000 0.2996638 0.4199719), wk = 0.0032680 k( 272) = ( 0.5000000 0.2996638 0.3989733), wk = 0.0032680 k( 273) = ( 0.5000000 0.2996638 0.3779747), wk = 0.0032680 k( 274) = ( 0.5000000 0.2996638 0.3569761), wk = 0.0032680 k( 275) = ( 0.5000000 0.2996638 0.3359775), wk = 0.0032680 k( 276) = ( 0.5000000 0.2996638 0.3149789), wk = 0.0032680 k( 277) = ( 0.5000000 0.2996638 0.2939803), wk = 0.0032680 k( 278) = ( 0.5000000 0.2996638 0.2729817), wk = 0.0032680 k( 279) = ( 0.5000000 0.2996638 0.2519831), wk = 0.0032680 k( 280) = ( 0.5000000 0.2996638 0.2309845), wk = 0.0032680 k( 281) = ( 0.5000000 0.2996638 0.2099859), wk = 0.0032680 k( 282) = ( 0.5000000 0.2996638 0.1889873), wk = 0.0032680 k( 283) = ( 0.5000000 0.2996638 0.1679888), wk = 0.0032680 k( 284) = ( 0.5000000 0.2996638 0.1469902), wk = 0.0032680 k( 285) = ( 0.5000000 0.2996638 0.1259916), wk = 0.0032680 k( 286) = ( 0.5000000 0.2996638 0.1049930), wk = 0.0032680 k( 287) = ( 0.5000000 0.2996638 0.0839944), wk = 0.0032680 k( 288) = ( 0.5000000 0.2996638 0.0629958), wk = 0.0032680 k( 289) = ( 0.5000000 0.2996638 0.0419972), wk = 0.0032680 k( 290) = ( 0.5000000 0.2996638 0.0209986), wk = 0.0032680 k( 291) = ( 0.5000000 0.2996638 0.0000000), wk = 0.0032680 k( 292) = ( 0.0000000 0.0000000 0.9726272), wk = 0.0032680 k( 293) = ( 0.0178571 0.0107023 0.9726272), wk = 0.0032680 k( 294) = ( 0.0357143 0.0214046 0.9726272), wk = 0.0032680 k( 295) = ( 0.0535714 0.0321068 0.9726272), wk = 0.0032680 k( 296) = ( 0.0714286 0.0428091 0.9726272), wk = 0.0032680 k( 297) = ( 0.0892857 0.0535114 0.9726272), wk = 0.0032680 k( 298) = ( 0.1071429 0.0642137 0.9726272), wk = 0.0032680 k( 299) = ( 0.1250000 0.0749159 0.9726272), wk = 0.0032680 k( 300) = ( 0.1428571 0.0856182 0.9726272), wk = 0.0032680 k( 301) = ( 0.1607143 0.0963205 0.9726272), wk = 0.0032680 k( 302) = ( 0.1785714 0.1070228 0.9726272), wk = 0.0032680 k( 303) = ( 0.1964286 0.1177250 0.9726272), wk = 0.0032680 k( 304) = ( 0.2142857 0.1284273 0.9726272), wk = 0.0032680 k( 305) = ( 0.2321429 0.1391296 0.9726272), wk = 0.0032680 k( 306) = ( 0.2500000 0.1498319 0.9726272), wk = 0.0032680 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 2) = ( 0.0000000 0.0000000 0.0106383), wk = 0.0032680 k( 3) = ( 0.0000000 0.0000000 0.0212766), wk = 0.0032680 k( 4) = ( 0.0000000 0.0000000 0.0319149), wk = 0.0032680 k( 5) = ( 0.0000000 0.0000000 0.0425532), wk = 0.0032680 k( 6) = ( 0.0000000 0.0000000 0.0531915), wk = 0.0032680 k( 7) = ( 0.0000000 0.0000000 0.0638298), wk = 0.0032680 k( 8) = ( 0.0000000 0.0000000 0.0744681), wk = 0.0032680 k( 9) = ( 0.0000000 0.0000000 0.0851064), wk = 0.0032680 k( 10) = ( 0.0000000 0.0000000 0.0957447), wk = 0.0032680 k( 11) = ( 0.0000000 0.0000000 0.1063830), wk = 0.0032680 k( 12) = ( 0.0000000 0.0000000 0.1170213), wk = 0.0032680 k( 13) = ( 0.0000000 0.0000000 0.1276596), wk = 0.0032680 k( 14) = ( 0.0000000 0.0000000 0.1382979), wk = 0.0032680 k( 15) = ( 0.0000000 0.0000000 0.1489362), wk = 0.0032680 k( 16) = ( 0.0000000 0.0000000 0.1595745), wk = 0.0032680 k( 17) = ( 0.0000000 0.0000000 0.1702128), wk = 0.0032680 k( 18) = ( 0.0000000 0.0000000 0.1808511), wk = 0.0032680 k( 19) = ( 0.0000000 0.0000000 0.1914894), wk = 0.0032680 k( 20) = ( 0.0000000 0.0000000 0.2021277), wk = 0.0032680 k( 21) = ( 0.0000000 0.0000000 0.2127660), wk = 0.0032680 k( 22) = ( 0.0000000 0.0000000 0.2234043), wk = 0.0032680 k( 23) = ( 0.0000000 0.0000000 0.2340426), wk = 0.0032680 k( 24) = ( 0.0000000 0.0000000 0.2446809), wk = 0.0032680 k( 25) = ( 0.0000000 0.0000000 0.2553191), wk = 0.0032680 k( 26) = ( 0.0000000 0.0000000 0.2659575), wk = 0.0032680 k( 27) = ( 0.0000000 0.0000000 0.2765957), wk = 0.0032680 k( 28) = ( 0.0000000 0.0000000 0.2872340), wk = 0.0032680 k( 29) = ( 0.0000000 0.0000000 0.2978723), wk = 0.0032680 k( 30) = ( 0.0000000 0.0000000 0.3085106), wk = 0.0032680 k( 31) = ( 0.0000000 0.0000000 0.3191489), wk = 0.0032680 k( 32) = ( 0.0000000 0.0000000 0.3297872), wk = 0.0032680 k( 33) = ( 0.0000000 0.0000000 0.3404255), wk = 0.0032680 k( 34) = ( 0.0000000 0.0000000 0.3510638), wk = 0.0032680 k( 35) = ( 0.0000000 0.0000000 0.3617021), wk = 0.0032680 k( 36) = ( 0.0000000 0.0000000 0.3723404), wk = 0.0032680 k( 37) = ( 0.0000000 0.0000000 0.3829787), wk = 0.0032680 k( 38) = ( 0.0000000 0.0000000 0.3936170), wk = 0.0032680 k( 39) = ( 0.0000000 0.0000000 0.4042553), wk = 0.0032680 k( 40) = ( 0.0000000 0.0000000 0.4148936), wk = 0.0032680 k( 41) = ( 0.0000000 0.0000000 0.4255319), wk = 0.0032680 k( 42) = ( 0.0000000 0.0000000 0.4361702), wk = 0.0032680 k( 43) = ( 0.0000000 0.0000000 0.4468085), wk = 0.0032680 k( 44) = ( 0.0000000 0.0000000 0.4574468), wk = 0.0032680 k( 45) = ( 0.0000000 0.0000000 0.4680851), wk = 0.0032680 k( 46) = ( 0.0000000 0.0000000 0.4787234), wk = 0.0032680 k( 47) = ( 0.0000000 0.0000000 0.4893617), wk = 0.0032680 k( 48) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032680 k( 49) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032680 k( 50) = ( -0.0099776 0.0099776 0.5000000), wk = 0.0032680 k( 51) = ( -0.0199552 0.0199552 0.5000000), wk = 0.0032680 k( 52) = ( -0.0299328 0.0299328 0.5000000), wk = 0.0032680 k( 53) = ( -0.0399104 0.0399104 0.5000000), wk = 0.0032680 k( 54) = ( -0.0498880 0.0498880 0.5000000), wk = 0.0032680 k( 55) = ( -0.0598656 0.0598656 0.5000000), wk = 0.0032680 k( 56) = ( -0.0698432 0.0698432 0.5000000), wk = 0.0032680 k( 57) = ( -0.0798208 0.0798208 0.5000000), wk = 0.0032680 k( 58) = ( -0.0897984 0.0897984 0.5000000), wk = 0.0032680 k( 59) = ( -0.0897984 0.0897984 0.5000000), wk = 0.0032680 k( 60) = ( -0.0973947 0.0973947 0.4924037), wk = 0.0032680 k( 61) = ( -0.1049910 0.1049910 0.4848074), wk = 0.0032680 k( 62) = ( -0.1125874 0.1125874 0.4772110), wk = 0.0032680 k( 63) = ( -0.1201837 0.1201837 0.4696147), wk = 0.0032680 k( 64) = ( -0.1277800 0.1277800 0.4620184), wk = 0.0032680 k( 65) = ( -0.1353763 0.1353763 0.4544220), wk = 0.0032680 k( 66) = ( -0.1429727 0.1429727 0.4468257), wk = 0.0032680 k( 67) = ( -0.1505690 0.1505690 0.4392294), wk = 0.0032680 k( 68) = ( -0.1581653 0.1581653 0.4316331), wk = 0.0032680 k( 69) = ( -0.1657616 0.1657616 0.4240367), wk = 0.0032680 k( 70) = ( -0.1733580 0.1733580 0.4164404), wk = 0.0032680 k( 71) = ( -0.1809543 0.1809543 0.4088441), wk = 0.0032680 k( 72) = ( -0.1885506 0.1885506 0.4012478), wk = 0.0032680 k( 73) = ( -0.1961469 0.1961469 0.3936514), wk = 0.0032680 k( 74) = ( -0.2037433 0.2037433 0.3860551), wk = 0.0032680 k( 75) = ( -0.2113396 0.2113396 0.3784588), wk = 0.0032680 k( 76) = ( -0.2189359 0.2189359 0.3708625), wk = 0.0032680 k( 77) = ( -0.2265322 0.2265322 0.3632661), wk = 0.0032680 k( 78) = ( -0.2341286 0.2341286 0.3556698), wk = 0.0032680 k( 79) = ( -0.2417249 0.2417249 0.3480735), wk = 0.0032680 k( 80) = ( -0.2493212 0.2493212 0.3404771), wk = 0.0032680 k( 81) = ( -0.2569175 0.2569175 0.3328808), wk = 0.0032680 k( 82) = ( -0.2645139 0.2645139 0.3252845), wk = 0.0032680 k( 83) = ( -0.2721102 0.2721102 0.3176882), wk = 0.0032680 k( 84) = ( -0.2797065 0.2797065 0.3100918), wk = 0.0032680 k( 85) = ( -0.2873029 0.2873029 0.3024955), wk = 0.0032680 k( 86) = ( -0.2948992 0.2948992 0.2948992), wk = 0.0032680 k( 87) = ( -0.2948992 0.2948992 0.2948992), wk = 0.0032680 k( 88) = ( -0.2873377 0.2873377 0.2873377), wk = 0.0032680 k( 89) = ( -0.2797762 0.2797762 0.2797762), wk = 0.0032680 k( 90) = ( -0.2722146 0.2722146 0.2722146), wk = 0.0032680 k( 91) = ( -0.2646531 0.2646531 0.2646531), wk = 0.0032680 k( 92) = ( -0.2570916 0.2570916 0.2570916), wk = 0.0032680 k( 93) = ( -0.2495301 0.2495301 0.2495301), wk = 0.0032680 k( 94) = ( -0.2419686 0.2419686 0.2419686), wk = 0.0032680 k( 95) = ( -0.2344070 0.2344070 0.2344070), wk = 0.0032680 k( 96) = ( -0.2268455 0.2268455 0.2268455), wk = 0.0032680 k( 97) = ( -0.2192840 0.2192840 0.2192840), wk = 0.0032680 k( 98) = ( -0.2117225 0.2117225 0.2117225), wk = 0.0032680 k( 99) = ( -0.2041610 0.2041610 0.2041610), wk = 0.0032680 k( 100) = ( -0.1965995 0.1965995 0.1965995), wk = 0.0032680 k( 101) = ( -0.1890379 0.1890379 0.1890379), wk = 0.0032680 k( 102) = ( -0.1814764 0.1814764 0.1814764), wk = 0.0032680 k( 103) = ( -0.1739149 0.1739149 0.1739149), wk = 0.0032680 k( 104) = ( -0.1663534 0.1663534 0.1663534), wk = 0.0032680 k( 105) = ( -0.1587919 0.1587919 0.1587919), wk = 0.0032680 k( 106) = ( -0.1512304 0.1512304 0.1512304), wk = 0.0032680 k( 107) = ( -0.1436688 0.1436688 0.1436688), wk = 0.0032680 k( 108) = ( -0.1361073 0.1361073 0.1361073), wk = 0.0032680 k( 109) = ( -0.1285458 0.1285458 0.1285458), wk = 0.0032680 k( 110) = ( -0.1209843 0.1209843 0.1209843), wk = 0.0032680 k( 111) = ( -0.1134228 0.1134228 0.1134228), wk = 0.0032680 k( 112) = ( -0.1058613 0.1058613 0.1058613), wk = 0.0032680 k( 113) = ( -0.0982997 0.0982997 0.0982997), wk = 0.0032680 k( 114) = ( -0.0907382 0.0907382 0.0907382), wk = 0.0032680 k( 115) = ( -0.0831767 0.0831767 0.0831767), wk = 0.0032680 k( 116) = ( -0.0756152 0.0756152 0.0756152), wk = 0.0032680 k( 117) = ( -0.0680537 0.0680537 0.0680537), wk = 0.0032680 k( 118) = ( -0.0604921 0.0604921 0.0604921), wk = 0.0032680 k( 119) = ( -0.0529306 0.0529306 0.0529306), wk = 0.0032680 k( 120) = ( -0.0453691 0.0453691 0.0453691), wk = 0.0032680 k( 121) = ( -0.0378076 0.0378076 0.0378076), wk = 0.0032680 k( 122) = ( -0.0302461 0.0302461 0.0302461), wk = 0.0032680 k( 123) = ( -0.0226846 0.0226846 0.0226846), wk = 0.0032680 k( 124) = ( -0.0151230 0.0151230 0.0151230), wk = 0.0032680 k( 125) = ( -0.0075615 0.0075615 0.0075615), wk = 0.0032680 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032680 k( 128) = ( 0.0178571 0.0178571 -0.0178571), wk = 0.0032680 k( 129) = ( 0.0357143 0.0357143 -0.0357143), wk = 0.0032680 k( 130) = ( 0.0535714 0.0535714 -0.0535714), wk = 0.0032680 k( 131) = ( 0.0714286 0.0714286 -0.0714286), wk = 0.0032680 k( 132) = ( 0.0892857 0.0892857 -0.0892857), wk = 0.0032680 k( 133) = ( 0.1071429 0.1071429 -0.1071429), wk = 0.0032680 k( 134) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0032680 k( 135) = ( 0.1428571 0.1428571 -0.1428571), wk = 0.0032680 k( 136) = ( 0.1607143 0.1607143 -0.1607143), wk = 0.0032680 k( 137) = ( 0.1785714 0.1785714 -0.1785714), wk = 0.0032680 k( 138) = ( 0.1964286 0.1964286 -0.1964286), wk = 0.0032680 k( 139) = ( 0.2142857 0.2142857 -0.2142857), wk = 0.0032680 k( 140) = ( 0.2321429 0.2321429 -0.2321429), wk = 0.0032680 k( 141) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0032680 k( 142) = ( 0.2678571 0.2678571 -0.2678571), wk = 0.0032680 k( 143) = ( 0.2857143 0.2857143 -0.2857143), wk = 0.0032680 k( 144) = ( 0.3035714 0.3035714 -0.3035714), wk = 0.0032680 k( 145) = ( 0.3214286 0.3214286 -0.3214286), wk = 0.0032680 k( 146) = ( 0.3392857 0.3392857 -0.3392857), wk = 0.0032680 k( 147) = ( 0.3571429 0.3571429 -0.3571429), wk = 0.0032680 k( 148) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0032680 k( 149) = ( 0.3928571 0.3928571 -0.3928571), wk = 0.0032680 k( 150) = ( 0.4107143 0.4107143 -0.4107143), wk = 0.0032680 k( 151) = ( 0.4285714 0.4285714 -0.4285714), wk = 0.0032680 k( 152) = ( 0.4464286 0.4464286 -0.4464286), wk = 0.0032680 k( 153) = ( 0.4642857 0.4642857 -0.4642857), wk = 0.0032680 k( 154) = ( 0.4821429 0.4821429 -0.4821429), wk = 0.0032680 k( 155) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032680 k( 156) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032680 k( 157) = ( 0.4924037 0.5075963 -0.4924037), wk = 0.0032680 k( 158) = ( 0.4848074 0.5151927 -0.4848074), wk = 0.0032680 k( 159) = ( 0.4772110 0.5227890 -0.4772110), wk = 0.0032680 k( 160) = ( 0.4696147 0.5303853 -0.4696147), wk = 0.0032680 k( 161) = ( 0.4620184 0.5379816 -0.4620184), wk = 0.0032680 k( 162) = ( 0.4544220 0.5455780 -0.4544220), wk = 0.0032680 k( 163) = ( 0.4468257 0.5531743 -0.4468257), wk = 0.0032680 k( 164) = ( 0.4392294 0.5607706 -0.4392294), wk = 0.0032680 k( 165) = ( 0.4316331 0.5683669 -0.4316331), wk = 0.0032680 k( 166) = ( 0.4240367 0.5759633 -0.4240367), wk = 0.0032680 k( 167) = ( 0.4164404 0.5835596 -0.4164404), wk = 0.0032680 k( 168) = ( 0.4088441 0.5911559 -0.4088441), wk = 0.0032680 k( 169) = ( 0.4012478 0.5987522 -0.4012478), wk = 0.0032680 k( 170) = ( 0.3936514 0.6063486 -0.3936514), wk = 0.0032680 k( 171) = ( 0.3860551 0.6139449 -0.3860551), wk = 0.0032680 k( 172) = ( 0.3784588 0.6215412 -0.3784588), wk = 0.0032680 k( 173) = ( 0.3708625 0.6291376 -0.3708625), wk = 0.0032680 k( 174) = ( 0.3632661 0.6367339 -0.3632661), wk = 0.0032680 k( 175) = ( 0.3556698 0.6443302 -0.3556698), wk = 0.0032680 k( 176) = ( 0.3480735 0.6519265 -0.3480735), wk = 0.0032680 k( 177) = ( 0.3404771 0.6595229 -0.3404771), wk = 0.0032680 k( 178) = ( 0.3328808 0.6671192 -0.3328808), wk = 0.0032680 k( 179) = ( 0.3252845 0.6747155 -0.3252845), wk = 0.0032680 k( 180) = ( 0.3176882 0.6823118 -0.3176882), wk = 0.0032680 k( 181) = ( 0.3100918 0.6899082 -0.3100918), wk = 0.0032680 k( 182) = ( 0.3024955 0.6975045 -0.3024955), wk = 0.0032680 k( 183) = ( 0.2948992 0.7051008 -0.2948992), wk = 0.0032680 k( 184) = ( 0.2948992 0.7051008 -0.2948992), wk = 0.0032680 k( 185) = ( 0.2764680 0.6922820 -0.2764680), wk = 0.0032680 k( 186) = ( 0.2580368 0.6794632 -0.2580368), wk = 0.0032680 k( 187) = ( 0.2396056 0.6666444 -0.2396056), wk = 0.0032680 k( 188) = ( 0.2211744 0.6538256 -0.2211744), wk = 0.0032680 k( 189) = ( 0.2027432 0.6410068 -0.2027432), wk = 0.0032680 k( 190) = ( 0.1843120 0.6281880 -0.1843120), wk = 0.0032680 k( 191) = ( 0.1658808 0.6153692 -0.1658808), wk = 0.0032680 k( 192) = ( 0.1474496 0.6025504 -0.1474496), wk = 0.0032680 k( 193) = ( 0.1290184 0.5897316 -0.1290184), wk = 0.0032680 k( 194) = ( 0.1105872 0.5769128 -0.1105872), wk = 0.0032680 k( 195) = ( 0.0921560 0.5640940 -0.0921560), wk = 0.0032680 k( 196) = ( 0.0737248 0.5512752 -0.0737248), wk = 0.0032680 k( 197) = ( 0.0552936 0.5384564 -0.0552936), wk = 0.0032680 k( 198) = ( 0.0368624 0.5256376 -0.0368624), wk = 0.0032680 k( 199) = ( 0.0184312 0.5128188 -0.0184312), wk = 0.0032680 k( 200) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032680 k( 201) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032680 k( 202) = ( 0.0075758 0.4924242 0.0075758), wk = 0.0032680 k( 203) = ( 0.0151515 0.4848485 0.0151515), wk = 0.0032680 k( 204) = ( 0.0227273 0.4772727 0.0227273), wk = 0.0032680 k( 205) = ( 0.0303030 0.4696970 0.0303030), wk = 0.0032680 k( 206) = ( 0.0378788 0.4621212 0.0378788), wk = 0.0032680 k( 207) = ( 0.0454546 0.4545454 0.0454546), wk = 0.0032680 k( 208) = ( 0.0530303 0.4469697 0.0530303), wk = 0.0032680 k( 209) = ( 0.0606061 0.4393939 0.0606061), wk = 0.0032680 k( 210) = ( 0.0681818 0.4318182 0.0681818), wk = 0.0032680 k( 211) = ( 0.0757576 0.4242424 0.0757576), wk = 0.0032680 k( 212) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0032680 k( 213) = ( 0.0909091 0.4090909 0.0909091), wk = 0.0032680 k( 214) = ( 0.0984848 0.4015151 0.0984848), wk = 0.0032680 k( 215) = ( 0.1060606 0.3939394 0.1060606), wk = 0.0032680 k( 216) = ( 0.1136364 0.3863636 0.1136364), wk = 0.0032680 k( 217) = ( 0.1212121 0.3787879 0.1212121), wk = 0.0032680 k( 218) = ( 0.1287879 0.3712121 0.1287879), wk = 0.0032680 k( 219) = ( 0.1363636 0.3636364 0.1363636), wk = 0.0032680 k( 220) = ( 0.1439394 0.3560606 0.1439394), wk = 0.0032680 k( 221) = ( 0.1515151 0.3484849 0.1515151), wk = 0.0032680 k( 222) = ( 0.1590909 0.3409091 0.1590909), wk = 0.0032680 k( 223) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0032680 k( 224) = ( 0.1742424 0.3257576 0.1742424), wk = 0.0032680 k( 225) = ( 0.1818182 0.3181818 0.1818182), wk = 0.0032680 k( 226) = ( 0.1893939 0.3106061 0.1893939), wk = 0.0032680 k( 227) = ( 0.1969697 0.3030303 0.1969697), wk = 0.0032680 k( 228) = ( 0.2045454 0.2954545 0.2045454), wk = 0.0032680 k( 229) = ( 0.2121212 0.2878788 0.2121212), wk = 0.0032680 k( 230) = ( 0.2196970 0.2803030 0.2196970), wk = 0.0032680 k( 231) = ( 0.2272727 0.2727273 0.2272727), wk = 0.0032680 k( 232) = ( 0.2348485 0.2651515 0.2348485), wk = 0.0032680 k( 233) = ( 0.2424242 0.2575758 0.2424242), wk = 0.0032680 k( 234) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032680 k( 235) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032680 k( 236) = ( 0.2647059 0.2647059 0.2300119), wk = 0.0032680 k( 237) = ( 0.2794118 0.2794118 0.2100237), wk = 0.0032680 k( 238) = ( 0.2941177 0.2941177 0.1900356), wk = 0.0032680 k( 239) = ( 0.3088235 0.3088235 0.1700474), wk = 0.0032680 k( 240) = ( 0.3235294 0.3235294 0.1500593), wk = 0.0032680 k( 241) = ( 0.3382353 0.3382353 0.1300712), wk = 0.0032680 k( 242) = ( 0.3529412 0.3529412 0.1100830), wk = 0.0032680 k( 243) = ( 0.3676471 0.3676471 0.0900949), wk = 0.0032680 k( 244) = ( 0.3823529 0.3823529 0.0701068), wk = 0.0032680 k( 245) = ( 0.3970588 0.3970588 0.0501186), wk = 0.0032680 k( 246) = ( 0.4117647 0.4117647 0.0301305), wk = 0.0032680 k( 247) = ( 0.4264706 0.4264706 0.0101423), wk = 0.0032680 k( 248) = ( 0.4411765 0.4411765 -0.0098458), wk = 0.0032680 k( 249) = ( 0.4558823 0.4558823 -0.0298339), wk = 0.0032680 k( 250) = ( 0.4705882 0.4705882 -0.0498221), wk = 0.0032680 k( 251) = ( 0.4852941 0.4852941 -0.0698102), wk = 0.0032680 k( 252) = ( 0.5000000 0.5000000 -0.0897984), wk = 0.0032680 k( 253) = ( 0.5000000 0.5000000 -0.0897984), wk = 0.0032680 k( 254) = ( 0.5000000 0.5000000 -0.1005932), wk = 0.0032680 k( 255) = ( 0.5000000 0.5000000 -0.1113879), wk = 0.0032680 k( 256) = ( 0.5000000 0.5000000 -0.1221827), wk = 0.0032680 k( 257) = ( 0.5000000 0.5000000 -0.1329775), wk = 0.0032680 k( 258) = ( 0.5000000 0.5000000 -0.1437723), wk = 0.0032680 k( 259) = ( 0.5000000 0.5000000 -0.1545671), wk = 0.0032680 k( 260) = ( 0.5000000 0.5000000 -0.1653618), wk = 0.0032680 k( 261) = ( 0.5000000 0.5000000 -0.1761566), wk = 0.0032680 k( 262) = ( 0.5000000 0.5000000 -0.1869514), wk = 0.0032680 k( 263) = ( 0.5000000 0.5000000 -0.1977462), wk = 0.0032680 k( 264) = ( 0.5000000 0.5000000 -0.2085409), wk = 0.0032680 k( 265) = ( 0.5000000 0.5000000 -0.2193357), wk = 0.0032680 k( 266) = ( 0.5000000 0.5000000 -0.2301305), wk = 0.0032680 k( 267) = ( 0.5000000 0.5000000 -0.2409253), wk = 0.0032680 k( 268) = ( 0.5000000 0.5000000 -0.2517201), wk = 0.0032680 k( 269) = ( 0.5000000 0.5000000 -0.2625148), wk = 0.0032680 k( 270) = ( 0.5000000 0.5000000 -0.2733096), wk = 0.0032680 k( 271) = ( 0.5000000 0.5000000 -0.2841044), wk = 0.0032680 k( 272) = ( 0.5000000 0.5000000 -0.2948992), wk = 0.0032680 k( 273) = ( 0.5000000 0.5000000 -0.3056940), wk = 0.0032680 k( 274) = ( 0.5000000 0.5000000 -0.3164887), wk = 0.0032680 k( 275) = ( 0.5000000 0.5000000 -0.3272835), wk = 0.0032680 k( 276) = ( 0.5000000 0.5000000 -0.3380783), wk = 0.0032680 k( 277) = ( 0.5000000 0.5000000 -0.3488731), wk = 0.0032680 k( 278) = ( 0.5000000 0.5000000 -0.3596679), wk = 0.0032680 k( 279) = ( 0.5000000 0.5000000 -0.3704626), wk = 0.0032680 k( 280) = ( 0.5000000 0.5000000 -0.3812574), wk = 0.0032680 k( 281) = ( 0.5000000 0.5000000 -0.3920522), wk = 0.0032680 k( 282) = ( 0.5000000 0.5000000 -0.4028470), wk = 0.0032680 k( 283) = ( 0.5000000 0.5000000 -0.4136418), wk = 0.0032680 k( 284) = ( 0.5000000 0.5000000 -0.4244365), wk = 0.0032680 k( 285) = ( 0.5000000 0.5000000 -0.4352313), wk = 0.0032680 k( 286) = ( 0.5000000 0.5000000 -0.4460261), wk = 0.0032680 k( 287) = ( 0.5000000 0.5000000 -0.4568209), wk = 0.0032680 k( 288) = ( 0.5000000 0.5000000 -0.4676157), wk = 0.0032680 k( 289) = ( 0.5000000 0.5000000 -0.4784104), wk = 0.0032680 k( 290) = ( 0.5000000 0.5000000 -0.4892052), wk = 0.0032680 k( 291) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032680 k( 292) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032680 k( 293) = ( 0.0178571 0.0178571 0.4821429), wk = 0.0032680 k( 294) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0032680 k( 295) = ( 0.0535714 0.0535714 0.4464286), wk = 0.0032680 k( 296) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0032680 k( 297) = ( 0.0892857 0.0892857 0.4107143), wk = 0.0032680 k( 298) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0032680 k( 299) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0032680 k( 300) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0032680 k( 301) = ( 0.1607143 0.1607143 0.3392857), wk = 0.0032680 k( 302) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0032680 k( 303) = ( 0.1964286 0.1964286 0.3035714), wk = 0.0032680 k( 304) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0032680 k( 305) = ( 0.2321429 0.2321429 0.2678571), wk = 0.0032680 k( 306) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032680 Dense grid: 59193 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 39871 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 284, 72) NL pseudopotentials 0.37 Mb ( 142, 171) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1644) G-vector shells 0.01 Mb ( 774) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.25 Mb ( 284, 288) Each subspace H/S matrix 0.08 Mb ( 72, 72) Each matrix 0.38 Mb ( 171, 2, 72) The potential is recalculated from file : ./BaxAgSnx2.save/charge-density.dat Starting wfc are 82 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 5.4 secs Computing kpt #: 3 total cpu time spent up to now is 6.5 secs Computing kpt #: 4 total cpu time spent up to now is 7.5 secs Computing kpt #: 5 total cpu time spent up to now is 8.6 secs Computing kpt #: 6 total cpu time spent up to now is 9.6 secs Computing kpt #: 7 total cpu time spent up to now is 10.6 secs Computing kpt #: 8 total cpu time spent up to now is 11.6 secs Computing kpt #: 9 total cpu time spent up to now is 12.6 secs Computing kpt #: 10 total cpu time spent up to now is 13.5 secs Computing kpt #: 11 total cpu time spent up to now is 14.5 secs Computing kpt #: 12 total cpu time spent up to now is 15.6 secs Computing kpt #: 13 total cpu time spent up to now is 16.6 secs Computing kpt #: 14 total cpu time spent up to now is 17.6 secs Computing kpt #: 15 total cpu time spent up to now is 18.6 secs Computing kpt #: 16 total cpu time spent up to now is 19.6 secs Computing kpt #: 17 total cpu time spent up to now is 20.6 secs Computing kpt #: 18 total cpu time spent up to now is 21.6 secs Computing kpt #: 19 total cpu time spent up to now is 22.6 secs Computing kpt #: 20 total cpu time spent up to now is 23.7 secs Computing kpt #: 21 total cpu time spent up to now is 24.8 secs Computing kpt #: 22 total cpu time spent up to now is 25.9 secs Computing kpt #: 23 total cpu time spent up to now is 26.9 secs Computing kpt #: 24 total cpu time spent up to now is 27.9 secs Computing kpt #: 25 total cpu time spent up to now is 28.9 secs Computing kpt #: 26 total cpu time spent up to now is 29.9 secs Computing kpt #: 27 total cpu time spent up to now is 30.9 secs Computing kpt #: 28 total cpu time spent up to now is 32.0 secs Computing kpt #: 29 total cpu time spent up to now is 33.0 secs Computing kpt #: 30 total cpu time spent up to now is 34.0 secs Computing kpt #: 31 total cpu time spent up to now is 35.0 secs Computing kpt #: 32 total cpu time spent up to now is 36.0 secs Computing kpt #: 33 total cpu time spent up to now is 37.1 secs Computing kpt #: 34 total cpu time spent up to now is 38.1 secs Computing kpt #: 35 total cpu time spent up to now is 39.2 secs Computing kpt #: 36 total cpu time spent up to now is 40.2 secs Computing kpt #: 37 total cpu time spent up to now is 41.2 secs Computing kpt #: 38 total cpu time spent up to now is 42.4 secs Computing kpt #: 39 total cpu time spent up to now is 43.6 secs Computing kpt #: 40 total cpu time spent up to now is 44.7 secs Computing kpt #: 41 total cpu time spent up to now is 45.9 secs Computing kpt #: 42 total cpu time spent up to now is 47.1 secs Computing kpt #: 43 total cpu time spent up to now is 48.2 secs Computing kpt #: 44 total cpu time spent up to now is 49.4 secs Computing kpt #: 45 total cpu time spent up to now is 50.6 secs Computing kpt #: 46 total cpu time spent up to now is 51.8 secs Computing kpt #: 47 total cpu time spent up to now is 52.9 secs Computing kpt #: 48 total cpu time spent up to now is 54.1 secs Computing kpt #: 49 total cpu time spent up to now is 55.2 secs Computing kpt #: 50 total cpu time spent up to now is 56.4 secs Computing kpt #: 51 total cpu time spent up to now is 57.5 secs Computing kpt #: 52 total cpu time spent up to now is 58.7 secs Computing kpt #: 53 total cpu time spent up to now is 59.9 secs Computing kpt #: 54 total cpu time spent up to now is 61.1 secs Computing kpt #: 55 total cpu time spent up to now is 62.2 secs Computing kpt #: 56 total cpu time spent up to now is 63.4 secs Computing kpt #: 57 total cpu time spent up to now is 64.5 secs Computing kpt #: 58 total cpu time spent up to now is 65.7 secs Computing kpt #: 59 total cpu time spent up to now is 66.8 secs Computing kpt #: 60 total cpu time spent up to now is 68.0 secs Computing kpt #: 61 total cpu time spent up to now is 69.2 secs Computing kpt #: 62 total cpu time spent up to now is 70.5 secs Computing kpt #: 63 total cpu time spent up to now is 71.7 secs Computing kpt #: 64 total cpu time spent up to now is 72.9 secs Computing kpt #: 65 total cpu time spent up to now is 73.9 secs Computing kpt #: 66 total cpu time spent up to now is 75.0 secs Computing kpt #: 67 total cpu time spent up to now is 76.0 secs Computing kpt #: 68 total cpu time spent up to now is 77.1 secs Computing kpt #: 69 total cpu time spent up to now is 78.1 secs Computing kpt #: 70 total cpu time spent up to now is 79.1 secs Computing kpt #: 71 total cpu time spent up to now is 80.1 secs Computing kpt #: 72 total cpu time spent up to now is 81.1 secs Computing kpt #: 73 total cpu time spent up to now is 82.1 secs Computing kpt #: 74 total cpu time spent up to now is 83.1 secs Computing kpt #: 75 total cpu time spent up to now is 84.0 secs Computing kpt #: 76 total cpu time spent up to now is 85.0 secs Computing kpt #: 77 total cpu time spent up to now is 86.0 secs Computing kpt #: 78 total cpu time spent up to now is 87.0 secs Computing kpt #: 79 total cpu time spent up to now is 88.0 secs Computing kpt #: 80 total cpu time spent up to now is 89.0 secs Computing kpt #: 81 total cpu time spent up to now is 90.0 secs Computing kpt #: 82 total cpu time spent up to now is 91.0 secs Computing kpt #: 83 total cpu time spent up to now is 92.1 secs Computing kpt #: 84 total cpu time spent up to now is 93.1 secs Computing kpt #: 85 total cpu time spent up to now is 94.1 secs Computing kpt #: 86 total cpu time spent up to now is 95.2 secs Computing kpt #: 87 total cpu time spent up to now is 96.2 secs Computing kpt #: 88 total cpu time spent up to now is 97.3 secs Computing kpt #: 89 total cpu time spent up to now is 98.3 secs Computing kpt #: 90 total cpu time spent up to now is 99.4 secs Computing kpt #: 91 total cpu time spent up to now is 100.4 secs Computing kpt #: 92 total cpu time spent up to now is 101.4 secs Computing kpt #: 93 total cpu time spent up to now is 102.4 secs Computing kpt #: 94 total cpu time spent up to now is 103.4 secs Computing kpt #: 95 total cpu time spent up to now is 104.4 secs Computing kpt #: 96 total cpu time spent up to now is 105.4 secs Computing kpt #: 97 total cpu time spent up to now is 106.4 secs Computing kpt #: 98 total cpu time spent up to now is 107.5 secs Computing kpt #: 99 total cpu time spent up to now is 108.5 secs Computing kpt #: 100 total cpu time spent up to now is 109.5 secs Computing kpt #: 101 total cpu time spent up to now is 110.6 secs Computing kpt #: 102 total cpu time spent up to now is 111.6 secs Computing kpt #: 103 total cpu time spent up to now is 112.6 secs Computing kpt #: 104 total cpu time spent up to now is 113.7 secs Computing kpt #: 105 total cpu time spent up to now is 114.7 secs Computing kpt #: 106 total cpu time spent up to now is 115.7 secs Computing kpt #: 107 total cpu time spent up to now is 116.7 secs Computing kpt #: 108 total cpu time spent up to now is 117.7 secs Computing kpt #: 109 total cpu time spent up to now is 118.9 secs Computing kpt #: 110 total cpu time spent up to now is 120.0 secs Computing kpt #: 111 total cpu time spent up to now is 121.0 secs Computing kpt #: 112 total cpu time spent up to now is 122.1 secs Computing kpt #: 113 total cpu time spent up to now is 123.1 secs Computing kpt #: 114 total cpu time spent up to now is 124.1 secs Computing kpt #: 115 total cpu time spent up to now is 125.1 secs Computing kpt #: 116 total cpu time spent up to now is 126.1 secs Computing kpt #: 117 total cpu time spent up to now is 127.1 secs Computing kpt #: 118 total cpu time spent up to now is 128.5 secs Computing kpt #: 119 total cpu time spent up to now is 129.6 secs Computing kpt #: 120 total cpu time spent up to now is 130.5 secs Computing kpt #: 121 total cpu time spent up to now is 131.6 secs Computing kpt #: 122 total cpu time spent up to now is 132.6 secs Computing kpt #: 123 total cpu time spent up to now is 133.7 secs Computing kpt #: 124 total cpu time spent up to now is 134.7 secs Computing kpt #: 125 total cpu time spent up to now is 135.8 secs Computing kpt #: 126 total cpu time spent up to now is 136.9 secs Computing kpt #: 127 total cpu time spent up to now is 138.0 secs Computing kpt #: 128 total cpu time spent up to now is 139.2 secs Computing kpt #: 129 total cpu time spent up to now is 140.2 secs Computing kpt #: 130 total cpu time spent up to now is 141.2 secs Computing kpt #: 131 total cpu time spent up to now is 142.2 secs Computing kpt #: 132 total cpu time spent up to now is 143.2 secs Computing kpt #: 133 total cpu time spent up to now is 144.2 secs Computing kpt #: 134 total cpu time spent up to now is 145.3 secs Computing kpt #: 135 total cpu time spent up to now is 146.3 secs Computing kpt #: 136 total cpu time spent up to now is 147.3 secs Computing kpt #: 137 total cpu time spent up to now is 148.3 secs Computing kpt #: 138 total cpu time spent up to now is 149.3 secs Computing kpt #: 139 total cpu time spent up to now is 150.4 secs Computing kpt #: 140 total cpu time spent up to now is 151.4 secs Computing kpt #: 141 total cpu time spent up to now is 152.5 secs Computing kpt #: 142 total cpu time spent up to now is 153.6 secs Computing kpt #: 143 total cpu time spent up to now is 154.6 secs Computing kpt #: 144 total cpu time spent up to now is 155.7 secs Computing kpt #: 145 total cpu time spent up to now is 156.8 secs Computing kpt #: 146 total cpu time spent up to now is 157.8 secs Computing kpt #: 147 total cpu time spent up to now is 158.9 secs Computing kpt #: 148 total cpu time spent up to now is 160.0 secs Computing kpt #: 149 total cpu time spent up to now is 161.0 secs Computing kpt #: 150 total cpu time spent up to now is 162.1 secs Computing kpt #: 151 total cpu time spent up to now is 163.1 secs Computing kpt #: 152 total cpu time spent up to now is 164.2 secs Computing kpt #: 153 total cpu time spent up to now is 165.2 secs Computing kpt #: 154 total cpu time spent up to now is 166.2 secs Computing kpt #: 155 total cpu time spent up to now is 167.3 secs Computing kpt #: 156 total cpu time spent up to now is 168.3 secs Computing kpt #: 157 total cpu time spent up to now is 169.4 secs Computing kpt #: 158 total cpu time spent up to now is 170.4 secs Computing kpt #: 159 total cpu time spent up to now is 171.4 secs Computing kpt #: 160 total cpu time spent up to now is 172.5 secs Computing kpt #: 161 total cpu time spent up to now is 173.6 secs Computing kpt #: 162 total cpu time spent up to now is 174.6 secs Computing kpt #: 163 total cpu time spent up to now is 175.7 secs Computing kpt #: 164 total cpu time spent up to now is 176.8 secs Computing kpt #: 165 total cpu time spent up to now is 177.8 secs Computing kpt #: 166 total cpu time spent up to now is 178.9 secs Computing kpt #: 167 total cpu time spent up to now is 180.0 secs Computing kpt #: 168 total cpu time spent up to now is 181.0 secs Computing kpt #: 169 total cpu time spent up to now is 182.1 secs Computing kpt #: 170 total cpu time spent up to now is 183.2 secs Computing kpt #: 171 total cpu time spent up to now is 184.2 secs Computing kpt #: 172 total cpu time spent up to now is 185.3 secs Computing kpt #: 173 total cpu time spent up to now is 186.3 secs Computing kpt #: 174 total cpu time spent up to now is 187.4 secs Computing kpt #: 175 total cpu time spent up to now is 188.4 secs Computing kpt #: 176 total cpu time spent up to now is 189.5 secs Computing kpt #: 177 total cpu time spent up to now is 190.5 secs Computing kpt #: 178 total cpu time spent up to now is 191.6 secs Computing kpt #: 179 total cpu time spent up to now is 192.6 secs Computing kpt #: 180 total cpu time spent up to now is 193.6 secs Computing kpt #: 181 total cpu time spent up to now is 194.7 secs Computing kpt #: 182 total cpu time spent up to now is 195.7 secs Computing kpt #: 183 total cpu time spent up to now is 196.8 secs Computing kpt #: 184 total cpu time spent up to now is 197.8 secs Computing kpt #: 185 total cpu time spent up to now is 198.9 secs Computing kpt #: 186 total cpu time spent up to now is 199.9 secs Computing kpt #: 187 total cpu time spent up to now is 200.9 secs Computing kpt #: 188 total cpu time spent up to now is 201.9 secs Computing kpt #: 189 total cpu time spent up to now is 202.9 secs Computing kpt #: 190 total cpu time spent up to now is 203.9 secs Computing kpt #: 191 total cpu time spent up to now is 205.0 secs Computing kpt #: 192 total cpu time spent up to now is 206.1 secs Computing kpt #: 193 total cpu time spent up to now is 207.1 secs Computing kpt #: 194 total cpu time spent up to now is 208.2 secs Computing kpt #: 195 total cpu time spent up to now is 209.2 secs Computing kpt #: 196 total cpu time spent up to now is 210.2 secs Computing kpt #: 197 total cpu time spent up to now is 211.2 secs Computing kpt #: 198 total cpu time spent up to now is 212.2 secs Computing kpt #: 199 total cpu time spent up to now is 213.1 secs Computing kpt #: 200 total cpu time spent up to now is 214.1 secs Computing kpt #: 201 total cpu time spent up to now is 215.1 secs Computing kpt #: 202 total cpu time spent up to now is 216.1 secs Computing kpt #: 203 total cpu time spent up to now is 217.1 secs Computing kpt #: 204 total cpu time spent up to now is 218.0 secs Computing kpt #: 205 total cpu time spent up to now is 219.0 secs Computing kpt #: 206 total cpu time spent up to now is 220.1 secs Computing kpt #: 207 total cpu time spent up to now is 221.1 secs Computing kpt #: 208 total cpu time spent up to now is 222.1 secs Computing kpt #: 209 total cpu time spent up to now is 223.1 secs Computing kpt #: 210 total cpu time spent up to now is 224.1 secs Computing kpt #: 211 total cpu time spent up to now is 225.1 secs Computing kpt #: 212 total cpu time spent up to now is 226.2 secs Computing kpt #: 213 total cpu time spent up to now is 227.2 secs Computing kpt #: 214 total cpu time spent up to now is 228.3 secs Computing kpt #: 215 total cpu time spent up to now is 229.3 secs Computing kpt #: 216 total cpu time spent up to now is 230.4 secs Computing kpt #: 217 total cpu time spent up to now is 231.4 secs Computing kpt #: 218 total cpu time spent up to now is 232.5 secs Computing kpt #: 219 total cpu time spent up to now is 233.5 secs Computing kpt #: 220 total cpu time spent up to now is 234.6 secs Computing kpt #: 221 total cpu time spent up to now is 235.6 secs Computing kpt #: 222 total cpu time spent up to now is 236.7 secs Computing kpt #: 223 total cpu time spent up to now is 237.7 secs Computing kpt #: 224 total cpu time spent up to now is 238.8 secs Computing kpt #: 225 total cpu time spent up to now is 239.8 secs Computing kpt #: 226 total cpu time spent up to now is 240.9 secs Computing kpt #: 227 total cpu time spent up to now is 242.0 secs Computing kpt #: 228 total cpu time spent up to now is 243.0 secs Computing kpt #: 229 total cpu time spent up to now is 244.1 secs Computing kpt #: 230 total cpu time spent up to now is 245.1 secs Computing kpt #: 231 total cpu time spent up to now is 247.1 secs Computing kpt #: 232 total cpu time spent up to now is 248.2 secs Computing kpt #: 233 total cpu time spent up to now is 249.2 secs Computing kpt #: 234 total cpu time spent up to now is 250.3 secs Computing kpt #: 235 total cpu time spent up to now is 251.3 secs Computing kpt #: 236 total cpu time spent up to now is 252.3 secs Computing kpt #: 237 total cpu time spent up to now is 253.4 secs Computing kpt #: 238 total cpu time spent up to now is 254.4 secs Computing kpt #: 239 total cpu time spent up to now is 255.5 secs Computing kpt #: 240 total cpu time spent up to now is 256.5 secs Computing kpt #: 241 total cpu time spent up to now is 257.6 secs Computing kpt #: 242 total cpu time spent up to now is 258.7 secs Computing kpt #: 243 total cpu time spent up to now is 259.9 secs Computing kpt #: 244 total cpu time spent up to now is 261.0 secs Computing kpt #: 245 total cpu time spent up to now is 262.0 secs Computing kpt #: 246 total cpu time spent up to now is 263.2 secs Computing kpt #: 247 total cpu time spent up to now is 264.3 secs Computing kpt #: 248 total cpu time spent up to now is 265.4 secs Computing kpt #: 249 total cpu time spent up to now is 266.6 secs Computing kpt #: 250 total cpu time spent up to now is 267.8 secs Computing kpt #: 251 total cpu time spent up to now is 268.8 secs Computing kpt #: 252 total cpu time spent up to now is 270.0 secs Computing kpt #: 253 total cpu time spent up to now is 271.2 secs Computing kpt #: 254 total cpu time spent up to now is 272.4 secs Computing kpt #: 255 total cpu time spent up to now is 273.5 secs Computing kpt #: 256 total cpu time spent up to now is 274.6 secs Computing kpt #: 257 total cpu time spent up to now is 275.6 secs Computing kpt #: 258 total cpu time spent up to now is 276.6 secs Computing kpt #: 259 total cpu time spent up to now is 277.6 secs Computing kpt #: 260 total cpu time spent up to now is 278.6 secs Computing kpt #: 261 total cpu time spent up to now is 279.6 secs Computing kpt #: 262 total cpu time spent up to now is 280.6 secs Computing kpt #: 263 total cpu time spent up to now is 281.5 secs Computing kpt #: 264 total cpu time spent up to now is 282.5 secs Computing kpt #: 265 total cpu time spent up to now is 283.4 secs Computing kpt #: 266 total cpu time spent up to now is 284.4 secs Computing kpt #: 267 total cpu time spent up to now is 285.3 secs Computing kpt #: 268 total cpu time spent up to now is 286.3 secs Computing kpt #: 269 total cpu time spent up to now is 287.2 secs Computing kpt #: 270 total cpu time spent up to now is 288.2 secs Computing kpt #: 271 total cpu time spent up to now is 289.2 secs Computing kpt #: 272 total cpu time spent up to now is 290.2 secs Computing kpt #: 273 total cpu time spent up to now is 291.2 secs Computing kpt #: 274 total cpu time spent up to now is 292.2 secs Computing kpt #: 275 total cpu time spent up to now is 293.3 secs Computing kpt #: 276 total cpu time spent up to now is 294.3 secs Computing kpt #: 277 total cpu time spent up to now is 295.3 secs Computing kpt #: 278 total cpu time spent up to now is 296.3 secs Computing kpt #: 279 total cpu time spent up to now is 297.3 secs Computing kpt #: 280 total cpu time spent up to now is 298.4 secs Computing kpt #: 281 total cpu time spent up to now is 299.4 secs Computing kpt #: 282 total cpu time spent up to now is 300.4 secs Computing kpt #: 283 total cpu time spent up to now is 301.5 secs Computing kpt #: 284 total cpu time spent up to now is 302.5 secs Computing kpt #: 285 total cpu time spent up to now is 303.6 secs Computing kpt #: 286 total cpu time spent up to now is 304.6 secs Computing kpt #: 287 total cpu time spent up to now is 305.7 secs Computing kpt #: 288 total cpu time spent up to now is 306.7 secs Computing kpt #: 289 total cpu time spent up to now is 307.7 secs Computing kpt #: 290 total cpu time spent up to now is 308.8 secs Computing kpt #: 291 total cpu time spent up to now is 309.8 secs Computing kpt #: 292 total cpu time spent up to now is 310.9 secs Computing kpt #: 293 total cpu time spent up to now is 312.1 secs Computing kpt #: 294 total cpu time spent up to now is 313.3 secs Computing kpt #: 295 total cpu time spent up to now is 314.4 secs Computing kpt #: 296 total cpu time spent up to now is 315.8 secs Computing kpt #: 297 total cpu time spent up to now is 316.9 secs Computing kpt #: 298 total cpu time spent up to now is 318.1 secs Computing kpt #: 299 total cpu time spent up to now is 319.2 secs Computing kpt #: 300 total cpu time spent up to now is 320.3 secs Computing kpt #: 301 total cpu time spent up to now is 321.3 secs Computing kpt #: 302 total cpu time spent up to now is 322.3 secs Computing kpt #: 303 total cpu time spent up to now is 323.3 secs Computing kpt #: 304 total cpu time spent up to now is 324.4 secs Computing kpt #: 305 total cpu time spent up to now is 325.4 secs Computing kpt #: 306 total cpu time spent up to now is 326.6 secs ethr = 1.67E-08, avg # of iterations = 19.1 total cpu time spent up to now is 326.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4959 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7382 -3.7382 -1.7672 -1.7672 -1.7107 -1.7107 1.3885 1.3885 3.5587 3.5587 5.0685 5.0685 5.2921 5.2921 5.3184 5.3184 5.5059 5.5059 5.9133 5.9133 6.0969 6.0969 6.2640 6.2640 6.3777 6.3777 6.6338 6.6338 7.1268 7.1268 7.5303 7.5303 9.5039 9.5039 9.5665 9.5665 11.1494 11.1494 11.3823 11.3823 11.7397 11.7397 12.2988 12.2988 13.8961 13.8961 14.0493 14.0493 14.1108 14.1108 k = 0.0000 0.0000 0.0207 ( 4963 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7383 -3.7383 -1.7673 -1.7673 -1.7110 -1.7110 1.3902 1.3902 3.5590 3.5590 5.0694 5.0694 5.2915 5.2915 5.3193 5.3193 5.5060 5.5060 5.9130 5.9130 6.0964 6.0964 6.2637 6.2637 6.3769 6.3769 6.6329 6.6329 7.1268 7.1268 7.5302 7.5302 9.5018 9.5018 9.5644 9.5644 11.1288 11.1288 11.3920 11.3920 11.7404 11.7404 12.3087 12.3087 13.9062 13.9062 14.0567 14.0567 14.1077 14.1077 k = 0.0000 0.0000 0.0414 ( 4967 PWs) bands (ev): -17.0702 -17.0702 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7386 -3.7386 -1.7676 -1.7676 -1.7121 -1.7121 1.3951 1.3951 3.5596 3.5596 5.0721 5.0721 5.2899 5.2899 5.3220 5.3220 5.5061 5.5061 5.9120 5.9120 6.0951 6.0951 6.2631 6.2631 6.3745 6.3745 6.6303 6.6303 7.1265 7.1265 7.5298 7.5298 9.4931 9.4931 9.5608 9.5608 11.0792 11.0792 11.4039 11.4039 11.7491 11.7491 12.3380 12.3380 13.9307 13.9307 14.0788 14.0788 14.1037 14.1037 k = 0.0000 0.0000 0.0621 ( 4953 PWs) bands (ev): -17.0701 -17.0701 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7391 -3.7391 -1.7680 -1.7680 -1.7138 -1.7138 1.4033 1.4033 3.5608 3.5608 5.0767 5.0767 5.2878 5.2878 5.3260 5.3260 5.5063 5.5063 5.9104 5.9104 6.0930 6.0930 6.2620 6.2620 6.3709 6.3709 6.6258 6.6258 7.1260 7.1260 7.5292 7.5292 9.4728 9.4728 9.5616 9.5616 11.0166 11.0166 11.3918 11.3918 11.7787 11.7787 12.3859 12.3859 13.9557 13.9557 14.0748 14.0748 14.1506 14.1506 k = 0.0000 0.0000 0.0828 ( 4961 PWs) bands (ev): -17.0700 -17.0700 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0139 -10.0139 -10.0050 -10.0050 -9.9859 -9.9859 -3.7398 -3.7398 -1.7687 -1.7687 -1.7161 -1.7161 1.4146 1.4146 3.5622 3.5622 5.0829 5.0829 5.2853 5.2853 5.3310 5.3310 5.5067 5.5067 5.9079 5.9079 6.0901 6.0901 6.2604 6.2604 6.3656 6.3656 6.6195 6.6195 7.1253 7.1253 7.5283 7.5283 9.4398 9.4398 9.5687 9.5687 10.9490 10.9490 11.3477 11.3477 11.8337 11.8337 12.4512 12.4512 13.9735 13.9735 14.0538 14.0538 14.2436 14.2436 k = 0.0000 0.0000 0.1035 ( 4969 PWs) bands (ev): -17.0699 -17.0699 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0139 -10.0139 -10.0050 -10.0050 -9.9859 -9.9859 -3.7406 -3.7406 -1.7695 -1.7695 -1.7191 -1.7191 1.4291 1.4291 3.5643 3.5643 5.0907 5.0907 5.2827 5.2827 5.3368 5.3368 5.5072 5.5072 5.9047 5.9047 6.0866 6.0866 6.2584 6.2584 6.3590 6.3590 6.6111 6.6111 7.1245 7.1245 7.5271 7.5271 9.3966 9.3966 9.5811 9.5811 10.8798 10.8798 11.2786 11.2786 11.9079 11.9079 12.5324 12.5324 13.9842 13.9842 14.0294 14.0294 14.3653 14.3653 k = 0.0000 0.0000 0.1242 ( 4967 PWs) bands (ev): -17.0698 -17.0698 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7417 -3.7417 -1.7706 -1.7706 -1.7225 -1.7225 1.4465 1.4465 3.5667 3.5667 5.0999 5.0999 5.2801 5.2801 5.3435 5.3435 5.5081 5.5081 5.9007 5.9007 6.0829 6.0829 6.2559 6.2559 6.3513 6.3513 6.6008 6.6008 7.1235 7.1235 7.5253 7.5253 9.3458 9.3458 9.5972 9.5972 10.8105 10.8105 11.1940 11.1940 11.9945 11.9945 12.6279 12.6279 13.9798 13.9798 14.0145 14.0145 14.5077 14.5077 k = 0.0000 0.0000 0.1449 ( 4959 PWs) bands (ev): -17.0696 -17.0696 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1037 -10.1037 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7429 -3.7429 -1.7719 -1.7719 -1.7265 -1.7265 1.4667 1.4667 3.5696 3.5696 5.1103 5.1103 5.2775 5.2775 5.3508 5.3508 5.5095 5.5095 5.8959 5.8959 6.0790 6.0790 6.2532 6.2532 6.3426 6.3426 6.5884 6.5884 7.1225 7.1225 7.5230 7.5230 9.2895 9.2895 9.6163 9.6163 10.7420 10.7420 11.1005 11.1005 12.0892 12.0892 12.7360 12.7360 13.9531 13.9531 14.0194 14.0194 14.6646 14.6646 k = 0.0000 0.0000 0.1656 ( 4955 PWs) bands (ev): -17.0694 -17.0694 -11.1474 -11.1474 -11.0834 -11.0834 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1038 -10.1038 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7443 -3.7443 -1.7734 -1.7734 -1.7307 -1.7307 1.4897 1.4897 3.5729 3.5729 5.1215 5.1215 5.2751 5.2751 5.3588 5.3588 5.5113 5.5113 5.8903 5.8903 6.0751 6.0751 6.2498 6.2498 6.3329 6.3329 6.5738 6.5738 7.1212 7.1212 7.5200 7.5200 9.2294 9.2294 9.6376 9.6376 10.6746 10.6746 11.0026 11.0026 12.1897 12.1897 12.8552 12.8552 13.9203 13.9203 14.0297 14.0297 14.8299 14.8299 k = 0.0000 0.0000 0.1862 ( 4962 PWs) bands (ev): -17.0691 -17.0691 -11.1474 -11.1474 -11.0834 -11.0834 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1038 -10.1038 -10.0336 -10.0336 -10.0139 -10.0139 -10.0050 -10.0050 -9.9857 -9.9857 -3.7458 -3.7458 -1.7752 -1.7752 -1.7353 -1.7353 1.5152 1.5152 3.5766 3.5766 5.1331 5.1331 5.2733 5.2733 5.3674 5.3674 5.5136 5.5136 5.8840 5.8840 6.0714 6.0714 6.2459 6.2459 6.3223 6.3223 6.5571 6.5571 7.1197 7.1197 7.5162 7.5162 9.1668 9.1668 9.6607 9.6607 10.6084 10.6084 10.9036 10.9036 12.2948 12.2948 12.9841 12.9841 13.8867 13.8867 14.0416 14.0416 14.9897 14.9897 k = 0.0000 0.0000 0.2069 ( 4966 PWs) bands (ev): -17.0689 -17.0689 -11.1474 -11.1474 -11.0834 -11.0834 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1039 -10.1039 -10.0336 -10.0336 -10.0139 -10.0139 -10.0050 -10.0050 -9.9857 -9.9857 -3.7474 -3.7474 -1.7774 -1.7774 -1.7399 -1.7399 1.5429 1.5429 3.5807 3.5807 5.1444 5.1444 5.2724 5.2724 5.3767 5.3767 5.5166 5.5166 5.8770 5.8770 6.0681 6.0681 6.2414 6.2414 6.3111 6.3111 6.5385 6.5385 7.1179 7.1179 7.5114 7.5114 9.1030 9.1030 9.6849 9.6849 10.5436 10.5436 10.8058 10.8058 12.4037 12.4037 13.1215 13.1215 13.8542 13.8542 14.0545 14.0545 15.0953 15.0953 k = 0.0000 0.0000 0.2276 ( 4962 PWs) bands (ev): -17.0686 -17.0686 -11.1474 -11.1474 -11.0835 -11.0835 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1040 -10.1040 -10.0335 -10.0335 -10.0139 -10.0139 -10.0050 -10.0050 -9.9857 -9.9857 -3.7492 -3.7492 -1.7800 -1.7800 -1.7446 -1.7446 1.5728 1.5728 3.5851 3.5851 5.1546 5.1546 5.2731 5.2731 5.3867 5.3867 5.5204 5.5204 5.8696 5.8696 6.0653 6.0653 6.2362 6.2362 6.2993 6.2993 6.5180 6.5180 7.1159 7.1159 7.5055 7.5055 9.0388 9.0388 9.7097 9.7097 10.4801 10.4801 10.7110 10.7110 12.5158 12.5158 13.2662 13.2662 13.8241 13.8241 14.0682 14.0682 15.1203 15.1203 k = 0.0000 0.0000 0.2483 ( 4966 PWs) bands (ev): -17.0683 -17.0683 -11.1474 -11.1474 -11.0835 -11.0835 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1041 -10.1041 -10.0335 -10.0335 -10.0139 -10.0139 -10.0050 -10.0050 -9.9856 -9.9856 -3.7511 -3.7511 -1.7830 -1.7830 -1.7491 -1.7491 1.6046 1.6046 3.5900 3.5900 5.1627 5.1627 5.2761 5.2761 5.3971 5.3971 5.5249 5.5249 5.8620 5.8620 6.0629 6.0629 6.2301 6.2301 6.2871 6.2871 6.4960 6.4960 7.1136 7.1136 7.4984 7.4984 8.9750 8.9750 9.7346 9.7346 10.4178 10.4178 10.6205 10.6205 12.6309 12.6309 13.4173 13.4173 13.7975 13.7975 14.0825 14.0825 15.1180 15.1180 k = 0.0000 0.0000 0.2690 ( 4974 PWs) bands (ev): -17.0679 -17.0679 -11.1474 -11.1474 -11.0836 -11.0836 -11.0722 -11.0722 -11.0597 -11.0597 -10.1400 -10.1400 -10.1042 -10.1042 -10.0334 -10.0334 -10.0139 -10.0139 -10.0050 -10.0050 -9.9856 -9.9856 -3.7531 -3.7531 -1.7865 -1.7865 -1.7534 -1.7534 1.6380 1.6380 3.5951 3.5951 5.1678 5.1678 5.2822 5.2822 5.4081 5.4081 5.5301 5.5301 5.8544 5.8544 6.0609 6.0609 6.2227 6.2227 6.2749 6.2749 6.4728 6.4728 7.1109 7.1109 7.4899 7.4899 8.9123 8.9123 9.7588 9.7588 10.3566 10.3566 10.5354 10.5354 12.7485 12.7485 13.5736 13.5736 13.7751 13.7751 14.0971 14.0971 15.1084 15.1084 k = 0.0000 0.0000 0.2897 ( 4976 PWs) bands (ev): -17.0676 -17.0676 -11.1475 -11.1475 -11.0837 -11.0837 -11.0722 -11.0722 -11.0597 -11.0597 -10.1400 -10.1400 -10.1043 -10.1043 -10.0333 -10.0333 -10.0139 -10.0139 -10.0050 -10.0050 -9.9855 -9.9855 -3.7551 -3.7551 -1.7905 -1.7905 -1.7574 -1.7574 1.6727 1.6727 3.6006 3.6006 5.1695 5.1695 5.2916 5.2916 5.4194 5.4194 5.5363 5.5363 5.8472 5.8472 6.0594 6.0594 6.2135 6.2135 6.2631 6.2631 6.4488 6.4488 7.1078 7.1078 7.4799 7.4799 8.8511 8.8511 9.7820 9.7820 10.2966 10.2966 10.4563 10.4563 12.8685 12.8685 13.7331 13.7331 13.7593 13.7593 14.1117 14.1117 15.0962 15.0962 k = 0.0000 0.0000 0.3104 ( 4978 PWs) bands (ev): -17.0672 -17.0672 -11.1475 -11.1475 -11.0837 -11.0837 -11.0722 -11.0722 -11.0596 -11.0596 -10.1400 -10.1400 -10.1044 -10.1044 -10.0332 -10.0332 -10.0139 -10.0139 -10.0049 -10.0049 -9.9855 -9.9855 -3.7573 -3.7573 -1.7949 -1.7949 -1.7609 -1.7609 1.7086 1.7086 3.6064 3.6064 5.1682 5.1682 5.3037 5.3037 5.4310 5.4310 5.5434 5.5434 5.8407 5.8407 6.0581 6.0581 6.2017 6.2017 6.2524 6.2524 6.4247 6.4247 7.1042 7.1042 7.4684 7.4684 8.7918 8.7918 9.8035 9.8035 10.2381 10.2381 10.3835 10.3835 12.9905 12.9905 13.7456 13.7456 13.8995 13.8995 14.1260 14.1260 15.0827 15.0827 k = 0.0000 0.0000 0.3311 ( 4974 PWs) bands (ev): -17.0669 -17.0669 -11.1475 -11.1475 -11.0838 -11.0838 -11.0722 -11.0722 -11.0596 -11.0596 -10.1400 -10.1400 -10.1046 -10.1046 -10.0331 -10.0331 -10.0139 -10.0139 -10.0049 -10.0049 -9.9854 -9.9854 -3.7594 -3.7594 -1.7998 -1.7998 -1.7641 -1.7641 1.7453 1.7453 3.6125 3.6125 5.1646 5.1646 5.3180 5.3180 5.4424 5.4424 5.5516 5.5516 5.8352 5.8352 6.0570 6.0570 6.1869 6.1869 6.2431 6.2431 6.4009 6.4009 7.1000 7.1000 7.4554 7.4554 8.7347 8.7347 9.8227 9.8227 10.1816 10.1816 10.3169 10.3169 13.1143 13.1143 13.7401 13.7401 14.0663 14.0663 14.1393 14.1393 15.0684 15.0684 k = 0.0000 0.0000 0.3518 ( 4978 PWs) bands (ev): -17.0665 -17.0665 -11.1475 -11.1475 -11.0839 -11.0839 -11.0723 -11.0723 -11.0595 -11.0595 -10.1400 -10.1400 -10.1047 -10.1047 -10.0330 -10.0330 -10.0139 -10.0139 -10.0049 -10.0049 -9.9854 -9.9854 -3.7616 -3.7616 -1.8050 -1.8050 -1.7669 -1.7669 1.7825 1.7825 3.6188 3.6188 5.1593 5.1593 5.3334 5.3334 5.4534 5.4534 5.5608 5.5608 5.8310 5.8310 6.0557 6.0557 6.1692 6.1692 6.2352 6.2352 6.3782 6.3782 7.0952 7.0952 7.4408 7.4408 8.6800 8.6800 9.8392 9.8392 10.1278 10.1278 10.2559 10.2559 13.2395 13.2395 13.7410 13.7410 14.1505 14.1505 14.2350 14.2350 15.0527 15.0527 k = 0.0000 0.0000 0.3725 ( 4974 PWs) bands (ev): -17.0661 -17.0661 -11.1475 -11.1475 -11.0840 -11.0840 -11.0723 -11.0723 -11.0594 -11.0594 -10.1400 -10.1400 -10.1049 -10.1049 -10.0329 -10.0329 -10.0139 -10.0139 -10.0049 -10.0049 -9.9853 -9.9853 -3.7639 -3.7639 -1.8104 -1.8104 -1.7695 -1.7695 1.8199 1.8199 3.6254 3.6254 5.1531 5.1531 5.3496 5.3496 5.4636 5.4636 5.5713 5.5713 5.8283 5.8283 6.0540 6.0540 6.1491 6.1491 6.2285 6.2285 6.3569 6.3569 7.0897 7.0897 7.4247 7.4247 8.6279 8.6279 9.8522 9.8522 10.0778 10.0778 10.1997 10.1997 13.3658 13.3658 13.7482 13.7482 14.1588 14.1588 14.4034 14.4034 15.0321 15.0321 k = 0.0000 0.0000 0.3932 ( 4972 PWs) bands (ev): -17.0657 -17.0657 -11.1475 -11.1475 -11.0841 -11.0841 -11.0723 -11.0723 -11.0593 -11.0593 -10.1400 -10.1400 -10.1050 -10.1050 -10.0328 -10.0328 -10.0139 -10.0139 -10.0049 -10.0049 -9.9853 -9.9853 -3.7661 -3.7661 -1.8158 -1.8158 -1.7718 -1.7718 1.8572 1.8572 3.6321 3.6321 5.1463 5.1463 5.3660 5.3660 5.4724 5.4724 5.5830 5.5830 5.8275 5.8275 6.0509 6.0509 6.1279 6.1279 6.2227 6.2227 6.3377 6.3377 7.0834 7.0834 7.4072 7.4072 8.5783 8.5783 9.8609 9.8609 10.0325 10.0325 10.1477 10.1477 13.4926 13.4926 13.7616 13.7616 14.1620 14.1620 14.5695 14.5695 14.9843 14.9843 k = 0.0000 0.0000 0.4139 ( 4972 PWs) bands (ev): -17.0653 -17.0653 -11.1475 -11.1475 -11.0842 -11.0842 -11.0723 -11.0723 -11.0593 -11.0593 -10.1400 -10.1400 -10.1052 -10.1052 -10.0327 -10.0327 -10.0139 -10.0139 -10.0049 -10.0049 -9.9852 -9.9852 -3.7683 -3.7683 -1.8212 -1.8212 -1.7739 -1.7739 1.8942 1.8942 3.6390 3.6390 5.1395 5.1395 5.3824 5.3824 5.4796 5.4796 5.5958 5.5958 5.8285 5.8285 6.0445 6.0445 6.1081 6.1081 6.2176 6.2176 6.3207 6.3207 7.0763 7.0763 7.3887 7.3887 8.5313 8.5313 9.8642 9.8642 9.9931 9.9931 10.0994 10.0994 13.6185 13.6185 13.7812 13.7812 14.1571 14.1571 14.7282 14.7282 14.8773 14.8773 k = 0.0000 0.0000 0.4346 ( 4976 PWs) bands (ev): -17.0649 -17.0649 -11.1475 -11.1475 -11.0843 -11.0843 -11.0724 -11.0724 -11.0592 -11.0592 -10.1401 -10.1401 -10.1053 -10.1053 -10.0325 -10.0325 -10.0139 -10.0139 -10.0048 -10.0048 -9.9852 -9.9852 -3.7705 -3.7705 -1.8265 -1.8265 -1.7759 -1.7759 1.9304 1.9304 3.6461 3.6461 5.1330 5.1330 5.3986 5.3986 5.4849 5.4849 5.6093 5.6093 5.8313 5.8313 6.0318 6.0318 6.0935 6.0935 6.2132 6.2132 6.3060 6.3060 7.0683 7.0683 7.3692 7.3692 8.4869 8.4869 9.8601 9.8601 9.9612 9.9612 10.0543 10.0543 13.7376 13.7376 13.8110 13.8110 14.1397 14.1397 14.7525 14.7525 14.8736 14.8736 k = 0.0000 0.0000 0.4553 ( 4990 PWs) bands (ev): -17.0644 -17.0644 -11.1475 -11.1475 -11.0844 -11.0844 -11.0724 -11.0724 -11.0591 -11.0591 -10.1401 -10.1401 -10.1055 -10.1055 -10.0324 -10.0324 -10.0139 -10.0139 -10.0048 -10.0048 -9.9851 -9.9851 -3.7727 -3.7727 -1.8317 -1.8317 -1.7777 -1.7777 1.9657 1.9657 3.6532 3.6532 5.1270 5.1270 5.4146 5.4146 5.4883 5.4883 5.6231 5.6231 5.8356 5.8356 6.0120 6.0120 6.0858 6.0858 6.2093 6.2093 6.2936 6.2936 7.0594 7.0594 7.3493 7.3493 8.4451 8.4451 9.8470 9.8470 9.9376 9.9376 10.0124 10.0124 13.8066 13.8066 13.8901 13.8901 14.1052 14.1052 14.6542 14.6542 14.9272 14.9272 k = 0.0000 0.0000 0.4760 ( 4994 PWs) bands (ev): -17.0640 -17.0640 -11.1475 -11.1475 -11.0845 -11.0845 -11.0724 -11.0724 -11.0590 -11.0590 -10.1401 -10.1401 -10.1057 -10.1057 -10.0322 -10.0322 -10.0139 -10.0139 -10.0048 -10.0048 -9.9851 -9.9851 -3.7748 -3.7748 -1.8367 -1.8367 -1.7794 -1.7794 1.9997 1.9997 3.6603 3.6603 5.1219 5.1219 5.4303 5.4303 5.4901 5.4901 5.6365 5.6365 5.8410 5.8410 5.9884 5.9884 6.0830 6.0830 6.2060 6.2060 6.2834 6.2834 7.0495 7.0495 7.3292 7.3292 8.4058 8.4058 9.8261 9.8261 9.9196 9.9196 9.9748 9.9748 13.8322 13.8322 13.9958 13.9958 14.0622 14.0622 14.5815 14.5815 14.8835 14.8835 k = 0.0000 0.0000 0.4967 ( 4994 PWs) bands (ev): -17.0636 -17.0636 -11.1475 -11.1475 -11.0846 -11.0846 -11.0724 -11.0724 -11.0589 -11.0589 -10.1401 -10.1401 -10.1059 -10.1059 -10.0321 -10.0321 -10.0139 -10.0139 -10.0048 -10.0048 -9.9851 -9.9851 -3.7768 -3.7768 -1.8414 -1.8414 -1.7810 -1.7810 2.0322 2.0322 3.6676 3.6676 5.1179 5.1179 5.4457 5.4457 5.4903 5.4903 5.6488 5.6488 5.8467 5.8467 5.9646 5.9646 6.0831 6.0831 6.2035 6.2035 6.2755 6.2755 7.0385 7.0385 7.3095 7.3095 8.3689 8.3689 9.8007 9.8007 9.8999 9.8999 9.9444 9.9444 13.8435 13.8435 13.9637 13.9637 14.1428 14.1428 14.5347 14.5347 14.8264 14.8264 k = 0.0000 0.0000 0.5174 ( 4982 PWs) bands (ev): -17.0632 -17.0632 -11.1475 -11.1475 -11.0847 -11.0847 -11.0725 -11.0725 -11.0588 -11.0588 -10.1401 -10.1401 -10.1061 -10.1061 -10.0319 -10.0319 -10.0139 -10.0139 -10.0047 -10.0047 -9.9850 -9.9850 -3.7788 -3.7788 -1.8458 -1.8458 -1.7825 -1.7825 2.0628 2.0628 3.6748 3.6748 5.1151 5.1151 5.4603 5.4603 5.4894 5.4894 5.6593 5.6593 5.8513 5.8513 5.9438 5.9438 6.0852 6.0852 6.2016 6.2016 6.2696 6.2696 7.0265 7.0265 7.2907 7.2907 8.3344 8.3344 9.7731 9.7731 9.8722 9.8722 9.9243 9.9243 13.8305 13.8305 13.8912 13.8912 14.2606 14.2606 14.5081 14.5081 14.7872 14.7872 k = 0.0000 0.0000 0.5380 ( 4982 PWs) bands (ev): -17.0628 -17.0628 -11.1475 -11.1475 -11.0848 -11.0848 -11.0725 -11.0725 -11.0587 -11.0587 -10.1401 -10.1401 -10.1063 -10.1063 -10.0317 -10.0317 -10.0139 -10.0139 -10.0047 -10.0047 -9.9850 -9.9850 -3.7807 -3.7807 -1.8500 -1.8500 -1.7838 -1.7838 2.0915 2.0915 3.6819 3.6819 5.1136 5.1136 5.4719 5.4719 5.4896 5.4896 5.6673 5.6673 5.8527 5.8527 5.9288 5.9288 6.0886 6.0886 6.2006 6.2006 6.2657 6.2657 7.0134 7.0134 7.2732 7.2732 8.3020 8.3020 9.7441 9.7441 9.8392 9.8392 9.9103 9.9103 13.7674 13.7674 13.8463 13.8463 14.3719 14.3719 14.4989 14.4989 14.7753 14.7753 k = 0.0000 0.0000 0.5587 ( 4990 PWs) bands (ev): -17.0624 -17.0624 -11.1475 -11.1475 -11.0849 -11.0849 -11.0725 -11.0725 -11.0585 -11.0585 -10.1401 -10.1401 -10.1065 -10.1065 -10.0316 -10.0316 -10.0139 -10.0139 -10.0047 -10.0047 -9.9850 -9.9850 -3.7826 -3.7826 -1.8539 -1.8539 -1.7851 -1.7851 2.1180 2.1180 3.6890 3.6890 5.1135 5.1135 5.4733 5.4733 5.4978 5.4978 5.6724 5.6724 5.8500 5.8500 5.9214 5.9214 6.0935 6.0935 6.2003 6.2003 6.2637 6.2637 6.9992 6.9992 7.2578 7.2578 8.2718 8.2718 9.7133 9.7133 9.8045 9.8045 9.8980 9.8980 13.6856 13.6856 13.8039 13.8039 14.4439 14.4439 14.5331 14.5331 14.7927 14.7927 k = 0.0000 0.0000 0.5794 ( 4992 PWs) bands (ev): -17.0620 -17.0620 -11.1475 -11.1475 -11.0850 -11.0850 -11.0726 -11.0726 -11.0584 -11.0584 -10.1401 -10.1401 -10.1067 -10.1067 -10.0314 -10.0314 -10.0139 -10.0139 -10.0046 -10.0046 -9.9849 -9.9849 -3.7843 -3.7843 -1.8575 -1.8575 -1.7862 -1.7862 2.1422 2.1422 3.6959 3.6959 5.1150 5.1150 5.4670 5.4670 5.5117 5.5117 5.6746 5.6746 5.8445 5.8445 5.9204 5.9204 6.0997 6.0997 6.2010 6.2010 6.2636 6.2636 6.9838 6.9838 7.2450 7.2450 8.2436 8.2436 9.6798 9.6798 9.7700 9.7700 9.8857 9.8857 13.6079 13.6079 13.7482 13.7482 14.4560 14.4560 14.6275 14.6275 14.8363 14.8363 k = 0.0000 0.0000 0.6001 ( 4984 PWs) bands (ev): -17.0616 -17.0616 -11.1475 -11.1475 -11.0852 -11.0852 -11.0726 -11.0726 -11.0583 -11.0583 -10.1401 -10.1401 -10.1069 -10.1069 -10.0312 -10.0312 -10.0139 -10.0139 -10.0046 -10.0046 -9.9849 -9.9849 -3.7860 -3.7860 -1.8608 -1.8608 -1.7872 -1.7872 2.1639 2.1639 3.7027 3.7027 5.1179 5.1179 5.4571 5.4571 5.5267 5.5267 5.6746 5.6746 5.8393 5.8393 5.9225 5.9225 6.1070 6.1070 6.2027 6.2027 6.2654 6.2654 6.9674 6.9674 7.2355 7.2355 8.2175 8.2175 9.6422 9.6422 9.7366 9.7366 9.8732 9.8732 13.5401 13.5401 13.6809 13.6809 14.4564 14.4564 14.7316 14.7316 14.8998 14.8998 k = 0.0000 0.0000 0.6208 ( 4992 PWs) bands (ev): -17.0612 -17.0612 -11.1475 -11.1475 -11.0853 -11.0853 -11.0726 -11.0726 -11.0582 -11.0582 -10.1401 -10.1401 -10.1071 -10.1071 -10.0310 -10.0310 -10.0139 -10.0139 -10.0046 -10.0046 -9.9849 -9.9849 -3.7875 -3.7875 -1.8638 -1.8638 -1.7882 -1.7882 2.1832 2.1832 3.7093 3.7093 5.1222 5.1222 5.4441 5.4441 5.5420 5.5420 5.6734 5.6734 5.8355 5.8355 5.9255 5.9255 6.1151 6.1151 6.2053 6.2053 6.2687 6.2687 6.9500 6.9500 7.2298 7.2298 8.1931 8.1931 9.5990 9.5990 9.7052 9.7052 9.8603 9.8603 13.4847 13.4847 13.6064 13.6064 14.4550 14.4550 14.8342 14.8342 14.9745 14.9745 k = 0.0000 0.0000 0.6415 ( 4992 PWs) bands (ev): -17.0608 -17.0608 -11.1475 -11.1475 -11.0854 -11.0854 -11.0727 -11.0727 -11.0581 -11.0581 -10.1401 -10.1401 -10.1072 -10.1072 -10.0308 -10.0308 -10.0139 -10.0139 -10.0045 -10.0045 -9.9848 -9.9848 -3.7890 -3.7890 -1.8665 -1.8665 -1.7890 -1.7890 2.2001 2.2001 3.7157 3.7157 5.1278 5.1278 5.4285 5.4285 5.5574 5.5574 5.6724 5.6724 5.8335 5.8335 5.9281 5.9281 6.1234 6.1234 6.2090 6.2090 6.2734 6.2734 6.9317 6.9317 7.2288 7.2288 8.1705 8.1705 9.5493 9.5493 9.6760 9.6760 9.8473 9.8473 13.4430 13.4430 13.5281 13.5281 14.4528 14.4528 14.9328 14.9328 15.0485 15.0485 k = 0.0000 0.0000 0.6622 ( 4990 PWs) bands (ev): -17.0605 -17.0605 -11.1476 -11.1476 -11.0855 -11.0855 -11.0727 -11.0727 -11.0580 -11.0580 -10.1401 -10.1401 -10.1074 -10.1074 -10.0307 -10.0307 -10.0139 -10.0139 -10.0045 -10.0045 -9.9848 -9.9848 -3.7904 -3.7904 -1.8690 -1.8690 -1.7897 -1.7897 2.2145 2.2145 3.7218 3.7218 5.1345 5.1345 5.4107 5.4107 5.5728 5.5728 5.6728 5.6728 5.8326 5.8326 5.9301 5.9301 6.1317 6.1317 6.2137 6.2137 6.2793 6.2793 6.9127 6.9127 7.2329 7.2329 8.1497 8.1497 9.4926 9.4926 9.6491 9.6491 9.8343 9.8343 13.4158 13.4158 13.4491 13.4491 14.4499 14.4499 15.0240 15.0240 15.1087 15.1087 k = 0.0000 0.0000 0.6829 ( 4982 PWs) bands (ev): -17.0602 -17.0602 -11.1476 -11.1476 -11.0856 -11.0856 -11.0727 -11.0727 -11.0579 -11.0579 -10.1402 -10.1402 -10.1076 -10.1076 -10.0305 -10.0305 -10.0139 -10.0139 -10.0044 -10.0044 -9.9848 -9.9848 -3.7916 -3.7916 -1.8711 -1.8711 -1.7903 -1.7903 2.2267 2.2267 3.7277 3.7277 5.1420 5.1420 5.3911 5.3911 5.5881 5.5881 5.6751 5.6751 5.8324 5.8324 5.9313 5.9313 6.1395 6.1395 6.2193 6.2193 6.2859 6.2859 6.8932 6.8932 7.2429 7.2429 8.1305 8.1305 9.4288 9.4288 9.6244 9.6244 9.8215 9.8215 13.3695 13.3695 13.4051 13.4051 14.4465 14.4465 15.1001 15.1001 15.1602 15.1602 k = 0.0000 0.0000 0.7036 ( 4982 PWs) bands (ev): -17.0598 -17.0598 -11.1476 -11.1476 -11.0857 -11.0857 -11.0727 -11.0727 -11.0578 -11.0578 -10.1402 -10.1402 -10.1078 -10.1078 -10.0303 -10.0303 -10.0139 -10.0139 -10.0044 -10.0044 -9.9848 -9.9848 -3.7928 -3.7928 -1.8731 -1.8731 -1.7908 -1.7908 2.2367 2.2367 3.7332 3.7332 5.1502 5.1502 5.3704 5.3704 5.6030 5.6030 5.6796 5.6796 5.8323 5.8323 5.9317 5.9317 6.1465 6.1465 6.2257 6.2257 6.2926 6.2926 6.8731 6.8731 7.2592 7.2592 8.1128 8.1128 9.3581 9.3581 9.6015 9.6015 9.8092 9.8092 13.2935 13.2935 13.4082 13.4082 14.4426 14.4426 15.1519 15.1519 15.2196 15.2196 k = 0.0000 0.0000 0.7243 ( 4974 PWs) bands (ev): -17.0595 -17.0595 -11.1476 -11.1476 -11.0858 -11.0858 -11.0728 -11.0728 -11.0576 -11.0576 -10.1402 -10.1402 -10.1080 -10.1080 -10.0301 -10.0301 -10.0140 -10.0140 -10.0044 -10.0044 -9.9848 -9.9848 -3.7939 -3.7939 -1.8748 -1.8748 -1.7912 -1.7912 2.2446 2.2446 3.7384 3.7384 5.1588 5.1588 5.3494 5.3494 5.6175 5.6175 5.6865 5.6865 5.8321 5.8321 5.9314 5.9314 6.1528 6.1528 6.2328 6.2328 6.2991 6.2991 6.8529 6.8529 7.2822 7.2822 8.0967 8.0967 9.2811 9.2811 9.5803 9.5803 9.7975 9.7975 13.2205 13.2205 13.4263 13.4263 14.4385 14.4385 15.1870 15.1870 15.2829 15.2829 k = 0.0000 0.0000 0.7450 ( 4978 PWs) bands (ev): -17.0593 -17.0593 -11.1476 -11.1476 -11.0859 -11.0859 -11.0728 -11.0728 -11.0575 -11.0575 -10.1402 -10.1402 -10.1081 -10.1081 -10.0300 -10.0300 -10.0140 -10.0140 -10.0043 -10.0043 -9.9848 -9.9848 -3.7948 -3.7948 -1.8763 -1.8763 -1.7915 -1.7915 2.2508 2.2508 3.7432 3.7432 5.1676 5.1676 5.3285 5.3285 5.6313 5.6313 5.6954 5.6954 5.8317 5.8317 5.9305 5.9305 6.1582 6.1582 6.2405 6.2405 6.3047 6.3047 6.8326 6.8326 7.3123 7.3123 8.0820 8.0820 9.1982 9.1982 9.5608 9.5608 9.7865 9.7865 13.1514 13.1514 13.4585 13.4585 14.4341 14.4341 15.2157 15.2157 15.3416 15.3416 k = 0.0000 0.0000 0.7657 ( 4974 PWs) bands (ev): -17.0590 -17.0590 -11.1476 -11.1476 -11.0860 -11.0860 -11.0728 -11.0728 -11.0574 -11.0574 -10.1402 -10.1402 -10.1083 -10.1083 -10.0298 -10.0298 -10.0140 -10.0140 -10.0043 -10.0043 -9.9847 -9.9847 -3.7957 -3.7957 -1.8776 -1.8776 -1.7918 -1.7918 2.2554 2.2554 3.7477 3.7477 5.1763 5.1763 5.3082 5.3082 5.6444 5.6444 5.7062 5.7062 5.8311 5.8311 5.9290 5.9290 6.1629 6.1629 6.2485 6.2485 6.3093 6.3093 6.8126 6.8126 7.3497 7.3497 8.0688 8.0688 9.1101 9.1101 9.5429 9.5429 9.7763 9.7763 13.0868 13.0868 13.5041 13.5041 14.4297 14.4297 15.2405 15.2405 15.3935 15.3935 k = 0.0000 0.0000 0.7864 ( 4966 PWs) bands (ev): -17.0588 -17.0588 -11.1476 -11.1476 -11.0861 -11.0861 -11.0729 -11.0729 -11.0574 -11.0574 -10.1402 -10.1402 -10.1084 -10.1084 -10.0297 -10.0297 -10.0140 -10.0140 -10.0043 -10.0043 -9.9847 -9.9847 -3.7965 -3.7965 -1.8787 -1.8787 -1.7919 -1.7919 2.2587 2.2587 3.7518 3.7518 5.1847 5.1847 5.2889 5.2889 5.6567 5.6567 5.7184 5.7184 5.8302 5.8302 5.9270 5.9270 6.1669 6.1669 6.2568 6.2568 6.3126 6.3126 6.7931 6.7931 7.3942 7.3942 8.0569 8.0569 9.0177 9.0177 9.5266 9.5266 9.7671 9.7671 13.0272 13.0272 13.5618 13.5618 14.4254 14.4254 15.2617 15.2617 15.4385 15.4385 k = 0.0000 0.0000 0.8071 ( 4970 PWs) bands (ev): -17.0586 -17.0586 -11.1476 -11.1476 -11.0862 -11.0862 -11.0729 -11.0729 -11.0573 -11.0573 -10.1402 -10.1402 -10.1086 -10.1086 -10.0296 -10.0296 -10.0140 -10.0140 -10.0043 -10.0043 -9.9847 -9.9847 -3.7972 -3.7972 -1.8797 -1.8797 -1.7920 -1.7920 2.2609 2.2609 3.7555 3.7555 5.1926 5.1926 5.2710 5.2710 5.6681 5.6681 5.7316 5.7316 5.8291 5.8291 5.9245 5.9245 6.1703 6.1703 6.2649 6.2649 6.3146 6.3146 6.7744 6.7744 7.4457 7.4457 8.0463 8.0463 8.9217 8.9217 9.5118 9.5118 9.7588 9.7588 12.9729 12.9729 13.6302 13.6302 14.4213 14.4213 15.2787 15.2787 15.4768 15.4768 k = 0.0000 0.0000 0.8278 ( 4966 PWs) bands (ev): -17.0584 -17.0584 -11.1476 -11.1476 -11.0863 -11.0863 -11.0729 -11.0729 -11.0572 -11.0572 -10.1402 -10.1402 -10.1087 -10.1087 -10.0294 -10.0294 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7978 -3.7978 -1.8805 -1.8805 -1.7921 -1.7921 2.2621 2.2621 3.7588 3.7588 5.1998 5.1998 5.2548 5.2548 5.6787 5.6787 5.7453 5.7453 5.8279 5.8279 5.9214 5.9214 6.1732 6.1732 6.2728 6.2728 6.3155 6.3155 6.7568 6.7568 7.5039 7.5039 8.0370 8.0370 8.8232 8.8232 9.4987 9.4987 9.7516 9.7516 12.9244 12.9244 13.7077 13.7077 14.4174 14.4174 15.2900 15.2900 15.5086 15.5086 k = 0.0000 0.0000 0.8485 ( 4970 PWs) bands (ev): -17.0582 -17.0582 -11.1475 -11.1475 -11.0864 -11.0864 -11.0729 -11.0729 -11.0571 -11.0571 -10.1402 -10.1402 -10.1088 -10.1088 -10.0293 -10.0293 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7983 -3.7983 -1.8812 -1.8812 -1.7921 -1.7921 2.2627 2.2627 3.7616 3.7616 5.2063 5.2063 5.2403 5.2403 5.6883 5.6883 5.7589 5.7589 5.8267 5.8267 5.9178 5.9178 6.1757 6.1757 6.2802 6.2802 6.3154 6.3154 6.7405 6.7405 7.5682 7.5682 8.0290 8.0290 8.7231 8.7231 9.4873 9.4873 9.7453 9.7453 12.8818 12.8818 13.7922 13.7922 14.4139 14.4139 15.2938 15.2938 15.5342 15.5342 k = 0.0000 0.0000 0.8692 ( 4978 PWs) bands (ev): -17.0581 -17.0581 -11.1475 -11.1475 -11.0864 -11.0864 -11.0729 -11.0729 -11.0571 -11.0571 -10.1402 -10.1402 -10.1089 -10.1089 -10.0293 -10.0293 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7987 -3.7987 -1.8818 -1.8818 -1.7922 -1.7922 2.2629 2.2629 3.7641 3.7641 5.2120 5.2120 5.2277 5.2277 5.6970 5.6970 5.7717 5.7717 5.8258 5.8258 5.9137 5.9137 6.1777 6.1777 6.2870 6.2870 6.3147 6.3147 6.7261 6.7261 7.6379 7.6379 8.0221 8.0221 8.6225 8.6225 9.4776 9.4776 9.7401 9.7401 12.8453 12.8453 13.8812 13.8812 14.4108 14.4108 15.2871 15.2871 15.5535 15.5535 k = 0.0000 0.0000 0.8899 ( 4978 PWs) bands (ev): -17.0579 -17.0579 -11.1475 -11.1475 -11.0865 -11.0865 -11.0729 -11.0729 -11.0570 -11.0570 -10.1402 -10.1402 -10.1090 -10.1090 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7991 -3.7991 -1.8822 -1.8822 -1.7921 -1.7921 2.2628 2.2628 3.7661 3.7661 5.2167 5.2167 5.2173 5.2173 5.7045 5.7045 5.7833 5.7833 5.8256 5.8256 5.9092 5.9092 6.1795 6.1795 6.2929 6.2929 6.3134 6.3134 6.7136 6.7136 7.7121 7.7121 8.0164 8.0164 8.5229 8.5229 9.4695 9.4695 9.7358 9.7358 12.8153 12.8153 13.9710 13.9710 14.4080 14.4080 15.2673 15.2673 15.5666 15.5666 k = 0.0000 0.0000 0.9105 ( 4978 PWs) bands (ev): -17.0579 -17.0579 -11.1475 -11.1475 -11.0865 -11.0865 -11.0729 -11.0729 -11.0570 -11.0570 -10.1402 -10.1402 -10.1090 -10.1090 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7993 -3.7993 -1.8825 -1.8825 -1.7921 -1.7921 2.2625 2.2625 3.7676 3.7676 5.2091 5.2091 5.2204 5.2204 5.7106 5.7106 5.7926 5.7926 5.8263 5.8263 5.9047 5.9047 6.1808 6.1808 6.2979 6.2979 6.3120 6.3120 6.7036 6.7036 7.7891 7.7891 8.0115 8.0115 8.4262 8.4262 9.4633 9.4633 9.7326 9.7326 12.7917 12.7917 14.0565 14.0565 14.4056 14.4056 15.2340 15.2340 15.5737 15.5737 k = 0.0000 0.0000 0.9312 ( 4974 PWs) bands (ev): -17.0578 -17.0578 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0570 -11.0570 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7995 -3.7995 -1.8828 -1.8828 -1.7921 -1.7921 2.2622 2.2622 3.7688 3.7688 5.2033 5.2033 5.2231 5.2231 5.7151 5.7151 5.7989 5.7989 5.8283 5.8283 5.9005 5.9005 6.1818 6.1818 6.3018 6.3018 6.3106 6.3106 6.6962 6.6962 7.8660 7.8660 8.0071 8.0071 8.3362 8.3362 9.4588 9.4588 9.7302 9.7302 12.7749 12.7749 14.1301 14.1301 14.4037 14.4037 15.1934 15.1934 15.5762 15.5762 k = 0.0000 0.0000 0.9519 ( 4974 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8829 -1.8829 -1.7921 -1.7921 2.2620 2.2620 3.7695 3.7695 5.1996 5.1996 5.2247 5.2247 5.7179 5.7179 5.8022 5.8022 5.8306 5.8306 5.8974 5.8974 6.1824 6.1824 6.3046 6.3046 6.3093 6.3093 6.6917 6.6917 7.9354 7.9354 8.0007 8.0007 8.2625 8.2625 9.4561 9.4561 9.7289 9.7289 12.7647 12.7647 14.1817 14.1817 14.4022 14.4022 15.1588 15.1588 15.5764 15.5764 k = 0.0000 0.0000 0.9726 ( 4978 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0290 -10.0290 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8830 -1.8830 -1.7921 -1.7921 2.2619 2.2619 3.7697 3.7697 5.1984 5.1984 5.2252 5.2252 5.7188 5.7188 5.8031 5.8031 5.8316 5.8316 5.8963 5.8963 6.1825 6.1825 6.3059 6.3059 6.3085 6.3085 6.6902 6.6902 7.9799 7.9799 7.9850 7.9850 8.2302 8.2302 9.4552 9.4552 9.7284 9.7284 12.7613 12.7613 14.2005 14.2005 14.4016 14.4016 15.1451 15.1451 15.5762 15.5762 k = 0.0000 0.0000 0.9726 ( 4978 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0290 -10.0290 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8830 -1.8830 -1.7921 -1.7921 2.2619 2.2619 3.7697 3.7697 5.1984 5.1984 5.2252 5.2252 5.7188 5.7188 5.8031 5.8031 5.8316 5.8316 5.8963 5.8963 6.1825 6.1825 6.3059 6.3059 6.3085 6.3085 6.6902 6.6902 7.9799 7.9799 7.9850 7.9850 8.2302 8.2302 9.4552 9.4552 9.7284 9.7284 12.7613 12.7613 14.2005 14.2005 14.4016 14.4016 15.1451 15.1451 15.5762 15.5762 k =-0.0100 0.0166 0.9726 ( 4974 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8829 -1.8829 -1.7922 -1.7922 2.2625 2.2625 3.7680 3.7680 5.1988 5.1988 5.2261 5.2261 5.7179 5.7179 5.8034 5.8034 5.8316 5.8316 5.8961 5.8961 6.1830 6.1830 6.3058 6.3058 6.3079 6.3079 6.6865 6.6865 7.9792 7.9792 7.9925 7.9925 8.2310 8.2310 9.4538 9.4538 9.7307 9.7307 12.7604 12.7604 14.1992 14.1992 14.4039 14.4039 15.1448 15.1448 15.5745 15.5745 k =-0.0200 0.0333 0.9726 ( 4974 PWs) bands (ev): -17.0578 -17.0578 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7996 -3.7996 -1.8827 -1.8827 -1.7924 -1.7924 2.2643 2.2643 3.7627 3.7627 5.1998 5.1998 5.2289 5.2289 5.7154 5.7154 5.8040 5.8040 5.8316 5.8316 5.8958 5.8958 6.1843 6.1843 6.3050 6.3050 6.3066 6.3066 6.6757 6.6757 7.9798 7.9798 8.0120 8.0120 8.2333 8.2333 9.4497 9.4497 9.7374 9.7374 12.7577 12.7577 14.1951 14.1951 14.4102 14.4102 15.1442 15.1442 15.5694 15.5694 k =-0.0299 0.0499 0.9726 ( 4980 PWs) bands (ev): -17.0578 -17.0578 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0570 -11.0570 -10.1401 -10.1401 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7995 -3.7995 -1.8823 -1.8823 -1.7927 -1.7927 2.2672 2.2672 3.7541 3.7541 5.2015 5.2015 5.2333 5.2333 5.7111 5.7111 5.8049 5.8049 5.8314 5.8314 5.8952 5.8952 6.1864 6.1864 6.3025 6.3025 6.3058 6.3058 6.6584 6.6584 7.9816 7.9816 8.0423 8.0423 8.2376 8.2376 9.4435 9.4435 9.7487 9.7487 12.7533 12.7533 14.1885 14.1885 14.4188 14.4188 15.1451 15.1451 15.5602 15.5602 k =-0.0399 0.0666 0.9726 ( 4996 PWs) bands (ev): -17.0579 -17.0579 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0570 -11.0570 -10.1401 -10.1401 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7993 -3.7993 -1.8817 -1.8817 -1.7932 -1.7932 2.2713 2.2713 3.7423 3.7423 5.2037 5.2037 5.2394 5.2394 5.7055 5.7055 5.8059 5.8059 5.8311 5.8311 5.8945 5.8945 6.1892 6.1892 6.2985 6.2985 6.3053 6.3053 6.6356 6.6356 7.9843 7.9843 8.0814 8.0814 8.2448 8.2448 9.4357 9.4357 9.7643 9.7643 12.7474 12.7474 14.1795 14.1795 14.4270 14.4270 15.1498 15.1498 15.5463 15.5463 k =-0.0499 0.0832 0.9726 ( 4988 PWs) bands (ev): -17.0580 -17.0580 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0570 -11.0570 -10.1401 -10.1401 -10.1091 -10.1091 -10.0292 -10.0292 -10.0141 -10.0141 -10.0040 -10.0040 -9.9847 -9.9847 -3.7990 -3.7990 -1.8810 -1.8810 -1.7938 -1.7938 2.2764 2.2764 3.7273 3.7273 5.2066 5.2066 5.2474 5.2474 5.6987 5.6987 5.8070 5.8070 5.8310 5.8310 5.8937 5.8937 6.1927 6.1927 6.2935 6.2935 6.3048 6.3048 6.6084 6.6084 7.9879 7.9879 8.1244 8.1244 8.2581 8.2581 9.4275 9.4275 9.7843 9.7843 12.7401 12.7401 14.1682 14.1682 14.4313 14.4313 15.1618 15.1618 15.5270 15.5270 k =-0.0599 0.0999 0.9726 ( 4986 PWs) bands (ev): -17.0581 -17.0581 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0570 -11.0570 -10.1401 -10.1401 -10.1090 -10.1090 -10.0293 -10.0293 -10.0141 -10.0141 -10.0040 -10.0040 -9.9847 -9.9847 -3.7987 -3.7987 -1.8801 -1.8801 -1.7946 -1.7946 2.2824 2.2824 3.7094 3.7094 5.2099 5.2099 5.2567 5.2567 5.6909 5.6909 5.8076 5.8076 5.8309 5.8309 5.8929 5.8929 6.1967 6.1967 6.2877 6.2877 6.3042 6.3042 6.5779 6.5779 7.9923 7.9923 8.1618 8.1618 8.2857 8.2857 9.4199 9.4199 9.8085 9.8085 12.7315 12.7315 14.1548 14.1548 14.4278 14.4278 15.1844 15.1844 15.5018 15.5018 k =-0.0698 0.1165 0.9726 ( 4984 PWs) bands (ev): -17.0583 -17.0583 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0571 -11.0571 -10.1401 -10.1401 -10.1090 -10.1090 -10.0293 -10.0293 -10.0141 -10.0141 -10.0039 -10.0039 -9.9847 -9.9847 -3.7984 -3.7984 -1.8791 -1.8791 -1.7954 -1.7954 2.2894 2.2894 3.6887 3.6887 5.2137 5.2137 5.2673 5.2673 5.6824 5.6824 5.8074 5.8074 5.8311 5.8311 5.8921 5.8921 6.2010 6.2010 6.2813 6.2813 6.3036 6.3036 6.5449 6.5449 7.9976 7.9976 8.1833 8.1833 8.3359 8.3359 9.4142 9.4142 9.8369 9.8369 12.7221 12.7221 14.1396 14.1396 14.4135 14.4135 15.2200 15.2200 15.4709 15.4709 k =-0.0798 0.1332 0.9726 ( 4982 PWs) bands (ev): -17.0584 -17.0584 -11.1475 -11.1475 -11.0864 -11.0864 -11.0730 -11.0730 -11.0571 -11.0571 -10.1400 -10.1400 -10.1090 -10.1090 -10.0294 -10.0294 -10.0141 -10.0141 -10.0038 -10.0038 -9.9846 -9.9846 -3.7979 -3.7979 -1.8779 -1.8779 -1.7964 -1.7964 2.2970 2.2970 3.6656 3.6656 5.2178 5.2178 5.2791 5.2791 5.6735 5.6735 5.8062 5.8062 5.8317 5.8317 5.8914 5.8914 6.2055 6.2055 6.2747 6.2747 6.3029 6.3029 6.5105 6.5105 8.0037 8.0037 8.1908 8.1908 8.4056 8.4056 9.4117 9.4117 9.8693 9.8693 12.7119 12.7119 14.1227 14.1227 14.3868 14.3868 15.2677 15.2677 15.4360 15.4360 k =-0.0898 0.1498 0.9726 ( 4986 PWs) bands (ev): -17.0586 -17.0586 -11.1474 -11.1474 -11.0864 -11.0864 -11.0730 -11.0730 -11.0571 -11.0571 -10.1400 -10.1400 -10.1089 -10.1089 -10.0295 -10.0295 -10.0142 -10.0142 -10.0038 -10.0038 -9.9846 -9.9846 -3.7975 -3.7975 -1.8765 -1.8765 -1.7974 -1.7974 2.3053 2.3053 3.6403 3.6403 5.2221 5.2221 5.2918 5.2918 5.6644 5.6644 5.8036 5.8036 5.8328 5.8328 5.8909 5.8909 6.2095 6.2095 6.2682 6.2682 6.3022 6.3022 6.4755 6.4755 8.0106 8.0106 8.1900 8.1900 8.4876 8.4876 9.4135 9.4135 9.9057 9.9057 12.7014 12.7014 14.1043 14.1043 14.3480 14.3480 15.3168 15.3168 15.4045 15.4045 k =-0.0898 0.1498 0.9726 ( 4986 PWs) bands (ev): -17.0586 -17.0586 -11.1474 -11.1474 -11.0864 -11.0864 -11.0730 -11.0730 -11.0571 -11.0571 -10.1400 -10.1400 -10.1089 -10.1089 -10.0295 -10.0295 -10.0142 -10.0142 -10.0038 -10.0038 -9.9846 -9.9846 -3.7975 -3.7975 -1.8765 -1.8765 -1.7974 -1.7974 2.3053 2.3053 3.6403 3.6403 5.2221 5.2221 5.2918 5.2918 5.6644 5.6644 5.8036 5.8036 5.8328 5.8328 5.8909 5.8909 6.2095 6.2095 6.2682 6.2682 6.3022 6.3022 6.4755 6.4755 8.0106 8.0106 8.1900 8.1900 8.4876 8.4876 9.4135 9.4135 9.9057 9.9057 12.7014 12.7014 14.1043 14.1043 14.3480 14.3480 15.3168 15.3168 15.4045 15.4045 k =-0.0974 0.1625 0.9579 ( 4980 PWs) bands (ev): -17.0588 -17.0588 -11.1474 -11.1474 -11.0864 -11.0864 -11.0730 -11.0730 -11.0572 -11.0572 -10.1400 -10.1400 -10.1089 -10.1089 -10.0296 -10.0296 -10.0142 -10.0142 -10.0037 -10.0037 -9.9846 -9.9846 -3.7970 -3.7970 -1.8754 -1.8754 -1.7982 -1.7982 2.3120 2.3120 3.6197 3.6197 5.2260 5.2260 5.3017 5.3017 5.6576 5.6576 5.7999 5.7999 5.8335 5.8335 5.8913 5.8913 6.2111 6.2111 6.2645 6.2645 6.3012 6.3012 6.4495 6.4495 7.9900 7.9900 8.2132 8.2132 8.5562 8.5562 9.4188 9.4188 9.9363 9.9363 12.6950 12.6950 14.0811 14.0811 14.3126 14.3126 15.3130 15.3130 15.4151 15.4151 k =-0.1050 0.1752 0.9431 ( 4984 PWs) bands (ev): -17.0589 -17.0589 -11.1474 -11.1474 -11.0864 -11.0864 -11.0730 -11.0730 -11.0572 -11.0572 -10.1400 -10.1400 -10.1089 -10.1089 -10.0297 -10.0297 -10.0142 -10.0142 -10.0036 -10.0036 -9.9846 -9.9846 -3.7966 -3.7966 -1.8744 -1.8744 -1.7987 -1.7987 2.3190 2.3190 3.5981 3.5981 5.2310 5.2310 5.3113 5.3113 5.6508 5.6508 5.7937 5.7937 5.8340 5.8340 5.8930 5.8930 6.2100 6.2100 6.2631 6.2631 6.2994 6.2994 6.4251 6.4251 7.9369 7.9369 8.2694 8.2694 8.6288 8.6288 9.4283 9.4283 9.9701 9.9701 12.6921 12.6921 14.0419 14.0419 14.2749 14.2749 15.2558 15.2558 15.4689 15.4689 k =-0.1126 0.1879 0.9283 ( 4982 PWs) bands (ev): -17.0591 -17.0591 -11.1474 -11.1474 -11.0863 -11.0863 -11.0730 -11.0730 -11.0573 -11.0573 -10.1399 -10.1399 -10.1088 -10.1088 -10.0298 -10.0298 -10.0143 -10.0143 -10.0036 -10.0036 -9.9846 -9.9846 -3.7960 -3.7960 -1.8736 -1.8736 -1.7989 -1.7989 2.3264 2.3264 3.5758 3.5758 5.2369 5.2369 5.3207 5.3207 5.6444 5.6444 5.7855 5.7855 5.8343 5.8343 5.8956 5.8956 6.2058 6.2058 6.2640 6.2640 6.2968 6.2968 6.4025 6.4025 7.8727 7.8727 8.3374 8.3374 8.7043 8.7043 9.4423 9.4423 10.0072 10.0072 12.6928 12.6928 13.9902 13.9902 14.2345 14.2345 15.1833 15.1833 15.5212 15.5212 k =-0.1202 0.2005 0.9135 ( 4983 PWs) bands (ev): -17.0594 -17.0594 -11.1474 -11.1474 -11.0863 -11.0863 -11.0730 -11.0730 -11.0573 -11.0573 -10.1399 -10.1399 -10.1088 -10.1088 -10.0299 -10.0299 -10.0143 -10.0143 -10.0035 -10.0035 -9.9846 -9.9846 -3.7955 -3.7955 -1.8731 -1.8731 -1.7987 -1.7987 2.3340 2.3340 3.5529 3.5529 5.2437 5.2437 5.3297 5.3297 5.6387 5.6387 5.7756 5.7756 5.8345 5.8345 5.8989 5.8989 6.1991 6.1991 6.2659 6.2659 6.2941 6.2941 6.3818 6.3818 7.8047 7.8047 8.4101 8.4101 8.7820 8.7820 9.4611 9.4611 10.0480 10.0480 12.6972 12.6972 13.9303 13.9303 14.1904 14.1904 15.1055 15.1055 15.5667 15.5667 k =-0.1278 0.2132 0.8987 ( 4983 PWs) bands (ev): -17.0596 -17.0596 -11.1473 -11.1473 -11.0862 -11.0862 -11.0730 -11.0730 -11.0574 -11.0574 -10.1399 -10.1399 -10.1087 -10.1087 -10.0300 -10.0300 -10.0143 -10.0143 -10.0034 -10.0034 -9.9846 -9.9846 -3.7949 -3.7949 -1.8730 -1.8730 -1.7981 -1.7981 2.3419 2.3419 3.5295 3.5295 5.2513 5.2513 5.3381 5.3381 5.6338 5.6338 5.7646 5.7646 5.8346 5.8346 5.9024 5.9024 6.1909 6.1909 6.2666 6.2666 6.2924 6.2924 6.3632 6.3632 7.7350 7.7350 8.4851 8.4851 8.8610 8.8610 9.4847 9.4847 10.0926 10.0926 12.7055 12.7055 13.8657 13.8657 14.1419 14.1419 15.0257 15.0257 15.6141 15.6141 k =-0.1354 0.2259 0.8840 ( 4989 PWs) bands (ev): -17.0598 -17.0598 -11.1473 -11.1473 -11.0862 -11.0862 -11.0730 -11.0730 -11.0574 -11.0574 -10.1399 -10.1399 -10.1086 -10.1086 -10.0301 -10.0301 -10.0143 -10.0143 -10.0034 -10.0034 -9.9846 -9.9846 -3.7943 -3.7943 -1.8734 -1.8734 -1.7968 -1.7968 2.3499 2.3499 3.5060 3.5060 5.2594 5.2594 5.3459 5.3459 5.6299 5.6299 5.7527 5.7527 5.8345 5.8345 5.9061 5.9061 6.1818 6.1818 6.2635 6.2635 6.2933 6.2933 6.3466 6.3466 7.6648 7.6648 8.5612 8.5612 8.9404 8.9404 9.5131 9.5131 10.1417 10.1417 12.7177 12.7177 13.7990 13.7990 14.0885 14.0885 14.9458 14.9458 15.6653 15.6653 k =-0.1430 0.2386 0.8692 ( 4990 PWs) bands (ev): -17.0601 -17.0601 -11.1473 -11.1473 -11.0861 -11.0861 -11.0731 -11.0731 -11.0575 -11.0575 -10.1398 -10.1398 -10.1086 -10.1086 -10.0303 -10.0303 -10.0144 -10.0144 -10.0033 -10.0033 -9.9846 -9.9846 -3.7936 -3.7936 -1.8743 -1.8743 -1.7949 -1.7949 2.3581 2.3581 3.4825 3.4825 5.2682 5.2682 5.3532 5.3532 5.6269 5.6269 5.7405 5.7405 5.8344 5.8344 5.9100 5.9100 6.1723 6.1723 6.2566 6.2566 6.2966 6.2966 6.3323 6.3323 7.5945 7.5945 8.6377 8.6377 9.0196 9.0196 9.5463 9.5463 10.1957 10.1957 12.7340 12.7340 13.7323 13.7323 14.0302 14.0302 14.8672 14.8672 15.7193 15.7193 k =-0.1506 0.2512 0.8544 ( 4990 PWs) bands (ev): -17.0604 -17.0604 -11.1473 -11.1473 -11.0861 -11.0861 -11.0731 -11.0731 -11.0576 -11.0576 -10.1398 -10.1398 -10.1085 -10.1085 -10.0304 -10.0304 -10.0144 -10.0144 -10.0032 -10.0032 -9.9846 -9.9846 -3.7930 -3.7930 -1.8756 -1.8756 -1.7925 -1.7925 2.3663 2.3663 3.4591 3.4591 5.2773 5.2773 5.3598 5.3598 5.6248 5.6248 5.7283 5.7283 5.8343 5.8343 5.9139 5.9139 6.1626 6.1626 6.2472 6.2472 6.3004 6.3004 6.3203 6.3203 7.5247 7.5247 8.7141 8.7141 9.0975 9.0975 9.5840 9.5840 10.2551 10.2551 12.7544 12.7544 13.6670 13.6670 13.9672 13.9672 14.7913 14.7913 15.7735 15.7735 k =-0.1582 0.2639 0.8396 ( 4982 PWs) bands (ev): -17.0606 -17.0606 -11.1473 -11.1473 -11.0860 -11.0860 -11.0731 -11.0731 -11.0577 -11.0577 -10.1398 -10.1398 -10.1084 -10.1084 -10.0306 -10.0306 -10.0144 -10.0144 -10.0031 -10.0031 -9.9846 -9.9846 -3.7924 -3.7924 -1.8774 -1.8774 -1.7894 -1.7894 2.3745 2.3745 3.4361 3.4361 5.2868 5.2868 5.3660 5.3660 5.6233 5.6233 5.7165 5.7165 5.8342 5.8342 5.9180 5.9180 6.1530 6.1530 6.2363 6.2363 6.3004 6.3004 6.3136 6.3136 7.4557 7.4557 8.7902 8.7902 9.1734 9.1734 9.6258 9.6258 10.3206 10.3206 12.7791 12.7791 13.6038 13.6038 13.8999 13.8999 14.7190 14.7190 15.8022 15.8022 k =-0.1658 0.2766 0.8249 ( 4982 PWs) bands (ev): -17.0609 -17.0609 -11.1472 -11.1472 -11.0859 -11.0859 -11.0731 -11.0731 -11.0577 -11.0577 -10.1397 -10.1397 -10.1083 -10.1083 -10.0307 -10.0307 -10.0145 -10.0145 -10.0031 -10.0031 -9.9845 -9.9845 -3.7917 -3.7917 -1.8796 -1.8796 -1.7860 -1.7860 2.3826 2.3826 3.4135 3.4135 5.2965 5.2965 5.3717 5.3717 5.6218 5.6218 5.7056 5.7056 5.8341 5.8341 5.9222 5.9222 6.1436 6.1436 6.2247 6.2247 6.2925 6.2925 6.3156 6.3156 7.3876 7.3876 8.8655 8.8655 9.2464 9.2464 9.6710 9.6710 10.3928 10.3928 12.8080 12.8080 13.5437 13.5437 13.8291 13.8291 14.6509 14.6509 15.6707 15.6707 k =-0.1734 0.2893 0.8101 ( 4988 PWs) bands (ev): -17.0612 -17.0612 -11.1472 -11.1472 -11.0859 -11.0859 -11.0731 -11.0731 -11.0578 -11.0578 -10.1397 -10.1397 -10.1082 -10.1082 -10.0308 -10.0308 -10.0145 -10.0145 -10.0030 -10.0030 -9.9845 -9.9845 -3.7911 -3.7911 -1.8821 -1.8821 -1.7821 -1.7821 2.3905 2.3905 3.3915 3.3915 5.3061 5.3061 5.3773 5.3773 5.6199 5.6199 5.6959 5.6959 5.8342 5.8342 5.9265 5.9265 6.1346 6.1346 6.2128 6.2128 6.2825 6.2825 6.3197 6.3197 7.3208 7.3208 8.9401 8.9401 9.3158 9.3158 9.7188 9.7188 10.4721 10.4721 12.8413 12.8413 13.4868 13.4868 13.7557 13.7557 14.5878 14.5878 15.5147 15.5147 k =-0.1810 0.3019 0.7953 ( 4990 PWs) bands (ev): -17.0614 -17.0614 -11.1472 -11.1472 -11.0858 -11.0858 -11.0731 -11.0731 -11.0579 -11.0579 -10.1397 -10.1397 -10.1081 -10.1081 -10.0310 -10.0310 -10.0145 -10.0145 -10.0029 -10.0029 -9.9845 -9.9845 -3.7905 -3.7905 -1.8848 -1.8848 -1.7779 -1.7779 2.3983 2.3983 3.3703 3.3703 5.3156 5.3156 5.3831 5.3831 5.6167 5.6167 5.6882 5.6882 5.8345 5.8345 5.9312 5.9312 6.1261 6.1261 6.2010 6.2010 6.2721 6.2721 6.3239 6.3239 7.2556 7.2556 9.0138 9.0138 9.3811 9.3811 9.7684 9.7684 10.5589 10.5589 12.8790 12.8790 13.4334 13.4334 13.6811 13.6811 14.5298 14.5298 15.3538 15.3538 k =-0.1886 0.3146 0.7805 ( 4984 PWs) bands (ev): -17.0617 -17.0617 -11.1472 -11.1472 -11.0857 -11.0857 -11.0731 -11.0731 -11.0580 -11.0580 -10.1396 -10.1396 -10.1080 -10.1080 -10.0311 -10.0311 -10.0146 -10.0146 -10.0028 -10.0028 -9.9845 -9.9845 -3.7899 -3.7899 -1.8877 -1.8877 -1.7735 -1.7735 2.4058 2.4058 3.3499 3.3499 5.3248 5.3248 5.3892 5.3892 5.6118 5.6118 5.6827 5.6827 5.8350 5.8350 5.9364 5.9364 6.1183 6.1183 6.1895 6.1895 6.2617 6.2617 6.3277 6.3277 7.1921 7.1921 9.0865 9.0865 9.4419 9.4419 9.8187 9.8187 10.6535 10.6535 12.9210 12.9210 13.3829 13.3829 13.6071 13.6071 14.4772 14.4772 15.1897 15.1897 k =-0.1961 0.3273 0.7658 ( 4984 PWs) bands (ev): -17.0620 -17.0620 -11.1471 -11.1471 -11.0857 -11.0857 -11.0731 -11.0731 -11.0580 -11.0580 -10.1396 -10.1396 -10.1080 -10.1080 -10.0313 -10.0313 -10.0146 -10.0146 -10.0028 -10.0028 -9.9845 -9.9845 -3.7894 -3.7894 -1.8907 -1.8907 -1.7690 -1.7690 2.4130 2.4130 3.3305 3.3305 5.3336 5.3336 5.3958 5.3958 5.6051 5.6051 5.6793 5.6793 5.8357 5.8357 5.9421 5.9421 6.1113 6.1113 6.1784 6.1784 6.2512 6.2512 6.3310 6.3310 7.1307 7.1307 9.1582 9.1582 9.4979 9.4979 9.8686 9.8686 10.7557 10.7557 12.9673 12.9673 13.3343 13.3343 13.5364 13.5364 14.4299 14.4299 15.0235 15.0235 k =-0.2037 0.3400 0.7510 ( 4986 PWs) bands (ev): -17.0622 -17.0622 -11.1471 -11.1471 -11.0856 -11.0856 -11.0731 -11.0731 -11.0581 -11.0581 -10.1396 -10.1396 -10.1079 -10.1079 -10.0314 -10.0314 -10.0146 -10.0146 -10.0027 -10.0027 -9.9845 -9.9845 -3.7889 -3.7889 -1.8937 -1.8937 -1.7645 -1.7645 2.4198 2.4198 3.3122 3.3122 5.3419 5.3419 5.4030 5.4030 5.5968 5.5968 5.6773 5.6773 5.8364 5.8364 5.9486 5.9486 6.1051 6.1051 6.1680 6.1680 6.2408 6.2408 6.3336 6.3336 7.0715 7.0715 9.2289 9.2289 9.5489 9.5489 9.9170 9.9170 10.8653 10.8653 13.0177 13.0177 13.2857 13.2857 13.4723 13.4723 14.3877 14.3877 14.8558 14.8558 k =-0.2113 0.3526 0.7362 ( 4980 PWs) bands (ev): -17.0625 -17.0625 -11.1471 -11.1471 -11.0856 -11.0856 -11.0731 -11.0731 -11.0582 -11.0582 -10.1396 -10.1396 -10.1078 -10.1078 -10.0316 -10.0316 -10.0147 -10.0147 -10.0027 -10.0027 -9.9845 -9.9845 -3.7884 -3.7884 -1.8967 -1.8967 -1.7600 -1.7600 2.4263 2.4263 3.2950 3.2950 5.3497 5.3497 5.4109 5.4109 5.5876 5.5876 5.6761 5.6761 5.8371 5.8371 5.9558 5.9558 6.0998 6.0998 6.1583 6.1583 6.2305 6.2305 6.3356 6.3356 7.0149 7.0149 9.2985 9.2985 9.5950 9.5950 9.9629 9.9629 10.9819 10.9819 13.0718 13.0718 13.2350 13.2350 13.4188 13.4188 14.3502 14.3502 14.6879 14.6879 k =-0.2189 0.3653 0.7214 ( 4982 PWs) bands (ev): -17.0627 -17.0627 -11.1471 -11.1471 -11.0855 -11.0855 -11.0731 -11.0731 -11.0582 -11.0582 -10.1395 -10.1395 -10.1077 -10.1077 -10.0317 -10.0317 -10.0147 -10.0147 -10.0026 -10.0026 -9.9845 -9.9845 -3.7879 -3.7879 -1.8995 -1.8995 -1.7556 -1.7556 2.4323 2.4323 3.2790 3.2790 5.3570 5.3570 5.4194 5.4194 5.5779 5.5779 5.6751 5.6751 5.8377 5.8377 5.9640 5.9640 6.0953 6.0953 6.1494 6.1494 6.2205 6.2205 6.3368 6.3368 6.9611 6.9611 9.3667 9.3667 9.6363 9.6363 10.0052 10.0052 11.1049 11.1049 13.1258 13.1258 13.1840 13.1840 13.3786 13.3786 14.3156 14.3156 14.5219 14.5219 k =-0.2265 0.3780 0.7066 ( 4980 PWs) bands (ev): -17.0629 -17.0629 -11.1471 -11.1471 -11.0854 -11.0854 -11.0731 -11.0731 -11.0583 -11.0583 -10.1395 -10.1395 -10.1076 -10.1076 -10.0318 -10.0318 -10.0147 -10.0147 -10.0025 -10.0025 -9.9845 -9.9845 -3.7875 -3.7875 -1.9022 -1.9022 -1.7514 -1.7514 2.4378 2.4378 3.2644 3.2644 5.3640 5.3640 5.4283 5.4283 5.5682 5.5682 5.6739 5.6739 5.8381 5.8381 5.9729 5.9729 6.0917 6.0917 6.1415 6.1415 6.2111 6.2111 6.3372 6.3372 6.9105 6.9105 9.4335 9.4335 9.6728 9.6728 10.0429 10.0429 11.2336 11.2336 13.1143 13.1143 13.1984 13.1984 13.3522 13.3522 14.2715 14.2715 14.3714 14.3714 k =-0.2341 0.3907 0.6919 ( 4982 PWs) bands (ev): -17.0631 -17.0631 -11.1471 -11.1471 -11.0854 -11.0854 -11.0731 -11.0731 -11.0584 -11.0584 -10.1395 -10.1395 -10.1076 -10.1076 -10.0319 -10.0319 -10.0147 -10.0147 -10.0025 -10.0025 -9.9845 -9.9845 -3.7872 -3.7872 -1.9048 -1.9048 -1.7475 -1.7475 2.4428 2.4428 3.2511 3.2511 5.3708 5.3708 5.4372 5.4372 5.5586 5.5586 5.6724 5.6724 5.8381 5.8381 5.9824 5.9824 6.0887 6.0887 6.1348 6.1348 6.2024 6.2024 6.3367 6.3367 6.8633 6.8633 9.4983 9.4983 9.7050 9.7050 10.0752 10.0752 11.3673 11.3673 13.0582 13.0582 13.2568 13.2568 13.3400 13.3400 14.1559 14.1559 14.2996 14.2996 k =-0.2417 0.4033 0.6771 ( 4984 PWs) bands (ev): -17.0633 -17.0633 -11.1470 -11.1470 -11.0853 -11.0853 -11.0731 -11.0731 -11.0584 -11.0584 -10.1395 -10.1395 -10.1075 -10.1075 -10.0320 -10.0320 -10.0148 -10.0148 -10.0024 -10.0024 -9.9845 -9.9845 -3.7868 -3.7868 -1.9071 -1.9071 -1.7439 -1.7439 2.4473 2.4473 3.2393 3.2393 5.3773 5.3773 5.4460 5.4460 5.5495 5.5495 5.6704 5.6704 5.8379 5.8379 5.9923 5.9923 6.0860 6.0860 6.1295 6.1295 6.1949 6.1949 6.3352 6.3352 6.8201 6.8201 9.5606 9.5606 9.7329 9.7329 10.1013 10.1013 11.5050 11.5050 13.0026 13.0026 13.2982 13.2982 13.3566 13.3566 14.0001 14.0001 14.2777 14.2777 k =-0.2493 0.4160 0.6623 ( 4978 PWs) bands (ev): -17.0635 -17.0635 -11.1470 -11.1470 -11.0853 -11.0853 -11.0731 -11.0731 -11.0585 -11.0585 -10.1395 -10.1395 -10.1075 -10.1075 -10.0321 -10.0321 -10.0148 -10.0148 -10.0024 -10.0024 -9.9845 -9.9845 -3.7866 -3.7866 -1.9092 -1.9092 -1.7407 -1.7407 2.4513 2.4513 3.2289 3.2289 5.3837 5.3837 5.4542 5.4542 5.5412 5.5412 5.6681 5.6681 5.8373 5.8373 6.0023 6.0023 6.0832 6.0832 6.1257 6.1257 6.1892 6.1892 6.3328 6.3328 6.7812 6.7812 9.6196 9.6196 9.7570 9.7570 10.1211 10.1211 11.6456 11.6456 12.9512 12.9512 13.3071 13.3071 13.4091 13.4091 13.8479 13.8479 14.2678 14.2678 k =-0.2569 0.4287 0.6475 ( 4974 PWs) bands (ev): -17.0636 -17.0636 -11.1470 -11.1470 -11.0853 -11.0853 -11.0731 -11.0731 -11.0585 -11.0585 -10.1394 -10.1394 -10.1074 -10.1074 -10.0322 -10.0322 -10.0148 -10.0148 -10.0024 -10.0024 -9.9845 -9.9845 -3.7863 -3.7863 -1.9109 -1.9109 -1.7379 -1.7379 2.4546 2.4546 3.2201 3.2201 5.3898 5.3898 5.4613 5.4613 5.5338 5.5338 5.6654 5.6654 5.8366 5.8366 6.0120 6.0120 6.0799 6.0799 6.1231 6.1231 6.1857 6.1857 6.3294 6.3294 6.7472 6.7472 9.6741 9.6741 9.7775 9.7775 10.1342 10.1342 11.7877 11.7877 12.9058 12.9058 13.3083 13.3083 13.4518 13.4518 13.7236 13.7236 14.2651 14.2651 k =-0.2645 0.4414 0.6328 ( 4970 PWs) bands (ev): -17.0637 -17.0637 -11.1470 -11.1470 -11.0852 -11.0852 -11.0731 -11.0731 -11.0585 -11.0585 -10.1394 -10.1394 -10.1074 -10.1074 -10.0322 -10.0322 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7861 -3.7861 -1.9124 -1.9124 -1.7355 -1.7355 2.4574 2.4574 3.2128 3.2128 5.3955 5.3955 5.4671 5.4671 5.5279 5.5279 5.6628 5.6628 5.8359 5.8359 6.0210 6.0210 6.0761 6.0761 6.1213 6.1213 6.1846 6.1846 6.3253 6.3253 6.7184 6.7184 9.7223 9.7223 9.7953 9.7953 10.1413 10.1413 11.9288 11.9288 12.8675 12.8675 13.3002 13.3002 13.4276 13.4276 13.6870 13.6870 14.2672 14.2672 k =-0.2721 0.4540 0.6180 ( 4960 PWs) bands (ev): -17.0638 -17.0638 -11.1470 -11.1470 -11.0852 -11.0852 -11.0731 -11.0731 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0323 -10.0323 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7860 -3.7860 -1.9136 -1.9136 -1.7337 -1.7337 2.4595 2.4595 3.2071 3.2071 5.4006 5.4006 5.4712 5.4712 5.5236 5.5236 5.6603 5.6603 5.8351 5.8351 6.0294 6.0294 6.0718 6.0718 6.1198 6.1198 6.1859 6.1859 6.3207 6.3207 6.6954 6.6954 9.7613 9.7613 9.8116 9.8116 10.1434 10.1434 12.0650 12.0650 12.8372 12.8372 13.2473 13.2473 13.3745 13.3745 13.7374 13.7374 14.2672 14.2672 k =-0.2797 0.4667 0.6032 ( 4958 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0731 -11.0731 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0323 -10.0323 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7859 -3.7859 -1.9145 -1.9145 -1.7323 -1.7323 2.4611 2.4611 3.2030 3.2030 5.4047 5.4047 5.4734 5.4734 5.5210 5.5210 5.6582 5.6582 5.8346 5.8346 6.0367 6.0367 6.0672 6.0672 6.1185 6.1185 6.1886 6.1886 6.3163 6.3163 6.6787 6.6787 9.7871 9.7871 9.8283 9.8283 10.1421 10.1421 12.1883 12.1883 12.8156 12.8156 13.1441 13.1441 13.3621 13.3621 13.8153 13.8153 14.2282 14.2282 k =-0.2873 0.4794 0.5884 ( 4960 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0731 -11.0731 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0323 -10.0323 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7858 -3.7858 -1.9150 -1.9150 -1.7315 -1.7315 2.4620 2.4620 3.2006 3.2006 5.4074 5.4074 5.4743 5.4743 5.5197 5.5197 5.6569 5.6569 5.8342 5.8342 6.0425 6.0425 6.0630 6.0630 6.1176 6.1176 6.1911 6.1911 6.3131 6.3131 6.6685 6.6685 9.7996 9.7996 9.8428 9.8428 10.1399 10.1399 12.2823 12.2823 12.8033 12.8033 13.0526 13.0526 13.3616 13.3616 13.8974 13.8974 14.1445 14.1445 k =-0.2949 0.4921 0.5737 ( 4968 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0732 -11.0732 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0324 -10.0324 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7858 -3.7858 -1.9152 -1.9152 -1.7312 -1.7312 2.4624 2.4624 3.1997 3.1997 5.4083 5.4083 5.4744 5.4744 5.5194 5.5194 5.6564 5.6564 5.8340 5.8340 6.0452 6.0452 6.0608 6.0608 6.1173 6.1173 6.1921 6.1921 6.3118 6.3118 6.6650 6.6650 9.8032 9.8032 9.8485 9.8485 10.1389 10.1389 12.3194 12.3194 12.7996 12.7996 13.0151 13.0151 13.3622 13.3622 13.9471 13.9471 14.0920 14.0920 k =-0.2949 0.4921 0.5737 ( 4968 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0732 -11.0732 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0324 -10.0324 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7858 -3.7858 -1.9152 -1.9152 -1.7312 -1.7312 2.4624 2.4624 3.1997 3.1997 5.4083 5.4083 5.4744 5.4744 5.5194 5.5194 5.6564 5.6564 5.8340 5.8340 6.0452 6.0452 6.0608 6.0608 6.1173 6.1173 6.1921 6.1921 6.3118 6.3118 6.6650 6.6650 9.8032 9.8032 9.8485 9.8485 10.1389 10.1389 12.3194 12.3194 12.7996 12.7996 13.0151 13.0151 13.3622 13.3622 13.9471 13.9471 14.0920 14.0920 k =-0.2873 0.4794 0.5589 ( 4966 PWs) bands (ev): -17.0638 -17.0638 -11.1470 -11.1470 -11.0851 -11.0851 -11.0731 -11.0731 -11.0587 -11.0587 -10.1395 -10.1395 -10.1072 -10.1072 -10.0324 -10.0324 -10.0148 -10.0148 -10.0025 -10.0025 -9.9845 -9.9845 -3.7866 -3.7866 -1.9184 -1.9184 -1.7297 -1.7297 2.4601 2.4601 3.2287 3.2287 5.4151 5.4151 5.4804 5.4804 5.5322 5.5322 5.6534 5.6534 5.8466 5.8466 6.0427 6.0427 6.0568 6.0568 6.1160 6.1160 6.1727 6.1727 6.2859 6.2859 6.6710 6.6710 9.7166 9.7166 9.8649 9.8649 10.0645 10.0645 12.2193 12.2193 12.8898 12.8898 12.9876 12.9876 13.4205 13.4205 13.9945 13.9945 14.1596 14.1596 k =-0.2798 0.4668 0.5442 ( 4960 PWs) bands (ev): -17.0637 -17.0637 -11.1471 -11.1471 -11.0851 -11.0851 -11.0730 -11.0730 -11.0587 -11.0587 -10.1395 -10.1395 -10.1071 -10.1071 -10.0324 -10.0324 -10.0147 -10.0147 -10.0027 -10.0027 -9.9845 -9.9845 -3.7873 -3.7873 -1.9210 -1.9210 -1.7282 -1.7282 2.4546 2.4546 3.2574 3.2574 5.4208 5.4208 5.4833 5.4833 5.5467 5.5467 5.6486 5.6486 5.8557 5.8557 6.0367 6.0367 6.0543 6.0543 6.1161 6.1161 6.1533 6.1533 6.2644 6.2644 6.6906 6.6906 9.6302 9.6302 9.8809 9.8809 9.9973 9.9973 12.1173 12.1173 12.9618 12.9618 12.9806 12.9806 13.4810 13.4810 14.0462 14.0462 14.2312 14.2312 k =-0.2722 0.4542 0.5295 ( 4956 PWs) bands (ev): -17.0636 -17.0636 -11.1471 -11.1471 -11.0850 -11.0850 -11.0730 -11.0730 -11.0587 -11.0587 -10.1396 -10.1396 -10.1070 -10.1070 -10.0324 -10.0324 -10.0146 -10.0146 -10.0028 -10.0028 -9.9845 -9.9845 -3.7878 -3.7878 -1.9230 -1.9230 -1.7269 -1.7269 2.4459 2.4459 3.2857 3.2857 5.4249 5.4249 5.4844 5.4844 5.5612 5.5612 5.6421 5.6421 5.8607 5.8607 6.0256 6.0256 6.0534 6.0534 6.1172 6.1172 6.1355 6.1355 6.2533 6.2533 6.7193 6.7193 9.5464 9.5464 9.8776 9.8776 9.9544 9.9544 12.0142 12.0142 12.9403 12.9403 13.0690 13.0690 13.5427 13.5427 14.1015 14.1015 14.3065 14.3065 k =-0.2647 0.4416 0.5148 ( 4968 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0729 -11.0729 -11.0588 -11.0588 -10.1396 -10.1396 -10.1068 -10.1068 -10.0325 -10.0325 -10.0146 -10.0146 -10.0030 -10.0030 -9.9845 -9.9845 -3.7880 -3.7880 -1.9244 -1.9244 -1.7258 -1.7258 2.4338 2.4338 3.3135 3.3135 5.4270 5.4270 5.4847 5.4847 5.5741 5.5741 5.6345 5.6345 5.8612 5.8612 6.0089 6.0089 6.0549 6.0549 6.1187 6.1187 6.1215 6.1215 6.2544 6.2544 6.7540 6.7540 9.4654 9.4654 9.8330 9.8330 9.9581 9.9581 11.9107 11.9107 12.9215 12.9215 13.1554 13.1554 13.6050 13.6050 14.1600 14.1600 14.3853 14.3853 k =-0.2571 0.4290 0.5001 ( 4964 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0729 -11.0729 -11.0588 -11.0588 -10.1397 -10.1397 -10.1067 -10.1067 -10.0325 -10.0325 -10.0145 -10.0145 -10.0032 -10.0032 -9.9845 -9.9845 -3.7881 -3.7881 -1.9251 -1.9251 -1.7248 -1.7248 2.4184 2.4184 3.3405 3.3405 5.4267 5.4267 5.4850 5.4850 5.5828 5.5828 5.6276 5.6276 5.8580 5.8580 5.9889 5.9889 6.0592 6.0592 6.1088 6.1088 6.1232 6.1232 6.2667 6.2667 6.7929 6.7929 9.3876 9.3876 9.7764 9.7764 9.9797 9.9797 11.8071 11.8071 12.9061 12.9061 13.2378 13.2378 13.6671 13.6671 14.2214 14.2214 14.4673 14.4673 k =-0.2495 0.4164 0.4854 ( 4970 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0145 -10.0145 -10.0033 -10.0033 -9.9845 -9.9845 -3.7880 -3.7880 -1.9251 -1.9251 -1.7239 -1.7239 2.3996 2.3996 3.3666 3.3666 5.4239 5.4239 5.4856 5.4856 5.5836 5.5836 5.6242 5.6242 5.8527 5.8527 5.9687 5.9687 6.0662 6.0662 6.0989 6.0989 6.1284 6.1284 6.2878 6.2878 6.8348 6.8348 9.3131 9.3131 9.7213 9.7213 10.0063 10.0063 11.7039 11.7039 12.8942 12.8942 13.3141 13.3141 13.7287 13.7287 14.2854 14.2854 14.5522 14.5522 k =-0.2420 0.4037 0.4707 ( 4974 PWs) bands (ev): -17.0635 -17.0635 -11.1473 -11.1473 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1398 -10.1398 -10.1065 -10.1065 -10.0326 -10.0326 -10.0144 -10.0144 -10.0035 -10.0035 -9.9846 -9.9846 -3.7876 -3.7876 -1.9244 -1.9244 -1.7232 -1.7232 2.3776 2.3776 3.3916 3.3916 5.4188 5.4188 5.4863 5.4863 5.5759 5.5759 5.6242 5.6242 5.8481 5.8481 5.9498 5.9498 6.0754 6.0754 6.0901 6.0901 6.1352 6.1352 6.3158 6.3158 6.8788 6.8788 9.2420 9.2420 9.6702 9.6702 10.0356 10.0356 11.6012 11.6012 12.8858 12.8858 13.3809 13.3809 13.7899 13.7899 14.3517 14.3517 14.6397 14.6397 k =-0.2344 0.3911 0.4560 ( 4962 PWs) bands (ev): -17.0636 -17.0636 -11.1473 -11.1473 -11.0847 -11.0847 -11.0727 -11.0727 -11.0590 -11.0590 -10.1398 -10.1398 -10.1064 -10.1064 -10.0326 -10.0326 -10.0144 -10.0144 -10.0036 -10.0036 -9.9846 -9.9846 -3.7871 -3.7871 -1.9230 -1.9230 -1.7227 -1.7227 2.3524 2.3524 3.4155 3.4155 5.4118 5.4118 5.4865 5.4865 5.5641 5.5641 5.6233 5.6233 5.8468 5.8468 5.9328 5.9328 6.0819 6.0819 6.0868 6.0868 6.1437 6.1437 6.3492 6.3492 6.9242 6.9242 9.1745 9.1745 9.6242 9.6242 10.0672 10.0672 11.4994 11.4994 12.8809 12.8809 13.4342 13.4342 13.8514 13.8514 14.4200 14.4200 14.7293 14.7293 k =-0.2268 0.3785 0.4413 ( 4962 PWs) bands (ev): -17.0637 -17.0637 -11.1473 -11.1473 -11.0846 -11.0846 -11.0727 -11.0727 -11.0590 -11.0590 -10.1398 -10.1398 -10.1062 -10.1062 -10.0327 -10.0327 -10.0143 -10.0143 -10.0037 -10.0037 -9.9846 -9.9846 -3.7863 -3.7863 -1.9210 -1.9210 -1.7224 -1.7224 2.3242 2.3242 3.4381 3.4381 5.4032 5.4032 5.4854 5.4854 5.5515 5.5515 5.6188 5.6188 5.8500 5.8500 5.9175 5.9175 6.0756 6.0756 6.0982 6.0982 6.1537 6.1537 6.3867 6.3867 6.9704 6.9704 9.1107 9.1107 9.5840 9.5840 10.1009 10.1009 11.3985 11.3985 12.8797 12.8797 13.4691 13.4691 13.9148 13.9148 14.4902 14.4902 14.8200 14.8200 k =-0.2193 0.3659 0.4266 ( 4954 PWs) bands (ev): -17.0638 -17.0638 -11.1473 -11.1473 -11.0846 -11.0846 -11.0726 -11.0726 -11.0591 -11.0591 -10.1399 -10.1399 -10.1061 -10.1061 -10.0327 -10.0327 -10.0143 -10.0143 -10.0039 -10.0039 -9.9847 -9.9847 -3.7853 -3.7853 -1.9183 -1.9183 -1.7223 -1.7223 2.2933 2.2933 3.4592 3.4592 5.3936 5.3936 5.4816 5.4816 5.5405 5.5405 5.6105 5.6105 5.8577 5.8577 5.9040 5.9040 6.0704 6.0704 6.1100 6.1100 6.1656 6.1656 6.4276 6.4276 7.0168 7.0168 9.0510 9.0510 9.5500 9.5500 10.1367 10.1367 11.2988 11.2988 12.8819 12.8819 13.4818 13.4818 13.9816 13.9816 14.5620 14.5620 14.9027 14.9027 k =-0.2117 0.3533 0.4119 ( 4958 PWs) bands (ev): -17.0639 -17.0639 -11.1474 -11.1474 -11.0845 -11.0845 -11.0726 -11.0726 -11.0591 -11.0591 -10.1399 -10.1399 -10.1060 -10.1060 -10.0328 -10.0328 -10.0142 -10.0142 -10.0040 -10.0040 -9.9847 -9.9847 -3.7842 -3.7842 -1.9149 -1.9149 -1.7223 -1.7223 2.2598 2.2598 3.4787 3.4787 5.3832 5.3832 5.4740 5.4740 5.5325 5.5325 5.5991 5.5991 5.8678 5.8678 5.8930 5.8930 6.0668 6.0668 6.1213 6.1213 6.1793 6.1793 6.4712 6.4712 7.0630 7.0630 8.9954 8.9954 9.5227 9.5227 10.1746 10.1746 11.2005 11.2005 12.8877 12.8877 13.4709 13.4709 14.0525 14.0525 14.6353 14.6353 14.9481 14.9481 k =-0.2042 0.3407 0.3971 ( 4958 PWs) bands (ev): -17.0641 -17.0641 -11.1474 -11.1474 -11.0845 -11.0845 -11.0725 -11.0725 -11.0592 -11.0592 -10.1399 -10.1399 -10.1058 -10.1058 -10.0328 -10.0328 -10.0142 -10.0142 -10.0041 -10.0041 -9.9847 -9.9847 -3.7828 -3.7828 -1.9108 -1.9108 -1.7224 -1.7224 2.2240 2.2240 3.4966 3.4966 5.3726 5.3726 5.4629 5.4629 5.5278 5.5278 5.5856 5.5856 5.8728 5.8728 5.8912 5.8912 6.0651 6.0651 6.1319 6.1319 6.1950 6.1950 6.5169 6.5169 7.1084 7.1084 8.9443 8.9443 9.5025 9.5025 10.2146 10.2146 11.1035 11.1035 12.8967 12.8967 13.4380 13.4380 14.1268 14.1268 14.7101 14.7101 14.9939 14.9939 k =-0.1966 0.3280 0.3824 ( 4962 PWs) bands (ev): -17.0643 -17.0643 -11.1474 -11.1474 -11.0844 -11.0844 -11.0725 -11.0725 -11.0592 -11.0592 -10.1399 -10.1399 -10.1057 -10.1057 -10.0328 -10.0328 -10.0141 -10.0141 -10.0042 -10.0042 -9.9848 -9.9848 -3.7813 -3.7813 -1.9061 -1.9061 -1.7228 -1.7228 2.1862 2.1862 3.5128 3.5128 5.3618 5.3618 5.4492 5.4492 5.5253 5.5253 5.5708 5.5708 5.8667 5.8667 5.9033 5.9033 6.0656 6.0656 6.1417 6.1417 6.2123 6.2123 6.5640 6.5640 7.1525 7.1525 8.8980 8.8980 9.4899 9.4899 10.2568 10.2568 11.0082 11.0082 12.9091 12.9091 13.3863 13.3863 14.2034 14.2034 14.7861 14.7861 15.0512 15.0512 k =-0.1890 0.3154 0.3677 ( 4964 PWs) bands (ev): -17.0645 -17.0645 -11.1474 -11.1474 -11.0843 -11.0843 -11.0725 -11.0725 -11.0593 -11.0593 -10.1399 -10.1399 -10.1056 -10.1056 -10.0329 -10.0329 -10.0141 -10.0141 -10.0043 -10.0043 -9.9848 -9.9848 -3.7796 -3.7796 -1.9008 -1.9008 -1.7232 -1.7232 2.1467 2.1467 3.5273 3.5273 5.3513 5.3513 5.4341 5.4341 5.5239 5.5239 5.5554 5.5554 5.8592 5.8592 5.9182 5.9182 6.0686 6.0686 6.1508 6.1508 6.2311 6.2311 6.6121 6.6121 7.1949 7.1949 8.8567 8.8567 9.4851 9.4851 10.3011 10.3011 10.9146 10.9146 12.9245 12.9245 13.3200 13.3200 14.2809 14.2809 14.8634 14.8634 15.1192 15.1192 k =-0.1815 0.3028 0.3530 ( 4960 PWs) bands (ev): -17.0647 -17.0647 -11.1474 -11.1474 -11.0843 -11.0843 -11.0724 -11.0724 -11.0593 -11.0593 -10.1400 -10.1400 -10.1054 -10.1054 -10.0330 -10.0330 -10.0141 -10.0141 -10.0044 -10.0044 -9.9849 -9.9849 -3.7778 -3.7778 -1.8949 -1.8949 -1.7238 -1.7238 2.1058 2.1058 3.5400 3.5400 5.3413 5.3413 5.4181 5.4181 5.5223 5.5223 5.5404 5.5404 5.8529 5.8529 5.9331 5.9331 6.0746 6.0746 6.1593 6.1593 6.2510 6.2510 6.6608 6.6608 7.2352 7.2352 8.8208 8.8208 9.4886 9.4886 10.3475 10.3475 10.8228 10.8228 12.9427 12.9427 13.2429 13.2429 14.3580 14.3580 14.9416 14.9416 15.1955 15.1955 k =-0.1739 0.2902 0.3383 ( 4964 PWs) bands (ev): -17.0650 -17.0650 -11.1474 -11.1474 -11.0842 -11.0842 -11.0724 -11.0724 -11.0594 -11.0594 -10.1400 -10.1400 -10.1053 -10.1053 -10.0330 -10.0330 -10.0141 -10.0141 -10.0045 -10.0045 -9.9849 -9.9849 -3.7758 -3.7758 -1.8885 -1.8885 -1.7245 -1.7245 2.0637 2.0637 3.5510 3.5510 5.3319 5.3319 5.4013 5.4013 5.5173 5.5173 5.5289 5.5289 5.8479 5.8479 5.9469 5.9469 6.0835 6.0835 6.1674 6.1674 6.2716 6.2716 6.7092 6.7092 7.2730 7.2730 8.7908 8.7908 9.5004 9.5004 10.3960 10.3960 10.7330 10.7330 12.9634 12.9634 13.1586 13.1586 14.4338 14.4338 15.0204 15.0204 15.2764 15.2764 k =-0.1664 0.2776 0.3236 ( 4960 PWs) bands (ev): -17.0653 -17.0653 -11.1474 -11.1474 -11.0841 -11.0841 -11.0724 -11.0724 -11.0594 -11.0594 -10.1400 -10.1400 -10.1052 -10.1052 -10.0331 -10.0331 -10.0140 -10.0140 -10.0045 -10.0045 -9.9850 -9.9850 -3.7737 -3.7737 -1.8815 -1.8815 -1.7253 -1.7253 2.0209 2.0209 3.5603 3.5603 5.3232 5.3232 5.3840 5.3840 5.5047 5.5047 5.5252 5.5252 5.8445 5.8445 5.9592 5.9592 6.0954 6.0954 6.1751 6.1751 6.2930 6.2930 6.7571 6.7571 7.3080 7.3080 8.7671 8.7671 9.5208 9.5208 10.4465 10.4465 10.6454 10.6454 12.9852 12.9852 13.0708 13.0708 14.5072 14.5072 15.0990 15.0990 15.3104 15.3104 k =-0.1588 0.2650 0.3089 ( 4946 PWs) bands (ev): -17.0655 -17.0655 -11.1474 -11.1474 -11.0841 -11.0841 -11.0724 -11.0724 -11.0595 -11.0595 -10.1400 -10.1400 -10.1051 -10.1051 -10.0331 -10.0331 -10.0140 -10.0140 -10.0046 -10.0046 -9.9851 -9.9851 -3.7716 -3.7716 -1.8741 -1.8741 -1.7261 -1.7261 1.9776 1.9776 3.5680 3.5680 5.3153 5.3153 5.3662 5.3662 5.4902 5.4902 5.5240 5.5240 5.8425 5.8425 5.9700 5.9700 6.1098 6.1098 6.1825 6.1825 6.3149 6.3149 6.8035 6.8035 7.3400 7.3400 8.7501 8.7501 9.5497 9.5497 10.4981 10.4981 10.5609 10.5609 12.9696 12.9696 13.0195 13.0195 14.5774 14.5774 15.1695 15.1695 15.2135 15.2135 k =-0.1512 0.2523 0.2942 ( 4946 PWs) bands (ev): -17.0658 -17.0658 -11.1474 -11.1474 -11.0840 -11.0840 -11.0723 -11.0723 -11.0595 -11.0595 -10.1400 -10.1400 -10.1049 -10.1049 -10.0332 -10.0332 -10.0140 -10.0140 -10.0047 -10.0047 -9.9851 -9.9851 -3.7694 -3.7694 -1.8664 -1.8664 -1.7270 -1.7270 1.9341 1.9341 3.5740 3.5740 5.3082 5.3082 5.3477 5.3477 5.4759 5.4759 5.5229 5.5229 5.8419 5.8419 5.9796 5.9796 6.1261 6.1261 6.1897 6.1897 6.3370 6.3370 6.8480 6.8480 7.3689 7.3689 8.7402 8.7402 9.5872 9.5872 10.4747 10.4747 10.5556 10.5556 12.8803 12.8803 13.0423 13.0423 14.6429 14.6429 15.0637 15.0637 15.2604 15.2604 k =-0.1437 0.2397 0.2795 ( 4950 PWs) bands (ev): -17.0662 -17.0662 -11.1475 -11.1475 -11.0839 -11.0839 -11.0723 -11.0723 -11.0595 -11.0595 -10.1400 -10.1400 -10.1048 -10.1048 -10.0332 -10.0332 -10.0140 -10.0140 -10.0047 -10.0047 -9.9852 -9.9852 -3.7671 -3.7671 -1.8583 -1.8583 -1.7279 -1.7279 1.8906 1.8906 3.5787 3.5787 5.3019 5.3019 5.3287 5.3287 5.4621 5.4621 5.5217 5.5217 5.8426 5.8426 5.9883 5.9883 6.1436 6.1436 6.1968 6.1968 6.3593 6.3593 6.8900 6.8900 7.3947 7.3947 8.7380 8.7380 9.6329 9.6329 10.3947 10.3947 10.6115 10.6115 12.7877 12.7877 13.0694 13.0694 14.6991 14.6991 14.9212 14.9212 15.3371 15.3371 k =-0.1361 0.2271 0.2648 ( 4950 PWs) bands (ev): -17.0665 -17.0665 -11.1475 -11.1475 -11.0839 -11.0839 -11.0723 -11.0723 -11.0596 -11.0596 -10.1400 -10.1400 -10.1047 -10.1047 -10.0333 -10.0333 -10.0140 -10.0140 -10.0048 -10.0048 -9.9852 -9.9852 -3.7648 -3.7648 -1.8499 -1.8499 -1.7288 -1.7288 1.8476 1.8476 3.5820 3.5820 5.2961 5.2961 5.3095 5.3095 5.4492 5.4492 5.5205 5.5205 5.8445 5.8445 5.9965 5.9965 6.1618 6.1618 6.2037 6.2037 6.3817 6.3817 6.9288 6.9288 7.4174 7.4174 8.7436 8.7436 9.6866 9.6866 10.3167 10.3167 10.6696 10.6696 12.6957 12.6957 13.0966 13.0966 14.7048 14.7048 14.8214 14.8214 15.4126 15.4126 k =-0.1285 0.2145 0.2501 ( 4956 PWs) bands (ev): -17.0668 -17.0668 -11.1475 -11.1475 -11.0838 -11.0838 -11.0723 -11.0723 -11.0596 -11.0596 -10.1400 -10.1400 -10.1046 -10.1046 -10.0333 -10.0333 -10.0140 -10.0140 -10.0048 -10.0048 -9.9853 -9.9853 -3.7625 -3.7625 -1.8414 -1.8414 -1.7297 -1.7297 1.8052 1.8052 3.5841 3.5841 5.2869 5.2869 5.2941 5.2941 5.4371 5.4371 5.5192 5.5192 5.8474 5.8474 6.0044 6.0044 6.1799 6.1799 6.2108 6.2108 6.4039 6.4039 6.9641 6.9641 7.4371 7.4371 8.7574 8.7574 9.7478 9.7478 10.2414 10.2414 10.7295 10.7295 12.6055 12.6055 13.1224 13.1224 14.5859 14.5859 14.8427 14.8427 15.4821 15.4821 k =-0.1210 0.2019 0.2353 ( 4952 PWs) bands (ev): -17.0671 -17.0671 -11.1474 -11.1474 -11.0837 -11.0837 -11.0722 -11.0722 -11.0597 -11.0597 -10.1400 -10.1400 -10.1045 -10.1045 -10.0334 -10.0334 -10.0140 -10.0140 -10.0048 -10.0048 -9.9854 -9.9854 -3.7602 -3.7602 -1.8329 -1.8329 -1.7305 -1.7305 1.7637 1.7637 3.5851 3.5851 5.2681 5.2681 5.2889 5.2889 5.4257 5.4257 5.5178 5.5178 5.8513 5.8513 6.0121 6.0121 6.1969 6.1969 6.2188 6.2188 6.4260 6.4260 6.9955 6.9955 7.4542 7.4542 8.7794 8.7794 9.8158 9.8158 10.1692 10.1692 10.7908 10.7908 12.5176 12.5176 13.1446 13.1446 14.4452 14.4452 14.8856 14.8856 15.3856 15.3856 k =-0.1134 0.1893 0.2206 ( 4952 PWs) bands (ev): -17.0674 -17.0674 -11.1474 -11.1474 -11.0837 -11.0837 -11.0722 -11.0722 -11.0597 -11.0597 -10.1400 -10.1400 -10.1044 -10.1044 -10.0334 -10.0334 -10.0140 -10.0140 -10.0049 -10.0049 -9.9854 -9.9854 -3.7579 -3.7579 -1.8243 -1.8243 -1.7312 -1.7312 1.7234 1.7234 3.5852 3.5852 5.2483 5.2483 5.2855 5.2855 5.4150 5.4150 5.5163 5.5163 5.8558 5.8558 6.0197 6.0197 6.2109 6.2109 6.2291 6.2291 6.4478 6.4478 7.0229 7.0229 7.4687 7.4687 8.8095 8.8095 9.8895 9.8895 10.1009 10.1009 10.8533 10.8533 12.4327 12.4327 13.1603 13.1603 14.3103 14.3103 14.9247 14.9247 15.2658 15.2658 k =-0.1059 0.1766 0.2059 ( 4968 PWs) bands (ev): -17.0677 -17.0677 -11.1474 -11.1474 -11.0836 -11.0836 -11.0722 -11.0722 -11.0597 -11.0597 -10.1400 -10.1400 -10.1043 -10.1043 -10.0335 -10.0335 -10.0140 -10.0140 -10.0049 -10.0049 -9.9855 -9.9855 -3.7557 -3.7557 -1.8160 -1.8160 -1.7317 -1.7317 1.6844 1.6844 3.5845 3.5845 5.2286 5.2286 5.2828 5.2828 5.4049 5.4049 5.5148 5.5148 5.8608 5.8608 6.0272 6.0272 6.2204 6.2204 6.2431 6.2431 6.4690 6.4690 7.0460 7.0460 7.4810 7.4810 8.8474 8.8474 9.9632 9.9632 10.0416 10.0416 10.9167 10.9167 12.3509 12.3509 13.1655 13.1655 14.1885 14.1885 14.9535 14.9535 15.1463 15.1463 k =-0.0983 0.1640 0.1912 ( 4972 PWs) bands (ev): -17.0680 -17.0680 -11.1474 -11.1474 -11.0836 -11.0836 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1042 -10.1042 -10.0335 -10.0335 -10.0139 -10.0139 -10.0049 -10.0049 -9.9855 -9.9855 -3.7535 -3.7535 -1.8079 -1.8079 -1.7319 -1.7319 1.6471 1.6471 3.5831 3.5831 5.2093 5.2093 5.2809 5.2809 5.3955 5.3955 5.5135 5.5135 5.8662 5.8662 6.0347 6.0347 6.2272 6.2272 6.2587 6.2587 6.4896 6.4896 7.0653 7.0653 7.4912 7.4912 8.8924 8.8924 9.9603 9.9603 10.0674 10.0674 10.9806 10.9806 12.2726 12.2726 13.1551 13.1551 14.0862 14.0862 14.9564 14.9564 15.0365 15.0365 k =-0.0907 0.1514 0.1765 ( 4968 PWs) bands (ev): -17.0683 -17.0683 -11.1474 -11.1474 -11.0835 -11.0835 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1041 -10.1041 -10.0335 -10.0335 -10.0139 -10.0139 -10.0049 -10.0049 -9.9856 -9.9856 -3.7515 -3.7515 -1.8004 -1.8004 -1.7318 -1.7318 1.6116 1.6116 3.5813 3.5813 5.1906 5.1906 5.2796 5.2796 5.3866 5.3866 5.5122 5.5122 5.8717 5.8717 6.0421 6.0421 6.2328 6.2328 6.2745 6.2745 6.5095 6.5095 7.0809 7.0809 7.4997 7.4997 8.9438 8.9438 9.9049 9.9049 10.1536 10.1536 11.0446 11.0446 12.1979 12.1979 13.1242 13.1242 14.0090 14.0090 14.8847 14.8847 14.9655 14.9655 k =-0.0832 0.1388 0.1618 ( 4964 PWs) bands (ev): -17.0686 -17.0686 -11.1474 -11.1474 -11.0835 -11.0835 -11.0722 -11.0722 -11.0598 -11.0598 -10.1399 -10.1399 -10.1040 -10.1040 -10.0336 -10.0336 -10.0139 -10.0139 -10.0050 -10.0050 -9.9856 -9.9856 -3.7495 -3.7495 -1.7934 -1.7934 -1.7313 -1.7313 1.5781 1.5781 3.5790 3.5790 5.1728 5.1728 5.2789 5.2789 5.3781 5.3781 5.5110 5.5110 5.8774 5.8774 6.0495 6.0495 6.2378 6.2378 6.2897 6.2897 6.5283 6.5283 7.0933 7.0933 7.5066 7.5066 9.0007 9.0007 9.8501 9.8501 10.2465 10.2465 11.1080 11.1080 12.1271 12.1271 13.0704 13.0704 13.9598 13.9598 14.7753 14.7753 14.8784 14.8784 k =-0.0756 0.1262 0.1471 ( 4968 PWs) bands (ev): -17.0689 -17.0689 -11.1474 -11.1474 -11.0834 -11.0834 -11.0722 -11.0722 -11.0599 -11.0599 -10.1399 -10.1399 -10.1039 -10.1039 -10.0336 -10.0336 -10.0139 -10.0139 -10.0050 -10.0050 -9.9857 -9.9857 -3.7476 -3.7476 -1.7872 -1.7872 -1.7303 -1.7303 1.5468 1.5468 3.5765 3.5765 5.1559 5.1559 5.2786 5.2786 5.3701 5.3701 5.5099 5.5099 5.8828 5.8828 6.0565 6.0565 6.2423 6.2423 6.3040 6.3040 6.5458 6.5458 7.1028 7.1028 7.5123 7.5123 9.0617 9.0617 9.7987 9.7987 10.3428 10.3428 11.1700 11.1700 12.0602 12.0602 12.9960 12.9960 13.9368 13.9368 14.6648 14.6648 14.7623 14.7623 k =-0.0681 0.1136 0.1324 ( 4968 PWs) bands (ev): -17.0691 -17.0691 -11.1474 -11.1474 -11.0834 -11.0834 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1038 -10.1038 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9857 -9.9857 -3.7459 -3.7459 -1.7819 -1.7819 -1.7287 -1.7287 1.5180 1.5180 3.5739 3.5739 5.1402 5.1402 5.2788 5.2788 5.3624 5.3624 5.5090 5.5090 5.8881 5.8881 6.0633 6.0633 6.2463 6.2463 6.3172 6.3172 6.5621 6.5621 7.1100 7.1100 7.5168 7.5168 9.1256 9.1256 9.7512 9.7512 10.4411 10.4411 11.2299 11.2299 11.9974 11.9974 12.9067 12.9067 13.9347 13.9347 14.5574 14.5574 14.6380 14.6380 k =-0.0605 0.1009 0.1177 ( 4964 PWs) bands (ev): -17.0694 -17.0694 -11.1474 -11.1474 -11.0834 -11.0834 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1038 -10.1038 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7444 -3.7444 -1.7777 -1.7777 -1.7267 -1.7267 1.4917 1.4917 3.5713 3.5713 5.1258 5.1258 5.2795 5.2795 5.3552 5.3552 5.5083 5.5083 5.8931 5.8931 6.0697 6.0697 6.2500 6.2500 6.3294 6.3294 6.5770 6.5770 7.1153 7.1153 7.5204 7.5204 9.1908 9.1908 9.7081 9.7081 10.5402 10.5402 11.2862 11.2862 11.9390 11.9390 12.8096 12.8096 13.9469 13.9469 14.4535 14.4535 14.5169 14.5169 k =-0.0529 0.0883 0.1030 ( 4960 PWs) bands (ev): -17.0696 -17.0696 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0599 -11.0599 -10.1399 -10.1399 -10.1037 -10.1037 -10.0337 -10.0337 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7430 -3.7430 -1.7743 -1.7743 -1.7241 -1.7241 1.4681 1.4681 3.5687 3.5687 5.1128 5.1128 5.2806 5.2806 5.3484 5.3484 5.5076 5.5076 5.8976 5.8976 6.0756 6.0756 6.2532 6.2532 6.3403 6.3403 6.5903 6.5903 7.1192 7.1192 7.5233 7.5233 9.2554 9.2554 9.6695 9.6695 10.6390 10.6390 11.3372 11.3372 11.8854 11.8854 12.7108 12.7108 13.9678 13.9678 14.3515 14.3515 14.4067 14.4067 k =-0.0454 0.0757 0.0883 ( 4960 PWs) bands (ev): -17.0698 -17.0698 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0139 -10.0139 -10.0050 -10.0050 -9.9858 -9.9858 -3.7417 -3.7417 -1.7719 -1.7719 -1.7214 -1.7214 1.4474 1.4474 3.5663 3.5663 5.1013 5.1013 5.2821 5.2821 5.3420 5.3420 5.5072 5.5072 5.9016 5.9016 6.0810 6.0810 6.2560 6.2560 6.3500 6.3500 6.6018 6.6018 7.1219 7.1219 7.5254 7.5254 9.3176 9.3176 9.6360 9.6360 10.7363 10.7363 11.3805 11.3805 11.8377 11.8377 12.6153 12.6153 13.9927 13.9927 14.2511 14.2511 14.3127 14.3127 k =-0.0378 0.0631 0.0735 ( 4958 PWs) bands (ev): -17.0699 -17.0699 -11.1474 -11.1474 -11.0833 -11.0833 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7407 -3.7407 -1.7701 -1.7701 -1.7186 -1.7186 1.4296 1.4296 3.5641 3.5641 5.0914 5.0914 5.2838 5.2838 5.3361 5.3361 5.5068 5.5068 5.9051 5.9051 6.0857 6.0857 6.2584 6.2584 6.3583 6.3583 6.6117 6.6117 7.1237 7.1237 7.5271 7.5271 9.3749 9.3749 9.6077 9.6077 10.8306 10.8306 11.4128 11.4128 11.7977 11.7977 12.5270 12.5270 14.0167 14.0167 14.1581 14.1581 14.2343 14.2343 k =-0.0302 0.0505 0.0588 ( 4966 PWs) bands (ev): -17.0700 -17.0700 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7398 -3.7398 -1.7689 -1.7689 -1.7160 -1.7160 1.4150 1.4150 3.5622 3.5622 5.0832 5.0832 5.2858 5.2858 5.3306 5.3306 5.5064 5.5064 5.9081 5.9081 6.0896 6.0896 6.2604 6.2604 6.3652 6.3652 6.6195 6.6195 7.1250 7.1250 7.5283 7.5283 9.4250 9.4250 9.5855 9.5855 10.9202 10.9202 11.4301 11.4301 11.7678 11.7678 12.4495 12.4495 14.0260 14.0260 14.0894 14.0894 14.1700 14.1700 k =-0.0227 0.0379 0.0441 ( 4966 PWs) bands (ev): -17.0701 -17.0701 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7391 -3.7391 -1.7681 -1.7681 -1.7138 -1.7138 1.4034 1.4034 3.5607 3.5607 5.0768 5.0768 5.2879 5.2879 5.3258 5.3258 5.5062 5.5062 5.9103 5.9103 6.0928 6.0928 6.2619 6.2619 6.3707 6.3707 6.6258 6.6258 7.1259 7.1259 7.5292 7.5292 9.4646 9.4646 9.5703 9.5703 11.0028 11.0028 11.4299 11.4299 11.7496 11.7496 12.3857 12.3857 13.9851 13.9851 14.0814 14.0814 14.1202 14.1202 k =-0.0151 0.0252 0.0294 ( 4966 PWs) bands (ev): -17.0702 -17.0702 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7386 -3.7386 -1.7676 -1.7676 -1.7121 -1.7121 1.3952 1.3952 3.5596 3.5596 5.0722 5.0722 5.2898 5.2898 5.3220 5.3220 5.5061 5.5061 5.9120 5.9120 6.0950 6.0950 6.2631 6.2631 6.3746 6.3746 6.6302 6.6302 7.1265 7.1265 7.5298 7.5298 9.4902 9.4902 9.5638 9.5638 11.0746 11.0746 11.4145 11.4145 11.7417 11.7417 12.3381 12.3381 13.9375 13.9375 14.0767 14.0767 14.1005 14.1005 k =-0.0076 0.0126 0.0147 ( 4961 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7383 -3.7383 -1.7673 -1.7673 -1.7110 -1.7110 1.3902 1.3902 3.5590 3.5590 5.0694 5.0694 5.2915 5.2915 5.3193 5.3193 5.5060 5.5060 5.9130 5.9130 6.0964 6.0964 6.2637 6.2637 6.3769 6.3769 6.6329 6.6329 7.1268 7.1268 7.5302 7.5302 9.5014 9.5014 9.5648 9.5648 11.1282 11.1282 11.3931 11.3931 11.7398 11.7398 12.3087 12.3087 13.9066 13.9066 14.0566 14.0566 14.1077 14.1077 k = 0.0000 0.0000 0.0000 ( 4959 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7382 -3.7382 -1.7672 -1.7672 -1.7107 -1.7107 1.3885 1.3885 3.5587 3.5587 5.0685 5.0685 5.2921 5.2921 5.3184 5.3184 5.5059 5.5059 5.9133 5.9133 6.0969 6.0969 6.2640 6.2640 6.3777 6.3777 6.6338 6.6338 7.1268 7.1268 7.5303 7.5303 9.5039 9.5039 9.5665 9.5665 11.1494 11.1494 11.3823 11.3823 11.7397 11.7397 12.2988 12.2988 13.8961 13.8961 14.0493 14.0493 14.1108 14.1108 k = 0.0000 0.0000 0.0000 ( 4959 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7382 -3.7382 -1.7672 -1.7672 -1.7107 -1.7107 1.3885 1.3885 3.5587 3.5587 5.0685 5.0685 5.2921 5.2921 5.3184 5.3184 5.5059 5.5059 5.9133 5.9133 6.0969 6.0969 6.2640 6.2640 6.3777 6.3777 6.6338 6.6338 7.1268 7.1268 7.5303 7.5303 9.5039 9.5039 9.5665 9.5665 11.1494 11.1494 11.3823 11.3823 11.7397 11.7397 12.2988 12.2988 13.8961 13.8961 14.0493 14.0493 14.1108 14.1108 k = 0.0179 0.0107 0.0000 ( 4959 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1035 -10.1035 -10.0338 -10.0338 -10.0140 -10.0140 -10.0050 -10.0050 -9.9859 -9.9859 -3.7382 -3.7382 -1.7674 -1.7674 -1.7107 -1.7107 1.3901 1.3901 3.5564 3.5564 5.0692 5.0692 5.2921 5.2921 5.3182 5.3182 5.5058 5.5058 5.9130 5.9130 6.0969 6.0969 6.2637 6.2637 6.3777 6.3777 6.6326 6.6326 7.1086 7.1086 7.5537 7.5537 9.5030 9.5030 9.5662 9.5662 11.1469 11.1469 11.3861 11.3861 11.7431 11.7431 12.3045 12.3045 13.8720 13.8720 14.0491 14.0491 14.1279 14.1279 k = 0.0357 0.0214 0.0000 ( 4951 PWs) bands (ev): -17.0703 -17.0703 -11.1474 -11.1474 -11.0832 -11.0832 -11.0721 -11.0721 -11.0600 -11.0600 -10.1399 -10.1399 -10.1036 -10.1036 -10.0338 -10.0338 -10.0140 -10.0140 -10.0049 -10.0049 -9.9859 -9.9859 -3.7384 -3.7384 -1.7681 -1.7681 -1.7107 -1.7107 1.3949 1.3949 3.5494 3.5494 5.0712 5.0712 5.2921 5.2921 5.3178 5.3178 5.5054 5.5054 5.9122 5.9122 6.0967 6.0967 6.2631 6.2631 6.3776 6.3776 6.6288 6.6288 7.0635 7.0635 7.6145 7.6145 9.5004 9.5004 9.5654 9.5654 11.1398 11.1398 11.3975 11.3975 11.7531 11.7531 12.3215 12.3215 13.8149 13.8149 14.0485 14.0485 14.1645 14.1645 k = 0.0536 0.0321 0.0000 ( 4955 PWs) bands (ev): -17.0703 -17.0703 -11.1473 -11.1473 -11.0833 -11.0833 -11.0722 -11.0722 -11.0599 -11.0599 -10.1398 -10.1398 -10.1037 -10.1037 -10.0338 -10.0338 -10.0140 -10.0140 -10.0048 -10.0048 -9.9859 -9.9859 -3.7386 -3.7386 -1.7692 -1.7692 -1.7106 -1.7106 1.4029 1.4029 3.5379 3.5379 5.0745 5.0745 5.2921 5.2921 5.3170 5.3170 5.5047 5.5047 5.9108 5.9108 6.0964 6.0964 6.2618 6.2618 6.3775 6.3775 6.6220 6.6220 7.0068 7.0068 7.6980 7.6980 9.4961 9.4961 9.5641 9.5641 11.1284 11.1284 11.4163 11.4163 11.7698 11.7698 12.3492 12.3492 13.7428 13.7428 14.0476 14.0476 14.2034 14.2034 k = 0.0714 0.0428 0.0000 ( 4939 PWs) bands (ev): -17.0703 -17.0703 -11.1473 -11.1473 -11.0833 -11.0833 -11.0722 -11.0722 -11.0599 -11.0599 -10.1398 -10.1398 -10.1038 -10.1038 -10.0338 -10.0338 -10.0141 -10.0141 -10.0046 -10.0046 -9.9859 -9.9859 -3.7389 -3.7389 -1.7706 -1.7706 -1.7106 -1.7106 1.4139 1.4139 3.5221 3.5221 5.0789 5.0789 5.2921 5.2921 5.3159 5.3159 5.5037 5.5037 5.9089 5.9089 6.0961 6.0961 6.2600 6.2600 6.3775 6.3775 6.6112 6.6112 6.9485 6.9485 7.7951 7.7951 9.4904 9.4904 9.5624 9.5624 11.1133 11.1133 11.4424 11.4424 11.7928 11.7928 12.3872 12.3872 13.6639 13.6639 14.0464 14.0464 14.2382 14.2382 k = 0.0893 0.0535 0.0000 ( 4947 PWs) bands (ev): -17.0702 -17.0702 -11.1473 -11.1473 -11.0834 -11.0834 -11.0723 -11.0723 -11.0598 -11.0598 -10.1397 -10.1397 -10.1039 -10.1039 -10.0337 -10.0337 -10.0142 -10.0142 -10.0044 -10.0044 -9.9859 -9.9859 -3.7393 -3.7393 -1.7725 -1.7725 -1.7105 -1.7105 1.4280 1.4280 3.5022 3.5022 5.0843 5.0843 5.2921 5.2921 5.3145 5.3145 5.5024 5.5024 5.9062 5.9062 6.0956 6.0956 6.2578 6.2578 6.3773 6.3773 6.5949 6.5949 6.8941 6.8941 7.9017 7.9017 9.4834 9.4834 9.5604 9.5604 11.0954 11.0954 11.4754 11.4754 11.8221 11.8221 12.4346 12.4346 13.5819 13.5819 14.0448 14.0448 14.2668 14.2668 k = 0.1071 0.0642 0.0000 ( 4955 PWs) bands (ev): -17.0702 -17.0702 -11.1472 -11.1472 -11.0835 -11.0835 -11.0724 -11.0724 -11.0598 -11.0598 -10.1397 -10.1397 -10.1041 -10.1041 -10.0337 -10.0337 -10.0143 -10.0143 -10.0042 -10.0042 -9.9858 -9.9858 -3.7397 -3.7397 -1.7747 -1.7747 -1.7105 -1.7105 1.4452 1.4452 3.4785 3.4785 5.0905 5.0905 5.2920 5.2920 5.3128 5.3128 5.5010 5.5010 5.9026 5.9026 6.0949 6.0949 6.2550 6.2550 6.3771 6.3771 6.5718 6.5718 6.8475 6.8475 8.0156 8.0156 9.4755 9.4755 9.5581 9.5581 11.0753 11.0753 11.5148 11.5148 11.8571 11.8571 12.4907 12.4907 13.4989 13.4989 14.0428 14.0428 14.2895 14.2895 k = 0.1250 0.0749 0.0000 ( 4951 PWs) bands (ev): -17.0702 -17.0702 -11.1472 -11.1472 -11.0836 -11.0836 -11.0725 -11.0725 -11.0597 -11.0597 -10.1396 -10.1396 -10.1043 -10.1043 -10.0336 -10.0336 -10.0144 -10.0144 -10.0039 -10.0039 -9.9858 -9.9858 -3.7402 -3.7402 -1.7772 -1.7772 -1.7104 -1.7104 1.4652 1.4652 3.4513 3.4513 5.0972 5.0972 5.2918 5.2918 5.3110 5.3110 5.4994 5.4994 5.8981 5.8981 6.0942 6.0942 6.2519 6.2519 6.3768 6.3768 6.5409 6.5409 6.8105 6.8105 8.1358 8.1358 9.4668 9.4668 9.5558 9.5558 11.0537 11.0537 11.5604 11.5604 11.8978 11.8978 12.5547 12.5547 13.4164 13.4164 14.0406 14.0406 14.3066 14.3066 k = 0.1429 0.0856 0.0000 ( 4935 PWs) bands (ev): -17.0702 -17.0702 -11.1471 -11.1471 -11.0837 -11.0837 -11.0726 -11.0726 -11.0596 -11.0596 -10.1396 -10.1396 -10.1045 -10.1045 -10.0335 -10.0335 -10.0145 -10.0145 -10.0036 -10.0036 -9.9858 -9.9858 -3.7408 -3.7408 -1.7800 -1.7800 -1.7104 -1.7104 1.4879 1.4879 3.4211 3.4211 5.1044 5.1044 5.2916 5.2916 5.3092 5.3092 5.4978 5.4978 5.8925 5.8925 6.0933 6.0933 6.2485 6.2485 6.3765 6.3765 6.5031 6.5031 6.7833 6.7833 8.2617 8.2617 9.4577 9.4577 9.5534 9.5534 11.0313 11.0313 11.6116 11.6116 11.9437 11.9437 12.6260 12.6260 13.3353 13.3353 14.0382 14.0382 14.3189 14.3189 k = 0.1607 0.0963 0.0000 ( 4943 PWs) bands (ev): -17.0702 -17.0702 -11.1471 -11.1471 -11.0838 -11.0838 -11.0727 -11.0727 -11.0595 -11.0595 -10.1395 -10.1395 -10.1048 -10.1048 -10.0335 -10.0335 -10.0146 -10.0146 -10.0033 -10.0033 -9.9857 -9.9857 -3.7414 -3.7414 -1.7830 -1.7830 -1.7103 -1.7103 1.5134 1.5134 3.3880 3.3880 5.1116 5.1116 5.2913 5.2913 5.3071 5.3071 5.4960 5.4960 5.8856 5.8856 6.0924 6.0924 6.2447 6.2447 6.3762 6.3762 6.4604 6.4604 6.7640 6.7640 8.3927 8.3927 9.4484 9.4484 9.5511 9.5511 11.0086 11.0086 11.6680 11.6680 11.9945 11.9945 12.7041 12.7041 13.2564 13.2564 14.0355 14.0355 14.3273 14.3273 k = 0.1786 0.1070 0.0000 ( 4936 PWs) bands (ev): -17.0701 -17.0701 -11.1470 -11.1470 -11.0839 -11.0839 -11.0728 -11.0728 -11.0594 -11.0594 -10.1394 -10.1394 -10.1050 -10.1050 -10.0334 -10.0334 -10.0147 -10.0147 -10.0030 -10.0030 -9.9857 -9.9857 -3.7421 -3.7421 -1.7862 -1.7862 -1.7102 -1.7102 1.5414 1.5414 3.3525 3.3525 5.1188 5.1188 5.2910 5.2910 5.3049 5.3049 5.4942 5.4942 5.8773 5.8773 6.0914 6.0914 6.2406 6.2406 6.3758 6.3758 6.4156 6.4156 6.7504 6.7504 8.5286 8.5286 9.4392 9.4392 9.5491 9.5491 10.9860 10.9860 11.7290 11.7290 12.0497 12.0497 12.7883 12.7883 13.1802 13.1802 14.0327 14.0327 14.3320 14.3320 k = 0.1964 0.1177 0.0000 ( 4936 PWs) bands (ev): -17.0701 -17.0701 -11.1470 -11.1470 -11.0840 -11.0840 -11.0729 -11.0729 -11.0592 -11.0592 -10.1393 -10.1393 -10.1053 -10.1053 -10.0333 -10.0333 -10.0149 -10.0149 -10.0026 -10.0026 -9.9856 -9.9856 -3.7428 -3.7428 -1.7896 -1.7896 -1.7101 -1.7101 1.5717 1.5717 3.3150 3.3150 5.1258 5.1258 5.2904 5.2904 5.3028 5.3028 5.4924 5.4924 5.8672 5.8672 6.0903 6.0903 6.2363 6.2363 6.3710 6.3710 6.3753 6.3753 6.7407 6.7407 8.6690 8.6690 9.4305 9.4305 9.5473 9.5473 10.9637 10.9637 11.7941 11.7941 12.1089 12.1089 12.8784 12.8784 13.1072 13.1072 14.0296 14.0296 14.3336 14.3336 k = 0.2143 0.1284 0.0000 ( 4940 PWs) bands (ev): -17.0701 -17.0701 -11.1469 -11.1469 -11.0842 -11.0842 -11.0730 -11.0730 -11.0591 -11.0591 -10.1392 -10.1392 -10.1056 -10.1056 -10.0332 -10.0332 -10.0150 -10.0150 -10.0023 -10.0023 -9.9856 -9.9856 -3.7436 -3.7436 -1.7931 -1.7931 -1.7100 -1.7100 1.6042 1.6042 3.2757 3.2757 5.1324 5.1324 5.2896 5.2896 5.3008 5.3008 5.4907 5.4907 5.8551 5.8551 6.0892 6.0892 6.2318 6.2318 6.3281 6.3281 6.3748 6.3748 6.7336 6.7336 8.8135 8.8135 9.4226 9.4226 9.5458 9.5458 10.9422 10.9422 11.8627 11.8627 12.1717 12.1717 12.9739 12.9739 13.0377 13.0377 14.0265 14.0265 14.3319 14.3319 k = 0.2321 0.1391 0.0000 ( 4936 PWs) bands (ev): -17.0701 -17.0701 -11.1468 -11.1468 -11.0843 -11.0843 -11.0732 -11.0732 -11.0590 -11.0590 -10.1391 -10.1391 -10.1059 -10.1059 -10.0332 -10.0332 -10.0151 -10.0151 -10.0019 -10.0019 -9.9856 -9.9856 -3.7443 -3.7443 -1.7967 -1.7967 -1.7100 -1.7100 1.6388 1.6388 3.2349 3.2349 5.1385 5.1385 5.2886 5.2886 5.2990 5.2990 5.4891 5.4891 5.8409 5.8409 6.0880 6.0880 6.2272 6.2272 6.2884 6.2884 6.3743 6.3743 6.7283 6.7283 8.9614 8.9614 9.4164 9.4164 9.5447 9.5447 10.9215 10.9215 11.9342 11.9342 12.2375 12.2375 12.9720 12.9720 13.0746 13.0746 14.0234 14.0234 14.3265 14.3265 k = 0.2500 0.1498 0.0000 ( 4940 PWs) bands (ev): -17.0700 -17.0700 -11.1467 -11.1467 -11.0845 -11.0845 -11.0733 -11.0733 -11.0589 -11.0589 -10.1390 -10.1390 -10.1062 -10.1062 -10.0331 -10.0331 -10.0152 -10.0152 -10.0015 -10.0015 -9.9855 -9.9855 -3.7451 -3.7451 -1.8003 -1.8003 -1.7099 -1.7099 1.6751 1.6751 3.1930 3.1930 5.1438 5.1438 5.2872 5.2872 5.2976 5.2976 5.4878 5.4878 5.8245 5.8245 6.0867 6.0867 6.2225 6.2225 6.2523 6.2523 6.3739 6.3739 6.7242 6.7242 9.1106 9.1106 9.4136 9.4136 9.5440 9.5440 10.9018 10.9018 12.0081 12.0081 12.3057 12.3057 12.9102 12.9102 13.1801 13.1801 14.0202 14.0202 14.3161 14.3161 k = 0.2679 0.1605 0.0000 ( 4948 PWs) bands (ev): -17.0700 -17.0700 -11.1467 -11.1467 -11.0846 -11.0846 -11.0734 -11.0734 -11.0588 -11.0588 -10.1389 -10.1389 -10.1065 -10.1065 -10.0330 -10.0330 -10.0154 -10.0154 -10.0012 -10.0012 -9.9855 -9.9855 -3.7459 -3.7459 -1.8038 -1.8038 -1.7098 -1.7098 1.7131 1.7131 3.1502 3.1502 5.1484 5.1484 5.2855 5.2855 5.2965 5.2965 5.4866 5.4866 5.8060 5.8060 6.0854 6.0854 6.2179 6.2179 6.2204 6.2204 6.3734 6.3734 6.7209 6.7209 9.2522 9.2522 9.4231 9.4231 9.5437 9.5437 10.8833 10.8833 12.0836 12.0836 12.3758 12.3758 12.8526 12.8526 13.2904 13.2904 14.0170 14.0170 14.2976 14.2976 k = 0.2857 0.1712 0.0000 ( 4948 PWs) bands (ev): -17.0700 -17.0700 -11.1466 -11.1466 -11.0848 -11.0848 -11.0735 -11.0735 -11.0587 -11.0587 -10.1388 -10.1388 -10.1068 -10.1068 -10.0329 -10.0329 -10.0155 -10.0155 -10.0008 -10.0008 -9.9854 -9.9854 -3.7467 -3.7467 -1.8073 -1.8073 -1.7097 -1.7097 1.7523 1.7523 3.1068 3.1068 5.1521 5.1521 5.2835 5.2835 5.2958 5.2958 5.4859 5.4859 5.7855 5.7855 6.0841 6.0841 6.1928 6.1928 6.2134 6.2134 6.3728 6.3728 6.7183 6.7183 9.3404 9.3404 9.4906 9.4906 9.5438 9.5438 10.8661 10.8661 12.1599 12.1599 12.4470 12.4470 12.7993 12.7993 13.4050 13.4050 14.0140 14.0140 14.2638 14.2638 k = 0.3036 0.1819 0.0000 ( 4948 PWs) bands (ev): -17.0700 -17.0700 -11.1465 -11.1465 -11.0849 -11.0849 -11.0736 -11.0736 -11.0586 -11.0586 -10.1387 -10.1387 -10.1071 -10.1071 -10.0328 -10.0328 -10.0156 -10.0156 -10.0005 -10.0005 -9.9854 -9.9854 -3.7474 -3.7474 -1.8107 -1.8107 -1.7096 -1.7096 1.7927 1.7927 3.0630 3.0630 5.1548 5.1548 5.2815 5.2815 5.2953 5.2953 5.4857 5.4857 5.7637 5.7637 6.0828 6.0828 6.1692 6.1692 6.2090 6.2090 6.3724 6.3724 6.7161 6.7161 9.3586 9.3586 9.5443 9.5443 9.6323 9.6323 10.8501 10.8501 12.2362 12.2362 12.5187 12.5187 12.7504 12.7504 13.5238 13.5238 14.0112 14.0112 14.1996 14.1996 k = 0.3214 0.1926 0.0000 ( 4972 PWs) bands (ev): -17.0699 -17.0699 -11.1464 -11.1464 -11.0850 -11.0850 -11.0738 -11.0738 -11.0585 -11.0585 -10.1386 -10.1386 -10.1073 -10.1073 -10.0327 -10.0327 -10.0157 -10.0157 -10.0002 -10.0002 -9.9854 -9.9854 -3.7481 -3.7481 -1.8139 -1.8139 -1.7095 -1.7095 1.8337 1.8337 3.0192 3.0192 5.1565 5.1565 5.2793 5.2793 5.2949 5.2949 5.4859 5.4859 5.7410 5.7410 6.0815 6.0815 6.1495 6.1495 6.2047 6.2047 6.3719 6.3719 6.7142 6.7142 9.3600 9.3600 9.5450 9.5450 9.7946 9.7946 10.8354 10.8354 12.3112 12.3112 12.5898 12.5898 12.7063 12.7063 13.6466 13.6466 14.0088 14.0088 14.0857 14.0857 k = 0.3393 0.2033 0.0000 ( 4964 PWs) bands (ev): -17.0699 -17.0699 -11.1464 -11.1464 -11.0852 -11.0852 -11.0739 -11.0739 -11.0584 -11.0584 -10.1386 -10.1386 -10.1076 -10.1076 -10.0327 -10.0327 -10.0158 -10.0158 -9.9999 -9.9999 -9.9853 -9.9853 -3.7488 -3.7488 -1.8169 -1.8169 -1.7094 -1.7094 1.8750 1.8750 2.9757 2.9757 5.1575 5.1575 5.2772 5.2772 5.2947 5.2947 5.4867 5.4867 5.7181 5.7181 6.0804 6.0804 6.1333 6.1333 6.2006 6.2006 6.3715 6.3715 6.7128 6.7128 9.3581 9.3581 9.5460 9.5460 9.9636 9.9636 10.8221 10.8221 12.3835 12.3835 12.6595 12.6595 12.6677 12.6677 13.7727 13.7727 13.9236 13.9236 14.0072 14.0072 k = 0.3571 0.2140 0.0000 ( 4960 PWs) bands (ev): -17.0699 -17.0699 -11.1463 -11.1463 -11.0853 -11.0853 -11.0739 -11.0739 -11.0583 -11.0583 -10.1385 -10.1385 -10.1078 -10.1078 -10.0326 -10.0326 -10.0159 -10.0159 -9.9996 -9.9996 -9.9853 -9.9853 -3.7495 -3.7495 -1.8197 -1.8197 -1.7094 -1.7094 1.9163 1.9163 2.9329 2.9329 5.1576 5.1576 5.2753 5.2753 5.2945 5.2945 5.4881 5.4881 5.6956 5.6956 6.0794 6.0794 6.1201 6.1201 6.1968 6.1968 6.3711 6.3711 6.7115 6.7115 9.3556 9.3556 9.5472 9.5472 10.1360 10.1360 10.8102 10.8102 12.4501 12.4501 12.6361 12.6361 12.7269 12.7269 13.7343 13.7343 13.8996 13.8996 14.0089 14.0089 k = 0.3750 0.2247 0.0000 ( 4968 PWs) bands (ev): -17.0699 -17.0699 -11.1462 -11.1462 -11.0854 -11.0854 -11.0740 -11.0740 -11.0582 -11.0582 -10.1384 -10.1384 -10.1080 -10.1080 -10.0325 -10.0325 -10.0160 -10.0160 -9.9993 -9.9993 -9.9853 -9.9853 -3.7500 -3.7500 -1.8222 -1.8222 -1.7093 -1.7093 1.9569 1.9569 2.8911 2.8911 5.1570 5.1570 5.2733 5.2733 5.2944 5.2944 5.4902 5.4902 5.6739 5.6739 6.0784 6.0784 6.1093 6.1093 6.1934 6.1934 6.3707 6.3707 6.7105 6.7105 9.3530 9.3530 9.5485 9.5485 10.3102 10.3102 10.7997 10.7997 12.5031 12.5031 12.6182 12.6182 12.7905 12.7905 13.5348 13.5348 13.9851 13.9851 14.0559 14.0559 k = 0.3929 0.2355 0.0000 ( 4964 PWs) bands (ev): -17.0699 -17.0699 -11.1462 -11.1462 -11.0855 -11.0855 -11.0741 -11.0741 -11.0582 -11.0582 -10.1383 -10.1383 -10.1082 -10.1082 -10.0325 -10.0325 -10.0161 -10.0161 -9.9991 -9.9991 -9.9852 -9.9852 -3.7506 -3.7506 -1.8245 -1.8245 -1.7092 -1.7092 1.9961 1.9961 2.8511 2.8511 5.1559 5.1559 5.2717 5.2717 5.2943 5.2943 5.4929 5.4929 5.6536 5.6536 6.0775 6.0775 6.1006 6.1006 6.1903 6.1903 6.3704 6.3704 6.7096 6.7096 9.3507 9.3507 9.5498 9.5498 10.4846 10.4846 10.7906 10.7906 12.5234 12.5234 12.6312 12.6312 12.8493 12.8493 13.3344 13.3344 13.9925 13.9925 14.1847 14.1847 k = 0.4107 0.2462 0.0000 ( 4972 PWs) bands (ev): -17.0698 -17.0698 -11.1461 -11.1461 -11.0856 -11.0856 -11.0742 -11.0742 -11.0581 -11.0581 -10.1383 -10.1383 -10.1084 -10.1084 -10.0324 -10.0324 -10.0162 -10.0162 -9.9989 -9.9989 -9.9852 -9.9852 -3.7510 -3.7510 -1.8265 -1.8265 -1.7092 -1.7092 2.0331 2.0331 2.8137 2.8137 5.1545 5.1545 5.2701 5.2701 5.2942 5.2942 5.4963 5.4963 5.6349 5.6349 6.0768 6.0768 6.0937 6.0937 6.1875 6.1875 6.3702 6.3702 6.7089 6.7089 9.3487 9.3487 9.5510 9.5510 10.6570 10.6570 10.7829 10.7829 12.5145 12.5145 12.6692 12.6692 12.9020 12.9020 13.1399 13.1399 13.9925 13.9925 14.3245 14.3245 k = 0.4286 0.2569 0.0000 ( 4984 PWs) bands (ev): -17.0698 -17.0698 -11.1461 -11.1461 -11.0856 -11.0856 -11.0742 -11.0742 -11.0580 -11.0580 -10.1382 -10.1382 -10.1085 -10.1085 -10.0324 -10.0324 -10.0162 -10.0162 -9.9988 -9.9988 -9.9852 -9.9852 -3.7514 -3.7514 -1.8281 -1.8281 -1.7091 -1.7091 2.0668 2.0668 2.7798 2.7798 5.1529 5.1529 5.2689 5.2689 5.2941 5.2941 5.5002 5.5002 5.6182 5.6182 6.0760 6.0760 6.0882 6.0882 6.1853 6.1853 6.3699 6.3699 6.7084 6.7084 9.3471 9.3471 9.5521 9.5521 10.7766 10.7766 10.8238 10.8238 12.4978 12.4978 12.7053 12.7053 12.9472 12.9472 12.9608 12.9608 13.9918 13.9918 14.4080 14.4080 k = 0.4464 0.2676 0.0000 ( 4984 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0857 -11.0857 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1086 -10.1086 -10.0323 -10.0323 -10.0163 -10.0163 -9.9986 -9.9986 -9.9852 -9.9852 -3.7517 -3.7517 -1.8294 -1.8294 -1.7091 -1.7091 2.0958 2.0958 2.7507 2.7507 5.1515 5.1515 5.2680 5.2680 5.2941 5.2941 5.5043 5.5043 5.6040 5.6040 6.0755 6.0755 6.0843 6.0843 6.1835 6.1835 6.3697 6.3697 6.7080 6.7080 9.3459 9.3459 9.5531 9.5531 10.7717 10.7717 10.9792 10.9792 12.4786 12.4786 12.7062 12.7062 12.8302 12.8302 12.9840 12.9840 13.9910 13.9910 14.4041 14.4041 k = 0.4643 0.2783 0.0000 ( 4984 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0857 -11.0857 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9986 -9.9986 -9.9852 -9.9852 -3.7519 -3.7519 -1.8303 -1.8303 -1.7091 -1.7091 2.1183 2.1183 2.7281 2.7281 5.1502 5.1502 5.2673 5.2673 5.2940 5.2940 5.5083 5.5083 5.5929 5.5929 6.0752 6.0752 6.0815 6.0815 6.1822 6.1822 6.3696 6.3696 6.7077 6.7077 9.3450 9.3450 9.5538 9.5538 10.7682 10.7682 11.1128 11.1128 12.4533 12.4533 12.6238 12.6238 12.8097 12.8097 13.0110 13.0110 13.9904 13.9904 14.4014 14.4014 k = 0.4821 0.2890 0.0000 ( 4996 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7520 -3.7520 -1.8308 -1.8308 -1.7090 -1.7090 2.1328 2.1328 2.7137 2.7137 5.1494 5.1494 5.2667 5.2667 5.2940 5.2940 5.5112 5.5112 5.5856 5.5856 6.0750 6.0750 6.0800 6.0800 6.1813 6.1813 6.3695 6.3695 6.7074 6.7074 9.3445 9.3445 9.5542 9.5542 10.7661 10.7661 11.2078 11.2078 12.4175 12.4175 12.5588 12.5588 12.8190 12.8190 13.0275 13.0275 13.9900 13.9900 14.3999 14.3999 k = 0.5000 0.2997 0.0000 ( 4988 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7521 -3.7521 -1.8310 -1.8310 -1.7090 -1.7090 2.1378 2.1378 2.7087 2.7087 5.1491 5.1491 5.2666 5.2666 5.2940 5.2940 5.5124 5.5124 5.5830 5.5830 6.0749 6.0749 6.0794 6.0794 6.1811 6.1811 6.3695 6.3695 6.7075 6.7075 9.3444 9.3444 9.5544 9.5544 10.7654 10.7654 11.2431 11.2431 12.3971 12.3971 12.5408 12.5408 12.8233 12.8233 13.0331 13.0331 13.9899 13.9899 14.3995 14.3995 k = 0.5000 0.2997 0.0000 ( 4988 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7521 -3.7521 -1.8310 -1.8310 -1.7090 -1.7090 2.1378 2.1378 2.7087 2.7087 5.1491 5.1491 5.2666 5.2666 5.2940 5.2940 5.5124 5.5124 5.5830 5.5830 6.0749 6.0749 6.0794 6.0794 6.1811 6.1811 6.3695 6.3695 6.7075 6.7075 9.3444 9.3444 9.5544 9.5544 10.7654 10.7654 11.2431 11.2431 12.3971 12.3971 12.5408 12.5408 12.8233 12.8233 13.0331 13.0331 13.9899 13.9899 14.3995 14.3995 k = 0.4924 0.3123 0.0148 ( 4994 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7522 -3.7522 -1.8310 -1.8310 -1.7094 -1.7094 2.1387 2.1387 2.7095 2.7095 5.1498 5.1498 5.2666 5.2666 5.2947 5.2947 5.5127 5.5127 5.5834 5.5834 6.0748 6.0748 6.0796 6.0796 6.1811 6.1811 6.3691 6.3691 6.7061 6.7061 9.3365 9.3365 9.5464 9.5464 10.7774 10.7774 11.2430 11.2430 12.3869 12.3869 12.5478 12.5478 12.8258 12.8258 13.0334 13.0334 13.9864 13.9864 14.3838 14.3838 k = 0.4848 0.3250 0.0296 ( 4980 PWs) bands (ev): -17.0697 -17.0697 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9851 -9.9851 -3.7524 -3.7524 -1.8310 -1.8310 -1.7104 -1.7104 2.1417 2.1417 2.7119 2.7119 5.1520 5.1520 5.2667 5.2667 5.2970 5.2970 5.5136 5.5136 5.5847 5.5847 6.0743 6.0743 6.0800 6.0800 6.1811 6.1811 6.3679 6.3679 6.7021 6.7021 9.3096 9.3096 9.5276 9.5276 10.8113 10.8113 11.2428 11.2428 12.3571 12.3571 12.5687 12.5687 12.8330 12.8330 13.0346 13.0346 13.9763 13.9763 14.3377 14.3377 k = 0.4772 0.3377 0.0443 ( 4978 PWs) bands (ev): -17.0697 -17.0697 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9851 -9.9851 -3.7528 -3.7528 -1.8310 -1.8310 -1.7120 -1.7120 2.1465 2.1465 2.7158 2.7158 5.1555 5.1555 5.2669 5.2669 5.3003 5.3003 5.5150 5.5150 5.5867 5.5867 6.0735 6.0735 6.0807 6.0807 6.1811 6.1811 6.3657 6.3657 6.6956 6.6956 9.2574 9.2574 9.5097 9.5097 10.8620 10.8620 11.2423 11.2423 12.3099 12.3099 12.6027 12.6027 12.8438 12.8438 13.0368 13.0368 13.9604 13.9604 14.2654 14.2654 k = 0.4696 0.3504 0.0591 ( 4976 PWs) bands (ev): -17.0696 -17.0696 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9986 -9.9986 -9.9851 -9.9851 -3.7533 -3.7533 -1.8310 -1.8310 -1.7141 -1.7141 2.1532 2.1532 2.7213 2.7213 5.1604 5.1604 5.2674 5.2674 5.3048 5.3048 5.5171 5.5171 5.5895 5.5895 6.0722 6.0722 6.0820 6.0820 6.1812 6.1812 6.3628 6.3628 6.6866 6.6866 9.1786 9.1786 9.4999 9.4999 10.9240 10.9240 11.2415 11.2415 12.2476 12.2476 12.6489 12.6489 12.8570 12.8570 13.0405 13.0405 13.9400 13.9400 14.1745 14.1745 k = 0.4620 0.3630 0.0739 ( 4980 PWs) bands (ev): -17.0694 -17.0694 -11.1461 -11.1461 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0162 -10.0162 -9.9987 -9.9987 -9.9851 -9.9851 -3.7540 -3.7540 -1.8311 -1.8311 -1.7168 -1.7168 2.1617 2.1617 2.7284 2.7284 5.1666 5.1666 5.2684 5.2684 5.3101 5.3101 5.5199 5.5199 5.5930 5.5930 6.0704 6.0704 6.0836 6.0836 6.1812 6.1812 6.3591 6.3591 6.6752 6.6752 9.0785 9.0785 9.4980 9.4980 10.9919 10.9919 11.2403 11.2403 12.1730 12.1730 12.7056 12.7056 12.8719 12.8719 13.0459 13.0459 13.9162 13.9162 14.0738 14.0738 k = 0.4544 0.3757 0.0887 ( 4978 PWs) bands (ev): -17.0693 -17.0693 -11.1461 -11.1461 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0162 -10.0162 -9.9987 -9.9987 -9.9851 -9.9851 -3.7548 -3.7548 -1.8313 -1.8313 -1.7199 -1.7199 2.1719 2.1719 2.7370 2.7370 5.1740 5.1740 5.2700 5.2700 5.3163 5.3163 5.5234 5.5234 5.5972 5.5972 6.0683 6.0683 6.0858 6.0858 6.1813 6.1813 6.3546 6.3546 6.6614 6.6614 8.9638 8.9638 9.5018 9.5018 11.0614 11.0614 11.2394 11.2394 12.0883 12.0883 12.7706 12.7706 12.8881 12.8881 13.0534 13.0534 13.8886 13.8886 13.9726 13.9726 k = 0.4468 0.3884 0.1034 ( 4978 PWs) bands (ev): -17.0691 -17.0691 -11.1461 -11.1461 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1382 -10.1382 -10.1086 -10.1086 -10.0323 -10.0323 -10.0162 -10.0162 -9.9988 -9.9988 -9.9851 -9.9851 -3.7557 -3.7557 -1.8318 -1.8318 -1.7233 -1.7233 2.1837 2.1837 2.7471 2.7471 5.1827 5.1827 5.2722 5.2722 5.3232 5.3232 5.5277 5.5277 5.6019 5.6019 6.0659 6.0659 6.0883 6.0883 6.1811 6.1811 6.3494 6.3494 6.6457 6.6457 8.8394 8.8394 9.5094 9.5094 11.1260 11.1260 11.2423 11.2423 11.9957 11.9957 12.8405 12.8405 12.9059 12.9059 13.0630 13.0630 13.8432 13.8432 13.8924 13.8924 k = 0.4392 0.4011 0.1182 ( 4974 PWs) bands (ev): -17.0689 -17.0689 -11.1461 -11.1461 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1383 -10.1383 -10.1086 -10.1086 -10.0323 -10.0323 -10.0161 -10.0161 -9.9990 -9.9990 -9.9850 -9.9850 -3.7568 -3.7568 -1.8325 -1.8325 -1.7268 -1.7268 2.1969 2.1969 2.7587 2.7587 5.1924 5.1924 5.2751 5.2751 5.3309 5.3309 5.5329 5.5329 5.6072 5.6072 6.0633 6.0633 6.0914 6.0914 6.1808 6.1808 6.3436 6.3436 6.6280 6.6280 8.7086 8.7086 9.5197 9.5197 11.1692 11.1692 11.2638 11.2638 11.8970 11.8970 12.9051 12.9051 12.9309 12.9309 13.0747 13.0747 13.7624 13.7624 13.8573 13.8573 k = 0.4316 0.4137 0.1330 ( 4962 PWs) bands (ev): -17.0687 -17.0687 -11.1462 -11.1462 -11.0857 -11.0857 -11.0741 -11.0741 -11.0580 -11.0580 -10.1383 -10.1383 -10.1086 -10.1086 -10.0323 -10.0323 -10.0161 -10.0161 -9.9991 -9.9991 -9.9850 -9.9850 -3.7580 -3.7580 -1.8335 -1.8335 -1.7304 -1.7304 2.2115 2.2115 2.7718 2.7718 5.2030 5.2030 5.2788 5.2788 5.3392 5.3392 5.5389 5.5389 5.6130 5.6130 6.0605 6.0605 6.0950 6.0950 6.1803 6.1803 6.3373 6.3373 6.6086 6.6086 8.5739 8.5739 9.5319 9.5319 11.1764 11.1764 11.3169 11.3169 11.7939 11.7939 12.9349 12.9349 12.9872 12.9872 13.0887 13.0887 13.6857 13.6857 13.8351 13.8351 k = 0.4240 0.4264 0.1478 ( 4966 PWs) bands (ev): -17.0685 -17.0685 -11.1462 -11.1462 -11.0857 -11.0857 -11.0741 -11.0741 -11.0581 -11.0581 -10.1384 -10.1384 -10.1085 -10.1085 -10.0323 -10.0323 -10.0160 -10.0160 -9.9992 -9.9992 -9.9850 -9.9850 -3.7593 -3.7593 -1.8350 -1.8350 -1.7338 -1.7338 2.2273 2.2273 2.7863 2.7863 5.2144 5.2144 5.2831 5.2831 5.3480 5.3480 5.5458 5.5458 5.6192 5.6192 6.0574 6.0574 6.0989 6.0989 6.1796 6.1796 6.3305 6.3305 6.5878 6.5878 8.4370 8.4370 9.5456 9.5456 11.1644 11.1644 11.3835 11.3835 11.6882 11.6882 12.9541 12.9541 13.0421 13.0421 13.1046 13.1046 13.6296 13.6296 13.8180 13.8180 k = 0.4164 0.4391 0.1625 ( 4958 PWs) bands (ev): -17.0682 -17.0682 -11.1462 -11.1462 -11.0857 -11.0857 -11.0741 -11.0741 -11.0581 -11.0581 -10.1384 -10.1384 -10.1085 -10.1085 -10.0323 -10.0323 -10.0160 -10.0160 -9.9993 -9.9993 -9.9849 -9.9849 -3.7607 -3.7607 -1.8371 -1.8371 -1.7370 -1.7370 2.2441 2.2441 2.8023 2.8023 5.2266 5.2266 5.2883 5.2883 5.3574 5.3574 5.5537 5.5537 5.6258 5.6258 6.0544 6.0544 6.1032 6.1032 6.1785 6.1785 6.3233 6.3233 6.5656 6.5656 8.2992 8.2992 9.5604 9.5604 11.1423 11.1423 11.4513 11.4513 11.5834 11.5834 12.9720 12.9720 13.0769 13.0769 13.1221 13.1221 13.6041 13.6041 13.8058 13.8058 k = 0.4088 0.4518 0.1773 ( 4970 PWs) bands (ev): -17.0679 -17.0679 -11.1463 -11.1463 -11.0857 -11.0857 -11.0740 -11.0740 -11.0581 -11.0581 -10.1385 -10.1385 -10.1085 -10.1085 -10.0322 -10.0322 -10.0159 -10.0159 -9.9995 -9.9995 -9.9849 -9.9849 -3.7622 -3.7622 -1.8397 -1.8397 -1.7397 -1.7397 2.2616 2.2616 2.8196 2.8196 5.2392 5.2392 5.2942 5.2942 5.3673 5.3673 5.5624 5.5624 5.6327 5.6327 6.0514 6.0514 6.1078 6.1078 6.1769 6.1769 6.3162 6.3162 6.5423 6.5423 8.1614 8.1614 9.5760 9.5760 11.1116 11.1116 11.4574 11.4574 11.5414 11.5414 12.9890 12.9890 13.0862 13.0862 13.1405 13.1405 13.6139 13.6139 13.7988 13.7988 k = 0.4012 0.4644 0.1921 ( 4976 PWs) bands (ev): -17.0676 -17.0676 -11.1463 -11.1463 -11.0856 -11.0856 -11.0740 -11.0740 -11.0581 -11.0581 -10.1385 -10.1385 -10.1084 -10.1084 -10.0322 -10.0322 -10.0159 -10.0159 -9.9997 -9.9997 -9.9849 -9.9849 -3.7638 -3.7638 -1.8431 -1.8431 -1.7420 -1.7420 2.2798 2.2798 2.8382 2.8382 5.2524 5.2524 5.3009 5.3009 5.3776 5.3776 5.5719 5.5719 5.6400 5.6400 6.0484 6.0484 6.1124 6.1124 6.1750 6.1750 6.3091 6.3091 6.5183 6.5183 8.0245 8.0245 9.5922 9.5922 11.0717 11.0717 11.3569 11.3569 11.6082 11.6082 13.0044 13.0044 13.0750 13.0750 13.1596 13.1596 13.6527 13.6527 13.7982 13.7982 k = 0.3937 0.4771 0.2069 ( 4982 PWs) bands (ev): -17.0673 -17.0673 -11.1464 -11.1464 -11.0856 -11.0856 -11.0739 -11.0739 -11.0581 -11.0581 -10.1386 -10.1386 -10.1084 -10.1084 -10.0322 -10.0322 -10.0158 -10.0158 -9.9998 -9.9998 -9.9848 -9.9848 -3.7655 -3.7655 -1.8470 -1.8470 -1.7436 -1.7436 2.2984 2.2984 2.8581 2.8581 5.2659 5.2659 5.3084 5.3084 5.3884 5.3884 5.5821 5.5821 5.6478 5.6478 6.0457 6.0457 6.1168 6.1168 6.1726 6.1726 6.3026 6.3026 6.4936 6.4936 7.8893 7.8893 9.6089 9.6089 11.0213 11.0213 11.2527 11.2527 11.6824 11.6824 13.0166 13.0166 13.0548 13.0548 13.1789 13.1789 13.7066 13.7066 13.8063 13.8063 k = 0.3861 0.4898 0.2217 ( 4974 PWs) bands (ev): -17.0670 -17.0670 -11.1464 -11.1464 -11.0856 -11.0856 -11.0739 -11.0739 -11.0582 -11.0582 -10.1386 -10.1386 -10.1083 -10.1083 -10.0322 -10.0322 -10.0157 -10.0157 -10.0000 -10.0000 -9.9848 -9.9848 -3.7672 -3.7672 -1.8516 -1.8516 -1.7446 -1.7446 2.3171 2.3171 2.8793 2.8793 5.2796 5.2796 5.3168 5.3168 5.3995 5.3995 5.5927 5.5927 5.6563 5.6563 6.0433 6.0433 6.1208 6.1208 6.1696 6.1696 6.2974 6.2974 6.4687 6.4687 7.7563 7.7563 9.6258 9.6258 10.9591 10.9591 11.1524 11.1524 11.7586 11.7586 13.0176 13.0176 13.0411 13.0411 13.1973 13.1973 13.7580 13.7580 13.8295 13.8295 k = 0.3785 0.5025 0.2364 ( 4982 PWs) bands (ev): -17.0667 -17.0667 -11.1465 -11.1465 -11.0856 -11.0856 -11.0738 -11.0738 -11.0582 -11.0582 -10.1387 -10.1387 -10.1082 -10.1082 -10.0322 -10.0322 -10.0157 -10.0157 -10.0002 -10.0002 -9.9848 -9.9848 -3.7689 -3.7689 -1.8567 -1.8567 -1.7451 -1.7451 2.3358 2.3358 2.9016 2.9016 5.2931 5.2931 5.3261 5.3261 5.4107 5.4107 5.6034 5.6034 5.6654 5.6654 6.0412 6.0412 6.1238 6.1238 6.1660 6.1660 6.2936 6.2936 6.4435 6.4435 7.6261 7.6261 9.6429 9.6429 10.8840 10.8840 11.0582 11.0582 11.8366 11.8366 13.0018 13.0018 13.0432 13.0432 13.2133 13.2133 13.7918 13.7918 13.8590 13.8590 k = 0.3709 0.5151 0.2512 ( 4984 PWs) bands (ev): -17.0664 -17.0664 -11.1465 -11.1465 -11.0855 -11.0855 -11.0738 -11.0738 -11.0582 -11.0582 -10.1388 -10.1388 -10.1082 -10.1082 -10.0322 -10.0322 -10.0156 -10.0156 -10.0004 -10.0004 -9.9847 -9.9847 -3.7707 -3.7707 -1.8622 -1.8622 -1.7451 -1.7451 2.3542 2.3542 2.9249 2.9249 5.3064 5.3064 5.3365 5.3365 5.4221 5.4221 5.6138 5.6138 5.6757 5.6757 6.0395 6.0395 6.1253 6.1253 6.1620 6.1620 6.2921 6.2921 6.4184 6.4184 7.4993 7.4993 9.6602 9.6602 10.7970 10.7970 10.9699 10.9699 11.9162 11.9162 12.9842 12.9842 13.0463 13.0463 13.2253 13.2253 13.8139 13.8139 13.8437 13.8437 k = 0.3633 0.5278 0.2660 ( 4980 PWs) bands (ev): -17.0661 -17.0661 -11.1466 -11.1466 -11.0855 -11.0855 -11.0737 -11.0737 -11.0583 -11.0583 -10.1388 -10.1388 -10.1081 -10.1081 -10.0322 -10.0322 -10.0155 -10.0155 -10.0006 -10.0006 -9.9847 -9.9847 -3.7725 -3.7725 -1.8680 -1.8680 -1.7446 -1.7446 2.3719 2.3719 2.9494 2.9494 5.3192 5.3192 5.3480 5.3480 5.4334 5.4334 5.6235 5.6235 5.6874 5.6874 6.0384 6.0384 6.1246 6.1246 6.1577 6.1577 6.2933 6.2933 6.3935 6.3935 7.3765 7.3765 9.6776 9.6776 10.7015 10.7015 10.8855 10.8855 11.9974 11.9974 12.9651 12.9651 13.0488 13.0488 13.2313 13.2313 13.8069 13.8069 13.8513 13.8513 k = 0.3557 0.5405 0.2808 ( 4980 PWs) bands (ev): -17.0658 -17.0658 -11.1466 -11.1466 -11.0855 -11.0855 -11.0736 -11.0736 -11.0583 -11.0583 -10.1389 -10.1389 -10.1080 -10.1080 -10.0322 -10.0322 -10.0154 -10.0154 -10.0007 -10.0007 -9.9847 -9.9847 -3.7743 -3.7743 -1.8739 -1.8739 -1.7437 -1.7437 2.3889 2.3889 2.9747 2.9747 5.3314 5.3314 5.3608 5.3608 5.4446 5.4446 5.6320 5.6320 5.7006 5.7006 6.0379 6.0379 6.1215 6.1215 6.1532 6.1532 6.2973 6.2973 6.3693 6.3693 7.2582 7.2582 9.6951 9.6951 10.6012 10.6012 10.8023 10.8023 12.0802 12.0802 12.9386 12.9386 13.0545 13.0545 13.2298 13.2298 13.7937 13.7937 13.8601 13.8601 k = 0.3481 0.5532 0.2955 ( 4980 PWs) bands (ev): -17.0655 -17.0655 -11.1467 -11.1467 -11.0854 -11.0854 -11.0736 -11.0736 -11.0583 -11.0583 -10.1390 -10.1390 -10.1079 -10.1079 -10.0322 -10.0322 -10.0154 -10.0154 -10.0009 -10.0009 -9.9846 -9.9846 -3.7760 -3.7760 -1.8799 -1.8799 -1.7426 -1.7426 2.4047 2.4047 3.0009 3.0009 5.3428 5.3428 5.3746 5.3746 5.4555 5.4555 5.6392 5.6392 5.7154 5.7154 6.0379 6.0379 6.1159 6.1159 6.1486 6.1486 6.3033 6.3033 6.3463 6.3463 7.1453 7.1453 9.7126 9.7126 10.4988 10.4988 10.7189 10.7189 12.1645 12.1645 12.8995 12.8995 13.0672 13.0672 13.2202 13.2202 13.7933 13.7933 13.8301 13.8301 k = 0.3405 0.5658 0.3103 ( 4976 PWs) bands (ev): -17.0653 -17.0653 -11.1467 -11.1467 -11.0854 -11.0854 -11.0735 -11.0735 -11.0584 -11.0584 -10.1390 -10.1390 -10.1079 -10.1079 -10.0323 -10.0323 -10.0153 -10.0153 -10.0011 -10.0011 -9.9846 -9.9846 -3.7777 -3.7777 -1.8859 -1.8859 -1.7412 -1.7412 2.4192 2.4192 3.0279 3.0279 5.3536 5.3536 5.3894 5.3894 5.4658 5.4658 5.6452 5.6452 5.7315 5.7315 6.0385 6.0385 6.1084 6.1084 6.1439 6.1439 6.3067 6.3067 6.3289 6.3289 7.0388 7.0388 9.7304 9.7304 10.3959 10.3959 10.6349 10.6349 12.2502 12.2502 12.8461 12.8461 13.0878 13.0878 13.2033 13.2033 13.8023 13.8023 13.8179 13.8179 k = 0.3329 0.5785 0.3251 ( 4960 PWs) bands (ev): -17.0650 -17.0650 -11.1468 -11.1468 -11.0854 -11.0854 -11.0735 -11.0735 -11.0584 -11.0584 -10.1391 -10.1391 -10.1078 -10.1078 -10.0323 -10.0323 -10.0152 -10.0152 -10.0013 -10.0013 -9.9846 -9.9846 -3.7793 -3.7793 -1.8917 -1.8917 -1.7396 -1.7396 2.4320 2.4320 3.0556 3.0556 5.3640 5.3640 5.4049 5.4049 5.4755 5.4755 5.6500 5.6500 5.7487 5.7487 6.0397 6.0397 6.0998 6.0998 6.1390 6.1390 6.2932 6.2932 6.3305 6.3305 6.9399 6.9399 9.7483 9.7483 10.2936 10.2936 10.5504 10.5504 12.3368 12.3368 12.7802 12.7802 13.1133 13.1133 13.1829 13.1829 13.8059 13.8059 13.8377 13.8377 k = 0.3253 0.5912 0.3399 ( 4954 PWs) bands (ev): -17.0647 -17.0647 -11.1468 -11.1468 -11.0853 -11.0853 -11.0734 -11.0734 -11.0584 -11.0584 -10.1392 -10.1392 -10.1077 -10.1077 -10.0323 -10.0323 -10.0151 -10.0151 -10.0015 -10.0015 -9.9846 -9.9846 -3.7809 -3.7809 -1.8972 -1.8972 -1.7380 -1.7380 2.4429 2.4429 3.0838 3.0838 5.3739 5.3739 5.4207 5.4207 5.4844 5.4844 5.6537 5.6537 5.7666 5.7666 6.0412 6.0412 6.0907 6.0907 6.1339 6.1339 6.2727 6.2727 6.3390 6.3390 6.8507 6.8507 9.7665 9.7665 10.1926 10.1926 10.4658 10.4658 12.4231 12.4231 12.7051 12.7051 13.1264 13.1264 13.1774 13.1774 13.8168 13.8168 13.8736 13.8736 k = 0.3177 0.6039 0.3546 ( 4956 PWs) bands (ev): -17.0645 -17.0645 -11.1469 -11.1469 -11.0853 -11.0853 -11.0733 -11.0733 -11.0585 -11.0585 -10.1392 -10.1392 -10.1076 -10.1076 -10.0323 -10.0323 -10.0151 -10.0151 -10.0017 -10.0017 -9.9845 -9.9845 -3.7823 -3.7823 -1.9023 -1.9023 -1.7362 -1.7362 2.4517 2.4517 3.1124 3.1124 5.3833 5.3833 5.4365 5.4365 5.4925 5.4925 5.6563 5.6563 5.7845 5.7845 6.0429 6.0429 6.0817 6.0817 6.1288 6.1288 6.2519 6.2519 6.3454 6.3454 6.7744 6.7744 9.7850 9.7850 10.0933 10.0933 10.3817 10.3817 12.5024 12.5024 12.6301 12.6301 13.1058 13.1058 13.2093 13.2093 13.8378 13.8378 13.9186 13.9186 k = 0.3101 0.6165 0.3694 ( 4958 PWs) bands (ev): -17.0643 -17.0643 -11.1469 -11.1469 -11.0852 -11.0852 -11.0733 -11.0733 -11.0585 -11.0585 -10.1393 -10.1393 -10.1075 -10.1075 -10.0323 -10.0323 -10.0150 -10.0150 -10.0019 -10.0019 -9.9845 -9.9845 -3.7836 -3.7836 -1.9071 -1.9071 -1.7345 -1.7345 2.4580 2.4580 3.1414 3.1414 5.3922 5.3922 5.4515 5.4515 5.5004 5.5004 5.6577 5.6577 5.8022 5.8022 6.0445 6.0445 6.0735 6.0735 6.1240 6.1240 6.2315 6.2315 6.3449 6.3449 6.7155 6.7155 9.8038 9.8038 9.9963 9.9963 10.2987 10.2987 12.5017 12.5017 12.6298 12.6298 13.0759 13.0759 13.2550 13.2550 13.8675 13.8675 13.9707 13.9707 k = 0.3025 0.6292 0.3842 ( 4956 PWs) bands (ev): -17.0641 -17.0641 -11.1470 -11.1470 -11.0852 -11.0852 -11.0732 -11.0732 -11.0586 -11.0586 -10.1394 -10.1394 -10.1074 -10.1074 -10.0323 -10.0323 -10.0149 -10.0149 -10.0021 -10.0021 -9.9845 -9.9845 -3.7848 -3.7848 -1.9114 -1.9114 -1.7328 -1.7328 2.4616 2.4616 3.1706 3.1706 5.4006 5.4006 5.4646 5.4646 5.5090 5.5090 5.6578 5.6578 5.8190 5.8190 6.0455 6.0455 6.0664 6.0664 6.1200 6.1200 6.2117 6.2117 6.3336 6.3336 6.6786 6.6786 9.8220 9.8220 9.9025 9.9025 10.2175 10.2175 12.4164 12.4164 12.7104 12.7104 13.0450 13.0450 13.3065 13.3065 13.9043 13.9043 14.0288 14.0288 k = 0.2949 0.6419 0.3990 ( 4968 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0732 -11.0732 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0324 -10.0324 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7858 -3.7858 -1.9152 -1.9152 -1.7312 -1.7312 2.4624 2.4624 3.1997 3.1997 5.4083 5.4083 5.4744 5.4744 5.5194 5.5194 5.6564 5.6564 5.8340 5.8340 6.0452 6.0452 6.0608 6.0608 6.1173 6.1173 6.1921 6.1921 6.3118 6.3118 6.6650 6.6650 9.8032 9.8032 9.8485 9.8485 10.1389 10.1389 12.3194 12.3194 12.7996 12.7996 13.0151 13.0151 13.3622 13.3622 13.9471 13.9471 14.0920 14.0920 k = 0.2949 0.6419 0.3990 ( 4968 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0852 -11.0852 -11.0732 -11.0732 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0324 -10.0324 -10.0148 -10.0148 -10.0023 -10.0023 -9.9845 -9.9845 -3.7858 -3.7858 -1.9152 -1.9152 -1.7312 -1.7312 2.4624 2.4624 3.1997 3.1997 5.4083 5.4083 5.4744 5.4744 5.5194 5.5194 5.6564 5.6564 5.8340 5.8340 6.0452 6.0452 6.0608 6.0608 6.1173 6.1173 6.1921 6.1921 6.3118 6.3118 6.6650 6.6650 9.8032 9.8032 9.8485 9.8485 10.1389 10.1389 12.3194 12.3194 12.7996 12.7996 13.0151 13.0151 13.3622 13.3622 13.9471 13.9471 14.0920 14.0920 k = 0.2765 0.6372 0.4044 ( 4962 PWs) bands (ev): -17.0639 -17.0639 -11.1470 -11.1470 -11.0851 -11.0851 -11.0731 -11.0731 -11.0586 -11.0586 -10.1394 -10.1394 -10.1073 -10.1073 -10.0324 -10.0324 -10.0148 -10.0148 -10.0024 -10.0024 -9.9845 -9.9845 -3.7861 -3.7861 -1.9164 -1.9164 -1.7306 -1.7306 2.4614 2.4614 3.2109 3.2109 5.4111 5.4111 5.4769 5.4769 5.5239 5.5239 5.6555 5.6555 5.8390 5.8390 6.0440 6.0440 6.0584 6.0584 6.1161 6.1161 6.1853 6.1853 6.3020 6.3020 6.6700 6.6700 9.7324 9.7324 9.8554 9.8554 10.1492 10.1492 12.2822 12.2822 12.8288 12.8288 13.0083 13.0083 13.3545 13.3545 13.9435 13.9435 14.1464 14.1464 k = 0.2580 0.6325 0.4099 ( 4968 PWs) bands (ev): -17.0638 -17.0638 -11.1470 -11.1470 -11.0851 -11.0851 -11.0731 -11.0731 -11.0586 -11.0586 -10.1395 -10.1395 -10.1072 -10.1072 -10.0324 -10.0324 -10.0148 -10.0148 -10.0024 -10.0024 -9.9845 -9.9845 -3.7864 -3.7864 -1.9176 -1.9176 -1.7299 -1.7299 2.4592 2.4592 3.2227 3.2227 5.4140 5.4140 5.4783 5.4783 5.5287 5.5287 5.6544 5.6544 5.8437 5.8437 6.0404 6.0404 6.0553 6.0553 6.1140 6.1140 6.1791 6.1791 6.2915 6.2915 6.6867 6.6867 9.6148 9.6148 9.8646 9.8646 10.2069 10.2069 12.2447 12.2447 12.8442 12.8442 13.0136 13.0136 13.3027 13.3027 13.9085 13.9085 14.2524 14.2524 k = 0.2396 0.6278 0.4153 ( 4969 PWs) bands (ev): -17.0638 -17.0638 -11.1471 -11.1471 -11.0851 -11.0851 -11.0731 -11.0731 -11.0587 -11.0587 -10.1395 -10.1395 -10.1071 -10.1071 -10.0324 -10.0324 -10.0147 -10.0147 -10.0025 -10.0025 -9.9845 -9.9845 -3.7867 -3.7867 -1.9187 -1.9187 -1.7293 -1.7293 2.4561 2.4561 3.2348 3.2348 5.4170 5.4170 5.4789 5.4789 5.5337 5.5337 5.6532 5.6532 5.8480 5.8480 6.0333 6.0333 6.0531 6.0531 6.1114 6.1114 6.1736 6.1736 6.2812 6.2812 6.7139 6.7139 9.4823 9.4823 9.8740 9.8740 10.2820 10.2820 12.2080 12.2080 12.8399 12.8399 13.0332 13.0332 13.2316 13.2316 13.8586 13.8586 14.3895 14.3895 k = 0.2212 0.6232 0.4208 ( 4967 PWs) bands (ev): -17.0637 -17.0637 -11.1471 -11.1471 -11.0851 -11.0851 -11.0730 -11.0730 -11.0587 -11.0587 -10.1395 -10.1395 -10.1071 -10.1071 -10.0324 -10.0324 -10.0147 -10.0147 -10.0026 -10.0026 -9.9845 -9.9845 -3.7869 -3.7869 -1.9197 -1.9197 -1.7286 -1.7286 2.4524 2.4524 3.2467 3.2467 5.4201 5.4201 5.4787 5.4787 5.5388 5.5388 5.6519 5.6519 5.8521 5.8521 6.0227 6.0227 6.0518 6.0518 6.1087 6.1087 6.1685 6.1685 6.2716 6.2716 6.7504 6.7504 9.3456 9.3456 9.8835 9.8835 10.3642 10.3642 12.1727 12.1727 12.8161 12.8161 13.0522 13.0522 13.1700 13.1700 13.8040 13.8040 14.5417 14.5417 k = 0.2027 0.6185 0.4263 ( 4976 PWs) bands (ev): -17.0637 -17.0637 -11.1471 -11.1471 -11.0850 -11.0850 -11.0730 -11.0730 -11.0587 -11.0587 -10.1395 -10.1395 -10.1070 -10.1070 -10.0324 -10.0324 -10.0147 -10.0147 -10.0027 -10.0027 -9.9845 -9.9845 -3.7871 -3.7871 -1.9207 -1.9207 -1.7279 -1.7279 2.4483 2.4483 3.2584 3.2584 5.4232 5.4232 5.4779 5.4779 5.5438 5.5438 5.6504 5.6504 5.8559 5.8559 6.0096 6.0096 6.0512 6.0512 6.1063 6.1063 6.1637 6.1637 6.2631 6.2631 6.7949 6.7949 9.2087 9.2087 9.8928 9.8928 10.4496 10.4496 12.1393 12.1393 12.7737 12.7737 13.0288 13.0288 13.1659 13.1659 13.7489 13.7489 14.6986 14.6986 k = 0.1843 0.6138 0.4317 ( 4980 PWs) bands (ev): -17.0637 -17.0637 -11.1471 -11.1471 -11.0850 -11.0850 -11.0730 -11.0730 -11.0587 -11.0587 -10.1396 -10.1396 -10.1070 -10.1070 -10.0324 -10.0324 -10.0146 -10.0146 -10.0028 -10.0028 -9.9845 -9.9845 -3.7873 -3.7873 -1.9215 -1.9215 -1.7272 -1.7272 2.4440 2.4440 3.2695 3.2695 5.4263 5.4263 5.4766 5.4766 5.5487 5.5487 5.6489 5.6489 5.8594 5.8594 5.9952 5.9952 6.0508 6.0508 6.1043 6.1043 6.1589 6.1589 6.2558 6.2558 6.8463 6.8463 9.0733 9.0733 9.9020 9.9020 10.5367 10.5367 12.1082 12.1082 12.7117 12.7117 12.9807 12.9807 13.2064 13.2064 13.6956 13.6956 14.8222 14.8222 k = 0.1659 0.6091 0.4372 ( 4978 PWs) bands (ev): -17.0636 -17.0636 -11.1471 -11.1471 -11.0850 -11.0850 -11.0730 -11.0730 -11.0588 -11.0588 -10.1396 -10.1396 -10.1069 -10.1069 -10.0325 -10.0325 -10.0146 -10.0146 -10.0029 -10.0029 -9.9845 -9.9845 -3.7874 -3.7874 -1.9223 -1.9223 -1.7265 -1.7265 2.4398 2.4398 3.2799 3.2799 5.4294 5.4294 5.4750 5.4750 5.5534 5.5534 5.6474 5.6474 5.8627 5.8627 5.9805 5.9805 6.0507 6.0507 6.1030 6.1030 6.1541 6.1541 6.2497 6.2497 6.9035 6.9035 8.9405 8.9405 9.9108 9.9108 10.6247 10.6247 12.0797 12.0797 12.6325 12.6325 12.9402 12.9402 13.2584 13.2584 13.6454 13.6454 14.8529 14.8529 k = 0.1474 0.6044 0.4426 ( 4982 PWs) bands (ev): -17.0636 -17.0636 -11.1472 -11.1472 -11.0850 -11.0850 -11.0729 -11.0729 -11.0588 -11.0588 -10.1396 -10.1396 -10.1069 -10.1069 -10.0325 -10.0325 -10.0146 -10.0146 -10.0030 -10.0030 -9.9845 -9.9845 -3.7876 -3.7876 -1.9230 -1.9230 -1.7259 -1.7259 2.4356 2.4356 3.2894 3.2894 5.4323 5.4323 5.4732 5.4732 5.5577 5.5577 5.6458 5.6458 5.8657 5.8657 5.9661 5.9661 6.0506 6.0506 6.1021 6.1021 6.1493 6.1493 6.2447 6.2447 6.9657 6.9657 8.8111 8.8111 9.9190 9.9190 10.7127 10.7127 12.0540 12.0540 12.5424 12.5424 12.9098 12.9098 13.3138 13.3138 13.5990 13.5990 14.8697 14.8697 k = 0.1290 0.5997 0.4481 ( 4976 PWs) bands (ev): -17.0636 -17.0636 -11.1472 -11.1472 -11.0849 -11.0849 -11.0729 -11.0729 -11.0588 -11.0588 -10.1396 -10.1396 -10.1068 -10.1068 -10.0325 -10.0325 -10.0145 -10.0145 -10.0031 -10.0031 -9.9845 -9.9845 -3.7877 -3.7877 -1.9237 -1.9237 -1.7253 -1.7253 2.4317 2.4317 3.2979 3.2979 5.4351 5.4351 5.4713 5.4713 5.5617 5.5617 5.6443 5.6443 5.8684 5.8684 5.9527 5.9527 6.0506 6.0506 6.1018 6.1018 6.1445 6.1445 6.2407 6.2407 7.0319 7.0319 8.6859 8.6859 9.9267 9.9267 10.8002 10.8002 12.0310 12.0310 12.4473 12.4473 12.8869 12.8869 13.3697 13.3697 13.5569 13.5569 14.8806 14.8806 k = 0.1106 0.5951 0.4536 ( 4976 PWs) bands (ev): -17.0636 -17.0636 -11.1472 -11.1472 -11.0849 -11.0849 -11.0729 -11.0729 -11.0588 -11.0588 -10.1397 -10.1397 -10.1068 -10.1068 -10.0325 -10.0325 -10.0145 -10.0145 -10.0031 -10.0031 -9.9845 -9.9845 -3.7878 -3.7878 -1.9242 -1.9242 -1.7247 -1.7247 2.4281 2.4281 3.3055 3.3055 5.4376 5.4376 5.4694 5.4694 5.5652 5.5652 5.6427 5.6427 5.8708 5.8708 5.9406 5.9406 6.0505 6.0505 6.1019 6.1019 6.1398 6.1398 6.2375 6.2375 7.1009 7.1009 8.5658 8.5658 9.9336 9.9336 10.8862 10.8862 12.0108 12.0108 12.3517 12.3517 12.8690 12.8690 13.4241 13.4241 13.5198 13.5198 14.8864 14.8864 k = 0.0922 0.5904 0.4590 ( 4978 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1067 -10.1067 -10.0325 -10.0325 -10.0145 -10.0145 -10.0032 -10.0032 -9.9845 -9.9845 -3.7879 -3.7879 -1.9247 -1.9247 -1.7242 -1.7242 2.4250 2.4250 3.3119 3.3119 5.4398 5.4398 5.4677 5.4677 5.5683 5.5683 5.6413 5.6413 5.8728 5.8728 5.9302 5.9302 6.0505 6.0505 6.1024 6.1024 6.1353 6.1353 6.2349 6.2349 7.1715 7.1715 8.4523 8.4523 9.9396 9.9396 10.9697 10.9697 11.9932 11.9932 12.2589 12.2589 12.8549 12.8549 13.4729 13.4729 13.4900 13.4900 14.8876 14.8876 k = 0.0737 0.5857 0.4645 ( 4985 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1067 -10.1067 -10.0325 -10.0325 -10.0144 -10.0144 -10.0033 -10.0033 -9.9845 -9.9845 -3.7879 -3.7879 -1.9251 -1.9251 -1.7238 -1.7238 2.4223 2.4223 3.3172 3.3172 5.4416 5.4416 5.4661 5.4661 5.5708 5.5708 5.6400 5.6400 5.8744 5.8744 5.9216 5.9216 6.0503 6.0503 6.1034 6.1034 6.1309 6.1309 6.2330 6.2330 7.2415 7.2415 8.3472 8.3472 9.9447 9.9447 11.0487 11.0487 11.9780 11.9780 12.1723 12.1723 12.8439 12.8439 13.4599 13.4599 13.5224 13.5224 14.8851 14.8851 k = 0.0553 0.5810 0.4699 ( 4984 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1067 -10.1067 -10.0325 -10.0325 -10.0144 -10.0144 -10.0033 -10.0033 -9.9845 -9.9845 -3.7880 -3.7880 -1.9254 -1.9254 -1.7235 -1.7235 2.4202 2.4202 3.3213 3.3213 5.4431 5.4431 5.4648 5.4648 5.5728 5.5728 5.6390 5.6390 5.8756 5.8756 5.9150 5.9150 6.0503 6.0503 6.1047 6.1047 6.1270 6.1270 6.2315 6.2315 7.3077 7.3077 8.2537 8.2537 9.9487 9.9487 11.1202 11.1202 11.9641 11.9641 12.0963 12.0963 12.8355 12.8355 13.4392 13.4392 13.5608 13.5608 14.8804 14.8804 k = 0.0369 0.5763 0.4754 ( 4980 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0033 -10.0033 -9.9845 -9.9845 -3.7880 -3.7880 -1.9256 -1.9256 -1.7232 -1.7232 2.4187 2.4187 3.3243 3.3243 5.4442 5.4442 5.4638 5.4638 5.5743 5.5743 5.6382 5.6382 5.8764 5.8764 5.9104 5.9104 6.0502 6.0502 6.1062 6.1062 6.1237 6.1237 6.2305 6.2305 7.3650 7.3650 8.1770 8.1770 9.9517 9.9517 11.1797 11.1797 11.9498 11.9498 12.0380 12.0380 12.8297 12.8297 13.4241 13.4241 13.5902 13.5902 14.8751 14.8751 k = 0.0184 0.5716 0.4809 ( 4988 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0033 -10.0033 -9.9845 -9.9845 -3.7880 -3.7880 -1.9257 -1.9257 -1.7231 -1.7231 2.4178 2.4178 3.3260 3.3260 5.4448 5.4448 5.4632 5.4632 5.5752 5.5752 5.6377 5.6377 5.8768 5.8768 5.9076 5.9076 6.0501 6.0501 6.1075 6.1075 6.1212 6.1212 6.2299 6.2299 7.4054 7.4054 8.1250 8.1250 9.9534 9.9534 11.2202 11.2202 11.9342 11.9342 12.0050 12.0050 12.8262 12.8262 13.4150 13.4150 13.6087 13.6087 14.8711 14.8711 k = 0.0000 0.5670 0.4863 ( 4992 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7880 -3.7880 -1.9257 -1.9257 -1.7231 -1.7231 2.4175 2.4175 3.3266 3.3266 5.4450 5.4450 5.4630 5.4630 5.5755 5.5755 5.6375 5.6375 5.8769 5.8769 5.9067 5.9067 6.0501 6.0501 6.1081 6.1081 6.1202 6.1202 6.2297 6.2297 7.4203 7.4203 8.1062 8.1062 9.9540 9.9540 11.2348 11.2348 11.9263 11.9263 11.9955 11.9955 12.8251 12.8251 13.4120 13.4120 13.6151 13.6151 14.8696 14.8696 k = 0.0000 0.5670 0.4863 ( 4992 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7880 -3.7880 -1.9257 -1.9257 -1.7231 -1.7231 2.4175 2.4175 3.3266 3.3266 5.4450 5.4450 5.4630 5.4630 5.5755 5.5755 5.6375 5.6375 5.8769 5.8769 5.9067 5.9067 6.0501 6.0501 6.1081 6.1081 6.1202 6.1202 6.2297 6.2297 7.4203 7.4203 8.1062 8.1062 9.9540 9.9540 11.2348 11.2348 11.9263 11.9263 11.9955 11.9955 12.8251 12.8251 13.4120 13.4120 13.6151 13.6151 14.8696 14.8696 k = 0.0076 0.5543 0.5011 ( 4988 PWs) bands (ev): -17.0635 -17.0635 -11.1472 -11.1472 -11.0848 -11.0848 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7880 -3.7880 -1.9256 -1.9256 -1.7233 -1.7233 2.4172 2.4172 3.3275 3.3275 5.4416 5.4416 5.4663 5.4663 5.5735 5.5735 5.6386 5.6386 5.8755 5.8755 5.9080 5.9080 6.0497 6.0497 6.1066 6.1066 6.1238 6.1238 6.2306 6.2306 7.4203 7.4203 8.1076 8.1076 9.9520 9.9520 11.2268 11.2268 11.9196 11.9196 11.9643 11.9643 12.8670 12.8670 13.4196 13.4196 13.6190 13.6190 14.8708 14.8708 k = 0.0152 0.5417 0.5158 ( 4982 PWs) bands (ev): -17.0634 -17.0634 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1066 -10.1066 -10.0325 -10.0325 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7881 -3.7881 -1.9251 -1.9251 -1.7241 -1.7241 2.4162 2.4162 3.3303 3.3303 5.4345 5.4345 5.4727 5.4727 5.5681 5.5681 5.6415 5.6415 5.8717 5.8717 5.9112 5.9112 6.0485 6.0485 6.1049 6.1049 6.1319 6.1319 6.2332 6.2332 7.4204 7.4204 8.1119 8.1119 9.9459 9.9459 11.2032 11.2032 11.8437 11.8437 11.9437 11.9437 12.9752 12.9752 13.4418 13.4418 13.6311 13.6311 14.8743 14.8743 k = 0.0227 0.5290 0.5305 ( 4988 PWs) bands (ev): -17.0634 -17.0634 -11.1472 -11.1472 -11.0849 -11.0849 -11.0728 -11.0728 -11.0589 -11.0589 -10.1397 -10.1397 -10.1067 -10.1067 -10.0325 -10.0325 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7882 -3.7882 -1.9242 -1.9242 -1.7254 -1.7254 2.4147 2.4147 3.3348 3.3348 5.4263 5.4263 5.4793 5.4793 5.5607 5.5607 5.6450 5.6450 5.8667 5.8667 5.9153 5.9153 6.0470 6.0470 6.1044 6.1044 6.1423 6.1423 6.2373 6.2373 7.4207 7.4207 8.1190 8.1190 9.9358 9.9358 11.1648 11.1648 11.7135 11.7135 11.9475 11.9475 13.1210 13.1210 13.4765 13.4765 13.6523 13.6523 14.8802 14.8802 k = 0.0303 0.5164 0.5453 ( 4982 PWs) bands (ev): -17.0633 -17.0633 -11.1473 -11.1473 -11.0849 -11.0849 -11.0728 -11.0728 -11.0588 -11.0588 -10.1397 -10.1397 -10.1067 -10.1067 -10.0324 -10.0324 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7883 -3.7883 -1.9231 -1.9231 -1.7272 -1.7272 2.4126 2.4126 3.3410 3.3410 5.4178 5.4178 5.4848 5.4848 5.5529 5.5529 5.6484 5.6484 5.8612 5.8612 5.9196 5.9196 6.0457 6.0457 6.1056 6.1056 6.1544 6.1544 6.2428 6.2428 7.4211 7.4211 8.1289 8.1289 9.9217 9.9217 11.1132 11.1132 11.5666 11.5666 11.9559 11.9559 13.2864 13.2864 13.5204 13.5204 13.6845 13.6845 14.8884 14.8884 k = 0.0379 0.5038 0.5600 ( 4984 PWs) bands (ev): -17.0632 -17.0632 -11.1473 -11.1473 -11.0849 -11.0849 -11.0728 -11.0728 -11.0588 -11.0588 -10.1398 -10.1398 -10.1067 -10.1067 -10.0324 -10.0324 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7885 -3.7885 -1.9216 -1.9216 -1.7294 -1.7294 2.4098 2.4098 3.3490 3.3490 5.4090 5.4090 5.4877 5.4877 5.5466 5.5466 5.6512 5.6512 5.8555 5.8555 5.9238 5.9238 6.0450 6.0450 6.1083 6.1083 6.1678 6.1678 6.2493 6.2493 7.4219 7.4219 8.1414 8.1414 9.9037 9.9037 11.0496 11.0496 11.4141 11.4141 11.9671 11.9671 13.4603 13.4603 13.5707 13.5707 13.7304 13.7304 14.8989 14.8989 k = 0.0455 0.4911 0.5747 ( 4982 PWs) bands (ev): -17.0630 -17.0630 -11.1473 -11.1473 -11.0850 -11.0850 -11.0728 -11.0728 -11.0587 -11.0587 -10.1398 -10.1398 -10.1068 -10.1068 -10.0323 -10.0323 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7887 -3.7887 -1.9199 -1.9199 -1.7321 -1.7321 2.4065 2.4065 3.3587 3.3587 5.4002 5.4002 5.4862 5.4862 5.5440 5.5440 5.6531 5.6531 5.8501 5.8501 5.9275 5.9275 6.0454 6.0454 6.1124 6.1124 6.1823 6.1823 6.2565 6.2565 7.4232 7.4232 8.1565 8.1565 9.8820 9.8820 10.9750 10.9750 11.2618 11.2618 11.9808 11.9808 13.6001 13.6001 13.6603 13.6603 13.7925 13.7925 14.9116 14.9116 k = 0.0530 0.4785 0.5895 ( 4986 PWs) bands (ev): -17.0629 -17.0629 -11.1473 -11.1473 -11.0850 -11.0850 -11.0728 -11.0728 -11.0587 -11.0587 -10.1398 -10.1398 -10.1069 -10.1069 -10.0322 -10.0322 -10.0143 -10.0143 -10.0035 -10.0035 -9.9845 -9.9845 -3.7889 -3.7889 -1.9179 -1.9179 -1.7352 -1.7352 2.4027 2.4027 3.3699 3.3699 5.3911 5.3911 5.4796 5.4796 5.5461 5.5461 5.6541 5.6541 5.8449 5.8449 5.9308 5.9308 6.0470 6.0470 6.1176 6.1176 6.1974 6.1974 6.2642 6.2642 7.4252 7.4252 8.1741 8.1741 9.8565 9.8565 10.8895 10.8895 11.1139 11.1139 11.9967 11.9967 13.6546 13.6546 13.8296 13.8296 13.8769 13.8769 14.9267 14.9267 k = 0.0606 0.4658 0.6042 ( 4990 PWs) bands (ev): -17.0627 -17.0627 -11.1473 -11.1473 -11.0851 -11.0851 -11.0728 -11.0728 -11.0586 -11.0586 -10.1398 -10.1398 -10.1069 -10.1069 -10.0321 -10.0321 -10.0143 -10.0143 -10.0035 -10.0035 -9.9845 -9.9845 -3.7892 -3.7892 -1.9156 -1.9156 -1.7387 -1.7387 2.3983 2.3983 3.3827 3.3827 5.3820 5.3820 5.4691 5.4691 5.5517 5.5517 5.6543 5.6543 5.8402 5.8402 5.9336 5.9336 6.0500 6.0500 6.1239 6.1239 6.2131 6.2131 6.2722 6.2722 7.4280 7.4280 8.1937 8.1937 9.8274 9.8274 10.7917 10.7917 10.9754 10.9754 12.0144 12.0144 13.7008 13.7008 13.9477 13.9477 14.0330 14.0330 14.9440 14.9440 k = 0.0682 0.4532 0.6189 ( 4986 PWs) bands (ev): -17.0625 -17.0625 -11.1473 -11.1473 -11.0851 -11.0851 -11.0728 -11.0728 -11.0585 -11.0585 -10.1398 -10.1398 -10.1070 -10.1070 -10.0320 -10.0320 -10.0143 -10.0143 -10.0035 -10.0035 -9.9845 -9.9845 -3.7895 -3.7895 -1.9132 -1.9132 -1.7424 -1.7424 2.3934 2.3934 3.3969 3.3969 5.3728 5.3728 5.4566 5.4566 5.5594 5.5594 5.6538 5.6538 5.8359 5.8359 5.9358 5.9358 6.0544 6.0544 6.1311 6.1311 6.2291 6.2291 6.2803 6.2803 7.4318 7.4318 8.2154 8.2154 9.7947 9.7947 10.6796 10.6796 10.8506 10.8506 12.0338 12.0338 13.7463 13.7463 14.0478 14.0478 14.2154 14.2154 14.9637 14.9637 k = 0.0758 0.4406 0.6337 ( 4986 PWs) bands (ev): -17.0623 -17.0623 -11.1473 -11.1473 -11.0852 -11.0852 -11.0728 -11.0728 -11.0585 -11.0585 -10.1398 -10.1398 -10.1071 -10.1071 -10.0318 -10.0318 -10.0143 -10.0143 -10.0035 -10.0035 -9.9845 -9.9845 -3.7899 -3.7899 -1.9105 -1.9105 -1.7464 -1.7464 2.3881 2.3881 3.4124 3.4124 5.3634 5.3634 5.4429 5.4429 5.5684 5.5684 5.6529 5.6529 5.8322 5.8322 5.9376 5.9376 6.0602 6.0602 6.1392 6.1392 6.2447 6.2447 6.2887 6.2887 7.4369 7.4369 8.2386 8.2386 9.7586 9.7586 10.5553 10.5553 10.7398 10.7398 12.0546 12.0546 13.7927 13.7927 14.1531 14.1531 14.3945 14.3945 14.9857 14.9857 k = 0.0833 0.4279 0.6484 ( 4986 PWs) bands (ev): -17.0621 -17.0621 -11.1473 -11.1473 -11.0852 -11.0852 -11.0729 -11.0729 -11.0584 -11.0584 -10.1399 -10.1399 -10.1072 -10.1072 -10.0317 -10.0317 -10.0143 -10.0143 -10.0036 -10.0036 -9.9845 -9.9845 -3.7903 -3.7903 -1.9077 -1.9077 -1.7506 -1.7506 2.3823 2.3823 3.4291 3.4291 5.3539 5.3539 5.4286 5.4286 5.5781 5.5781 5.6518 5.6518 5.8291 5.8291 5.9389 5.9389 6.0672 6.0672 6.1478 6.1478 6.2596 6.2596 6.2974 6.2974 7.4434 7.4434 8.2629 8.2629 9.7191 9.7191 10.4249 10.4249 10.6389 10.6389 12.0762 12.0762 13.8403 13.8403 14.2635 14.2635 14.5613 14.5613 15.0104 15.0104 k = 0.0909 0.4153 0.6632 ( 4988 PWs) bands (ev): -17.0618 -17.0618 -11.1473 -11.1473 -11.0853 -11.0853 -11.0729 -11.0729 -11.0583 -11.0583 -10.1399 -10.1399 -10.1073 -10.1073 -10.0315 -10.0315 -10.0143 -10.0143 -10.0036 -10.0036 -9.9845 -9.9845 -3.7907 -3.7907 -1.9049 -1.9049 -1.7549 -1.7549 2.3761 2.3761 3.4470 3.4470 5.3443 5.3443 5.4140 5.4140 5.5884 5.5884 5.6507 5.6507 5.8265 5.8265 5.9398 5.9398 6.0753 6.0753 6.1569 6.1569 6.2730 6.2730 6.3071 6.3071 7.4515 7.4515 8.2878 8.2878 9.6761 9.6761 10.2941 10.2941 10.5441 10.5441 12.0983 12.0983 13.8894 13.8894 14.3780 14.3780 14.7003 14.7003 15.0370 15.0370 k = 0.0985 0.4026 0.6779 ( 4986 PWs) bands (ev): -17.0616 -17.0616 -11.1474 -11.1474 -11.0854 -11.0854 -11.0729 -11.0729 -11.0582 -11.0582 -10.1399 -10.1399 -10.1074 -10.1074 -10.0314 -10.0314 -10.0143 -10.0143 -10.0037 -10.0037 -9.9845 -9.9845 -3.7911 -3.7911 -1.9019 -1.9019 -1.7593 -1.7593 2.3696 2.3696 3.4657 3.4657 5.3346 5.3346 5.3993 5.3993 5.5991 5.5991 5.6500 5.6500 5.8244 5.8244 5.9403 5.9403 6.0843 6.0843 6.1664 6.1664 6.2839 6.2839 6.3183 6.3183 7.4614 7.4614 8.3126 8.3126 9.6296 9.6296 10.1665 10.1665 10.4536 10.4536 12.1203 12.1203 13.9398 13.9398 14.4956 14.4956 14.7816 14.7816 15.0617 15.0617 k = 0.1061 0.3900 0.6926 ( 4982 PWs) bands (ev): -17.0613 -17.0613 -11.1474 -11.1474 -11.0854 -11.0854 -11.0729 -11.0729 -11.0581 -11.0581 -10.1399 -10.1399 -10.1075 -10.1075 -10.0312 -10.0312 -10.0142 -10.0142 -10.0037 -10.0037 -9.9845 -9.9845 -3.7916 -3.7916 -1.8990 -1.8990 -1.7636 -1.7636 2.3628 2.3628 3.4853 3.4853 5.3248 5.3248 5.3848 5.3848 5.6101 5.6101 5.6499 5.6499 5.8227 5.8227 5.9406 5.9406 6.0940 6.0940 6.1762 6.1762 6.2920 6.2920 6.3313 6.3313 7.4732 7.4732 8.3365 8.3365 9.5796 9.5796 10.0447 10.0447 10.3669 10.3669 12.1416 12.1416 13.9915 13.9915 14.6158 14.6158 14.7857 14.7857 15.0839 15.0839 k = 0.1136 0.3774 0.7074 ( 4976 PWs) bands (ev): -17.0610 -17.0610 -11.1474 -11.1474 -11.0855 -11.0855 -11.0729 -11.0729 -11.0580 -11.0580 -10.1400 -10.1400 -10.1076 -10.1076 -10.0311 -10.0311 -10.0142 -10.0142 -10.0037 -10.0037 -9.9845 -9.9845 -3.7921 -3.7921 -1.8960 -1.8960 -1.7679 -1.7679 2.3557 2.3557 3.5056 3.5056 5.3151 5.3151 5.3705 5.3705 5.6213 5.6213 5.6506 5.6506 5.8215 5.8215 5.9406 5.9406 6.1044 6.1044 6.1861 6.1861 6.2979 6.2979 6.3453 6.3453 7.4871 7.4871 8.3582 8.3582 9.5261 9.5261 9.9306 9.9306 10.2839 10.2839 12.1614 12.1614 14.0443 14.0443 14.7309 14.7309 14.7467 14.7467 15.1100 15.1100 k = 0.1212 0.3647 0.7221 ( 4982 PWs) bands (ev): -17.0608 -17.0608 -11.1474 -11.1474 -11.0856 -11.0856 -11.0729 -11.0729 -11.0579 -11.0579 -10.1400 -10.1400 -10.1077 -10.1077 -10.0309 -10.0309 -10.0142 -10.0142 -10.0038 -10.0038 -9.9845 -9.9845 -3.7927 -3.7927 -1.8932 -1.8932 -1.7720 -1.7720 2.3485 2.3485 3.5263 3.5263 5.3053 5.3053 5.3564 5.3564 5.6324 5.6324 5.6524 5.6524 5.8206 5.8206 5.9403 5.9403 6.1150 6.1150 6.1961 6.1961 6.3019 6.3019 6.3599 6.3599 7.5031 7.5031 8.3765 8.3765 9.4689 9.4689 9.8259 9.8259 10.2049 10.2049 12.1791 12.1791 14.0981 14.0981 14.6754 14.6754 14.8626 14.8626 15.1392 15.1392 k = 0.1288 0.3521 0.7368 ( 4986 PWs) bands (ev): -17.0605 -17.0605 -11.1474 -11.1474 -11.0857 -11.0857 -11.0729 -11.0729 -11.0578 -11.0578 -10.1400 -10.1400 -10.1078 -10.1078 -10.0308 -10.0308 -10.0142 -10.0142 -10.0038 -10.0038 -9.9845 -9.9845 -3.7932 -3.7932 -1.8906 -1.8906 -1.7759 -1.7759 2.3412 2.3412 3.5473 3.5473 5.2956 5.2956 5.3428 5.3428 5.6429 5.6429 5.6562 5.6562 5.8200 5.8200 5.9398 5.9398 6.1259 6.1259 6.2061 6.2061 6.3048 6.3048 6.3744 6.3744 7.5214 7.5214 8.3899 8.3899 9.4083 9.4083 9.7325 9.7325 10.1304 10.1304 12.1937 12.1937 14.1527 14.1527 14.6112 14.6112 14.9872 14.9872 15.1701 15.1701 k = 0.1364 0.3394 0.7516 ( 4980 PWs) bands (ev): -17.0602 -17.0602 -11.1474 -11.1474 -11.0857 -11.0857 -11.0730 -11.0730 -11.0578 -11.0578 -10.1401 -10.1401 -10.1079 -10.1079 -10.0306 -10.0306 -10.0142 -10.0142 -10.0039 -10.0039 -9.9845 -9.9845 -3.7938 -3.7938 -1.8882 -1.8882 -1.7795 -1.7795 2.3338 2.3338 3.5684 3.5684 5.2860 5.2860 5.3297 5.3297 5.6512 5.6512 5.6633 5.6633 5.8196 5.8196 5.9391 5.9391 6.1369 6.1369 6.2160 6.2160 6.3066 6.3066 6.3885 6.3885 7.5420 7.5420 8.3968 8.3968 9.3444 9.3444 9.6519 9.6519 10.0606 10.0606 12.2046 12.2046 14.2081 14.2081 14.5526 14.5526 15.1125 15.1125 15.2020 15.2020 k = 0.1439 0.3268 0.7663 ( 4986 PWs) bands (ev): -17.0599 -17.0599 -11.1474 -11.1474 -11.0858 -11.0858 -11.0730 -11.0730 -11.0577 -11.0577 -10.1401 -10.1401 -10.1081 -10.1081 -10.0304 -10.0304 -10.0141 -10.0141 -10.0039 -10.0039 -9.9845 -9.9845 -3.7944 -3.7944 -1.8860 -1.8860 -1.7827 -1.7827 2.3264 2.3264 3.5893 3.5893 5.2766 5.2766 5.3170 5.3170 5.6575 5.6575 5.6736 5.6736 5.8194 5.8194 5.9380 5.9380 6.1478 6.1478 6.2257 6.2257 6.3077 6.3077 6.4021 6.4021 7.5649 7.5649 8.3956 8.3956 9.2778 9.2778 9.5855 9.5855 9.9958 9.9958 12.2110 12.2110 14.2641 14.2641 14.5033 14.5033 15.2283 15.2283 15.2441 15.2441 k = 0.1515 0.3142 0.7810 ( 4988 PWs) bands (ev): -17.0597 -17.0597 -11.1475 -11.1475 -11.0859 -11.0859 -11.0730 -11.0730 -11.0576 -11.0576 -10.1401 -10.1401 -10.1082 -10.1082 -10.0303 -10.0303 -10.0141 -10.0141 -10.0039 -10.0039 -9.9845 -9.9845 -3.7949 -3.7949 -1.8842 -1.8842 -1.7856 -1.7856 2.3192 2.3192 3.6101 3.6101 5.2675 5.2675 5.3049 5.3049 5.6634 5.6634 5.6855 5.6855 5.8192 5.8192 5.9367 5.9367 6.1584 6.1584 6.2352 6.2352 6.3082 6.3082 6.4151 6.4151 7.5901 7.5901 8.3851 8.3851 9.2092 9.2092 9.5341 9.5341 9.9360 9.9360 12.2123 12.2123 14.3206 14.3206 14.4655 14.4655 15.2650 15.2650 15.3651 15.3651 k = 0.1591 0.3015 0.7958 ( 4986 PWs) bands (ev): -17.0594 -17.0594 -11.1475 -11.1475 -11.0860 -11.0860 -11.0730 -11.0730 -11.0575 -11.0575 -10.1401 -10.1401 -10.1083 -10.1083 -10.0301 -10.0301 -10.0141 -10.0141 -10.0040 -10.0040 -9.9845 -9.9845 -3.7955 -3.7955 -1.8828 -1.8828 -1.7879 -1.7879 2.3121 2.3121 3.6303 3.6303 5.2587 5.2587 5.2936 5.2936 5.6699 5.6699 5.6979 5.6979 5.8191 5.8191 5.9349 5.9349 6.1688 6.1688 6.2445 6.2445 6.3082 6.3082 6.4272 6.4272 7.6176 7.6176 8.3652 8.3652 9.1391 9.1391 9.4977 9.4977 9.8814 9.8814 12.2082 12.2082 14.3772 14.3772 14.4408 14.4408 15.2970 15.2970 15.4896 15.4896 k = 0.1667 0.2889 0.8105 ( 4980 PWs) bands (ev): -17.0592 -17.0592 -11.1475 -11.1475 -11.0860 -11.0860 -11.0730 -11.0730 -11.0574 -11.0574 -10.1402 -10.1402 -10.1084 -10.1084 -10.0300 -10.0300 -10.0141 -10.0141 -10.0040 -10.0040 -9.9845 -9.9845 -3.7961 -3.7961 -1.8816 -1.8816 -1.7899 -1.7899 2.3052 2.3052 3.6498 3.6498 5.2503 5.2503 5.2829 5.2829 5.6771 5.6771 5.7108 5.7108 5.8189 5.8189 5.9328 5.9328 6.1787 6.1787 6.2534 6.2534 6.3081 6.3081 6.4385 6.4385 7.6473 7.6473 8.3365 8.3365 9.0683 9.0683 9.4755 9.4755 9.8317 9.8317 12.1987 12.1987 14.4219 14.4219 14.4418 14.4418 15.3279 15.3279 15.6124 15.6124 k = 0.1742 0.2762 0.8253 ( 4974 PWs) bands (ev): -17.0589 -17.0589 -11.1475 -11.1475 -11.0861 -11.0861 -11.0730 -11.0730 -11.0573 -11.0573 -10.1402 -10.1402 -10.1085 -10.1085 -10.0299 -10.0299 -10.0141 -10.0141 -10.0040 -10.0040 -9.9845 -9.9845 -3.7966 -3.7966 -1.8809 -1.8809 -1.7913 -1.7913 2.2987 2.2987 3.6684 3.6684 5.2424 5.2424 5.2731 5.2731 5.6847 5.6847 5.7238 5.7238 5.8187 5.8187 5.9301 5.9301 6.1880 6.1880 6.2619 6.2619 6.3078 6.3078 6.4490 6.4490 7.6792 7.6792 8.3005 8.3005 8.9971 8.9971 9.4660 9.4660 9.7870 9.7870 12.1842 12.1842 14.4277 14.4277 14.4958 14.4958 15.3572 15.3572 15.7310 15.7310 k = 0.1818 0.2636 0.8400 ( 4980 PWs) bands (ev): -17.0587 -17.0587 -11.1475 -11.1475 -11.0862 -11.0862 -11.0730 -11.0730 -11.0573 -11.0573 -10.1402 -10.1402 -10.1085 -10.1085 -10.0297 -10.0297 -10.0140 -10.0140 -10.0041 -10.0041 -9.9845 -9.9845 -3.7971 -3.7971 -1.8805 -1.8805 -1.7923 -1.7923 2.2925 2.2925 3.6859 3.6859 5.2349 5.2349 5.2640 5.2640 5.6928 5.6928 5.7369 5.7369 5.8183 5.8183 5.9269 5.9269 6.1966 6.1966 6.2699 6.2699 6.3075 6.3075 6.4584 6.4584 7.7130 7.7130 8.2596 8.2596 8.9261 8.9261 9.4668 9.4668 9.7470 9.7470 12.1653 12.1653 14.4430 14.4430 14.5538 14.5538 15.3843 15.3843 15.8354 15.8354 k = 0.1894 0.2510 0.8547 ( 4978 PWs) bands (ev): -17.0585 -17.0585 -11.1475 -11.1475 -11.0862 -11.0862 -11.0730 -11.0730 -11.0572 -11.0572 -10.1402 -10.1402 -10.1086 -10.1086 -10.0296 -10.0296 -10.0140 -10.0140 -10.0041 -10.0041 -9.9845 -9.9845 -3.7976 -3.7976 -1.8804 -1.8804 -1.7930 -1.7930 2.2868 2.2868 3.7022 3.7022 5.2281 5.2281 5.2558 5.2558 5.7011 5.7011 5.7501 5.7501 5.8178 5.8178 5.9230 5.9230 6.2043 6.2043 6.2773 6.2773 6.3074 6.3074 6.4669 6.4669 7.7486 7.7486 8.2161 8.2161 8.8560 8.8560 9.4754 9.4754 9.7117 9.7117 12.1431 12.1431 14.4708 14.4708 14.6123 14.6123 15.4079 15.4079 15.8667 15.8667 k = 0.1970 0.2383 0.8695 ( 4972 PWs) bands (ev): -17.0583 -17.0583 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0571 -11.0571 -10.1402 -10.1402 -10.1087 -10.1087 -10.0295 -10.0295 -10.0140 -10.0140 -10.0041 -10.0041 -9.9845 -9.9845 -3.7981 -3.7981 -1.8805 -1.8805 -1.7933 -1.7933 2.2815 2.2815 3.7170 3.7170 5.2219 5.2219 5.2486 5.2486 5.7094 5.7094 5.7632 5.7632 5.8173 5.8173 5.9185 5.9185 6.2112 6.2112 6.2840 6.2840 6.3075 6.3075 6.4744 6.4744 7.7855 7.7855 8.1725 8.1725 8.7874 8.7874 9.4891 9.4891 9.6809 9.6809 12.1189 12.1189 14.5105 14.5105 14.6706 14.6706 15.4262 15.4262 15.8107 15.8107 k = 0.2045 0.2257 0.8842 ( 4978 PWs) bands (ev): -17.0582 -17.0582 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0571 -11.0571 -10.1403 -10.1403 -10.1088 -10.1088 -10.0294 -10.0294 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7985 -3.7985 -1.8808 -1.8808 -1.7934 -1.7934 2.2769 2.2769 3.7301 3.7301 5.2163 5.2163 5.2422 5.2422 5.7174 5.7174 5.7758 5.7758 5.8172 5.8172 5.9131 5.9131 6.2170 6.2170 6.2899 6.2899 6.3080 6.3080 6.4808 6.4808 7.8233 7.8233 8.1309 8.1309 8.7214 8.7214 9.5055 9.5055 9.6547 9.6547 12.0940 12.0940 14.5610 14.5610 14.7283 14.7283 15.4360 15.4360 15.7391 15.7391 k = 0.2121 0.2130 0.8989 ( 4976 PWs) bands (ev): -17.0581 -17.0581 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0570 -11.0570 -10.1403 -10.1403 -10.1088 -10.1088 -10.0293 -10.0293 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7988 -3.7988 -1.8811 -1.8811 -1.7934 -1.7934 2.2729 2.2729 3.7416 3.7416 5.2115 5.2115 5.2368 5.2368 5.7249 5.7249 5.7871 5.7871 5.8182 5.8182 5.9069 5.9069 6.2219 6.2219 6.2947 6.2947 6.3090 6.3090 6.4863 6.4863 7.8611 7.8611 8.0929 8.0929 8.6590 8.6590 9.5225 9.5225 9.6330 9.6330 12.0698 12.0698 14.6212 14.6212 14.7844 14.7844 15.4307 15.4307 15.6658 15.6658 k = 0.2197 0.2004 0.9137 ( 4986 PWs) bands (ev): -17.0579 -17.0579 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0570 -11.0570 -10.1403 -10.1403 -10.1089 -10.1089 -10.0293 -10.0293 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7991 -3.7991 -1.8815 -1.8815 -1.7932 -1.7932 2.2695 2.2695 3.7510 3.7510 5.2075 5.2075 5.2323 5.2323 5.7317 5.7317 5.7954 5.7954 5.8218 5.8218 5.8998 5.8998 6.2258 6.2258 6.2984 6.2984 6.3104 6.3104 6.4906 6.4906 7.8975 7.8975 8.0603 8.0603 8.6018 8.6018 9.5380 9.5380 9.6163 9.6163 12.0478 12.0478 14.6897 14.6897 14.8376 14.8376 15.4001 15.4001 15.6020 15.6020 k = 0.2273 0.1878 0.9284 ( 4986 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0570 -11.0570 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7994 -3.7994 -1.8819 -1.8819 -1.7930 -1.7930 2.2668 2.2668 3.7586 3.7586 5.2044 5.2044 5.2288 5.2288 5.7374 5.7374 5.7993 5.7993 5.8296 5.8296 5.8918 5.8918 6.2287 6.2287 6.3009 6.3009 6.3122 6.3122 6.4941 6.4941 7.9305 7.9305 8.0344 8.0344 8.5516 8.5516 9.5499 9.5499 9.6049 9.6049 12.0293 12.0293 14.7646 14.7646 14.8858 14.8858 15.3398 15.3398 15.5533 15.5533 k = 0.2348 0.1751 0.9432 ( 4984 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7995 -3.7995 -1.8822 -1.8822 -1.7929 -1.7929 2.2649 2.2649 3.7640 3.7640 5.2021 5.2021 5.2263 5.2263 5.7419 5.7419 5.8003 5.8003 5.8400 5.8400 5.8828 5.8828 6.2307 6.2307 6.3024 6.3024 6.3138 6.3138 6.4965 6.4965 7.9566 7.9566 8.0169 8.0169 8.5115 8.5115 9.5568 9.5568 9.5993 9.5993 12.0152 12.0152 14.8430 14.8430 14.9258 14.9258 15.2616 15.2616 15.5158 15.5158 k = 0.2424 0.1625 0.9579 ( 4988 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7996 -3.7996 -1.8823 -1.8823 -1.7928 -1.7928 2.2638 2.2638 3.7673 3.7673 5.2008 5.2008 5.2249 5.2249 5.7447 5.7447 5.8002 5.8002 5.8512 5.8512 5.8731 5.8731 6.2319 6.2319 6.3032 6.3032 6.3150 6.3150 6.4979 6.4979 7.9710 7.9710 8.0098 8.0098 8.4851 8.4851 9.5590 9.5590 9.5981 9.5981 12.0064 12.0064 14.9171 14.9171 14.9529 14.9529 15.1843 15.1843 15.4900 15.4900 k = 0.2500 0.1498 0.9726 ( 4984 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8824 -1.8824 -1.7927 -1.7927 2.2634 2.2634 3.7683 3.7683 5.2003 5.2003 5.2244 5.2244 5.7457 5.7457 5.8002 5.8002 5.8607 5.8607 5.8641 5.8641 6.2323 6.2323 6.3035 6.3035 6.3154 6.3154 6.4984 6.4984 7.9743 7.9743 8.0093 8.0093 8.4758 8.4758 9.5593 9.5593 9.5982 9.5982 12.0034 12.0034 14.9570 14.9570 14.9615 14.9615 15.1439 15.1439 15.4805 15.4805 k = 0.2500 0.1498 0.9726 ( 4984 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8824 -1.8824 -1.7927 -1.7927 2.2634 2.2634 3.7683 3.7683 5.2003 5.2003 5.2244 5.2244 5.7457 5.7457 5.8002 5.8002 5.8607 5.8607 5.8641 5.8641 6.2323 6.2323 6.3035 6.3035 6.3154 6.3154 6.4984 6.4984 7.9743 7.9743 8.0093 8.0093 8.4758 8.4758 9.5593 9.5593 9.5982 9.5982 12.0034 12.0034 14.9570 14.9570 14.9615 14.9615 15.1439 15.1439 15.4805 15.4805 k = 0.2647 0.1586 0.9624 ( 4984 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7997 -3.7997 -1.8824 -1.8824 -1.7928 -1.7928 2.2635 2.2635 3.7681 3.7681 5.2003 5.2003 5.2246 5.2246 5.7452 5.7452 5.8002 5.8002 5.8558 5.8558 5.8689 5.8689 6.2316 6.2316 6.3035 6.3035 6.3152 6.3152 6.5001 6.5001 7.9739 7.9739 8.0092 8.0092 8.4757 8.4757 9.5545 9.5545 9.6032 9.6032 12.0091 12.0091 14.8859 14.8859 15.0140 15.0140 15.1615 15.1615 15.4805 15.4805 k = 0.2794 0.1675 0.9521 ( 4986 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7996 -3.7996 -1.8823 -1.8823 -1.7928 -1.7928 2.2638 2.2638 3.7671 3.7671 5.2004 5.2004 5.2253 5.2253 5.7437 5.7437 5.8005 5.8005 5.8499 5.8499 5.8744 5.8744 6.2296 6.2296 6.3034 6.3034 6.3144 6.3144 6.5046 6.5046 7.9732 7.9732 8.0091 8.0091 8.4748 8.4748 9.5445 9.5445 9.6136 9.6136 12.0258 12.0258 14.8115 14.8115 15.0294 15.0294 15.2160 15.2160 15.4816 15.4816 k = 0.2941 0.1763 0.9418 ( 4990 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7996 -3.7996 -1.8822 -1.8822 -1.7928 -1.7928 2.2643 2.2643 3.7655 3.7655 5.2005 5.2005 5.2264 5.2264 5.7412 5.7412 5.8011 5.8011 5.8444 5.8444 5.8795 5.8795 6.2267 6.2267 6.3031 6.3031 6.3132 6.3132 6.5113 6.5113 7.9729 7.9729 8.0095 8.0095 8.4722 8.4722 9.5321 9.5321 9.6270 9.6270 12.0530 12.0530 14.7385 14.7385 15.0262 15.0262 15.2784 15.2784 15.4881 15.4881 k = 0.3088 0.1851 0.9315 ( 4983 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7995 -3.7995 -1.8821 -1.8821 -1.7929 -1.7929 2.2651 2.2651 3.7630 3.7630 5.2006 5.2006 5.2282 5.2282 5.7378 5.7378 5.8018 5.8018 5.8395 5.8395 5.8839 5.8839 6.2233 6.2233 6.3027 6.3027 6.3118 6.3118 6.5193 6.5193 7.9736 7.9736 8.0109 8.0109 8.4674 8.4674 9.5186 9.5186 9.6422 9.6422 12.0895 12.0895 14.6675 14.6675 15.0199 15.0199 15.3182 15.3182 15.5100 15.5100 k = 0.3235 0.1939 0.9213 ( 4985 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9845 -9.9845 -3.7995 -3.7995 -1.8820 -1.8820 -1.7931 -1.7931 2.2662 2.2662 3.7595 3.7595 5.2009 5.2009 5.2305 5.2305 5.7335 5.7335 5.8027 5.8027 5.8353 5.8353 5.8877 5.8877 6.2195 6.2195 6.3020 6.3020 6.3103 6.3103 6.5278 6.5278 7.9754 7.9754 8.0140 8.0140 8.4602 8.4602 9.5049 9.5049 9.6588 9.6588 12.1344 12.1344 14.5992 14.5992 15.0153 15.0153 15.3185 15.3185 15.5491 15.5491 k = 0.3382 0.2027 0.9110 ( 4989 PWs) bands (ev): -17.0578 -17.0578 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0570 -11.0570 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0141 -10.0141 -10.0041 -10.0041 -9.9845 -9.9845 -3.7994 -3.7994 -1.8818 -1.8818 -1.7932 -1.7932 2.2677 2.2677 3.7550 3.7550 5.2012 5.2012 5.2334 5.2334 5.7285 5.7285 5.8037 5.8037 5.8318 5.8318 5.8907 5.8907 6.2159 6.2159 6.3009 6.3009 6.3088 6.3088 6.5358 6.5358 7.9783 7.9783 8.0197 8.0197 8.4505 8.4505 9.4912 9.4912 9.6766 9.6766 12.1864 12.1864 14.5339 14.5339 15.0136 15.0136 15.2829 15.2829 15.5782 15.5782 k = 0.3529 0.2115 0.9007 ( 4985 PWs) bands (ev): -17.0579 -17.0579 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0570 -11.0570 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0141 -10.0141 -10.0041 -10.0041 -9.9845 -9.9845 -3.7993 -3.7993 -1.8815 -1.8815 -1.7934 -1.7934 2.2695 2.2695 3.7494 3.7494 5.2017 5.2017 5.2370 5.2370 5.7229 5.7229 5.8047 5.8047 5.8292 5.8292 5.8930 5.8930 6.2125 6.2125 6.2995 6.2995 6.3076 6.3076 6.5427 6.5427 7.9815 7.9815 8.0289 8.0289 8.4386 8.4386 9.4782 9.4782 9.6955 9.6955 12.2438 12.2438 14.4721 14.4721 15.0144 15.0144 15.2200 15.2200 15.5758 15.5758 k = 0.3676 0.2203 0.8904 ( 4991 PWs) bands (ev): -17.0579 -17.0579 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0570 -11.0570 -10.1402 -10.1402 -10.1089 -10.1089 -10.0292 -10.0292 -10.0141 -10.0141 -10.0041 -10.0041 -9.9845 -9.9845 -3.7992 -3.7992 -1.8813 -1.8813 -1.7936 -1.7936 2.2717 2.2717 3.7427 3.7427 5.2025 5.2025 5.2409 5.2409 5.7169 5.7169 5.8056 5.8056 5.8273 5.8273 5.8946 5.8946 6.2095 6.2095 6.2976 6.2976 6.3064 6.3064 6.5478 6.5478 7.9847 7.9847 8.0424 8.0424 8.4251 8.4251 9.4659 9.4659 9.7154 9.7154 12.3053 12.3053 14.4141 14.4141 15.0114 15.0114 15.1436 15.1436 15.5604 15.5604 k = 0.3824 0.2292 0.8801 ( 4994 PWs) bands (ev): -17.0580 -17.0580 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0570 -11.0570 -10.1402 -10.1402 -10.1089 -10.1089 -10.0293 -10.0293 -10.0142 -10.0142 -10.0040 -10.0040 -9.9845 -9.9845 -3.7990 -3.7990 -1.8809 -1.8809 -1.7939 -1.7939 2.2742 2.2742 3.7349 3.7349 5.2035 5.2035 5.2453 5.2453 5.7107 5.7107 5.8063 5.8063 5.8263 5.8263 5.8956 5.8956 6.2071 6.2071 6.2952 6.2952 6.3055 6.3055 6.5507 6.5507 7.9876 7.9876 8.0605 8.0605 8.4107 8.4107 9.4545 9.4545 9.7360 9.7360 12.3690 12.3690 14.3603 14.3603 14.9743 14.9743 15.0930 15.0930 15.5426 15.5426 k = 0.3971 0.2380 0.8699 ( 4984 PWs) bands (ev): -17.0580 -17.0580 -11.1475 -11.1475 -11.0863 -11.0863 -11.0731 -11.0731 -11.0570 -11.0570 -10.1402 -10.1402 -10.1090 -10.1090 -10.0293 -10.0293 -10.0142 -10.0142 -10.0040 -10.0040 -9.9845 -9.9845 -3.7989 -3.7989 -1.8805 -1.8805 -1.7942 -1.7942 2.2771 2.2771 3.7260 3.7260 5.2049 5.2049 5.2502 5.2502 5.7044 5.7044 5.8068 5.8068 5.8261 5.8261 5.8960 5.8960 6.2054 6.2054 6.2926 6.2926 6.3048 6.3048 6.5510 6.5510 7.9903 7.9903 8.0827 8.0827 8.3966 8.3966 9.4442 9.4442 9.7572 9.7572 12.4332 12.4332 14.3109 14.3109 14.8857 14.8857 15.0937 15.0937 15.5250 15.5250 k = 0.4118 0.2468 0.8596 ( 4990 PWs) bands (ev): -17.0581 -17.0581 -11.1475 -11.1475 -11.0863 -11.0863 -11.0732 -11.0732 -11.0570 -11.0570 -10.1402 -10.1402 -10.1090 -10.1090 -10.0293 -10.0293 -10.0142 -10.0142 -10.0040 -10.0040 -9.9845 -9.9845 -3.7987 -3.7987 -1.8801 -1.8801 -1.7946 -1.7946 2.2804 2.2804 3.7160 3.7160 5.2066 5.2066 5.2555 5.2555 5.6981 5.6981 5.8070 5.8070 5.8265 5.8265 5.8959 5.8959 6.2042 6.2042 6.2895 6.2895 6.3042 6.3042 6.5484 6.5484 7.9928 7.9928 8.1080 8.1080 8.3842 8.3842 9.4351 9.4351 9.7790 9.7790 12.4957 12.4957 14.2661 14.2661 14.7827 14.7827 15.1143 15.1143 15.5077 15.5077 k = 0.4265 0.2556 0.8493 ( 4988 PWs) bands (ev): -17.0582 -17.0582 -11.1475 -11.1475 -11.0863 -11.0863 -11.0732 -11.0732 -11.0570 -11.0570 -10.1402 -10.1402 -10.1090 -10.1090 -10.0293 -10.0293 -10.0142 -10.0142 -10.0039 -10.0039 -9.9845 -9.9845 -3.7986 -3.7986 -1.8796 -1.8796 -1.7950 -1.7950 2.2840 2.2840 3.7051 3.7051 5.2086 5.2086 5.2610 5.2610 5.6920 5.6920 5.8069 5.8069 5.8274 5.8274 5.8954 5.8954 6.2038 6.2038 6.2863 6.2863 6.3037 6.3037 6.5429 6.5429 7.9954 7.9954 8.1342 8.1342 8.3758 8.3758 9.4271 9.4271 9.8010 9.8010 12.5542 12.5542 14.2263 14.2263 14.6808 14.6808 15.1432 15.1432 15.4904 15.4904 k = 0.4412 0.2644 0.8390 ( 4989 PWs) bands (ev): -17.0583 -17.0583 -11.1475 -11.1475 -11.0863 -11.0863 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0294 -10.0294 -10.0143 -10.0143 -10.0039 -10.0039 -9.9845 -9.9845 -3.7984 -3.7984 -1.8791 -1.8791 -1.7955 -1.7955 2.2879 2.2879 3.6932 3.6932 5.2109 5.2109 5.2669 5.2669 5.6860 5.6860 5.8067 5.8067 5.8285 5.8285 5.8945 5.8945 6.2040 6.2040 6.2829 6.2829 6.3032 6.3032 6.5345 6.5345 7.9981 7.9981 8.1585 8.1585 8.3748 8.3748 9.4204 9.4204 9.8232 9.8232 12.6064 12.6064 14.1915 14.1915 14.5861 14.5861 15.1775 15.1775 15.4730 15.4730 k = 0.4559 0.2732 0.8288 ( 4989 PWs) bands (ev): -17.0583 -17.0583 -11.1475 -11.1475 -11.0863 -11.0863 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0294 -10.0294 -10.0143 -10.0143 -10.0038 -10.0038 -9.9845 -9.9845 -3.7982 -3.7982 -1.8785 -1.8785 -1.7959 -1.7959 2.2920 2.2920 3.6807 3.6807 5.2133 5.2133 5.2731 5.2731 5.6803 5.6803 5.8063 5.8063 5.8298 5.8298 5.8935 5.8935 6.2048 6.2048 6.2793 6.2793 6.3028 6.3028 6.5232 6.5232 8.0011 8.0011 8.1768 8.1768 8.3849 8.3849 9.4151 9.4151 9.8453 9.8453 12.6496 12.6496 14.1621 14.1621 14.5027 14.5027 15.2151 15.2151 15.4551 15.4551 k = 0.4706 0.2820 0.8185 ( 4979 PWs) bands (ev): -17.0584 -17.0584 -11.1475 -11.1475 -11.0863 -11.0863 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0294 -10.0294 -10.0143 -10.0143 -10.0038 -10.0038 -9.9845 -9.9845 -3.7979 -3.7979 -1.8778 -1.8778 -1.7964 -1.7964 2.2964 2.2964 3.6675 3.6675 5.2159 5.2159 5.2795 5.2795 5.6748 5.6748 5.8058 5.8058 5.8310 5.8310 5.8926 5.8926 6.2061 6.2061 6.2757 6.2757 6.3025 6.3025 6.5095 6.5095 8.0043 8.0043 8.1869 8.1869 8.4083 8.4083 9.4113 9.4113 9.8672 9.8672 12.6811 12.6811 14.1380 14.1380 14.4337 14.4337 15.2536 15.2536 15.4371 15.4371 k = 0.4853 0.2909 0.8082 ( 4982 PWs) bands (ev): -17.0585 -17.0585 -11.1475 -11.1475 -11.0862 -11.0862 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0295 -10.0295 -10.0143 -10.0143 -10.0037 -10.0037 -9.9845 -9.9845 -3.7977 -3.7977 -1.8772 -1.8772 -1.7970 -1.7970 2.3008 2.3008 3.6539 3.6539 5.2184 5.2184 5.2861 5.2861 5.6696 5.6696 5.8048 5.8048 5.8320 5.8320 5.8918 5.8918 6.2078 6.2078 6.2721 6.2721 6.3021 6.3021 6.4935 6.4935 8.0077 8.0077 8.1899 8.1899 8.4435 8.4435 9.4096 9.4096 9.8886 9.8886 12.6987 12.6987 14.1194 14.1194 14.3818 14.3818 15.2899 15.2899 15.4194 15.4194 k = 0.5000 0.2997 0.7979 ( 4986 PWs) bands (ev): -17.0586 -17.0586 -11.1475 -11.1475 -11.0862 -11.0862 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0295 -10.0295 -10.0143 -10.0143 -10.0037 -10.0037 -9.9845 -9.9845 -3.7974 -3.7974 -1.8764 -1.8764 -1.7975 -1.7975 2.3053 2.3053 3.6400 3.6400 5.2208 5.2208 5.2929 5.2929 5.6647 5.6647 5.8034 5.8034 5.8327 5.8327 5.8913 5.8913 6.2097 6.2097 6.2687 6.2687 6.3017 6.3017 6.4756 6.4756 8.0115 8.0115 8.1888 8.1888 8.4867 8.4867 9.4105 9.4105 9.9093 9.9093 12.7008 12.7008 14.1065 14.1065 14.3486 14.3486 15.3182 15.3182 15.4042 15.4042 k = 0.5000 0.2997 0.7979 ( 4986 PWs) bands (ev): -17.0586 -17.0586 -11.1475 -11.1475 -11.0862 -11.0862 -11.0732 -11.0732 -11.0571 -11.0571 -10.1401 -10.1401 -10.1089 -10.1089 -10.0295 -10.0295 -10.0143 -10.0143 -10.0037 -10.0037 -9.9845 -9.9845 -3.7974 -3.7974 -1.8764 -1.8764 -1.7975 -1.7975 2.3053 2.3053 3.6400 3.6400 5.2208 5.2208 5.2929 5.2929 5.6647 5.6647 5.8034 5.8034 5.8327 5.8327 5.8913 5.8913 6.2097 6.2097 6.2687 6.2687 6.3017 6.3017 6.4756 6.4756 8.0115 8.0115 8.1888 8.1888 8.4867 8.4867 9.4105 9.4105 9.9093 9.9093 12.7008 12.7008 14.1065 14.1065 14.3486 14.3486 15.3182 15.3182 15.4042 15.4042 k = 0.5000 0.2997 0.7769 ( 4986 PWs) bands (ev): -17.0588 -17.0588 -11.1474 -11.1474 -11.0862 -11.0862 -11.0732 -11.0732 -11.0572 -11.0572 -10.1400 -10.1400 -10.1089 -10.1089 -10.0296 -10.0296 -10.0144 -10.0144 -10.0036 -10.0036 -9.9845 -9.9845 -3.7969 -3.7969 -1.8748 -1.8748 -1.7986 -1.7986 2.3148 2.3148 3.6104 3.6104 5.2256 5.2256 5.3073 5.3073 5.6552 5.6552 5.7991 5.7991 5.8344 5.8344 5.8910 5.8910 6.2129 6.2129 6.2627 6.2627 6.3008 6.3008 6.4377 6.4377 8.0198 8.0198 8.1816 8.1816 8.5850 8.5850 9.4187 9.4187 9.9529 9.9529 12.6892 12.6892 14.0851 14.0851 14.2943 14.2943 15.3209 15.3209 15.4005 15.4005 k = 0.5000 0.2997 0.7559 ( 4990 PWs) bands (ev): -17.0591 -17.0591 -11.1474 -11.1474 -11.0862 -11.0862 -11.0732 -11.0732 -11.0572 -11.0572 -10.1400 -10.1400 -10.1088 -10.1088 -10.0298 -10.0298 -10.0144 -10.0144 -10.0035 -10.0035 -9.9845 -9.9845 -3.7962 -3.7962 -1.8729 -1.8729 -1.7998 -1.7998 2.3246 2.3246 3.5789 3.5789 5.2305 5.2305 5.3220 5.3220 5.6464 5.6464 5.7932 5.7932 5.8361 5.8361 5.8910 5.8910 6.2140 6.2140 6.2585 6.2585 6.2996 6.2996 6.4008 6.4008 8.0290 8.0290 8.1698 8.1698 8.6909 8.6909 9.4342 9.4342 10.0009 10.0009 12.6778 12.6778 14.0622 14.0622 14.2298 14.2298 15.2746 15.2746 15.3698 15.3698 k = 0.5000 0.2997 0.7350 ( 4994 PWs) bands (ev): -17.0593 -17.0593 -11.1474 -11.1474 -11.0861 -11.0861 -11.0732 -11.0732 -11.0573 -11.0573 -10.1399 -10.1399 -10.1088 -10.1088 -10.0299 -10.0299 -10.0144 -10.0144 -10.0034 -10.0034 -9.9845 -9.9845 -3.7955 -3.7955 -1.8709 -1.8709 -1.8010 -1.8010 2.3345 2.3345 3.5456 3.5456 5.2353 5.2353 5.3364 5.3364 5.6390 5.6390 5.7858 5.7858 5.8379 5.8379 5.8915 5.8915 6.2123 6.2123 6.2568 6.2568 6.2975 6.2975 6.3660 6.3660 8.0388 8.0388 8.1545 8.1545 8.8031 8.8031 9.4579 9.4579 10.0531 10.0531 12.6670 12.6670 14.0381 14.0381 14.1575 14.1575 15.2173 15.2173 15.3111 15.3111 k = 0.5000 0.2997 0.7140 ( 4986 PWs) bands (ev): -17.0596 -17.0596 -11.1473 -11.1473 -11.0861 -11.0861 -11.0733 -11.0733 -11.0573 -11.0573 -10.1399 -10.1399 -10.1087 -10.1087 -10.0300 -10.0300 -10.0145 -10.0145 -10.0033 -10.0033 -9.9845 -9.9845 -3.7946 -3.7946 -1.8686 -1.8686 -1.8023 -1.8023 2.3443 2.3443 3.5111 3.5111 5.2400 5.2400 5.3498 5.3498 5.6334 5.6334 5.7769 5.7769 5.8393 5.8393 5.8924 5.8924 6.2081 6.2081 6.2573 6.2573 6.2921 6.2921 6.3365 6.3365 8.0483 8.0483 8.1378 8.1378 8.9205 8.9205 9.4899 9.4899 10.1093 10.1093 12.6572 12.6572 14.0124 14.0124 14.0795 14.0795 15.1522 15.1522 15.2448 15.2448 k = 0.5000 0.2997 0.6930 ( 4986 PWs) bands (ev): -17.0599 -17.0599 -11.1473 -11.1473 -11.0860 -11.0860 -11.0733 -11.0733 -11.0574 -11.0574 -10.1398 -10.1398 -10.1087 -10.1087 -10.0301 -10.0301 -10.0145 -10.0145 -10.0032 -10.0032 -9.9844 -9.9844 -3.7937 -3.7937 -1.8661 -1.8661 -1.8035 -1.8035 2.3538 2.3538 3.4755 3.4755 5.2446 5.2446 5.3615 5.3615 5.6301 5.6301 5.7668 5.7668 5.8401 5.8401 5.8939 5.8939 6.2023 6.2023 6.2584 6.2584 6.2769 6.2769 6.3195 6.3195 8.0555 8.0555 8.1229 8.1229 9.0424 9.0424 9.5303 9.5303 10.1694 10.1694 12.6486 12.6486 13.9839 13.9839 13.9988 13.9988 15.0772 15.0772 15.1784 15.1784 k = 0.5000 0.2997 0.6720 ( 4980 PWs) bands (ev): -17.0602 -17.0602 -11.1473 -11.1473 -11.0860 -11.0860 -11.0733 -11.0733 -11.0574 -11.0574 -10.1398 -10.1398 -10.1087 -10.1087 -10.0303 -10.0303 -10.0146 -10.0146 -10.0030 -10.0030 -9.9844 -9.9844 -3.7928 -3.7928 -1.8634 -1.8634 -1.8047 -1.8047 2.3628 2.3628 3.4391 3.4391 5.2489 5.2489 5.3707 5.3707 5.6294 5.6294 5.7555 5.7555 5.8402 5.8402 5.8963 5.8963 6.1958 6.1958 6.2496 6.2496 6.2624 6.2624 6.3145 6.3145 8.0555 8.0555 8.1160 8.1160 9.1681 9.1681 9.5788 9.5788 10.2333 10.2333 12.6418 12.6418 13.9119 13.9119 13.9569 13.9569 14.9916 14.9916 15.1152 15.1152 k = 0.5000 0.2997 0.6510 ( 4982 PWs) bands (ev): -17.0606 -17.0606 -11.1472 -11.1472 -11.0860 -11.0860 -11.0733 -11.0733 -11.0575 -11.0575 -10.1397 -10.1397 -10.1086 -10.1086 -10.0304 -10.0304 -10.0146 -10.0146 -10.0029 -10.0029 -9.9844 -9.9844 -3.7917 -3.7917 -1.8604 -1.8604 -1.8058 -1.8058 2.3710 2.3710 3.4022 3.4022 5.2529 5.2529 5.3770 5.3770 5.6312 5.6312 5.7431 5.7431 5.8392 5.8392 5.8998 5.8998 6.1889 6.1889 6.2246 6.2246 6.2625 6.2625 6.3139 6.3139 8.0459 8.0459 8.1210 8.1210 9.2966 9.2966 9.6354 9.6354 10.3007 10.3007 12.6370 12.6370 13.8261 13.8261 13.9245 13.9245 14.8980 14.8980 15.0556 15.0556 k = 0.5000 0.2997 0.6300 ( 4980 PWs) bands (ev): -17.0609 -17.0609 -11.1472 -11.1472 -11.0859 -11.0859 -11.0734 -11.0734 -11.0576 -11.0576 -10.1397 -10.1397 -10.1086 -10.1086 -10.0305 -10.0305 -10.0147 -10.0147 -10.0027 -10.0027 -9.9844 -9.9844 -3.7906 -3.7906 -1.8573 -1.8573 -1.8068 -1.8068 2.3783 2.3783 3.3651 3.3651 5.2565 5.2565 5.3803 5.3803 5.6347 5.6347 5.7304 5.7304 5.8369 5.8369 5.9049 5.9049 6.1808 6.1808 6.2020 6.2020 6.2627 6.2627 6.3147 6.3147 8.0320 8.0320 8.1341 8.1341 9.4268 9.4268 9.7001 9.7001 10.3716 10.3716 12.6347 12.6347 13.7398 13.7398 13.8883 13.8883 14.7999 14.7999 14.9985 14.9985 k = 0.5000 0.2997 0.6090 ( 4976 PWs) bands (ev): -17.0613 -17.0613 -11.1471 -11.1471 -11.0859 -11.0859 -11.0734 -11.0734 -11.0576 -11.0576 -10.1396 -10.1396 -10.1085 -10.1085 -10.0307 -10.0307 -10.0148 -10.0148 -10.0026 -10.0026 -9.9844 -9.9844 -3.7894 -3.7894 -1.8540 -1.8540 -1.8078 -1.8078 2.3844 2.3844 3.3279 3.3279 5.2598 5.2598 5.3808 5.3808 5.6385 5.6385 5.7178 5.7178 5.8328 5.8328 5.9123 5.9123 6.1677 6.1677 6.1873 6.1873 6.2621 6.2621 6.3160 6.3160 8.0191 8.0191 8.1516 8.1516 9.5572 9.5572 9.7732 9.7732 10.4458 10.4458 12.6351 12.6351 13.6538 13.6538 13.8464 13.8464 14.7015 14.7015 14.9431 14.9431 k = 0.5000 0.2997 0.5880 ( 4972 PWs) bands (ev): -17.0617 -17.0617 -11.1471 -11.1471 -11.0859 -11.0859 -11.0734 -11.0734 -11.0577 -11.0577 -10.1396 -10.1396 -10.1085 -10.1085 -10.0308 -10.0308 -10.0148 -10.0148 -10.0024 -10.0024 -9.9844 -9.9844 -3.7881 -3.7881 -1.8506 -1.8506 -1.8085 -1.8085 2.3891 2.3891 3.2909 3.2909 5.2627 5.2627 5.3787 5.3787 5.6401 5.6401 5.7069 5.7069 5.8268 5.8268 5.9225 5.9225 6.1508 6.1508 6.1803 6.1803 6.2606 6.2606 6.3173 6.3173 8.0097 8.0097 8.1718 8.1718 9.6847 9.6847 9.8568 9.8568 10.5232 10.5232 12.6388 12.6388 13.5690 13.5690 13.7966 13.7966 14.6067 14.6067 14.8892 14.8892 k = 0.5000 0.2997 0.5670 ( 4972 PWs) bands (ev): -17.0620 -17.0620 -11.1470 -11.1470 -11.0858 -11.0858 -11.0734 -11.0734 -11.0577 -11.0577 -10.1395 -10.1395 -10.1085 -10.1085 -10.0309 -10.0309 -10.0149 -10.0149 -10.0022 -10.0022 -9.9845 -9.9845 -3.7867 -3.7867 -1.8470 -1.8470 -1.8090 -1.8090 2.3924 2.3924 3.2543 3.2543 5.2652 5.2652 5.3748 5.3748 5.6369 5.6369 5.6993 5.6993 5.8184 5.8184 5.9360 5.9360 6.1348 6.1348 6.1759 6.1759 6.2583 6.2583 6.3186 6.3186 8.0054 8.0054 8.1945 8.1945 9.8050 9.8050 9.9539 9.9539 10.6036 10.6036 12.6461 12.6461 13.4860 13.4860 13.7366 13.7366 14.5194 14.5194 14.8365 14.8365 k = 0.5000 0.2997 0.5460 ( 4968 PWs) bands (ev): -17.0624 -17.0624 -11.1470 -11.1470 -11.0858 -11.0858 -11.0735 -11.0735 -11.0578 -11.0578 -10.1394 -10.1394 -10.1085 -10.1085 -10.0311 -10.0311 -10.0150 -10.0150 -10.0021 -10.0021 -9.9845 -9.9845 -3.7853 -3.7853 -1.8435 -1.8435 -1.8092 -1.8092 2.3940 2.3940 3.2181 3.2181 5.2674 5.2674 5.3694 5.3694 5.6277 5.6277 5.6954 5.6954 5.8079 5.8079 5.9531 5.9531 6.1212 6.1212 6.1729 6.1729 6.2553 6.2553 6.3200 6.3200 8.0073 8.0073 8.2194 8.2194 9.9145 9.9145 10.0671 10.0671 10.6869 10.6869 12.6575 12.6575 13.4054 13.4054 13.6640 13.6640 14.4432 14.4432 14.7850 14.7850 k = 0.5000 0.2997 0.5250 ( 4978 PWs) bands (ev): -17.0628 -17.0628 -11.1469 -11.1469 -11.0858 -11.0858 -11.0735 -11.0735 -11.0578 -11.0578 -10.1394 -10.1394 -10.1084 -10.1084 -10.0312 -10.0312 -10.0150 -10.0150 -10.0019 -10.0019 -9.9845 -9.9845 -3.7838 -3.7838 -1.8401 -1.8401 -1.8089 -1.8089 2.3939 2.3939 3.1826 3.1826 5.2692 5.2692 5.3630 5.3630 5.6137 5.6137 5.6934 5.6934 5.7953 5.7953 5.9733 5.9733 6.1101 6.1101 6.1706 6.1706 6.2516 6.2516 6.3218 6.3218 8.0160 8.0160 8.2465 8.2465 10.0148 10.0148 10.1933 10.1933 10.7730 10.7730 12.6733 12.6733 13.3277 13.3277 13.5776 13.5776 14.3803 14.3803 14.7346 14.7346 k = 0.5000 0.2997 0.5040 ( 4980 PWs) bands (ev): -17.0632 -17.0632 -11.1469 -11.1469 -11.0857 -11.0857 -11.0736 -11.0736 -11.0579 -11.0579 -10.1393 -10.1393 -10.1084 -10.1084 -10.0313 -10.0313 -10.0151 -10.0151 -10.0017 -10.0017 -9.9845 -9.9845 -3.7822 -3.7822 -1.8370 -1.8370 -1.8080 -1.8080 2.3921 2.3921 3.1479 3.1479 5.2706 5.2706 5.3558 5.3558 5.5970 5.5970 5.6915 5.6915 5.7810 5.7810 5.9962 5.9962 6.1012 6.1012 6.1689 6.1689 6.2476 6.2476 6.3243 6.3243 8.0319 8.0319 8.2759 8.2759 10.1102 10.1102 10.3270 10.3270 10.8617 10.8617 12.6942 12.6942 13.2537 13.2537 13.4780 13.4780 14.3313 14.3313 14.6854 14.6854 k = 0.5000 0.2997 0.4830 ( 4976 PWs) bands (ev): -17.0636 -17.0636 -11.1468 -11.1468 -11.0857 -11.0857 -11.0736 -11.0736 -11.0579 -11.0579 -10.1392 -10.1392 -10.1084 -10.1084 -10.0314 -10.0314 -10.0152 -10.0152 -10.0015 -10.0015 -9.9845 -9.9845 -3.7806 -3.7806 -1.8343 -1.8343 -1.8064 -1.8064 2.3884 2.3884 3.1141 3.1141 5.2717 5.2717 5.3482 5.3482 5.5787 5.5787 5.6886 5.6886 5.7655 5.7655 6.0206 6.0206 6.0942 6.0942 6.1674 6.1674 6.2438 6.2438 6.3281 6.3281 8.0551 8.0551 8.3078 8.3078 10.2039 10.2039 10.4638 10.4638 10.9529 10.9529 12.7205 12.7205 13.1838 13.1838 13.3667 13.3667 14.2954 14.2954 14.6372 14.6372 k = 0.5000 0.2997 0.4620 ( 4984 PWs) bands (ev): -17.0641 -17.0641 -11.1468 -11.1468 -11.0857 -11.0857 -11.0736 -11.0736 -11.0579 -11.0579 -10.1391 -10.1391 -10.1084 -10.1084 -10.0315 -10.0315 -10.0152 -10.0152 -10.0013 -10.0013 -9.9846 -9.9846 -3.7790 -3.7790 -1.8323 -1.8323 -1.8038 -1.8038 2.3830 2.3830 3.0813 3.0813 5.2725 5.2725 5.3401 5.3401 5.5597 5.5597 5.6842 5.6842 5.7491 5.7491 6.0452 6.0452 6.0885 6.0885 6.1660 6.1660 6.2408 6.2408 6.3334 6.3334 8.0855 8.0855 8.3422 8.3422 10.2968 10.2968 10.6010 10.6010 11.0464 11.0464 12.7523 12.7523 13.1189 13.1189 13.2464 13.2464 14.2710 14.2710 14.5901 14.5901 k = 0.5000 0.2997 0.4410 ( 4986 PWs) bands (ev): -17.0645 -17.0645 -11.1467 -11.1467 -11.0857 -11.0857 -11.0737 -11.0737 -11.0580 -11.0580 -10.1391 -10.1391 -10.1084 -10.1084 -10.0316 -10.0316 -10.0153 -10.0153 -10.0011 -10.0011 -9.9846 -9.9846 -3.7773 -3.7773 -1.8309 -1.8309 -1.8003 -1.8003 2.3758 2.3758 3.0496 3.0496 5.2729 5.2729 5.3317 5.3317 5.5404 5.5404 5.6782 5.6782 5.7326 5.7326 6.0685 6.0685 6.0839 6.0839 6.1644 6.1644 6.2398 6.2398 6.3408 6.3408 8.1230 8.1230 8.3794 8.3794 10.3891 10.3891 10.7368 10.7368 11.1422 11.1422 12.7890 12.7890 13.0596 13.0596 13.1209 13.1209 14.2562 14.2562 14.5439 14.5439 k = 0.5000 0.2997 0.4200 ( 4988 PWs) bands (ev): -17.0649 -17.0649 -11.1467 -11.1467 -11.0857 -11.0857 -11.0737 -11.0737 -11.0580 -11.0580 -10.1390 -10.1390 -10.1084 -10.1084 -10.0317 -10.0317 -10.0154 -10.0154 -10.0009 -10.0009 -9.9846 -9.9846 -3.7756 -3.7756 -1.8300 -1.8300 -1.7960 -1.7960 2.3669 2.3669 3.0191 3.0191 5.2730 5.2730 5.3229 5.3229 5.5210 5.5210 5.6705 5.6705 5.7165 5.7165 6.0802 6.0802 6.0885 6.0885 6.1630 6.1630 6.2416 6.2416 6.3509 6.3509 8.1671 8.1671 8.4195 8.4195 10.4805 10.4805 10.8699 10.8699 11.2400 11.2400 12.8249 12.8249 12.9880 12.9880 13.0171 13.0171 14.2496 14.2496 14.4984 14.4984 k = 0.5000 0.2997 0.3990 ( 4976 PWs) bands (ev): -17.0653 -17.0653 -11.1466 -11.1466 -11.0857 -11.0857 -11.0738 -11.0738 -11.0580 -11.0580 -10.1389 -10.1389 -10.1084 -10.1084 -10.0318 -10.0318 -10.0155 -10.0155 -10.0007 -10.0007 -9.9846 -9.9846 -3.7738 -3.7738 -1.8295 -1.8295 -1.7911 -1.7911 2.3565 2.3565 2.9897 2.9897 5.2728 5.2728 5.3140 5.3140 5.5019 5.5019 5.6611 5.6611 5.7015 5.7015 6.0771 6.0771 6.1033 6.1033 6.1624 6.1624 6.2465 6.2465 6.3639 6.3639 8.2173 8.2173 8.4626 8.4626 10.5704 10.5704 10.9991 10.9991 11.3395 11.3395 12.8085 12.8085 12.9080 12.9080 12.9858 12.9858 14.2497 14.2497 14.4529 14.4529 k = 0.5000 0.2997 0.3780 ( 4976 PWs) bands (ev): -17.0657 -17.0657 -11.1466 -11.1466 -11.0856 -11.0856 -11.0738 -11.0738 -11.0580 -11.0580 -10.1389 -10.1389 -10.1084 -10.1084 -10.0319 -10.0319 -10.0155 -10.0155 -10.0006 -10.0006 -9.9847 -9.9847 -3.7721 -3.7721 -1.8293 -1.8293 -1.7858 -1.7858 2.3447 2.3447 2.9617 2.9617 5.2720 5.2720 5.3049 5.3049 5.4831 5.4831 5.6497 5.6497 5.6880 5.6880 6.0745 6.0745 6.1116 6.1116 6.1635 6.1635 6.2542 6.2542 6.3804 6.3804 8.2731 8.2731 8.5090 8.5090 10.6579 10.6579 11.1234 11.1234 11.4406 11.4406 12.6901 12.6901 12.8887 12.8887 13.0100 13.0100 14.2553 14.2553 14.4061 14.4061 k = 0.5000 0.2997 0.3570 ( 4984 PWs) bands (ev): -17.0661 -17.0661 -11.1465 -11.1465 -11.0856 -11.0856 -11.0739 -11.0739 -11.0580 -11.0580 -10.1388 -10.1388 -10.1084 -10.1084 -10.0319 -10.0319 -10.0156 -10.0156 -10.0004 -10.0004 -9.9847 -9.9847 -3.7703 -3.7703 -1.8293 -1.8293 -1.7801 -1.7801 2.3317 2.3317 2.9350 2.9350 5.2706 5.2706 5.2960 5.2960 5.4647 5.4647 5.6367 5.6367 5.6762 5.6762 6.0723 6.0723 6.1140 6.1140 6.1663 6.1663 6.2638 6.2638 6.4001 6.4001 8.3337 8.3337 8.5589 8.5589 10.7420 10.7420 11.2419 11.2419 11.5430 11.5430 12.5536 12.5536 12.8634 12.8634 13.0746 13.0746 14.2636 14.2636 14.3544 14.3544 k = 0.5000 0.2997 0.3360 ( 4980 PWs) bands (ev): -17.0664 -17.0664 -11.1465 -11.1465 -11.0856 -11.0856 -11.0739 -11.0739 -11.0580 -11.0580 -10.1387 -10.1387 -10.1084 -10.1084 -10.0320 -10.0320 -10.0157 -10.0157 -10.0002 -10.0002 -9.9847 -9.9847 -3.7686 -3.7686 -1.8293 -1.8293 -1.7742 -1.7742 2.3176 2.3176 2.9096 2.9096 5.2677 5.2677 5.2879 5.2879 5.4470 5.4470 5.6229 5.6229 5.6659 5.6659 6.0706 6.0706 6.1127 6.1127 6.1696 6.1696 6.2743 6.2743 6.4230 6.4230 8.3985 8.3985 8.6124 8.6124 10.8217 10.8217 11.3540 11.3540 11.6462 11.6462 12.4142 12.4142 12.8412 12.8412 13.1566 13.1566 14.2499 14.2499 14.3049 14.3049 k = 0.5000 0.2997 0.3150 ( 4972 PWs) bands (ev): -17.0668 -17.0668 -11.1464 -11.1464 -11.0856 -11.0856 -11.0739 -11.0739 -11.0580 -11.0580 -10.1387 -10.1387 -10.1085 -10.1085 -10.0320 -10.0320 -10.0157 -10.0157 -10.0000 -10.0000 -9.9848 -9.9848 -3.7669 -3.7669 -1.8295 -1.8295 -1.7682 -1.7682 2.3028 2.3028 2.8857 2.8857 5.2623 5.2623 5.2819 5.2819 5.4300 5.4300 5.6089 5.6089 5.6567 5.6567 6.0692 6.0692 6.1096 6.1096 6.1727 6.1727 6.2848 6.2848 6.4481 6.4481 8.4667 8.4667 8.6696 8.6696 10.8958 10.8958 11.4594 11.4594 11.7500 11.7500 12.2745 12.2745 12.8259 12.8259 13.2498 13.2498 14.1624 14.1624 14.2703 14.2703 k = 0.5000 0.2997 0.2940 ( 4964 PWs) bands (ev): -17.0672 -17.0672 -11.1464 -11.1464 -11.0857 -11.0857 -11.0740 -11.0740 -11.0580 -11.0580 -10.1386 -10.1386 -10.1085 -10.1085 -10.0321 -10.0321 -10.0158 -10.0158 -9.9998 -9.9998 -9.9848 -9.9848 -3.7653 -3.7653 -1.8296 -1.8296 -1.7622 -1.7622 2.2873 2.2873 2.8632 2.8632 5.2542 5.2542 5.2781 5.2781 5.4137 5.4137 5.5954 5.5954 5.6481 5.6481 6.0682 6.0682 6.1058 6.1058 6.1752 6.1752 6.2949 6.2949 6.4746 6.4746 8.5376 8.5376 8.7308 8.7308 10.9633 10.9633 11.5579 11.5579 11.8540 11.8540 12.1356 12.1356 12.8184 12.8184 13.3509 13.3509 14.0625 14.0625 14.2002 14.2002 k = 0.5000 0.2997 0.2730 ( 4968 PWs) bands (ev): -17.0675 -17.0675 -11.1463 -11.1463 -11.0857 -11.0857 -11.0740 -11.0740 -11.0580 -11.0580 -10.1385 -10.1385 -10.1085 -10.1085 -10.0321 -10.0321 -10.0159 -10.0159 -9.9997 -9.9997 -9.9849 -9.9849 -3.7637 -3.7637 -1.8298 -1.8298 -1.7562 -1.7562 2.2715 2.2715 2.8422 2.8422 5.2443 5.2443 5.2758 5.2758 5.3983 5.3983 5.5825 5.5825 5.6401 5.6401 6.0675 6.0675 6.1020 6.1020 6.1772 6.1772 6.3045 6.3045 6.5016 6.5016 8.6102 8.6102 8.7957 8.7957 11.0234 11.0234 11.6498 11.6498 11.9547 11.9547 12.0014 12.0014 12.8181 12.8181 13.4542 13.4542 13.9699 13.9699 14.1172 14.1172 k = 0.5000 0.2997 0.2520 ( 4974 PWs) bands (ev): -17.0678 -17.0678 -11.1463 -11.1463 -11.0857 -11.0857 -11.0741 -11.0741 -11.0580 -11.0580 -10.1385 -10.1385 -10.1085 -10.1085 -10.0322 -10.0322 -10.0159 -10.0159 -9.9995 -9.9995 -9.9849 -9.9849 -3.7621 -3.7621 -1.8300 -1.8300 -1.7503 -1.7503 2.2556 2.2556 2.8226 2.8226 5.2336 5.2336 5.2741 5.2741 5.3838 5.3838 5.5706 5.5706 5.6326 5.6326 6.0672 6.0672 6.0983 6.0983 6.1786 6.1786 6.3134 6.3134 6.5285 6.5285 8.6839 8.6839 8.8642 8.8642 11.0753 11.0753 11.7354 11.7354 11.8609 11.8609 12.0634 12.0634 12.8231 12.8231 13.5447 13.5447 13.9007 13.9007 14.0268 14.0268 k = 0.5000 0.2997 0.2310 ( 4970 PWs) bands (ev): -17.0681 -17.0681 -11.1462 -11.1462 -11.0857 -11.0857 -11.0741 -11.0741 -11.0580 -11.0580 -10.1384 -10.1384 -10.1085 -10.1085 -10.0322 -10.0322 -10.0160 -10.0160 -9.9993 -9.9993 -9.9849 -9.9849 -3.7606 -3.7606 -1.8301 -1.8301 -1.7445 -1.7445 2.2399 2.2399 2.8045 2.8045 5.2228 5.2228 5.2727 5.2727 5.3703 5.3703 5.5599 5.5599 5.6256 5.6256 6.0673 6.0673 6.0949 6.0949 6.1797 6.1797 6.3218 6.3218 6.5545 6.5545 8.7581 8.7581 8.9359 8.9359 11.1189 11.1189 11.7283 11.7283 11.8154 11.8154 12.1658 12.1658 12.8302 12.8302 13.5824 13.5824 13.8933 13.8933 13.9408 13.9408 k = 0.5000 0.2997 0.2100 ( 4962 PWs) bands (ev): -17.0684 -17.0684 -11.1462 -11.1462 -11.0857 -11.0857 -11.0741 -11.0741 -11.0580 -11.0580 -10.1384 -10.1384 -10.1086 -10.1086 -10.0322 -10.0322 -10.0160 -10.0160 -9.9992 -9.9992 -9.9850 -9.9850 -3.7593 -3.7593 -1.8303 -1.8303 -1.7390 -1.7390 2.2245 2.2245 2.7880 2.7880 5.2120 5.2120 5.2715 5.2715 5.3579 5.3579 5.5505 5.5505 5.6190 5.6190 6.0676 6.0676 6.0919 6.0919 6.1804 6.1804 6.3296 6.3296 6.5794 6.5794 8.8322 8.8322 9.0099 9.0099 11.1542 11.1542 11.5988 11.5988 11.8905 11.8905 12.2670 12.2670 12.8343 12.8343 13.5453 13.5453 13.8670 13.8670 13.9712 13.9712 k = 0.5000 0.2997 0.1890 ( 4982 PWs) bands (ev): -17.0687 -17.0687 -11.1462 -11.1462 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1383 -10.1383 -10.1086 -10.1086 -10.0322 -10.0322 -10.0161 -10.0161 -9.9991 -9.9991 -9.9850 -9.9850 -3.7580 -3.7580 -1.8304 -1.8304 -1.7338 -1.7338 2.2098 2.2098 2.7730 2.7730 5.2015 5.2015 5.2703 5.2703 5.3464 5.3464 5.5422 5.5422 5.6128 5.6128 6.0681 6.0681 6.0892 6.0892 6.1809 6.1809 6.3367 6.3367 6.6026 6.6026 8.9057 8.9057 9.0852 9.0852 11.1819 11.1819 11.4733 11.4733 11.9614 11.9614 12.3657 12.3657 12.8298 12.8298 13.4740 13.4740 13.8178 13.8178 14.0875 14.0875 k = 0.5000 0.2997 0.1680 ( 4974 PWs) bands (ev): -17.0689 -17.0689 -11.1461 -11.1461 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1383 -10.1383 -10.1086 -10.1086 -10.0323 -10.0323 -10.0161 -10.0161 -9.9990 -9.9990 -9.9850 -9.9850 -3.7568 -3.7568 -1.8306 -1.8306 -1.7290 -1.7290 2.1960 2.1960 2.7596 2.7596 5.1915 5.1915 5.2693 5.2693 5.3360 5.3360 5.5351 5.5351 5.6071 5.6071 6.0690 6.0690 6.0870 6.0870 6.1812 6.1812 6.3433 6.3433 6.6239 6.6239 8.9779 8.9779 9.1607 9.1607 11.2025 11.2025 11.3528 11.3528 12.0288 12.0288 12.4609 12.4609 12.8123 12.8123 13.3943 13.3943 13.7963 13.7963 14.2067 14.2067 k = 0.5000 0.2997 0.1470 ( 4982 PWs) bands (ev): -17.0691 -17.0691 -11.1461 -11.1461 -11.0857 -11.0857 -11.0742 -11.0742 -11.0580 -11.0580 -10.1383 -10.1383 -10.1087 -10.1087 -10.0323 -10.0323 -10.0162 -10.0162 -9.9988 -9.9988 -9.9851 -9.9851 -3.7557 -3.7557 -1.8307 -1.8307 -1.7246 -1.7246 2.1832 2.1832 2.7477 2.7477 5.1822 5.1822 5.2684 5.2684 5.3266 5.3266 5.5291 5.5291 5.6018 5.6018 6.0700 6.0700 6.0850 6.0850 6.1813 6.1813 6.3493 6.3493 6.6430 6.6430 9.0480 9.0480 9.2347 9.2347 11.2139 11.2139 11.2416 11.2416 12.0932 12.0932 12.5509 12.5509 12.7808 12.7808 13.3145 13.3145 13.8028 13.8028 14.2249 14.2249 k = 0.5000 0.2997 0.1260 ( 4986 PWs) bands (ev): -17.0693 -17.0693 -11.1461 -11.1461 -11.0857 -11.0857 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0162 -10.0162 -9.9987 -9.9987 -9.9851 -9.9851 -3.7548 -3.7548 -1.8308 -1.8308 -1.7206 -1.7206 2.1717 2.1717 2.7374 2.7374 5.1739 5.1739 5.2677 5.2677 5.3183 5.3183 5.5242 5.5242 5.5971 5.5971 6.0710 6.0710 6.0834 6.0834 6.1814 6.1814 6.3544 6.3544 6.6599 6.6599 9.1148 9.1148 9.3057 9.3057 11.1284 11.1284 11.2297 11.2297 12.1548 12.1548 12.6337 12.6337 12.7387 12.7387 13.2384 13.2384 13.8318 13.8318 14.2257 14.2257 k = 0.5000 0.2997 0.1050 ( 4982 PWs) bands (ev): -17.0694 -17.0694 -11.1461 -11.1461 -11.0857 -11.0857 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0162 -10.0162 -9.9987 -9.9987 -9.9851 -9.9851 -3.7540 -3.7540 -1.8309 -1.8309 -1.7172 -1.7172 2.1617 2.1617 2.7286 2.7286 5.1666 5.1666 5.2671 5.2671 5.3112 5.3112 5.5204 5.5204 5.5930 5.5930 6.0720 6.0720 6.0821 6.0821 6.1814 6.1814 6.3590 6.3590 6.6742 6.6742 9.1769 9.1769 9.3720 9.3720 11.0302 11.0302 11.2359 11.2359 12.2134 12.2134 12.6877 12.6877 12.7103 12.7103 13.1686 13.1686 13.8736 13.8736 14.2363 14.2363 k = 0.5000 0.2997 0.0840 ( 4982 PWs) bands (ev): -17.0696 -17.0696 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1382 -10.1382 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9986 -9.9986 -9.9851 -9.9851 -3.7533 -3.7533 -1.8309 -1.8309 -1.7143 -1.7143 2.1533 2.1533 2.7215 2.7215 5.1605 5.1605 5.2668 5.2668 5.3053 5.3053 5.5174 5.5174 5.5895 5.5895 6.0730 6.0730 6.0811 6.0811 6.1812 6.1812 6.3628 6.3628 6.6861 6.6861 9.2324 9.2324 9.4316 9.4316 10.9428 10.9428 11.2397 11.2397 12.2683 12.2683 12.6427 12.6427 12.7676 12.7676 13.1089 13.1089 13.9166 13.9166 14.2609 14.2609 k = 0.5000 0.2997 0.0630 ( 4982 PWs) bands (ev): -17.0697 -17.0697 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9851 -9.9851 -3.7528 -3.7528 -1.8310 -1.8310 -1.7120 -1.7120 2.1466 2.1466 2.7159 2.7159 5.1556 5.1556 5.2666 5.2666 5.3006 5.3006 5.5151 5.5151 5.5867 5.5867 6.0738 6.0738 6.0804 6.0804 6.1811 6.1811 6.3657 6.3657 6.6954 6.6954 9.2790 9.2790 9.4821 9.4821 10.8694 10.8694 11.2417 11.2417 12.3177 12.3177 12.6010 12.6010 12.8078 12.8078 13.0646 13.0646 13.9514 13.9514 14.2998 14.2998 k = 0.5000 0.2997 0.0420 ( 4976 PWs) bands (ev): -17.0697 -17.0697 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9851 -9.9851 -3.7524 -3.7524 -1.8310 -1.8310 -1.7104 -1.7104 2.1417 2.1417 2.7119 2.7119 5.1521 5.1521 5.2666 5.2666 5.2970 5.2970 5.5136 5.5136 5.5847 5.5847 6.0744 6.0744 6.0799 6.0799 6.1811 6.1811 6.3679 6.3679 6.7021 6.7021 9.3145 9.3145 9.5210 9.5210 10.8132 10.8132 11.2427 11.2427 12.3588 12.3588 12.5685 12.5685 12.8251 12.8251 13.0406 13.0406 13.9741 13.9741 14.3458 14.3458 k = 0.5000 0.2997 0.0210 ( 4992 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7522 -3.7522 -1.8310 -1.8310 -1.7094 -1.7094 2.1388 2.1388 2.7095 2.7095 5.1498 5.1498 5.2666 5.2666 5.2948 5.2948 5.5127 5.5127 5.5834 5.5834 6.0748 6.0748 6.0796 6.0796 6.1811 6.1811 6.3691 6.3691 6.7060 6.7060 9.3368 9.3368 9.5458 9.5458 10.7776 10.7776 11.2430 11.2430 12.3869 12.3869 12.5478 12.5478 12.8255 12.8255 13.0337 13.0337 13.9862 13.9862 14.3843 14.3843 k = 0.5000 0.2997 0.0000 ( 4988 PWs) bands (ev): -17.0698 -17.0698 -11.1460 -11.1460 -11.0858 -11.0858 -11.0743 -11.0743 -11.0580 -11.0580 -10.1381 -10.1381 -10.1087 -10.1087 -10.0323 -10.0323 -10.0163 -10.0163 -9.9985 -9.9985 -9.9852 -9.9852 -3.7521 -3.7521 -1.8310 -1.8310 -1.7090 -1.7090 2.1378 2.1378 2.7087 2.7087 5.1491 5.1491 5.2666 5.2666 5.2940 5.2940 5.5124 5.5124 5.5830 5.5830 6.0749 6.0749 6.0794 6.0794 6.1811 6.1811 6.3695 6.3695 6.7075 6.7075 9.3444 9.3444 9.5544 9.5544 10.7654 10.7654 11.2431 11.2431 12.3971 12.3971 12.5408 12.5408 12.8233 12.8233 13.0331 13.0331 13.9899 13.9899 14.3995 14.3995 k = 0.0000 0.0000 0.9726 ( 4978 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0290 -10.0290 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8830 -1.8830 -1.7921 -1.7921 2.2619 2.2619 3.7697 3.7697 5.1984 5.1984 5.2252 5.2252 5.7188 5.7188 5.8031 5.8031 5.8316 5.8316 5.8963 5.8963 6.1825 6.1825 6.3059 6.3059 6.3085 6.3085 6.6902 6.6902 7.9799 7.9799 7.9850 7.9850 8.2302 8.2302 9.4552 9.4552 9.7284 9.7284 12.7613 12.7613 14.2005 14.2005 14.4016 14.4016 15.1451 15.1451 15.5762 15.5762 k = 0.0179 0.0107 0.9726 ( 4974 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0290 -10.0290 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8830 -1.8830 -1.7921 -1.7921 2.2619 2.2619 3.7697 3.7697 5.1985 5.1985 5.2252 5.2252 5.7192 5.7192 5.8031 5.8031 5.8317 5.8317 5.8961 5.8961 6.1830 6.1830 6.3059 6.3059 6.3085 6.3085 6.6879 6.6879 7.9796 7.9796 7.9857 7.9857 8.2332 8.2332 9.4559 9.4559 9.7273 9.7273 12.7473 12.7473 14.2050 14.2050 14.4204 14.4204 15.1453 15.1453 15.5762 15.5762 k = 0.0357 0.0214 0.9726 ( 4978 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0290 -10.0290 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8829 -1.8829 -1.7921 -1.7921 2.2620 2.2620 3.7696 3.7696 5.1986 5.1986 5.2251 5.2251 5.7201 5.7201 5.8030 5.8030 5.8322 5.8322 5.8955 5.8955 6.1843 6.1843 6.3058 6.3058 6.3085 6.3085 6.6808 6.6808 7.9790 7.9790 7.9875 7.9875 8.2419 8.2419 9.4579 9.4579 9.7242 9.7242 12.7074 12.7074 14.2183 14.2183 14.4746 14.4746 15.1461 15.1461 15.5763 15.5763 k = 0.0536 0.0321 0.9726 ( 4976 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0041 -10.0041 -9.9847 -9.9847 -3.7997 -3.7997 -1.8829 -1.8829 -1.7921 -1.7921 2.2621 2.2621 3.7695 3.7695 5.1987 5.1987 5.2251 5.2251 5.7217 5.7217 5.8029 5.8029 5.8328 5.8328 5.8946 5.8946 6.1864 6.1864 6.3058 6.3058 6.3087 6.3087 6.6696 6.6696 7.9784 7.9784 7.9899 7.9899 8.2561 8.2561 9.4614 9.4614 9.7191 9.7191 12.6471 12.6471 14.2405 14.2405 14.5583 14.5583 15.1475 15.1475 15.5764 15.5764 k = 0.0714 0.0428 0.9726 ( 4980 PWs) bands (ev): -17.0577 -17.0577 -11.1475 -11.1475 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7997 -3.7997 -1.8829 -1.8829 -1.7922 -1.7922 2.2622 2.2622 3.7694 3.7694 5.1989 5.1989 5.2250 5.2250 5.7237 5.7237 5.8027 5.8027 5.8338 5.8338 5.8933 5.8933 6.1893 6.1893 6.3056 6.3056 6.3090 6.3090 6.6549 6.6549 7.9778 7.9778 7.9926 7.9926 8.2752 8.2752 9.4662 9.4662 9.7120 9.7120 12.5730 12.5730 14.2713 14.2713 14.6641 14.6641 15.1498 15.1498 15.5763 15.5763 k = 0.0893 0.0535 0.9726 ( 4984 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1091 -10.1091 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7997 -3.7997 -1.8828 -1.8828 -1.7922 -1.7922 2.2623 2.2623 3.7693 3.7693 5.1991 5.1991 5.2249 5.2249 5.7262 5.7262 5.8025 5.8025 5.8351 5.8351 5.8917 5.8917 6.1930 6.1930 6.3054 6.3054 6.3094 6.3094 6.6372 6.6372 7.9772 7.9772 7.9954 7.9954 8.2981 8.2981 9.4724 9.4724 9.7033 9.7033 12.4914 12.4914 14.3104 14.3104 14.7841 14.7841 15.1537 15.1537 15.5756 15.5756 k = 0.1071 0.0642 0.9726 ( 4988 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1090 -10.1090 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9847 -9.9847 -3.7997 -3.7997 -1.8828 -1.8828 -1.7923 -1.7923 2.2625 2.2625 3.7692 3.7692 5.1993 5.1993 5.2248 5.2248 5.7290 5.7290 5.8023 5.8023 5.8367 5.8367 5.8897 5.8897 6.1974 6.1974 6.3052 6.3052 6.3099 6.3099 6.6176 6.6176 7.9767 7.9767 7.9981 7.9981 8.3239 8.3239 9.4798 9.4798 9.6930 9.6930 12.4073 12.4073 14.3574 14.3574 14.9089 14.9089 15.1615 15.1615 15.5720 15.5720 k = 0.1250 0.0749 0.9726 ( 4988 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1090 -10.1090 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8827 -1.8827 -1.7924 -1.7924 2.2626 2.2626 3.7690 3.7690 5.1995 5.1995 5.2246 5.2246 5.7320 5.7320 5.8020 5.8020 5.8387 5.8387 5.8873 5.8873 6.2024 6.2024 6.3050 6.3050 6.3104 6.3104 6.5969 6.5969 7.9762 7.9762 8.0007 8.0007 8.3512 8.3512 9.4885 9.4885 9.6814 9.6814 12.3248 12.3248 14.4121 14.4121 15.0228 15.0228 15.1814 15.1814 15.5563 15.5563 k = 0.1429 0.0856 0.9726 ( 4986 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1402 -10.1402 -10.1090 -10.1090 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8827 -1.8827 -1.7924 -1.7924 2.2628 2.2628 3.7689 3.7689 5.1997 5.1997 5.2245 5.2245 5.7350 5.7350 5.8016 5.8016 5.8411 5.8411 5.8846 5.8846 6.2079 6.2079 6.3047 6.3047 6.3111 6.3111 6.5759 6.5759 7.9757 7.9757 8.0029 8.0029 8.3787 8.3787 9.4983 9.4983 9.6687 9.6687 12.2473 12.2473 14.4738 14.4738 15.0930 15.0930 15.2369 15.2369 15.5073 15.5073 k = 0.1607 0.0963 0.9726 ( 4982 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1403 -10.1403 -10.1090 -10.1090 -10.0291 -10.0291 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8826 -1.8826 -1.7925 -1.7925 2.2630 2.2630 3.7688 3.7688 5.2000 5.2000 5.2244 5.2244 5.7379 5.7379 5.8013 5.8013 5.8439 5.8439 5.8815 5.8815 6.2136 6.2136 6.3045 6.3045 6.3120 6.3120 6.5557 6.5557 7.9753 7.9753 8.0049 8.0049 8.4049 8.4049 9.5091 9.5091 9.6552 9.6552 12.1774 12.1774 14.5421 14.5421 15.1170 15.1170 15.3185 15.3185 15.4321 15.4321 k = 0.1786 0.1070 0.9726 ( 4994 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1403 -10.1403 -10.1090 -10.1090 -10.0291 -10.0291 -10.0139 -10.0139 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8826 -1.8826 -1.7926 -1.7926 2.2631 2.2631 3.7686 3.7686 5.2002 5.2002 5.2243 5.2243 5.7405 5.7405 5.8009 5.8009 5.8470 5.8470 5.8781 5.8781 6.2193 6.2193 6.3041 6.3041 6.3128 6.3128 6.5371 6.5371 7.9749 7.9749 8.0065 8.0065 8.4286 8.4286 9.5207 9.5207 9.6412 9.6412 12.1172 12.1172 14.6164 14.6164 15.1249 15.1249 15.3403 15.3403 15.3943 15.3943 k = 0.1964 0.1177 0.9726 ( 4994 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0865 -11.0865 -11.0730 -11.0730 -11.0569 -11.0569 -10.1403 -10.1403 -10.1090 -10.1090 -10.0291 -10.0291 -10.0139 -10.0139 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8825 -1.8825 -1.7926 -1.7926 2.2632 2.2632 3.7685 3.7685 5.2003 5.2003 5.2243 5.2243 5.7426 5.7426 5.8006 5.8006 5.8505 5.8505 5.8744 5.8744 6.2244 6.2244 6.3039 6.3039 6.3137 6.3137 6.5212 6.5212 7.9747 7.9747 8.0077 8.0077 8.4484 8.4484 9.5329 9.5329 9.6272 9.6272 12.0685 12.0685 14.6960 14.6960 15.1264 15.1264 15.2538 15.2538 15.4377 15.4377 k = 0.2143 0.1284 0.9726 ( 4990 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1090 -10.1090 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8825 -1.8825 -1.7927 -1.7927 2.2633 2.2633 3.7684 3.7684 5.2004 5.2004 5.2243 5.2243 5.7443 5.7443 5.8004 5.8004 5.8542 5.8542 5.8705 5.8705 6.2286 6.2286 6.3036 6.3036 6.3146 6.3146 6.5089 6.5089 7.9745 7.9745 8.0086 8.0086 8.4634 8.4634 9.5450 9.5450 9.6137 9.6137 12.0327 12.0327 14.7801 14.7801 15.1147 15.1147 15.1744 15.1744 15.4636 15.4636 k = 0.2321 0.1391 0.9726 ( 4992 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8824 -1.8824 -1.7927 -1.7927 2.2634 2.2634 3.7684 3.7684 5.2004 5.2004 5.2243 5.2243 5.7453 5.7453 5.8002 5.8002 5.8581 5.8581 5.8666 5.8666 6.2313 6.2313 6.3035 6.3035 6.3152 6.3152 6.5011 6.5011 7.9744 7.9744 8.0092 8.0092 8.4727 8.4727 9.5554 9.5554 9.6025 9.6025 12.0108 12.0108 14.8678 14.8678 15.0496 15.0496 15.1468 15.1468 15.4765 15.4765 k = 0.2500 0.1498 0.9726 ( 4984 PWs) bands (ev): -17.0577 -17.0577 -11.1476 -11.1476 -11.0864 -11.0864 -11.0731 -11.0731 -11.0569 -11.0569 -10.1403 -10.1403 -10.1089 -10.1089 -10.0292 -10.0292 -10.0140 -10.0140 -10.0042 -10.0042 -9.9846 -9.9846 -3.7997 -3.7997 -1.8824 -1.8824 -1.7927 -1.7927 2.2634 2.2634 3.7683 3.7683 5.2003 5.2003 5.2244 5.2244 5.7457 5.7457 5.8002 5.8002 5.8607 5.8607 5.8641 5.8641 6.2323 6.2323 6.3035 6.3035 6.3154 6.3154 6.4984 6.4984 7.9743 7.9743 8.0093 8.0093 8.4758 8.4758 9.5593 9.5593 9.5982 9.5982 12.0034 12.0034 14.9570 14.9570 14.9615 14.9615 15.1439 15.1439 15.4805 15.4805 Writing output data file BaxAgSnx2.save init_run : 0.43s CPU 0.52s WALL ( 1 calls) electrons : 319.62s CPU 323.42s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.03s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 319.61s CPU 323.40s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.10s WALL ( 306 calls) cegterg : 293.11s CPU 295.88s WALL ( 356 calls) Called by sum_band: Called by *egterg: h_psi : 190.05s CPU 191.90s WALL ( 6499 calls) s_psi : 9.58s CPU 9.71s WALL ( 6499 calls) g_psi : 0.36s CPU 0.34s WALL ( 5837 calls) cdiaghg : 88.35s CPU 89.06s WALL ( 6143 calls) cegterg:over : 10.55s CPU 10.77s WALL ( 5837 calls) cegterg:upda : 8.93s CPU 9.02s WALL ( 5837 calls) cegterg:last : 4.26s CPU 4.33s WALL ( 968 calls) cdiaghg:chol : 5.29s CPU 5.17s WALL ( 6143 calls) cdiaghg:inve : 3.70s CPU 3.81s WALL ( 6143 calls) cdiaghg:para : 6.93s CPU 6.72s WALL ( 12286 calls) Called by h_psi: h_psi:vloc : 171.22s CPU 173.31s WALL ( 6499 calls) h_psi:vnl : 18.45s CPU 18.23s WALL ( 6499 calls) add_vuspsi : 10.16s CPU 10.01s WALL ( 6499 calls) General routines calbec : 8.26s CPU 8.20s WALL ( 6499 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 162.26s CPU 163.98s WALL ( 966296 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.52s WALL ( 612 calls) Parallel routines fft_scatter : 50.99s CPU 51.98s WALL ( 966319 calls) PWSCF : 5m43.06s CPU 6m 6.72s WALL This run was terminated on: 14:50:47 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=