Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 2:45:27 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Rb2PdI6.save/ file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 116 50 13 7041 1998 281 Max 117 51 14 7047 2023 287 Sum 8395 3643 979 507127 144719 20395 bravais-lattice index = 14 lattice parameter (alat) = 14.9458 a.u. unit-cell volume = 2360.7200 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 78.00 number of Kohn-Sham states= 94 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 545.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.945823 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pd read from file: /users/gautes/Pseudo/Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 7926b04c0aa9b348bf6cb39d90ce6236 Pseudo is Ultrasoft + core correction, Zval = 18.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 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 Rb read from file: /users/gautes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 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 I 7.00 126.90450 I( 1.00) Pd 18.00 106.42000 Pd( 1.00) Rb 9.00 85.46780 Rb( 1.00) 12 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 [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 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 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 195 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 2) = ( 0.0172414 -0.0099543 0.0140775), wk = 0.0051282 k( 3) = ( 0.0344828 -0.0199086 0.0281551), wk = 0.0051282 k( 4) = ( 0.0517241 -0.0298629 0.0422326), wk = 0.0051282 k( 5) = ( 0.0689655 -0.0398173 0.0563101), wk = 0.0051282 k( 6) = ( 0.0862069 -0.0497716 0.0703876), wk = 0.0051282 k( 7) = ( 0.1034483 -0.0597259 0.0844652), wk = 0.0051282 k( 8) = ( 0.1206897 -0.0696802 0.0985427), wk = 0.0051282 k( 9) = ( 0.1379310 -0.0796345 0.1126202), wk = 0.0051282 k( 10) = ( 0.1551724 -0.0895888 0.1266977), wk = 0.0051282 k( 11) = ( 0.1724138 -0.0995431 0.1407753), wk = 0.0051282 k( 12) = ( 0.1896552 -0.1094975 0.1548528), wk = 0.0051282 k( 13) = ( 0.2068966 -0.1194518 0.1689303), wk = 0.0051282 k( 14) = ( 0.2241379 -0.1294061 0.1830079), wk = 0.0051282 k( 15) = ( 0.2413793 -0.1393604 0.1970854), wk = 0.0051282 k( 16) = ( 0.2586207 -0.1493147 0.2111629), wk = 0.0051282 k( 17) = ( 0.2758621 -0.1592690 0.2252404), wk = 0.0051282 k( 18) = ( 0.2931034 -0.1692234 0.2393180), wk = 0.0051282 k( 19) = ( 0.3103448 -0.1791777 0.2533955), wk = 0.0051282 k( 20) = ( 0.3275862 -0.1891320 0.2674730), wk = 0.0051282 k( 21) = ( 0.3448276 -0.1990863 0.2815505), wk = 0.0051282 k( 22) = ( 0.3620690 -0.2090406 0.2956281), wk = 0.0051282 k( 23) = ( 0.3793103 -0.2189949 0.3097056), wk = 0.0051282 k( 24) = ( 0.3965517 -0.2289492 0.3237831), wk = 0.0051282 k( 25) = ( 0.4137931 -0.2389036 0.3378607), wk = 0.0051282 k( 26) = ( 0.4310345 -0.2488579 0.3519382), wk = 0.0051282 k( 27) = ( 0.4482759 -0.2588122 0.3660157), wk = 0.0051282 k( 28) = ( 0.4655172 -0.2687665 0.3800932), wk = 0.0051282 k( 29) = ( 0.4827586 -0.2787208 0.3941708), wk = 0.0051282 k( 30) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0051282 k( 31) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0051282 k( 32) = ( 0.5000000 -0.2694301 0.4218566), wk = 0.0051282 k( 33) = ( 0.5000000 -0.2501851 0.4354648), wk = 0.0051282 k( 34) = ( 0.5000000 -0.2309401 0.4490731), wk = 0.0051282 k( 35) = ( 0.5000000 -0.2116951 0.4626814), wk = 0.0051282 k( 36) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0051282 k( 37) = ( 0.5000000 -0.1732051 0.4898979), wk = 0.0051282 k( 38) = ( 0.5000000 -0.1539601 0.5035062), wk = 0.0051282 k( 39) = ( 0.5000000 -0.1347151 0.5171145), wk = 0.0051282 k( 40) = ( 0.5000000 -0.1154701 0.5307228), wk = 0.0051282 k( 41) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0051282 k( 42) = ( 0.5000000 -0.0769800 0.5579393), wk = 0.0051282 k( 43) = ( 0.5000000 -0.0577350 0.5715476), wk = 0.0051282 k( 44) = ( 0.5000000 -0.0384900 0.5851559), wk = 0.0051282 k( 45) = ( 0.5000000 -0.0192450 0.5987642), wk = 0.0051282 k( 46) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0051282 k( 47) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0051282 k( 48) = ( 0.4875000 0.0216506 0.6123724), wk = 0.0051282 k( 49) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0051282 k( 50) = ( 0.4625000 0.0649519 0.6123724), wk = 0.0051282 k( 51) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0051282 k( 52) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0051282 k( 53) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0051282 k( 54) = ( 0.4125000 0.1515544 0.6123724), wk = 0.0051282 k( 55) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0051282 k( 56) = ( 0.3875000 0.1948557 0.6123724), wk = 0.0051282 k( 57) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0051282 k( 58) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0051282 k( 59) = ( 0.3625000 0.2092895 0.5919600), wk = 0.0051282 k( 60) = ( 0.3500000 0.2020726 0.5715476), wk = 0.0051282 k( 61) = ( 0.3375000 0.1948557 0.5511352), wk = 0.0051282 k( 62) = ( 0.3250000 0.1876388 0.5307228), wk = 0.0051282 k( 63) = ( 0.3125000 0.1804220 0.5103104), wk = 0.0051282 k( 64) = ( 0.3000000 0.1732051 0.4898979), wk = 0.0051282 k( 65) = ( 0.2875000 0.1659882 0.4694855), wk = 0.0051282 k( 66) = ( 0.2750000 0.1587713 0.4490731), wk = 0.0051282 k( 67) = ( 0.2625000 0.1515544 0.4286607), wk = 0.0051282 k( 68) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0051282 k( 69) = ( 0.2375000 0.1371207 0.3878359), wk = 0.0051282 k( 70) = ( 0.2250000 0.1299038 0.3674235), wk = 0.0051282 k( 71) = ( 0.2125000 0.1226869 0.3470110), wk = 0.0051282 k( 72) = ( 0.2000000 0.1154701 0.3265986), wk = 0.0051282 k( 73) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0051282 k( 74) = ( 0.1750000 0.1010363 0.2857738), wk = 0.0051282 k( 75) = ( 0.1625000 0.0938194 0.2653614), wk = 0.0051282 k( 76) = ( 0.1500000 0.0866025 0.2449490), wk = 0.0051282 k( 77) = ( 0.1375000 0.0793857 0.2245366), wk = 0.0051282 k( 78) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0051282 k( 79) = ( 0.1125000 0.0649519 0.1837117), wk = 0.0051282 k( 80) = ( 0.1000000 0.0577350 0.1632993), wk = 0.0051282 k( 81) = ( 0.0875000 0.0505181 0.1428869), wk = 0.0051282 k( 82) = ( 0.0750000 0.0433013 0.1224745), wk = 0.0051282 k( 83) = ( 0.0625000 0.0360844 0.1020621), wk = 0.0051282 k( 84) = ( 0.0500000 0.0288675 0.0816497), wk = 0.0051282 k( 85) = ( 0.0375000 0.0216506 0.0612372), wk = 0.0051282 k( 86) = ( 0.0250000 0.0144338 0.0408248), wk = 0.0051282 k( 87) = ( 0.0125000 0.0072169 0.0204124), wk = 0.0051282 k( 88) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 90) = ( 0.0200000 0.0115470 0.0081650), wk = 0.0051282 k( 91) = ( 0.0400000 0.0230940 0.0163299), wk = 0.0051282 k( 92) = ( 0.0600000 0.0346410 0.0244949), wk = 0.0051282 k( 93) = ( 0.0800000 0.0461880 0.0326599), wk = 0.0051282 k( 94) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0051282 k( 95) = ( 0.1200000 0.0692820 0.0489898), wk = 0.0051282 k( 96) = ( 0.1400000 0.0808290 0.0571548), wk = 0.0051282 k( 97) = ( 0.1600000 0.0923760 0.0653197), wk = 0.0051282 k( 98) = ( 0.1800000 0.1039230 0.0734847), wk = 0.0051282 k( 99) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0051282 k( 100) = ( 0.2200000 0.1270171 0.0898146), wk = 0.0051282 k( 101) = ( 0.2400000 0.1385641 0.0979796), wk = 0.0051282 k( 102) = ( 0.2600000 0.1501111 0.1061446), wk = 0.0051282 k( 103) = ( 0.2800000 0.1616581 0.1143095), wk = 0.0051282 k( 104) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0051282 k( 105) = ( 0.3200000 0.1847521 0.1306395), wk = 0.0051282 k( 106) = ( 0.3400000 0.1962991 0.1388044), wk = 0.0051282 k( 107) = ( 0.3600000 0.2078461 0.1469694), wk = 0.0051282 k( 108) = ( 0.3800000 0.2193931 0.1551344), wk = 0.0051282 k( 109) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0051282 k( 110) = ( 0.4200000 0.2424871 0.1714643), wk = 0.0051282 k( 111) = ( 0.4400000 0.2540341 0.1796292), wk = 0.0051282 k( 112) = ( 0.4600000 0.2655811 0.1877942), wk = 0.0051282 k( 113) = ( 0.4800000 0.2771281 0.1959592), wk = 0.0051282 k( 114) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0051282 k( 115) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0051282 k( 116) = ( 0.5069444 0.2686283 0.2154644), wk = 0.0051282 k( 117) = ( 0.5138889 0.2485814 0.2268046), wk = 0.0051282 k( 118) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0051282 k( 119) = ( 0.5277778 0.2084876 0.2494851), wk = 0.0051282 k( 120) = ( 0.5347222 0.1884407 0.2608253), wk = 0.0051282 k( 121) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0051282 k( 122) = ( 0.5486111 0.1483469 0.2835058), wk = 0.0051282 k( 123) = ( 0.5555556 0.1283001 0.2948460), wk = 0.0051282 k( 124) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0051282 k( 125) = ( 0.5694444 0.0882063 0.3175264), wk = 0.0051282 k( 126) = ( 0.5763889 0.0681594 0.3288667), wk = 0.0051282 k( 127) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0051282 k( 128) = ( 0.5902778 0.0280656 0.3515471), wk = 0.0051282 k( 129) = ( 0.5972222 0.0080188 0.3628874), wk = 0.0051282 k( 130) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0051282 k( 131) = ( 0.6111111 -0.0320750 0.3855678), wk = 0.0051282 k( 132) = ( 0.6180556 -0.0521219 0.3969081), wk = 0.0051282 k( 133) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0051282 k( 134) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0051282 k( 135) = ( 0.6125000 -0.0649519 0.4286607), wk = 0.0051282 k( 136) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0051282 k( 137) = ( 0.5875000 -0.0505181 0.4694855), wk = 0.0051282 k( 138) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0051282 k( 139) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0051282 k( 140) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0051282 k( 141) = ( 0.5375000 -0.0216506 0.5511352), wk = 0.0051282 k( 142) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0051282 k( 143) = ( 0.5125000 -0.0072169 0.5919600), wk = 0.0051282 k( 144) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0051282 k( 145) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0051282 k( 146) = ( 0.5000000 0.0144338 0.5919600), wk = 0.0051282 k( 147) = ( 0.5000000 0.0288675 0.5715476), wk = 0.0051282 k( 148) = ( 0.5000000 0.0433013 0.5511352), wk = 0.0051282 k( 149) = ( 0.5000000 0.0577350 0.5307228), wk = 0.0051282 k( 150) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0051282 k( 151) = ( 0.5000000 0.0866025 0.4898979), wk = 0.0051282 k( 152) = ( 0.5000000 0.1010363 0.4694855), wk = 0.0051282 k( 153) = ( 0.5000000 0.1154701 0.4490731), wk = 0.0051282 k( 154) = ( 0.5000000 0.1299038 0.4286607), wk = 0.0051282 k( 155) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0051282 k( 156) = ( 0.5000000 0.1587713 0.3878359), wk = 0.0051282 k( 157) = ( 0.5000000 0.1732051 0.3674235), wk = 0.0051282 k( 158) = ( 0.5000000 0.1876388 0.3470110), wk = 0.0051282 k( 159) = ( 0.5000000 0.2020726 0.3265986), wk = 0.0051282 k( 160) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0051282 k( 161) = ( 0.5000000 0.2309401 0.2857738), wk = 0.0051282 k( 162) = ( 0.5000000 0.2453739 0.2653614), wk = 0.0051282 k( 163) = ( 0.5000000 0.2598076 0.2449490), wk = 0.0051282 k( 164) = ( 0.5000000 0.2742414 0.2245366), wk = 0.0051282 k( 165) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0051282 k( 166) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0051282 k( 167) = ( 0.4930556 0.2846658 0.2268046), wk = 0.0051282 k( 168) = ( 0.4861111 0.2806564 0.2494851), wk = 0.0051282 k( 169) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0051282 k( 170) = ( 0.4722222 0.2726376 0.2948460), wk = 0.0051282 k( 171) = ( 0.4652778 0.2686283 0.3175264), wk = 0.0051282 k( 172) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0051282 k( 173) = ( 0.4513889 0.2606095 0.3628874), wk = 0.0051282 k( 174) = ( 0.4444444 0.2566001 0.3855678), wk = 0.0051282 k( 175) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0051282 k( 176) = ( 0.4305556 0.2485814 0.4309287), wk = 0.0051282 k( 177) = ( 0.4236111 0.2445720 0.4536092), wk = 0.0051282 k( 178) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0051282 k( 179) = ( 0.4097222 0.2365532 0.4989701), wk = 0.0051282 k( 180) = ( 0.4027778 0.2325439 0.5216506), wk = 0.0051282 k( 181) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0051282 k( 182) = ( 0.3888889 0.2245251 0.5670115), wk = 0.0051282 k( 183) = ( 0.3819444 0.2205157 0.5896920), wk = 0.0051282 k( 184) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0051282 k( 185) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0051282 k( 186) = ( 0.6125000 -0.0938194 0.4082483), wk = 0.0051282 k( 187) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0051282 k( 188) = ( 0.5875000 -0.1371207 0.4082483), wk = 0.0051282 k( 189) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0051282 k( 190) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0051282 k( 191) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0051282 k( 192) = ( 0.5375000 -0.2237232 0.4082483), wk = 0.0051282 k( 193) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0051282 k( 194) = ( 0.5125000 -0.2670245 0.4082483), wk = 0.0051282 k( 195) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0051282 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 2) = ( 0.0172414 0.0000000 0.0172414), wk = 0.0051282 k( 3) = ( 0.0344828 0.0000000 0.0344828), wk = 0.0051282 k( 4) = ( 0.0517241 0.0000000 0.0517241), wk = 0.0051282 k( 5) = ( 0.0689655 0.0000000 0.0689655), wk = 0.0051282 k( 6) = ( 0.0862069 -0.0000000 0.0862069), wk = 0.0051282 k( 7) = ( 0.1034483 0.0000000 0.1034483), wk = 0.0051282 k( 8) = ( 0.1206897 0.0000000 0.1206897), wk = 0.0051282 k( 9) = ( 0.1379310 0.0000000 0.1379310), wk = 0.0051282 k( 10) = ( 0.1551724 -0.0000000 0.1551724), wk = 0.0051282 k( 11) = ( 0.1724138 -0.0000000 0.1724138), wk = 0.0051282 k( 12) = ( 0.1896552 0.0000000 0.1896552), wk = 0.0051282 k( 13) = ( 0.2068966 0.0000000 0.2068966), wk = 0.0051282 k( 14) = ( 0.2241379 -0.0000000 0.2241379), wk = 0.0051282 k( 15) = ( 0.2413793 -0.0000000 0.2413793), wk = 0.0051282 k( 16) = ( 0.2586207 0.0000000 0.2586207), wk = 0.0051282 k( 17) = ( 0.2758621 -0.0000000 0.2758621), wk = 0.0051282 k( 18) = ( 0.2931034 -0.0000000 0.2931034), wk = 0.0051282 k( 19) = ( 0.3103448 0.0000000 0.3103448), wk = 0.0051282 k( 20) = ( 0.3275862 -0.0000000 0.3275862), wk = 0.0051282 k( 21) = ( 0.3448276 -0.0000000 0.3448276), wk = 0.0051282 k( 22) = ( 0.3620690 -0.0000000 0.3620690), wk = 0.0051282 k( 23) = ( 0.3793103 0.0000000 0.3793103), wk = 0.0051282 k( 24) = ( 0.3965517 -0.0000000 0.3965517), wk = 0.0051282 k( 25) = ( 0.4137931 0.0000000 0.4137931), wk = 0.0051282 k( 26) = ( 0.4310345 0.0000000 0.4310345), wk = 0.0051282 k( 27) = ( 0.4482759 -0.0000000 0.4482759), wk = 0.0051282 k( 28) = ( 0.4655172 -0.0000000 0.4655172), wk = 0.0051282 k( 29) = ( 0.4827586 -0.0000000 0.4827586), wk = 0.0051282 k( 30) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0051282 k( 31) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0051282 k( 32) = ( 0.5000000 0.0166667 0.5166667), wk = 0.0051282 k( 33) = ( 0.5000000 0.0333333 0.5333333), wk = 0.0051282 k( 34) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0051282 k( 35) = ( 0.5000000 0.0666667 0.5666667), wk = 0.0051282 k( 36) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0051282 k( 37) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0051282 k( 38) = ( 0.5000000 0.1166667 0.6166667), wk = 0.0051282 k( 39) = ( 0.5000000 0.1333333 0.6333333), wk = 0.0051282 k( 40) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0051282 k( 41) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0051282 k( 42) = ( 0.5000000 0.1833333 0.6833333), wk = 0.0051282 k( 43) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0051282 k( 44) = ( 0.5000000 0.2166667 0.7166667), wk = 0.0051282 k( 45) = ( 0.5000000 0.2333333 0.7333333), wk = 0.0051282 k( 46) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0051282 k( 47) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0051282 k( 48) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0051282 k( 49) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0051282 k( 50) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0051282 k( 51) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0051282 k( 52) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0051282 k( 53) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0051282 k( 54) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0051282 k( 55) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0051282 k( 56) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0051282 k( 57) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0051282 k( 58) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0051282 k( 59) = ( 0.3625000 0.3625000 0.7250000), wk = 0.0051282 k( 60) = ( 0.3500000 0.3500000 0.7000000), wk = 0.0051282 k( 61) = ( 0.3375000 0.3375000 0.6750000), wk = 0.0051282 k( 62) = ( 0.3250000 0.3250000 0.6500000), wk = 0.0051282 k( 63) = ( 0.3125000 0.3125000 0.6250000), wk = 0.0051282 k( 64) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0051282 k( 65) = ( 0.2875000 0.2875000 0.5750000), wk = 0.0051282 k( 66) = ( 0.2750000 0.2750000 0.5500000), wk = 0.0051282 k( 67) = ( 0.2625000 0.2625000 0.5250000), wk = 0.0051282 k( 68) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0051282 k( 69) = ( 0.2375000 0.2375000 0.4750000), wk = 0.0051282 k( 70) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0051282 k( 71) = ( 0.2125000 0.2125000 0.4250000), wk = 0.0051282 k( 72) = ( 0.2000000 0.2000000 0.4000000), wk = 0.0051282 k( 73) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0051282 k( 74) = ( 0.1750000 0.1750000 0.3500000), wk = 0.0051282 k( 75) = ( 0.1625000 0.1625000 0.3250000), wk = 0.0051282 k( 76) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0051282 k( 77) = ( 0.1375000 0.1375000 0.2750000), wk = 0.0051282 k( 78) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0051282 k( 79) = ( 0.1125000 0.1125000 0.2250000), wk = 0.0051282 k( 80) = ( 0.1000000 0.1000000 0.2000000), wk = 0.0051282 k( 81) = ( 0.0875000 0.0875000 0.1750000), wk = 0.0051282 k( 82) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0051282 k( 83) = ( 0.0625000 0.0625000 0.1250000), wk = 0.0051282 k( 84) = ( 0.0500000 0.0500000 0.1000000), wk = 0.0051282 k( 85) = ( 0.0375000 0.0375000 0.0750000), wk = 0.0051282 k( 86) = ( 0.0250000 0.0250000 0.0500000), wk = 0.0051282 k( 87) = ( 0.0125000 0.0125000 0.0250000), wk = 0.0051282 k( 88) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 89) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051282 k( 90) = ( 0.0200000 0.0200000 0.0200000), wk = 0.0051282 k( 91) = ( 0.0400000 0.0400000 0.0400000), wk = 0.0051282 k( 92) = ( 0.0600000 0.0600000 0.0600000), wk = 0.0051282 k( 93) = ( 0.0800000 0.0800000 0.0800000), wk = 0.0051282 k( 94) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0051282 k( 95) = ( 0.1200000 0.1200000 0.1200000), wk = 0.0051282 k( 96) = ( 0.1400000 0.1400000 0.1400000), wk = 0.0051282 k( 97) = ( 0.1600000 0.1600000 0.1600000), wk = 0.0051282 k( 98) = ( 0.1800000 0.1800000 0.1800000), wk = 0.0051282 k( 99) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0051282 k( 100) = ( 0.2200000 0.2200000 0.2200000), wk = 0.0051282 k( 101) = ( 0.2400000 0.2400000 0.2400000), wk = 0.0051282 k( 102) = ( 0.2600000 0.2600000 0.2600000), wk = 0.0051282 k( 103) = ( 0.2800000 0.2800000 0.2800000), wk = 0.0051282 k( 104) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0051282 k( 105) = ( 0.3200000 0.3200000 0.3200000), wk = 0.0051282 k( 106) = ( 0.3400000 0.3400000 0.3400000), wk = 0.0051282 k( 107) = ( 0.3600000 0.3600000 0.3600000), wk = 0.0051282 k( 108) = ( 0.3800000 0.3800000 0.3800000), wk = 0.0051282 k( 109) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0051282 k( 110) = ( 0.4200000 0.4200000 0.4200000), wk = 0.0051282 k( 111) = ( 0.4400000 0.4400000 0.4400000), wk = 0.0051282 k( 112) = ( 0.4600000 0.4600000 0.4600000), wk = 0.0051282 k( 113) = ( 0.4800000 0.4800000 0.4800000), wk = 0.0051282 k( 114) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0051282 k( 115) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0051282 k( 116) = ( 0.5069444 0.4861111 0.5069444), wk = 0.0051282 k( 117) = ( 0.5138889 0.4722222 0.5138889), wk = 0.0051282 k( 118) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0051282 k( 119) = ( 0.5277778 0.4444444 0.5277778), wk = 0.0051282 k( 120) = ( 0.5347222 0.4305556 0.5347222), wk = 0.0051282 k( 121) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0051282 k( 122) = ( 0.5486111 0.4027778 0.5486111), wk = 0.0051282 k( 123) = ( 0.5555556 0.3888889 0.5555556), wk = 0.0051282 k( 124) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0051282 k( 125) = ( 0.5694444 0.3611111 0.5694444), wk = 0.0051282 k( 126) = ( 0.5763889 0.3472222 0.5763889), wk = 0.0051282 k( 127) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0051282 k( 128) = ( 0.5902778 0.3194444 0.5902778), wk = 0.0051282 k( 129) = ( 0.5972222 0.3055556 0.5972222), wk = 0.0051282 k( 130) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0051282 k( 131) = ( 0.6111111 0.2777778 0.6111111), wk = 0.0051282 k( 132) = ( 0.6180556 0.2638889 0.6180556), wk = 0.0051282 k( 133) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0051282 k( 134) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0051282 k( 135) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0051282 k( 136) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0051282 k( 137) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0051282 k( 138) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0051282 k( 139) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0051282 k( 140) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0051282 k( 141) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0051282 k( 142) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0051282 k( 143) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0051282 k( 144) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0051282 k( 145) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0051282 k( 146) = ( 0.5000000 0.2625000 0.7375000), wk = 0.0051282 k( 147) = ( 0.5000000 0.2750000 0.7250000), wk = 0.0051282 k( 148) = ( 0.5000000 0.2875000 0.7125000), wk = 0.0051282 k( 149) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0051282 k( 150) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0051282 k( 151) = ( 0.5000000 0.3250000 0.6750000), wk = 0.0051282 k( 152) = ( 0.5000000 0.3375000 0.6625000), wk = 0.0051282 k( 153) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0051282 k( 154) = ( 0.5000000 0.3625000 0.6375000), wk = 0.0051282 k( 155) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0051282 k( 156) = ( 0.5000000 0.3875000 0.6125000), wk = 0.0051282 k( 157) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0051282 k( 158) = ( 0.5000000 0.4125000 0.5875000), wk = 0.0051282 k( 159) = ( 0.5000000 0.4250000 0.5750000), wk = 0.0051282 k( 160) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0051282 k( 161) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0051282 k( 162) = ( 0.5000000 0.4625000 0.5375000), wk = 0.0051282 k( 163) = ( 0.5000000 0.4750000 0.5250000), wk = 0.0051282 k( 164) = ( 0.5000000 0.4875000 0.5125000), wk = 0.0051282 k( 165) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0051282 k( 166) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0051282 k( 167) = ( 0.4930556 0.4930556 0.5138889), wk = 0.0051282 k( 168) = ( 0.4861111 0.4861111 0.5277778), wk = 0.0051282 k( 169) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0051282 k( 170) = ( 0.4722222 0.4722222 0.5555556), wk = 0.0051282 k( 171) = ( 0.4652778 0.4652778 0.5694444), wk = 0.0051282 k( 172) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0051282 k( 173) = ( 0.4513889 0.4513889 0.5972222), wk = 0.0051282 k( 174) = ( 0.4444444 0.4444444 0.6111111), wk = 0.0051282 k( 175) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0051282 k( 176) = ( 0.4305556 0.4305556 0.6388889), wk = 0.0051282 k( 177) = ( 0.4236111 0.4236111 0.6527778), wk = 0.0051282 k( 178) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0051282 k( 179) = ( 0.4097222 0.4097222 0.6805556), wk = 0.0051282 k( 180) = ( 0.4027778 0.4027778 0.6944444), wk = 0.0051282 k( 181) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0051282 k( 182) = ( 0.3888889 0.3888889 0.7222222), wk = 0.0051282 k( 183) = ( 0.3819444 0.3819444 0.7361111), wk = 0.0051282 k( 184) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0051282 k( 185) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0051282 k( 186) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0051282 k( 187) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0051282 k( 188) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0051282 k( 189) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0051282 k( 190) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0051282 k( 191) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0051282 k( 192) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0051282 k( 193) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0051282 k( 194) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0051282 k( 195) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0051282 Dense grid: 507127 G-vectors FFT dimensions: ( 120, 120, 120) Smooth grid: 144719 G-vectors FFT dimensions: ( 75, 75, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.72 Mb ( 504, 94) NL pseudopotentials 1.18 Mb ( 252, 306) Each V/rho on FFT grid 0.44 Mb ( 28800) Each G-vector array 0.05 Mb ( 7042) G-vector shells 0.01 Mb ( 1776) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.89 Mb ( 504, 376) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.88 Mb ( 306, 2, 94) The potential is recalculated from file : ./Rb2PdI6.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.7 secs Computing kpt #: 2 total cpu time spent up to now is 11.2 secs Computing kpt #: 3 total cpu time spent up to now is 15.1 secs Computing kpt #: 4 total cpu time spent up to now is 18.7 secs Computing kpt #: 5 total cpu time spent up to now is 22.0 secs Computing kpt #: 6 total cpu time spent up to now is 25.7 secs Computing kpt #: 7 total cpu time spent up to now is 30.0 secs Computing kpt #: 8 total cpu time spent up to now is 36.4 secs Computing kpt #: 9 total cpu time spent up to now is 39.9 secs Computing kpt #: 10 total cpu time spent up to now is 43.5 secs Computing kpt #: 11 total cpu time spent up to now is 47.0 secs Computing kpt #: 12 total cpu time spent up to now is 50.7 secs Computing kpt #: 13 total cpu time spent up to now is 54.2 secs Computing kpt #: 14 total cpu time spent up to now is 57.7 secs Computing kpt #: 15 total cpu time spent up to now is 61.3 secs Computing kpt #: 16 total cpu time spent up to now is 64.8 secs Computing kpt #: 17 total cpu time spent up to now is 68.4 secs Computing kpt #: 18 total cpu time spent up to now is 72.0 secs Computing kpt #: 19 total cpu time spent up to now is 75.6 secs Computing kpt #: 20 total cpu time spent up to now is 79.1 secs Computing kpt #: 21 total cpu time spent up to now is 82.7 secs Computing kpt #: 22 total cpu time spent up to now is 86.3 secs Computing kpt #: 23 total cpu time spent up to now is 89.9 secs Computing kpt #: 24 total cpu time spent up to now is 93.6 secs Computing kpt #: 25 total cpu time spent up to now is 97.2 secs Computing kpt #: 26 total cpu time spent up to now is 100.7 secs Computing kpt #: 27 total cpu time spent up to now is 104.4 secs Computing kpt #: 28 total cpu time spent up to now is 108.0 secs Computing kpt #: 29 total cpu time spent up to now is 111.6 secs Computing kpt #: 30 total cpu time spent up to now is 115.1 secs Computing kpt #: 31 total cpu time spent up to now is 118.9 secs Computing kpt #: 32 total cpu time spent up to now is 122.6 secs Computing kpt #: 33 total cpu time spent up to now is 126.1 secs Computing kpt #: 34 total cpu time spent up to now is 129.9 secs Computing kpt #: 35 total cpu time spent up to now is 133.7 secs Computing kpt #: 36 total cpu time spent up to now is 137.3 secs Computing kpt #: 37 total cpu time spent up to now is 141.1 secs Computing kpt #: 38 total cpu time spent up to now is 144.8 secs Computing kpt #: 39 total cpu time spent up to now is 148.6 secs Computing kpt #: 40 total cpu time spent up to now is 152.3 secs Computing kpt #: 41 total cpu time spent up to now is 156.0 secs Computing kpt #: 42 total cpu time spent up to now is 159.9 secs Computing kpt #: 43 total cpu time spent up to now is 163.7 secs Computing kpt #: 44 total cpu time spent up to now is 167.8 secs Computing kpt #: 45 total cpu time spent up to now is 171.9 secs Computing kpt #: 46 total cpu time spent up to now is 175.6 secs Computing kpt #: 47 total cpu time spent up to now is 179.4 secs Computing kpt #: 48 total cpu time spent up to now is 184.0 secs Computing kpt #: 49 total cpu time spent up to now is 188.4 secs Computing kpt #: 50 total cpu time spent up to now is 192.3 secs Computing kpt #: 51 total cpu time spent up to now is 196.2 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 203.8 secs Computing kpt #: 53 total cpu time spent up to now is 207.8 secs Computing kpt #: 54 total cpu time spent up to now is 211.6 secs Computing kpt #: 55 total cpu time spent up to now is 215.3 secs Computing kpt #: 56 total cpu time spent up to now is 219.1 secs Computing kpt #: 57 total cpu time spent up to now is 222.8 secs Computing kpt #: 58 total cpu time spent up to now is 226.5 secs Computing kpt #: 59 total cpu time spent up to now is 230.2 secs Computing kpt #: 60 total cpu time spent up to now is 234.0 secs Computing kpt #: 61 total cpu time spent up to now is 237.7 secs Computing kpt #: 62 total cpu time spent up to now is 241.4 secs Computing kpt #: 63 total cpu time spent up to now is 244.9 secs Computing kpt #: 64 total cpu time spent up to now is 248.5 secs Computing kpt #: 65 total cpu time spent up to now is 252.0 secs Computing kpt #: 66 total cpu time spent up to now is 255.6 secs Computing kpt #: 67 total cpu time spent up to now is 259.1 secs Computing kpt #: 68 total cpu time spent up to now is 262.6 secs Computing kpt #: 69 total cpu time spent up to now is 265.7 secs Computing kpt #: 70 total cpu time spent up to now is 269.2 secs Computing kpt #: 71 total cpu time spent up to now is 272.7 secs Computing kpt #: 72 total cpu time spent up to now is 276.3 secs Computing kpt #: 73 total cpu time spent up to now is 279.8 secs Computing kpt #: 74 total cpu time spent up to now is 283.3 secs Computing kpt #: 75 total cpu time spent up to now is 286.6 secs Computing kpt #: 76 total cpu time spent up to now is 290.1 secs Computing kpt #: 77 total cpu time spent up to now is 293.6 secs Computing kpt #: 78 total cpu time spent up to now is 297.1 secs Computing kpt #: 79 total cpu time spent up to now is 300.7 secs Computing kpt #: 80 total cpu time spent up to now is 304.3 secs Computing kpt #: 81 total cpu time spent up to now is 307.8 secs Computing kpt #: 82 total cpu time spent up to now is 311.4 secs Computing kpt #: 83 total cpu time spent up to now is 314.9 secs Computing kpt #: 84 total cpu time spent up to now is 318.4 secs Computing kpt #: 85 total cpu time spent up to now is 322.4 secs Computing kpt #: 86 total cpu time spent up to now is 326.3 secs Computing kpt #: 87 total cpu time spent up to now is 329.9 secs Computing kpt #: 88 total cpu time spent up to now is 334.3 secs Computing kpt #: 89 total cpu time spent up to now is 338.3 secs Computing kpt #: 90 total cpu time spent up to now is 341.8 secs Computing kpt #: 91 total cpu time spent up to now is 345.8 secs Computing kpt #: 92 total cpu time spent up to now is 349.7 secs Computing kpt #: 93 total cpu time spent up to now is 353.1 secs Computing kpt #: 94 total cpu time spent up to now is 356.6 secs Computing kpt #: 95 total cpu time spent up to now is 360.2 secs Computing kpt #: 96 total cpu time spent up to now is 363.7 secs Computing kpt #: 97 total cpu time spent up to now is 367.2 secs Computing kpt #: 98 total cpu time spent up to now is 370.6 secs Computing kpt #: 99 total cpu time spent up to now is 373.8 secs Computing kpt #: 100 total cpu time spent up to now is 377.0 secs Computing kpt #: 101 total cpu time spent up to now is 380.3 secs Computing kpt #: 102 total cpu time spent up to now is 383.2 secs Computing kpt #: 103 total cpu time spent up to now is 386.1 secs Computing kpt #: 104 total cpu time spent up to now is 389.0 secs Computing kpt #: 105 total cpu time spent up to now is 391.9 secs Computing kpt #: 106 total cpu time spent up to now is 395.2 secs Computing kpt #: 107 total cpu time spent up to now is 398.6 secs Computing kpt #: 108 total cpu time spent up to now is 401.9 secs Computing kpt #: 109 total cpu time spent up to now is 405.2 secs Computing kpt #: 110 total cpu time spent up to now is 408.5 secs Computing kpt #: 111 total cpu time spent up to now is 412.1 secs Computing kpt #: 112 total cpu time spent up to now is 415.6 secs Computing kpt #: 113 total cpu time spent up to now is 419.2 secs Computing kpt #: 114 total cpu time spent up to now is 422.7 secs Computing kpt #: 115 total cpu time spent up to now is 426.3 secs Computing kpt #: 116 total cpu time spent up to now is 429.9 secs Computing kpt #: 117 total cpu time spent up to now is 433.4 secs Computing kpt #: 118 total cpu time spent up to now is 437.0 secs Computing kpt #: 119 total cpu time spent up to now is 440.6 secs Computing kpt #: 120 total cpu time spent up to now is 444.2 secs Computing kpt #: 121 total cpu time spent up to now is 447.7 secs Computing kpt #: 122 total cpu time spent up to now is 451.3 secs Computing kpt #: 123 total cpu time spent up to now is 454.8 secs Computing kpt #: 124 total cpu time spent up to now is 458.4 secs Computing kpt #: 125 total cpu time spent up to now is 462.0 secs Computing kpt #: 126 total cpu time spent up to now is 465.6 secs Computing kpt #: 127 total cpu time spent up to now is 469.1 secs Computing kpt #: 128 total cpu time spent up to now is 472.9 secs Computing kpt #: 129 total cpu time spent up to now is 476.7 secs Computing kpt #: 130 total cpu time spent up to now is 480.5 secs Computing kpt #: 131 total cpu time spent up to now is 484.2 secs Computing kpt #: 132 total cpu time spent up to now is 487.9 secs Computing kpt #: 133 total cpu time spent up to now is 491.5 secs Computing kpt #: 134 total cpu time spent up to now is 495.2 secs Computing kpt #: 135 total cpu time spent up to now is 498.9 secs Computing kpt #: 136 total cpu time spent up to now is 502.6 secs Computing kpt #: 137 total cpu time spent up to now is 506.3 secs Computing kpt #: 138 total cpu time spent up to now is 510.1 secs Computing kpt #: 139 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 518.2 secs Computing kpt #: 140 total cpu time spent up to now is 522.8 secs Computing kpt #: 141 total cpu time spent up to now is 527.4 secs Computing kpt #: 142 total cpu time spent up to now is 531.4 secs Computing kpt #: 143 total cpu time spent up to now is 535.2 secs Computing kpt #: 144 total cpu time spent up to now is 539.2 secs Computing kpt #: 145 total cpu time spent up to now is 543.0 secs Computing kpt #: 146 total cpu time spent up to now is 547.0 secs Computing kpt #: 147 total cpu time spent up to now is 551.1 secs Computing kpt #: 148 total cpu time spent up to now is 554.9 secs Computing kpt #: 149 total cpu time spent up to now is 558.8 secs Computing kpt #: 150 total cpu time spent up to now is 562.6 secs Computing kpt #: 151 total cpu time spent up to now is 566.3 secs Computing kpt #: 152 total cpu time spent up to now is 569.9 secs Computing kpt #: 153 total cpu time spent up to now is 573.2 secs Computing kpt #: 154 total cpu time spent up to now is 576.6 secs Computing kpt #: 155 total cpu time spent up to now is 580.0 secs Computing kpt #: 156 total cpu time spent up to now is 583.5 secs Computing kpt #: 157 total cpu time spent up to now is 587.1 secs Computing kpt #: 158 total cpu time spent up to now is 590.6 secs Computing kpt #: 159 total cpu time spent up to now is 594.3 secs Computing kpt #: 160 total cpu time spent up to now is 597.8 secs Computing kpt #: 161 total cpu time spent up to now is 601.3 secs Computing kpt #: 162 total cpu time spent up to now is 604.8 secs Computing kpt #: 163 total cpu time spent up to now is 608.4 secs Computing kpt #: 164 total cpu time spent up to now is 611.9 secs Computing kpt #: 165 total cpu time spent up to now is 615.4 secs Computing kpt #: 166 total cpu time spent up to now is 618.9 secs Computing kpt #: 167 total cpu time spent up to now is 622.5 secs Computing kpt #: 168 total cpu time spent up to now is 626.3 secs Computing kpt #: 169 total cpu time spent up to now is 629.9 secs Computing kpt #: 170 total cpu time spent up to now is 633.4 secs Computing kpt #: 171 total cpu time spent up to now is 636.9 secs Computing kpt #: 172 total cpu time spent up to now is 640.5 secs Computing kpt #: 173 total cpu time spent up to now is 644.1 secs Computing kpt #: 174 total cpu time spent up to now is 647.6 secs Computing kpt #: 175 total cpu time spent up to now is 651.2 secs Computing kpt #: 176 total cpu time spent up to now is 654.8 secs Computing kpt #: 177 total cpu time spent up to now is 658.4 secs Computing kpt #: 178 total cpu time spent up to now is 662.0 secs Computing kpt #: 179 total cpu time spent up to now is 665.5 secs Computing kpt #: 180 total cpu time spent up to now is 669.3 secs Computing kpt #: 181 total cpu time spent up to now is 673.1 secs Computing kpt #: 182 total cpu time spent up to now is 676.8 secs Computing kpt #: 183 total cpu time spent up to now is 680.5 secs Computing kpt #: 184 total cpu time spent up to now is 684.2 secs Computing kpt #: 185 total cpu time spent up to now is 687.9 secs Computing kpt #: 186 total cpu time spent up to now is 692.5 secs Computing kpt #: 187 total cpu time spent up to now is 696.2 secs Computing kpt #: 188 total cpu time spent up to now is 700.0 secs Computing kpt #: 189 total cpu time spent up to now is 703.7 secs Computing kpt #: 190 total cpu time spent up to now is 707.4 secs Computing kpt #: 191 total cpu time spent up to now is 711.1 secs Computing kpt #: 192 total cpu time spent up to now is 714.8 secs Computing kpt #: 193 total cpu time spent up to now is 718.5 secs Computing kpt #: 194 total cpu time spent up to now is 722.2 secs Computing kpt #: 195 total cpu time spent up to now is 725.9 secs ethr = 1.28E-08, avg # of iterations = 27.2 total cpu time spent up to now is 725.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 18149 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4729 -8.4729 -7.6709 -7.6709 -7.6587 -7.6587 -7.6587 -7.6587 -7.4540 -7.4540 -7.4540 -7.4540 -6.6334 -6.6334 -6.6148 -6.6148 -5.7699 -5.7699 -5.7699 -5.7699 -5.7435 -5.7435 -5.7435 -5.7435 -0.7353 -0.7353 -0.1133 -0.1133 -0.1133 -0.1133 0.0592 0.0592 0.0592 0.0592 0.3714 0.3714 0.7064 0.7064 0.7064 0.7064 1.1157 1.1157 2.2272 2.2272 2.2272 2.2272 2.5712 2.5712 2.8817 2.8817 2.8901 2.8901 2.8901 2.8901 3.3210 3.3210 3.6536 3.6536 4.0390 4.0390 4.0390 4.0390 4.2267 4.2267 4.2267 4.2267 5.4322 5.4322 5.4322 5.4322 7.4270 7.4270 8.0548 8.0548 8.3423 8.3423 8.7476 8.7476 8.7476 8.7476 9.5945 9.5945 k = 0.0172-0.0100 0.0141 ( 18117 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4725 -8.4725 -7.6710 -7.6710 -7.6589 -7.6589 -7.6588 -7.6588 -7.4545 -7.4545 -7.4539 -7.4539 -6.6332 -6.6332 -6.6147 -6.6147 -5.7697 -5.7697 -5.7697 -5.7697 -5.7435 -5.7435 -5.7433 -5.7433 -0.7337 -0.7337 -0.1150 -0.1150 -0.1133 -0.1133 0.0592 0.0592 0.0597 0.0597 0.3716 0.3716 0.7069 0.7069 0.7082 0.7082 1.1168 1.1168 2.2269 2.2269 2.2271 2.2271 2.5708 2.5708 2.8804 2.8804 2.8898 2.8898 2.8900 2.8900 3.3205 3.3205 3.6520 3.6520 4.0351 4.0351 4.0382 4.0382 4.2240 4.2240 4.2260 4.2260 5.4282 5.4282 5.4320 5.4320 7.4302 7.4302 8.0580 8.0580 8.3479 8.3479 8.7498 8.7498 8.7516 8.7516 9.5986 9.5986 k = 0.0345-0.0199 0.0282 ( 18109 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4714 -8.4714 -7.6715 -7.6715 -7.6594 -7.6594 -7.6594 -7.6594 -7.4561 -7.4561 -7.4539 -7.4539 -6.6326 -6.6326 -6.6145 -6.6145 -5.7693 -5.7693 -5.7692 -5.7692 -5.7434 -5.7434 -5.7429 -5.7429 -0.7289 -0.7289 -0.1198 -0.1198 -0.1133 -0.1133 0.0591 0.0591 0.0610 0.0610 0.3722 0.3722 0.7082 0.7082 0.7137 0.7137 1.1202 1.1202 2.2260 2.2260 2.2267 2.2267 2.5695 2.5695 2.8767 2.8767 2.8890 2.8890 2.8897 2.8897 3.3189 3.3189 3.6471 3.6471 4.0234 4.0234 4.0358 4.0358 4.2159 4.2159 4.2237 4.2237 5.4162 5.4162 5.4313 5.4313 7.4400 7.4400 8.0675 8.0675 8.3648 8.3648 8.7565 8.7565 8.7639 8.7639 9.6106 9.6106 k = 0.0517-0.0299 0.0422 ( 18085 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4695 -8.4695 -7.6722 -7.6722 -7.6603 -7.6603 -7.6602 -7.6602 -7.4589 -7.4589 -7.4537 -7.4537 -6.6318 -6.6318 -6.6140 -6.6140 -5.7687 -5.7687 -5.7683 -5.7683 -5.7433 -5.7433 -5.7422 -5.7422 -0.7209 -0.7209 -0.1276 -0.1276 -0.1134 -0.1134 0.0589 0.0589 0.0632 0.0632 0.3733 0.3733 0.7105 0.7105 0.7225 0.7225 1.1258 1.1258 2.2245 2.2245 2.2261 2.2261 2.5674 2.5674 2.8704 2.8704 2.8877 2.8877 2.8891 2.8891 3.3164 3.3164 3.6388 3.6388 4.0044 4.0044 4.0317 4.0317 4.2024 4.2024 4.2199 4.2199 5.3964 5.3964 5.4301 5.4301 7.4562 7.4562 8.0832 8.0832 8.3925 8.3925 8.7677 8.7677 8.7841 8.7841 9.6299 9.6299 k = 0.0690-0.0398 0.0563 ( 18093 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4670 -8.4670 -7.6733 -7.6733 -7.6616 -7.6616 -7.6614 -7.6614 -7.4626 -7.4626 -7.4535 -7.4535 -6.6306 -6.6306 -6.6133 -6.6133 -5.7677 -5.7677 -5.7671 -5.7671 -5.7431 -5.7431 -5.7413 -5.7413 -0.7098 -0.7098 -0.1381 -0.1381 -0.1134 -0.1134 0.0587 0.0587 0.0662 0.0662 0.3747 0.3747 0.7136 0.7136 0.7344 0.7344 1.1336 1.1336 2.2224 2.2224 2.2252 2.2252 2.5646 2.5646 2.8617 2.8617 2.8860 2.8860 2.8882 2.8882 3.3129 3.3129 3.6272 3.6272 3.9786 3.9786 4.0261 4.0261 4.1838 4.1838 4.2146 4.2146 5.3690 5.3690 5.4285 5.4285 7.4788 7.4788 8.1051 8.1051 8.4306 8.4306 8.7837 8.7837 8.8123 8.8123 9.6559 9.6559 k = 0.0862-0.0498 0.0704 ( 18098 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4637 -8.4637 -7.6746 -7.6746 -7.6632 -7.6632 -7.6629 -7.6629 -7.4674 -7.4674 -7.4532 -7.4532 -6.6291 -6.6291 -6.6125 -6.6125 -5.7666 -5.7666 -5.7656 -5.7656 -5.7429 -5.7429 -5.7401 -5.7401 -0.6957 -0.6957 -0.1508 -0.1508 -0.1134 -0.1134 0.0583 0.0583 0.0700 0.0700 0.3767 0.3767 0.7176 0.7176 0.7492 0.7492 1.1434 1.1434 2.2198 2.2198 2.2239 2.2239 2.5611 2.5611 2.8505 2.8505 2.8838 2.8838 2.8869 2.8869 3.3088 3.3088 3.6122 3.6122 3.9469 3.9469 4.0190 4.0190 4.1602 4.1602 4.2080 4.2080 5.3345 5.3345 5.4266 5.4266 7.5079 7.5079 8.1332 8.1332 8.4784 8.4784 8.8045 8.8045 8.8482 8.8482 9.6881 9.6881 k = 0.1034-0.0597 0.0845 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4597 -8.4597 -7.6762 -7.6762 -7.6650 -7.6650 -7.6647 -7.6647 -7.4731 -7.4731 -7.4529 -7.4529 -6.6273 -6.6273 -6.6115 -6.6115 -5.7652 -5.7652 -5.7638 -5.7638 -5.7427 -5.7427 -5.7387 -5.7387 -0.6788 -0.6788 -0.1652 -0.1652 -0.1135 -0.1135 0.0577 0.0577 0.0745 0.0745 0.3790 0.3790 0.7224 0.7224 0.7664 0.7664 1.1553 1.1553 2.2167 2.2167 2.2224 2.2224 2.5572 2.5572 2.8369 2.8369 2.8812 2.8812 2.8851 2.8851 3.3042 3.3042 3.5937 3.5937 3.9100 3.9100 4.0104 4.0104 4.1319 4.1319 4.2001 4.2001 5.2935 5.2935 5.4243 5.4243 7.5433 7.5433 8.1672 8.1672 8.5348 8.5348 8.8307 8.8307 8.8916 8.8916 9.7197 9.7197 k = 0.1207-0.0697 0.0985 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4551 -8.4551 -7.6781 -7.6781 -7.6671 -7.6671 -7.6667 -7.6667 -7.4798 -7.4798 -7.4526 -7.4526 -6.6252 -6.6252 -6.6104 -6.6104 -5.7635 -5.7635 -5.7617 -5.7617 -5.7424 -5.7424 -5.7371 -5.7371 -0.6594 -0.6594 -0.1808 -0.1808 -0.1135 -0.1135 0.0570 0.0570 0.0798 0.0798 0.3819 0.3819 0.7279 0.7279 0.7857 0.7857 1.1690 1.1690 2.2132 2.2132 2.2204 2.2204 2.5530 2.5530 2.8211 2.8211 2.8783 2.8783 2.8828 2.8828 3.2993 3.2993 3.5718 3.5718 3.8688 3.8688 4.0003 4.0003 4.0991 4.0991 4.1914 4.1914 5.2464 5.2464 5.4218 5.4218 7.5849 7.5849 8.2071 8.2071 8.5982 8.5982 8.8630 8.8630 8.9422 8.9422 9.7340 9.7340 k = 0.1379-0.0796 0.1126 ( 18062 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4498 -8.4498 -7.6803 -7.6803 -7.6694 -7.6694 -7.6690 -7.6690 -7.4873 -7.4873 -7.4521 -7.4521 -6.6229 -6.6229 -6.6092 -6.6092 -5.7617 -5.7617 -5.7593 -5.7593 -5.7421 -5.7421 -5.7353 -5.7353 -0.6377 -0.6377 -0.1970 -0.1970 -0.1136 -0.1136 0.0561 0.0561 0.0858 0.0858 0.3852 0.3852 0.7340 0.7340 0.8068 0.8068 1.1844 1.1844 2.2093 2.2093 2.2180 2.2180 2.5488 2.5488 2.8032 2.8032 2.8750 2.8750 2.8799 2.8799 3.2943 3.2943 3.5465 3.5465 3.8242 3.8242 3.9888 3.9888 4.0625 4.0625 4.1819 4.1819 5.1940 5.1940 5.4190 5.4190 7.6327 7.6327 8.2527 8.2527 8.6667 8.6667 8.9025 8.9025 8.9998 8.9998 9.7505 9.7505 k = 0.1552-0.0896 0.1267 ( 18054 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4440 -8.4440 -7.6826 -7.6826 -7.6718 -7.6718 -7.6715 -7.6715 -7.4956 -7.4956 -7.4517 -7.4517 -6.6204 -6.6204 -6.6079 -6.6079 -5.7597 -5.7597 -5.7568 -5.7568 -5.7418 -5.7418 -5.7334 -5.7334 -0.6141 -0.6141 -0.2131 -0.2131 -0.1136 -0.1136 0.0550 0.0550 0.0923 0.0923 0.3890 0.3890 0.7407 0.7407 0.8294 0.8294 1.2014 1.2014 2.2051 2.2051 2.2150 2.2150 2.5446 2.5446 2.7833 2.7833 2.8713 2.8713 2.8762 2.8762 3.2894 3.2894 3.5178 3.5178 3.7772 3.7772 3.9752 3.9752 4.0229 4.0229 4.1719 4.1719 5.1369 5.1369 5.4161 5.4161 7.6865 7.6865 8.3038 8.3038 8.7375 8.7375 8.9511 8.9511 9.0639 9.0639 9.7690 9.7690 k = 0.1724-0.0995 0.1408 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4376 -8.4376 -7.6852 -7.6852 -7.6744 -7.6744 -7.6742 -7.6742 -7.5047 -7.5047 -7.4512 -7.4512 -6.6177 -6.6177 -6.6065 -6.6065 -5.7576 -5.7576 -5.7540 -5.7540 -5.7415 -5.7415 -5.7313 -5.7313 -0.5892 -0.5892 -0.2282 -0.2282 -0.1137 -0.1137 0.0537 0.0537 0.0994 0.0994 0.3932 0.3932 0.7479 0.7479 0.8531 0.8531 1.2197 1.2197 2.2008 2.2008 2.2115 2.2115 2.5408 2.5408 2.7616 2.7616 2.8674 2.8674 2.8717 2.8717 3.2850 3.2850 3.4858 3.4858 3.7286 3.7286 3.9562 3.9562 3.9842 3.9842 4.1618 4.1618 5.0760 5.0760 5.4131 5.4131 7.7462 7.7462 8.3603 8.3603 8.8070 8.8070 9.0110 9.0110 9.1341 9.1341 9.7895 9.7895 k = 0.1897-0.1095 0.1549 ( 18054 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9150 -21.9150 -8.4307 -8.4307 -7.6880 -7.6880 -7.6770 -7.6770 -7.6770 -7.6770 -7.5144 -7.5144 -7.4507 -7.4507 -6.6149 -6.6149 -6.6051 -6.6051 -5.7553 -5.7553 -5.7511 -5.7511 -5.7411 -5.7411 -5.7291 -5.7291 -0.5640 -0.5640 -0.2416 -0.2416 -0.1138 -0.1138 0.0522 0.0522 0.1069 0.1069 0.3979 0.3979 0.7555 0.7555 0.8779 0.8779 1.2391 1.2391 2.1962 2.1962 2.2072 2.2072 2.5375 2.5375 2.7383 2.7383 2.8631 2.8631 2.8665 2.8665 3.2811 3.2811 3.4509 3.4509 3.6792 3.6792 3.9205 3.9205 3.9581 3.9581 4.1516 4.1516 5.0121 5.0121 5.4100 5.4100 7.8114 7.8114 8.4218 8.4218 8.8728 8.8728 9.0837 9.0837 9.2101 9.2101 9.8120 9.8120 k = 0.2069-0.1195 0.1689 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4234 -8.4234 -7.6909 -7.6909 -7.6799 -7.6799 -7.6797 -7.6797 -7.5247 -7.5247 -7.4502 -7.4502 -6.6120 -6.6120 -6.6037 -6.6037 -5.7530 -5.7530 -5.7481 -5.7481 -5.7407 -5.7407 -5.7269 -5.7269 -0.5394 -0.5394 -0.2518 -0.2518 -0.1139 -0.1139 0.0504 0.0504 0.1148 0.1148 0.4030 0.4030 0.7634 0.7634 0.9034 0.9034 1.2595 1.2595 2.1916 2.1916 2.2020 2.2020 2.5352 2.5352 2.7138 2.7138 2.8586 2.8586 2.8605 2.8605 3.2780 3.2780 3.4131 3.4131 3.6300 3.6300 3.8728 3.8728 3.9407 3.9407 4.1415 4.1415 4.9459 4.9459 5.4069 5.4069 7.8821 7.8821 8.4883 8.4883 8.9341 8.9341 9.1683 9.1683 9.2912 9.2912 9.8363 9.8363 k = 0.2241-0.1294 0.1830 ( 18022 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4157 -8.4157 -7.6938 -7.6938 -7.6829 -7.6829 -7.6824 -7.6824 -7.5355 -7.5355 -7.4496 -7.4496 -6.6089 -6.6089 -6.6022 -6.6022 -5.7506 -5.7506 -5.7450 -5.7450 -5.7402 -5.7402 -5.7245 -5.7245 -0.5173 -0.5173 -0.2573 -0.2573 -0.1140 -0.1140 0.0485 0.0485 0.1230 0.1230 0.4086 0.4086 0.7715 0.7715 0.9295 0.9295 1.2804 1.2804 2.1870 2.1870 2.1959 2.1959 2.5339 2.5339 2.6884 2.6884 2.8536 2.8536 2.8538 2.8538 3.2757 3.2757 3.3730 3.3730 3.5816 3.5816 3.8208 3.8208 3.9245 3.9245 4.1315 4.1315 4.8784 4.8784 5.4038 5.4038 7.9579 7.9579 8.5594 8.5594 8.9923 8.9923 9.2622 9.2622 9.3770 9.3770 9.8625 9.8625 k = 0.2414-0.1394 0.1971 ( 18018 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4077 -8.4077 -7.6968 -7.6968 -7.6860 -7.6860 -7.6850 -7.6850 -7.5466 -7.5466 -7.4491 -7.4491 -6.6059 -6.6059 -6.6008 -6.6008 -5.7481 -5.7481 -5.7418 -5.7418 -5.7398 -5.7398 -5.7222 -5.7222 -0.4996 -0.4996 -0.2562 -0.2562 -0.1141 -0.1141 0.0463 0.0463 0.1314 0.1314 0.4144 0.4144 0.7797 0.7797 0.9560 0.9560 1.3016 1.3016 2.1825 2.1825 2.1886 2.1886 2.5339 2.5339 2.6625 2.6625 2.8462 2.8462 2.8487 2.8487 3.2743 3.2743 3.3308 3.3308 3.5347 3.5347 3.7663 3.7663 3.9084 3.9084 4.1218 4.1218 4.8102 4.8102 5.4007 5.4007 8.0385 8.0385 8.6349 8.6349 9.0489 9.0489 9.3617 9.3617 9.4669 9.4669 9.8903 9.8903 k = 0.2586-0.1493 0.2112 ( 18014 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.3995 -8.3995 -7.6997 -7.6997 -7.6890 -7.6890 -7.6876 -7.6876 -7.5581 -7.5581 -7.4485 -7.4485 -6.6028 -6.6028 -6.5994 -6.5994 -5.7457 -5.7457 -5.7393 -5.7393 -5.7386 -5.7386 -5.7199 -5.7199 -0.4879 -0.4879 -0.2468 -0.2468 -0.1142 -0.1142 0.0440 0.0440 0.1399 0.1399 0.4205 0.4205 0.7878 0.7878 0.9828 0.9828 1.3229 1.3229 2.1780 2.1780 2.1798 2.1798 2.5356 2.5356 2.6367 2.6367 2.8381 2.8381 2.8433 2.8433 3.2739 3.2739 3.2873 3.2873 3.4897 3.4897 3.7102 3.7102 3.8922 3.8922 4.1123 4.1123 4.7422 4.7422 5.3978 5.3978 8.1236 8.1236 8.7145 8.7145 9.1053 9.1053 9.4638 9.4638 9.5602 9.5602 9.9196 9.9196 k = 0.2759-0.1593 0.2252 ( 18034 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3912 -8.3912 -7.7026 -7.7026 -7.6920 -7.6920 -7.6901 -7.6901 -7.5698 -7.5698 -7.4480 -7.4480 -6.5998 -6.5998 -6.5980 -6.5980 -5.7434 -5.7434 -5.7387 -5.7387 -5.7355 -5.7355 -5.7177 -5.7177 -0.4828 -0.4828 -0.2289 -0.2289 -0.1143 -0.1143 0.0415 0.0415 0.1484 0.1484 0.4269 0.4269 0.7958 0.7958 1.0096 1.0096 1.3439 1.3439 2.1693 2.1693 2.1736 2.1736 2.5391 2.5391 2.6117 2.6117 2.8298 2.8298 2.8374 2.8374 3.2430 3.2430 3.2744 3.2744 3.4472 3.4472 3.6529 3.6529 3.8759 3.8759 4.1029 4.1029 4.6752 4.6752 5.3949 5.3949 8.2127 8.2127 8.7979 8.7979 9.1618 9.1618 9.5654 9.5654 9.6562 9.6562 9.9502 9.9502 k = 0.2931-0.1692 0.2393 ( 18046 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3829 -8.3829 -7.7052 -7.7052 -7.6949 -7.6949 -7.6926 -7.6926 -7.5816 -7.5816 -7.4474 -7.4474 -6.5968 -6.5968 -6.5967 -6.5967 -5.7414 -5.7414 -5.7379 -5.7379 -5.7324 -5.7324 -5.7154 -5.7154 -0.4833 -0.4833 -0.2038 -0.2038 -0.1145 -0.1145 0.0390 0.0390 0.1569 0.1569 0.4333 0.4333 0.8035 0.8035 1.0364 1.0364 1.3643 1.3643 2.1569 2.1569 2.1693 2.1693 2.5446 2.5446 2.5881 2.5881 2.8212 2.8212 2.8311 2.8311 3.1984 3.1984 3.2755 3.2755 3.4075 3.4075 3.5949 3.5949 3.8597 3.8597 4.0937 4.0937 4.6100 4.6100 5.3922 5.3922 8.3054 8.3054 8.8847 8.8847 9.2187 9.2187 9.6632 9.6632 9.7541 9.7541 9.9818 9.9818 k = 0.3103-0.1792 0.2534 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3745 -8.3745 -7.7076 -7.7076 -7.6977 -7.6977 -7.6949 -7.6949 -7.5934 -7.5934 -7.4469 -7.4469 -6.5954 -6.5954 -6.5940 -6.5940 -5.7399 -5.7399 -5.7366 -5.7366 -5.7294 -5.7294 -5.7133 -5.7133 -0.4878 -0.4878 -0.1733 -0.1733 -0.1146 -0.1146 0.0364 0.0364 0.1651 0.1651 0.4398 0.4398 0.8108 0.8108 1.0628 1.0628 1.3838 1.3838 2.1425 2.1425 2.1653 2.1653 2.5523 2.5523 2.5668 2.5668 2.8127 2.8127 2.8241 2.8241 3.1544 3.1544 3.2771 3.2771 3.3708 3.3708 3.5370 3.5370 3.8437 3.8437 4.0844 4.0844 4.5475 4.5475 5.3896 5.3896 8.4011 8.4011 8.9746 8.9746 9.2757 9.2757 9.7539 9.7539 9.8530 9.8530 10.0139 10.0139 k = 0.3276-0.1891 0.2675 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3664 -8.3664 -7.7096 -7.7096 -7.7004 -7.7004 -7.6971 -7.6971 -7.6051 -7.6051 -7.4464 -7.4464 -6.5943 -6.5943 -6.5913 -6.5913 -5.7389 -5.7389 -5.7349 -5.7349 -5.7265 -5.7265 -5.7113 -5.7113 -0.4946 -0.4946 -0.1395 -0.1395 -0.1147 -0.1147 0.0338 0.0338 0.1731 0.1731 0.4462 0.4462 0.8177 0.8177 1.0886 1.0886 1.4021 1.4021 2.1261 2.1261 2.1615 2.1615 2.5483 2.5483 2.5623 2.5623 2.8047 2.8047 2.8163 2.8163 3.1116 3.1116 3.2786 3.2786 3.3374 3.3374 3.4798 3.4798 3.8281 3.8281 4.0749 4.0749 4.4885 4.4885 5.3872 5.3872 8.4992 8.4992 9.0672 9.0672 9.3323 9.3323 9.8339 9.8339 9.9518 9.9518 10.0462 10.0462 k = 0.3448-0.1991 0.2816 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3585 -8.3585 -7.7113 -7.7113 -7.7029 -7.7029 -7.6991 -7.6991 -7.6165 -7.6165 -7.4459 -7.4459 -6.5932 -6.5932 -6.5887 -6.5887 -5.7384 -5.7384 -5.7330 -5.7330 -5.7238 -5.7238 -5.7095 -5.7095 -0.5026 -0.5026 -0.1148 -0.1148 -0.1040 -0.1040 0.0313 0.0313 0.1806 0.1806 0.4524 0.4524 0.8240 0.8240 1.1135 1.1135 1.4189 1.4189 2.1078 2.1078 2.1579 2.1579 2.5331 2.5331 2.5745 2.5745 2.7973 2.7973 2.8074 2.8074 3.0708 3.0708 3.2786 3.2786 3.3074 3.3074 3.4249 3.4249 3.8130 3.8130 4.0651 4.0651 4.4338 4.4338 5.3850 5.3850 8.5990 8.5990 9.1619 9.1619 9.3879 9.3879 9.8997 9.8997 10.0493 10.0493 10.0778 10.0778 k = 0.3621-0.2090 0.2956 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3510 -8.3510 -7.7126 -7.7126 -7.7053 -7.7053 -7.7009 -7.7009 -7.6277 -7.6277 -7.4454 -7.4454 -6.5922 -6.5922 -6.5863 -6.5863 -5.7379 -5.7379 -5.7311 -5.7311 -5.7213 -5.7213 -5.7077 -5.7077 -0.5110 -0.5110 -0.1149 -0.1149 -0.0684 -0.0684 0.0289 0.0289 0.1878 0.1878 0.4584 0.4584 0.8298 0.8298 1.1372 1.1372 1.4340 1.4340 2.0881 2.0881 2.1546 2.1546 2.5217 2.5217 2.5888 2.5888 2.7910 2.7910 2.7973 2.7973 3.0327 3.0327 3.2740 3.2740 3.2810 3.2810 3.3758 3.3758 3.7987 3.7987 4.0547 4.0547 4.3842 4.3842 5.3830 5.3830 8.6995 8.6995 9.2583 9.2583 9.4415 9.4415 9.9487 9.9487 10.1078 10.1078 10.1442 10.1442 k = 0.3793-0.2190 0.3097 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3441 -8.3441 -7.7133 -7.7133 -7.7074 -7.7074 -7.7025 -7.7025 -7.6385 -7.6385 -7.4450 -7.4450 -6.5913 -6.5913 -6.5842 -6.5842 -5.7375 -5.7375 -5.7294 -5.7294 -5.7190 -5.7190 -5.7062 -5.7062 -0.5191 -0.5191 -0.1150 -0.1150 -0.0337 -0.0337 0.0266 0.0266 0.1943 0.1943 0.4640 0.4640 0.8349 0.8349 1.1595 1.1595 1.4472 1.4472 2.0677 2.0677 2.1516 2.1516 2.5140 2.5140 2.6049 2.6049 2.7859 2.7859 2.7863 2.7863 2.9981 2.9981 3.2560 3.2560 3.2581 3.2581 3.3415 3.3415 3.7853 3.7853 4.0438 4.0438 4.3404 4.3404 5.3811 5.3811 8.7998 8.7998 9.3557 9.3557 9.4919 9.4919 9.9803 9.9803 10.1348 10.1348 10.2349 10.2349 k = 0.3966-0.2289 0.3238 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3377 -8.3377 -7.7136 -7.7136 -7.7093 -7.7093 -7.7039 -7.7039 -7.6487 -7.6487 -7.4447 -7.4447 -6.5906 -6.5906 -6.5823 -6.5823 -5.7372 -5.7372 -5.7278 -5.7278 -5.7169 -5.7169 -5.7048 -5.7048 -0.5266 -0.5266 -0.1151 -0.1151 -0.0010 -0.0010 0.0246 0.0246 0.2003 0.2003 0.4691 0.4691 0.8393 0.8393 1.1798 1.1798 1.4583 1.4583 2.0475 2.0475 2.1488 2.1488 2.5097 2.5097 2.6220 2.6220 2.7731 2.7731 2.7840 2.7840 2.9677 2.9677 3.2192 3.2192 3.2388 3.2388 3.3277 3.3277 3.7730 3.7730 4.0322 4.0322 4.3031 4.3031 5.3795 5.3795 8.8985 8.8985 9.4532 9.4532 9.5375 9.5375 9.9956 9.9956 10.1569 10.1569 10.3196 10.3196 k = 0.4138-0.2389 0.3379 ( 18070 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3321 -8.3321 -7.7133 -7.7133 -7.7109 -7.7109 -7.7048 -7.7048 -7.6583 -7.6583 -7.4443 -7.4443 -6.5899 -6.5899 -6.5806 -6.5806 -5.7370 -5.7370 -5.7264 -5.7264 -5.7152 -5.7152 -5.7037 -5.7037 -0.5333 -0.5333 -0.1152 -0.1152 0.0227 0.0227 0.0287 0.0287 0.2055 0.2055 0.4736 0.4736 0.8431 0.8431 1.1979 1.1979 1.4673 1.4673 2.0284 2.0284 2.1465 2.1465 2.5085 2.5085 2.6391 2.6391 2.7591 2.7591 2.7850 2.7850 2.9420 2.9420 3.1734 3.1734 3.2229 3.2229 3.3249 3.3249 3.7621 3.7621 4.0203 4.0203 4.2724 4.2724 5.3782 5.3782 8.9939 8.9939 9.5498 9.5498 9.5765 9.5765 9.9977 9.9977 10.1719 10.1719 10.3965 10.3965 k = 0.4310-0.2489 0.3519 ( 18082 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3274 -8.3274 -7.7127 -7.7127 -7.7123 -7.7123 -7.7052 -7.7052 -7.6672 -7.6672 -7.4441 -7.4441 -6.5894 -6.5894 -6.5793 -6.5793 -5.7368 -5.7368 -5.7253 -5.7253 -5.7137 -5.7137 -5.7027 -5.7027 -0.5389 -0.5389 -0.1153 -0.1153 0.0212 0.0212 0.0545 0.0545 0.2099 0.2099 0.4774 0.4774 0.8461 0.8461 1.2133 1.2133 1.4742 1.4742 2.0115 2.0115 2.1445 2.1445 2.5096 2.5096 2.6546 2.6546 2.7446 2.7446 2.7903 2.7903 2.9213 2.9213 3.1266 3.1266 3.2102 3.2102 3.3257 3.3257 3.7528 3.7528 4.0088 4.0088 4.2484 4.2484 5.3770 5.3770 9.0837 9.0837 9.6066 9.6066 9.6439 9.6439 9.9906 9.9906 10.1768 10.1768 10.4634 10.4634 k = 0.4483-0.2588 0.3660 ( 18086 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3236 -8.3236 -7.7133 -7.7133 -7.7120 -7.7120 -7.7047 -7.7047 -7.6753 -7.6753 -7.4439 -7.4439 -6.5890 -6.5890 -6.5782 -6.5782 -5.7366 -5.7366 -5.7243 -5.7243 -5.7125 -5.7125 -5.7019 -5.7019 -0.5434 -0.5434 -0.1154 -0.1154 0.0200 0.0200 0.0755 0.0755 0.2135 0.2135 0.4805 0.4805 0.8485 0.8485 1.2257 1.2257 1.4793 1.4793 1.9974 1.9974 2.1429 2.1429 2.5123 2.5123 2.6670 2.6670 2.7309 2.7309 2.8006 2.8006 2.9056 2.9056 3.0826 3.0826 3.2007 3.2007 3.3274 3.3274 3.7453 3.7453 3.9983 3.9983 4.2306 4.2306 5.3762 5.3762 9.1647 9.1647 9.6261 9.6261 9.7333 9.7333 9.9790 9.9790 10.1695 10.1695 10.5184 10.5184 k = 0.4655-0.2688 0.3801 ( 18094 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3208 -8.3208 -7.7141 -7.7141 -7.7115 -7.7115 -7.7029 -7.7029 -7.6825 -7.6825 -7.4437 -7.4437 -6.5887 -6.5887 -6.5774 -6.5774 -5.7365 -5.7365 -5.7237 -5.7237 -5.7117 -5.7117 -5.7014 -5.7014 -0.5467 -0.5467 -0.1154 -0.1154 0.0191 0.0191 0.0910 0.0910 0.2162 0.2162 0.4827 0.4827 0.8502 0.8502 1.2349 1.2349 1.4827 1.4827 1.9869 1.9869 2.1418 2.1418 2.5155 2.5155 2.6754 2.6754 2.7193 2.7193 2.8147 2.8147 2.8947 2.8947 3.0444 3.0444 3.1941 3.1941 3.3291 3.3291 3.7398 3.7398 3.9900 3.9900 4.2185 4.2185 5.3755 5.3755 9.2319 9.2319 9.6346 9.6346 9.8139 9.8139 9.9677 9.9677 10.1498 10.1498 10.5593 10.5593 k = 0.4828-0.2787 0.3942 ( 18102 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3191 -8.3191 -7.7146 -7.7146 -7.7114 -7.7114 -7.7001 -7.7001 -7.6886 -7.6886 -7.4436 -7.4436 -6.5885 -6.5885 -6.5769 -6.5769 -5.7364 -5.7364 -5.7233 -5.7233 -5.7112 -5.7112 -5.7010 -5.7010 -0.5487 -0.5487 -0.1154 -0.1154 0.0185 0.0185 0.1005 0.1005 0.2178 0.2178 0.4841 0.4841 0.8512 0.8512 1.2404 1.2404 1.4846 1.4846 1.9804 1.9804 2.1411 2.1411 2.5181 2.5181 2.6801 2.6801 2.7115 2.7115 2.8284 2.8284 2.8883 2.8883 3.0166 3.0166 3.1902 3.1902 3.3303 3.3303 3.7364 3.7364 3.9846 3.9846 4.2114 4.2114 5.3752 5.3752 9.2782 9.2782 9.6351 9.6351 9.8772 9.8772 9.9598 9.9598 10.1238 10.1238 10.5846 10.5846 k = 0.5000-0.2887 0.4082 ( 18102 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3185 -8.3185 -7.7147 -7.7147 -7.7114 -7.7114 -7.6978 -7.6978 -7.6919 -7.6919 -7.4436 -7.4436 -6.5884 -6.5884 -6.5768 -6.5768 -5.7364 -5.7364 -5.7231 -5.7231 -5.7110 -5.7110 -5.7009 -5.7009 -0.5494 -0.5494 -0.1154 -0.1154 0.0184 0.0184 0.1037 0.1037 0.2184 0.2184 0.4845 0.4845 0.8515 0.8515 1.2423 1.2423 1.4852 1.4852 1.9782 1.9782 2.1409 2.1409 2.5190 2.5190 2.6815 2.6815 2.7088 2.7088 2.8344 2.8344 2.8862 2.8862 3.0059 3.0059 3.1889 3.1889 3.3307 3.3307 3.7353 3.7353 3.9827 3.9827 4.2091 4.2091 5.3750 5.3750 9.2951 9.2951 9.6340 9.6340 9.9037 9.9037 9.9571 9.9571 10.1097 10.1097 10.5931 10.5931 k = 0.5000-0.2887 0.4082 ( 18102 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3185 -8.3185 -7.7147 -7.7147 -7.7114 -7.7114 -7.6978 -7.6978 -7.6919 -7.6919 -7.4436 -7.4436 -6.5884 -6.5884 -6.5768 -6.5768 -5.7364 -5.7364 -5.7231 -5.7231 -5.7110 -5.7110 -5.7009 -5.7009 -0.5494 -0.5494 -0.1154 -0.1154 0.0184 0.0184 0.1037 0.1037 0.2184 0.2184 0.4845 0.4845 0.8515 0.8515 1.2423 1.2423 1.4852 1.4852 1.9782 1.9782 2.1409 2.1409 2.5190 2.5190 2.6815 2.6815 2.7088 2.7088 2.8344 2.8344 2.8862 2.8862 3.0059 3.0059 3.1889 3.1889 3.3307 3.3307 3.7353 3.7353 3.9827 3.9827 4.2091 4.2091 5.3750 5.3750 9.2951 9.2951 9.6340 9.6340 9.9037 9.9037 9.9571 9.9571 10.1097 10.1097 10.5931 10.5931 k = 0.5000-0.2694 0.4219 ( 18114 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3184 -8.3184 -7.7213 -7.7213 -7.7127 -7.7127 -7.6934 -7.6934 -7.6882 -7.6882 -7.4439 -7.4439 -6.5884 -6.5884 -6.5768 -6.5768 -5.7364 -5.7364 -5.7232 -5.7232 -5.7110 -5.7110 -5.7010 -5.7010 -0.5485 -0.5485 -0.1164 -0.1164 0.0189 0.0189 0.1031 0.1031 0.2180 0.2180 0.4843 0.4843 0.8526 0.8526 1.2417 1.2417 1.4854 1.4854 1.9780 1.9780 2.1416 2.1416 2.5179 2.5179 2.6693 2.6693 2.7200 2.7200 2.8352 2.8352 2.8868 2.8868 3.0075 3.0075 3.1874 3.1874 3.3327 3.3327 3.7304 3.7304 3.9858 3.9858 4.2106 4.2106 5.3728 5.3728 9.2964 9.2964 9.6361 9.6361 9.9046 9.9046 9.9581 9.9581 10.1103 10.1103 10.5931 10.5931 k = 0.5000-0.2502 0.4355 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3180 -8.3180 -7.7336 -7.7336 -7.7127 -7.7127 -7.6930 -7.6930 -7.6756 -7.6756 -7.4448 -7.4448 -6.5883 -6.5883 -6.5769 -6.5769 -5.7362 -5.7362 -5.7232 -5.7232 -5.7110 -5.7110 -5.7011 -5.7011 -0.5460 -0.5460 -0.1194 -0.1194 0.0206 0.0206 0.1014 0.1014 0.2169 0.2169 0.4835 0.4835 0.8559 0.8559 1.2399 1.2399 1.4860 1.4860 1.9776 1.9776 2.1439 2.1439 2.5146 2.5146 2.6490 2.6490 2.7373 2.7373 2.8377 2.8377 2.8885 2.8885 3.0126 3.0126 3.1833 3.1833 3.3387 3.3387 3.7166 3.7166 3.9932 3.9932 4.2156 4.2156 5.3664 5.3664 9.3004 9.3004 9.6425 9.6425 9.9071 9.9071 9.9611 9.9611 10.1119 10.1119 10.5931 10.5931 k = 0.5000-0.2309 0.4491 ( 18070 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3174 -8.3174 -7.7463 -7.7463 -7.7125 -7.7125 -7.6932 -7.6932 -7.6619 -7.6619 -7.4464 -7.4464 -6.5882 -6.5882 -6.5770 -6.5770 -5.7360 -5.7360 -5.7233 -5.7233 -5.7111 -5.7111 -5.7012 -5.7012 -0.5419 -0.5419 -0.1244 -0.1244 0.0233 0.0233 0.0986 0.0986 0.2151 0.2151 0.4823 0.4823 0.8611 0.8611 1.2369 1.2369 1.4869 1.4869 1.9770 1.9770 2.1474 2.1474 2.5092 2.5092 2.6279 2.6279 2.7531 2.7531 2.8418 2.8418 2.8910 2.8910 3.0210 3.0210 3.1770 3.1770 3.3483 3.3483 3.6967 3.6967 4.0010 4.0010 4.2255 4.2255 5.3556 5.3556 9.3068 9.3068 9.6529 9.6529 9.9113 9.9113 9.9661 9.9661 10.1147 10.1147 10.5929 10.5929 k = 0.5000-0.2117 0.4627 ( 18060 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3166 -8.3166 -7.7587 -7.7587 -7.7122 -7.7122 -7.6935 -7.6935 -7.6480 -7.6480 -7.4485 -7.4485 -6.5881 -6.5881 -6.5772 -6.5772 -5.7357 -5.7357 -5.7234 -5.7234 -5.7111 -5.7111 -5.7015 -5.7015 -0.5363 -0.5363 -0.1313 -0.1313 0.0270 0.0270 0.0951 0.0951 0.2125 0.2125 0.4808 0.4808 0.8683 0.8683 1.2326 1.2326 1.4883 1.4883 1.9763 1.9763 2.1522 2.1522 2.5021 2.5021 2.6075 2.6075 2.7662 2.7662 2.8474 2.8474 2.8939 2.8939 3.0328 3.0328 3.1693 3.1693 3.3615 3.3615 3.6729 3.6729 4.0052 4.0052 4.2419 4.2419 5.3409 5.3409 9.3155 9.3155 9.6674 9.6674 9.9171 9.9171 9.9730 9.9730 10.1183 10.1183 10.5922 10.5922 k = 0.5000-0.1925 0.4763 ( 18044 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3156 -8.3156 -7.7706 -7.7706 -7.7118 -7.7118 -7.6939 -7.6939 -7.6342 -7.6342 -7.4513 -7.4513 -6.5879 -6.5879 -6.5774 -6.5774 -5.7353 -5.7353 -5.7236 -5.7236 -5.7112 -5.7112 -5.7018 -5.7018 -0.5291 -0.5291 -0.1402 -0.1402 0.0317 0.0317 0.0912 0.0912 0.2093 0.2093 0.4789 0.4789 0.8770 0.8770 1.2269 1.2269 1.4903 1.4903 1.9757 1.9757 2.1579 2.1579 2.4937 2.4937 2.5882 2.5882 2.7766 2.7766 2.8537 2.8537 2.8966 2.8966 3.0475 3.0475 3.1608 3.1608 3.3780 3.3780 3.6471 3.6471 4.0030 4.0030 4.2653 4.2653 5.3225 5.3225 9.3259 9.3259 9.6856 9.6856 9.9245 9.9245 9.9817 9.9817 10.1228 10.1228 10.5909 10.5909 k = 0.5000-0.1732 0.4899 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9152 -21.9152 -8.3144 -8.3144 -7.7818 -7.7818 -7.7113 -7.7113 -7.6944 -7.6944 -7.6205 -7.6205 -7.4547 -7.4547 -6.5877 -6.5877 -6.5777 -6.5777 -5.7349 -5.7349 -5.7238 -5.7238 -5.7112 -5.7112 -5.7021 -5.7021 -0.5206 -0.5206 -0.1510 -0.1510 0.0372 0.0372 0.0871 0.0871 0.2053 0.2053 0.4767 0.4767 0.8872 0.8872 1.2199 1.2199 1.4927 1.4927 1.9751 1.9751 2.1644 2.1644 2.4842 2.4842 2.5702 2.5702 2.7848 2.7848 2.8603 2.8603 2.8986 2.8986 3.0645 3.0645 3.1524 3.1524 3.3977 3.3977 3.6206 3.6206 3.9938 3.9938 4.2951 4.2951 5.3008 5.3008 9.3378 9.3378 9.7074 9.7074 9.9333 9.9333 9.9921 9.9921 10.1279 10.1279 10.5885 10.5885 k = 0.5000-0.1540 0.5035 ( 18054 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3132 -8.3132 -7.7922 -7.7922 -7.7107 -7.7107 -7.6950 -7.6950 -7.6071 -7.6071 -7.4587 -7.4587 -6.5875 -6.5875 -6.5780 -6.5780 -5.7344 -5.7344 -5.7241 -5.7241 -5.7112 -5.7112 -5.7025 -5.7025 -0.5108 -0.5108 -0.1634 -0.1634 0.0435 0.0435 0.0831 0.0831 0.2007 0.2007 0.4744 0.4744 0.8983 0.8983 1.2116 1.2116 1.4956 1.4956 1.9748 1.9748 2.1713 2.1713 2.4743 2.4743 2.5538 2.5538 2.7915 2.7915 2.8664 2.8664 2.8997 2.8997 3.0823 3.0823 3.1456 3.1456 3.4202 3.4202 3.5944 3.5944 3.9783 3.9783 4.3296 4.3296 5.2762 5.2762 9.3506 9.3506 9.7322 9.7322 9.9434 9.9434 10.0040 10.0040 10.1334 10.1334 10.5847 10.5847 k = 0.5000-0.1347 0.5171 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3119 -8.3119 -7.8018 -7.8018 -7.7101 -7.7101 -7.6956 -7.6956 -7.5939 -7.5939 -7.4634 -7.4634 -6.5872 -6.5872 -6.5784 -6.5784 -5.7338 -5.7338 -5.7244 -5.7244 -5.7112 -5.7112 -5.7029 -5.7029 -0.4999 -0.4999 -0.1771 -0.1771 0.0504 0.0504 0.0793 0.0793 0.1955 0.1955 0.4721 0.4721 0.9102 0.9102 1.2022 1.2022 1.4988 1.4988 1.9747 1.9747 2.1785 2.1785 2.4643 2.4643 2.5390 2.5390 2.7974 2.7974 2.8718 2.8718 2.8993 2.8993 3.0978 3.0978 3.1431 3.1431 3.4446 3.4446 3.5698 3.5698 3.9574 3.9574 4.3670 4.3670 5.2494 5.2494 9.3638 9.3638 9.7596 9.7596 9.9544 9.9544 10.0169 10.0169 10.1392 10.1392 10.5792 10.5792 k = 0.5000-0.1155 0.5307 ( 18046 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3107 -8.3107 -7.8103 -7.8103 -7.7095 -7.7095 -7.6962 -7.6962 -7.5812 -7.5812 -7.4687 -7.4687 -6.5870 -6.5870 -6.5787 -6.5787 -5.7332 -5.7332 -5.7248 -5.7248 -5.7112 -5.7112 -5.7033 -5.7033 -0.4884 -0.4884 -0.1916 -0.1916 0.0577 0.0577 0.0761 0.0761 0.1898 0.1898 0.4698 0.4698 0.9225 0.9225 1.1920 1.1920 1.5022 1.5022 1.9748 1.9748 2.1856 2.1856 2.4547 2.4547 2.5258 2.5258 2.8028 2.8028 2.8763 2.8763 2.8975 2.8975 3.1056 3.1056 3.1501 3.1501 3.4677 3.4677 3.5501 3.5501 3.9320 3.9320 4.4055 4.4055 5.2213 5.2213 9.3767 9.3767 9.7888 9.7888 9.9659 9.9659 10.0303 10.0303 10.1450 10.1450 10.5719 10.5719 k = 0.5000-0.0962 0.5443 ( 18044 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3095 -8.3095 -7.8177 -7.8177 -7.7088 -7.7088 -7.6969 -7.6969 -7.5688 -7.5688 -7.4746 -7.4746 -6.5867 -6.5867 -6.5791 -6.5791 -5.7325 -5.7325 -5.7253 -5.7253 -5.7111 -5.7111 -5.7037 -5.7037 -0.4764 -0.4764 -0.2066 -0.2066 0.0648 0.0648 0.0738 0.0738 0.1837 0.1837 0.4677 0.4677 0.9347 0.9347 1.1815 1.1815 1.5055 1.5055 1.9751 1.9751 2.1924 2.1924 2.4458 2.4458 2.5143 2.5143 2.8081 2.8081 2.8799 2.8799 2.8944 2.8944 3.1057 3.1057 3.1660 3.1660 3.4787 3.4787 3.5461 3.5461 3.9031 3.9031 4.4435 4.4435 5.1929 5.1929 9.3888 9.3888 9.8187 9.8187 9.9774 9.9774 10.0436 10.0436 10.1505 10.1505 10.5633 10.5633 k = 0.5000-0.0770 0.5579 ( 18060 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3084 -8.3084 -7.8239 -7.8239 -7.7082 -7.7082 -7.6976 -7.6976 -7.5570 -7.5570 -7.4811 -7.4811 -6.5864 -6.5864 -6.5794 -6.5794 -5.7318 -5.7318 -5.7259 -5.7259 -5.7110 -5.7110 -5.7041 -5.7041 -0.4645 -0.4645 -0.2212 -0.2212 0.0684 0.0684 0.0754 0.0754 0.1775 0.1775 0.4659 0.4659 0.9463 0.9463 1.1711 1.1711 1.5087 1.5087 1.9755 1.9755 2.1984 2.1984 2.4382 2.4382 2.5046 2.5046 2.8134 2.8134 2.8824 2.8824 2.8904 2.8904 3.1032 3.1032 3.1849 3.1849 3.4695 3.4695 3.5660 3.5660 3.8714 3.8714 4.4790 4.4790 5.1654 5.1654 9.3995 9.3995 9.8480 9.8480 9.9883 9.9883 10.0561 10.0561 10.1554 10.1554 10.5542 10.5542 k = 0.5000-0.0577 0.5715 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3075 -8.3075 -7.8288 -7.8288 -7.7075 -7.7075 -7.6982 -7.6982 -7.5457 -7.5457 -7.4882 -7.4882 -6.5862 -6.5862 -6.5797 -6.5797 -5.7310 -5.7310 -5.7265 -5.7265 -5.7109 -5.7109 -5.7044 -5.7044 -0.4535 -0.4535 -0.2345 -0.2345 0.0677 0.0677 0.0815 0.0815 0.1716 0.1716 0.4644 0.4644 0.9566 0.9566 1.1616 1.1616 1.5113 1.5113 1.9760 1.9760 2.2036 2.2036 2.4319 2.4319 2.4967 2.4967 2.8185 2.8185 2.8823 2.8823 2.8876 2.8876 3.1007 3.1007 3.2035 3.2035 3.4528 3.4528 3.5972 3.5972 3.8379 3.8379 4.5103 4.5103 5.1407 5.1407 9.4084 9.4084 9.8748 9.8748 9.9980 9.9980 10.0668 10.0668 10.1595 10.1595 10.5460 10.5460 k = 0.5000-0.0385 0.5852 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3069 -8.3069 -7.8323 -7.8323 -7.7070 -7.7070 -7.6987 -7.6987 -7.5351 -7.5351 -7.4958 -7.4958 -6.5860 -6.5860 -6.5799 -6.5799 -5.7303 -5.7303 -5.7272 -5.7272 -5.7108 -5.7108 -5.7047 -5.7047 -0.4444 -0.4444 -0.2455 -0.2455 0.0666 0.0666 0.0874 0.0874 0.1663 0.1663 0.4632 0.4632 0.9650 0.9650 1.1537 1.1537 1.5134 1.5134 1.9764 1.9764 2.2075 2.2075 2.4273 2.4273 2.4910 2.4910 2.8231 2.8231 2.8786 2.8786 2.8879 2.8879 3.0987 3.0987 3.2195 3.2195 3.4368 3.4368 3.6313 3.6313 3.8037 3.8037 4.5351 4.5351 5.1206 5.1206 9.4151 9.4151 9.8967 9.8967 10.0057 10.0057 10.0750 10.0750 10.1626 10.1626 10.5409 10.5409 k = 0.5000-0.0192 0.5988 ( 18084 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3064 -8.3064 -7.8345 -7.8345 -7.7067 -7.7067 -7.6991 -7.6991 -7.5254 -7.5254 -7.5037 -7.5037 -6.5859 -6.5859 -6.5801 -6.5801 -5.7295 -5.7295 -5.7279 -5.7279 -5.7107 -5.7107 -5.7049 -5.7049 -0.4381 -0.4381 -0.2529 -0.2529 0.0659 0.0659 0.0915 0.0915 0.1627 0.1627 0.4625 0.4625 0.9705 0.9705 1.1485 1.1485 1.5146 1.5146 1.9767 1.9767 2.2100 2.2100 2.4244 2.4244 2.4875 2.4875 2.8265 2.8265 2.8751 2.8751 2.8885 2.8885 3.0975 3.0975 3.2306 3.2306 3.4254 3.4254 3.6632 3.6632 3.7720 3.7720 4.5512 4.5512 5.1074 5.1074 9.4192 9.4192 9.9113 9.9113 10.0108 10.0108 10.0800 10.0800 10.1646 10.1646 10.5411 10.5411 k = 0.5000-0.0000 0.6124 ( 18140 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3063 -8.3063 -7.8352 -7.8352 -7.7065 -7.7065 -7.6992 -7.6992 -7.5197 -7.5197 -7.5088 -7.5088 -6.5858 -6.5858 -6.5801 -6.5801 -5.7290 -5.7290 -5.7284 -5.7284 -5.7107 -5.7107 -5.7049 -5.7049 -0.4359 -0.4359 -0.2555 -0.2555 0.0656 0.0656 0.0930 0.0930 0.1613 0.1613 0.4623 0.4623 0.9725 0.9725 1.1467 1.1467 1.5151 1.5151 1.9768 1.9768 2.2108 2.2108 2.4235 2.4235 2.4863 2.4863 2.8278 2.8278 2.8737 2.8737 2.8887 2.8887 3.0971 3.0971 3.2347 3.2347 3.4212 3.4212 3.6798 3.6798 3.7555 3.7555 4.5568 4.5568 5.1028 5.1028 9.4206 9.4206 9.9164 9.9164 10.0126 10.0126 10.0817 10.0817 10.1652 10.1652 10.5460 10.5460 k = 0.5000-0.0000 0.6124 ( 18140 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3063 -8.3063 -7.8352 -7.8352 -7.7065 -7.7065 -7.6992 -7.6992 -7.5197 -7.5197 -7.5088 -7.5088 -6.5858 -6.5858 -6.5801 -6.5801 -5.7290 -5.7290 -5.7284 -5.7284 -5.7107 -5.7107 -5.7049 -5.7049 -0.4359 -0.4359 -0.2555 -0.2555 0.0656 0.0656 0.0930 0.0930 0.1613 0.1613 0.4623 0.4623 0.9725 0.9725 1.1467 1.1467 1.5151 1.5151 1.9768 1.9768 2.2108 2.2108 2.4235 2.4235 2.4863 2.4863 2.8278 2.8278 2.8737 2.8737 2.8887 2.8887 3.0971 3.0971 3.2347 3.2347 3.4212 3.4212 3.6798 3.6798 3.7555 3.7555 4.5568 4.5568 5.1028 5.1028 9.4206 9.4206 9.9164 9.9164 10.0126 10.0126 10.0817 10.0817 10.1652 10.1652 10.5460 10.5460 k = 0.4875 0.0217 0.6124 ( 18100 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3065 -8.3065 -7.8351 -7.8351 -7.7062 -7.7062 -7.6989 -7.6989 -7.5233 -7.5233 -7.5056 -7.5056 -6.5859 -6.5859 -6.5801 -6.5801 -5.7294 -5.7294 -5.7281 -5.7281 -5.7108 -5.7108 -5.7049 -5.7049 -0.4368 -0.4368 -0.2540 -0.2540 0.0633 0.0633 0.0937 0.0937 0.1621 0.1621 0.4624 0.4624 0.9703 0.9703 1.1476 1.1476 1.5156 1.5156 1.9770 1.9770 2.2108 2.2108 2.4242 2.4242 2.4862 2.4862 2.8250 2.8250 2.8693 2.8693 2.8965 2.8965 3.0974 3.0974 3.2324 3.2324 3.4255 3.4255 3.6699 3.6699 3.7651 3.7651 4.5547 4.5547 5.1054 5.1054 9.4161 9.4161 9.9062 9.9062 10.0002 10.0002 10.0905 10.0905 10.1735 10.1735 10.5426 10.5426 k = 0.4750 0.0433 0.6124 ( 18088 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3070 -8.3070 -7.8348 -7.8348 -7.7053 -7.7053 -7.6980 -7.6980 -7.5299 -7.5299 -7.5002 -7.5002 -6.5860 -6.5860 -6.5801 -6.5801 -5.7300 -5.7300 -5.7276 -5.7276 -5.7109 -5.7109 -5.7049 -5.7049 -0.4393 -0.4393 -0.2499 -0.2499 0.0570 0.0570 0.0954 0.0954 0.1643 0.1643 0.4626 0.4626 0.9640 0.9640 1.1503 1.1503 1.5171 1.5171 1.9775 1.9775 2.2106 2.2106 2.4261 2.4261 2.4859 2.4859 2.8194 2.8194 2.8623 2.8623 2.9110 2.9110 3.0981 3.0981 3.2259 3.2259 3.4377 3.4377 3.6491 3.6491 3.7847 3.7847 4.5487 4.5487 5.1128 5.1128 9.4049 9.4049 9.8792 9.8792 9.9703 9.9703 10.1158 10.1158 10.1906 10.1906 10.5426 10.5426 k = 0.4625 0.0650 0.6124 ( 18076 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3077 -8.3077 -7.8346 -7.8346 -7.7039 -7.7039 -7.6966 -7.6966 -7.5372 -7.5372 -7.4948 -7.4948 -6.5863 -6.5863 -6.5801 -6.5801 -5.7307 -5.7307 -5.7270 -5.7270 -5.7110 -5.7110 -5.7049 -5.7049 -0.4431 -0.4431 -0.2435 -0.2435 0.0484 0.0484 0.0975 0.0975 0.1671 0.1671 0.4629 0.4629 0.9546 0.9546 1.1547 1.1547 1.5194 1.5194 1.9781 1.9781 2.2104 2.2104 2.4291 2.4291 2.4850 2.4850 2.8138 2.8138 2.8555 2.8555 2.9265 2.9265 3.0992 3.0992 3.2165 3.2165 3.4553 3.4553 3.6260 3.6260 3.8060 3.8060 4.5393 4.5393 5.1241 5.1241 9.3896 9.3896 9.8438 9.8438 9.9345 9.9345 10.1469 10.1469 10.2086 10.2086 10.5476 10.5476 k = 0.4500 0.0866 0.6124 ( 18075 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3086 -8.3086 -7.8344 -7.8344 -7.7023 -7.7023 -7.6945 -7.6945 -7.5446 -7.5446 -7.4900 -7.4900 -6.5865 -6.5865 -6.5800 -6.5800 -5.7314 -5.7314 -5.7266 -5.7266 -5.7112 -5.7112 -5.7049 -5.7049 -0.4477 -0.4477 -0.2354 -0.2354 0.0389 0.0389 0.0993 0.0993 0.1703 0.1703 0.4632 0.4632 0.9433 0.9433 1.1600 1.1600 1.5221 1.5221 1.9788 1.9788 2.2103 2.2103 2.4328 2.4328 2.4834 2.4834 2.8094 2.8094 2.8493 2.8493 2.9415 2.9415 3.1004 3.1004 3.2061 3.2061 3.4748 3.4748 3.6044 3.6044 3.8261 3.8261 4.5272 4.5272 5.1380 5.1380 9.3726 9.3726 9.8068 9.8068 9.8984 9.8984 10.1754 10.1754 10.2245 10.2245 10.5568 10.5568 k = 0.4375 0.1083 0.6124 ( 18080 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3095 -8.3095 -7.8342 -7.8342 -7.7009 -7.7009 -7.6915 -7.6915 -7.5518 -7.5518 -7.4858 -7.4858 -6.5868 -6.5868 -6.5799 -6.5799 -5.7321 -5.7321 -5.7261 -5.7261 -5.7114 -5.7114 -5.7049 -5.7049 -0.4525 -0.4525 -0.2264 -0.2264 0.0293 0.0293 0.1006 0.1006 0.1734 0.1734 0.4636 0.4636 0.9316 0.9316 1.1656 1.1656 1.5250 1.5250 1.9794 1.9794 2.2101 2.2101 2.4369 2.4369 2.4811 2.4811 2.8066 2.8066 2.8436 2.8436 2.9549 2.9549 3.1018 3.1018 3.1960 3.1960 3.4920 3.4920 3.5875 3.5875 3.8440 3.8440 4.5138 4.5138 5.1531 5.1531 9.3555 9.3555 9.7720 9.7720 9.8647 9.8647 10.1971 10.1971 10.2373 10.2373 10.5688 10.5692 k = 0.4250 0.1299 0.6124 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3103 -8.3103 -7.8342 -7.8342 -7.6998 -7.6998 -7.6879 -7.6879 -7.5586 -7.5586 -7.4823 -7.4823 -6.5871 -6.5871 -6.5799 -6.5799 -5.7327 -5.7327 -5.7258 -5.7258 -5.7116 -5.7116 -5.7049 -5.7049 -0.4571 -0.4571 -0.2174 -0.2174 0.0203 0.0203 0.1014 0.1014 0.1762 0.1762 0.4639 0.4639 0.9205 0.9205 1.1709 1.1709 1.5277 1.5277 1.9800 1.9800 2.2101 2.2101 2.4413 2.4413 2.4782 2.4782 2.8054 2.8054 2.8383 2.8383 2.9664 2.9664 3.1032 3.1032 3.1875 3.1875 3.5017 3.5017 3.5794 3.5794 3.8591 3.8591 4.5003 4.5003 5.1677 5.1677 9.3397 9.3397 9.7416 9.7416 9.8354 9.8354 10.2108 10.2108 10.2467 10.2467 10.5683 10.5683 k = 0.4125 0.1516 0.6124 ( 18071 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3110 -8.3110 -7.8342 -7.8342 -7.6990 -7.6990 -7.6842 -7.6842 -7.5647 -7.5647 -7.4795 -7.4795 -6.5873 -6.5873 -6.5798 -6.5798 -5.7332 -5.7332 -5.7254 -5.7254 -5.7118 -5.7118 -5.7049 -5.7049 -0.4610 -0.4610 -0.2091 -0.2091 0.0124 0.0124 0.1019 0.1019 0.1786 0.1786 0.4642 0.4642 0.9109 0.9109 1.1755 1.1755 1.5301 1.5301 1.9804 1.9804 2.2100 2.2100 2.4459 2.4459 2.4747 2.4747 2.8055 2.8055 2.8335 2.8335 2.9754 2.9754 3.1045 3.1045 3.1809 3.1809 3.5013 3.5013 3.5819 3.5819 3.8711 3.8711 4.4880 4.4880 5.1807 5.1807 9.3262 9.3262 9.7170 9.7170 9.8114 9.8114 10.2179 10.2179 10.2527 10.2527 10.5648 10.5648 k = 0.4000 0.1732 0.6124 ( 18067 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3116 -8.3116 -7.8343 -7.8343 -7.6985 -7.6985 -7.6809 -7.6809 -7.5695 -7.5695 -7.4775 -7.4775 -6.5875 -6.5875 -6.5797 -6.5797 -5.7335 -5.7335 -5.7252 -5.7252 -5.7120 -5.7120 -5.7049 -5.7049 -0.4641 -0.4641 -0.2024 -0.2024 0.0062 0.0062 0.1021 0.1021 0.1804 0.1804 0.4644 0.4644 0.9036 0.9036 1.1790 1.1790 1.5319 1.5319 1.9807 1.9807 2.2100 2.2100 2.4503 2.4503 2.4710 2.4710 2.8067 2.8067 2.8295 2.8295 2.9817 2.9817 3.1055 3.1055 3.1765 3.1765 3.4956 3.4956 3.5894 3.5894 3.8798 3.8798 4.4782 4.4782 5.1907 5.1907 9.3159 9.3159 9.6989 9.6989 9.7938 9.7938 10.2206 10.2206 10.2562 10.2562 10.5611 10.5611 k = 0.3875 0.1949 0.6124 ( 18048 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3119 -8.3119 -7.8343 -7.8343 -7.6982 -7.6982 -7.6787 -7.6787 -7.5726 -7.5726 -7.4763 -7.4763 -6.5876 -6.5876 -6.5797 -6.5797 -5.7338 -5.7338 -5.7251 -5.7251 -5.7121 -5.7121 -5.7049 -5.7049 -0.4660 -0.4660 -0.1980 -0.1980 0.0022 0.0022 0.1021 0.1021 0.1815 0.1815 0.4646 0.4646 0.8991 0.8991 1.1812 1.1812 1.5330 1.5330 1.9809 1.9809 2.2101 2.2101 2.4543 2.4543 2.4674 2.4674 2.8080 2.8080 2.8265 2.8265 2.9854 2.9854 3.1062 3.1062 3.1741 3.1741 3.4903 3.4903 3.5958 3.5958 3.8851 3.8851 4.4719 4.4719 5.1972 5.1972 9.3095 9.3095 9.6879 9.6879 9.7830 9.7830 10.2211 10.2211 10.2580 10.2580 10.5582 10.5582 k = 0.3750 0.2165 0.6124 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1022 0.1022 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.3750 0.2165 0.6124 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1022 0.1022 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.3625 0.2093 0.5920 ( 18062 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3125 -8.3125 -7.8419 -7.8419 -7.6984 -7.6984 -7.6714 -7.6714 -7.5636 -7.5636 -7.4822 -7.4822 -6.5878 -6.5878 -6.5803 -6.5803 -5.7338 -5.7338 -5.7254 -5.7254 -5.7124 -5.7124 -5.7057 -5.7057 -0.4516 -0.4516 -0.2077 -0.2077 -0.0153 -0.0153 0.1104 0.1104 0.1755 0.1755 0.4621 0.4621 0.8951 0.8951 1.1699 1.1699 1.5454 1.5454 1.9847 1.9847 2.2221 2.2221 2.4456 2.4456 2.4548 2.4548 2.8007 2.8007 2.8206 2.8206 3.0023 3.0023 3.1139 3.1139 3.1934 3.1934 3.5145 3.5145 3.6026 3.6026 3.8543 3.8543 4.5155 4.5155 5.1757 5.1757 9.2699 9.2699 9.6625 9.6625 9.7768 9.7768 10.2466 10.2466 10.3004 10.3004 10.4813 10.4813 k = 0.3500 0.2021 0.5715 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3137 -8.3137 -7.8479 -7.8479 -7.6987 -7.6987 -7.6643 -7.6643 -7.5541 -7.5541 -7.4888 -7.4888 -6.5881 -6.5881 -6.5809 -6.5809 -5.7339 -5.7339 -5.7259 -5.7259 -5.7127 -5.7127 -5.7066 -5.7066 -0.4360 -0.4360 -0.2185 -0.2185 -0.0336 -0.0336 0.1184 0.1184 0.1692 0.1692 0.4600 0.4600 0.8904 0.8904 1.1569 1.1569 1.5573 1.5573 1.9896 1.9896 2.2346 2.2346 2.4284 2.4284 2.4547 2.4547 2.7825 2.7825 2.8261 2.8261 3.0131 3.0131 3.1269 3.1269 3.2150 3.2150 3.5413 3.5413 3.6110 3.6110 3.8215 3.8215 4.5618 4.5618 5.1536 5.1536 9.2187 9.2187 9.6315 9.6315 9.7842 9.7842 10.2513 10.2513 10.3420 10.3420 10.4187 10.4187 k = 0.3375 0.1949 0.5511 ( 18052 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3156 -8.3156 -7.8523 -7.8523 -7.6989 -7.6989 -7.6568 -7.6568 -7.5453 -7.5453 -7.4957 -7.4957 -6.5885 -6.5885 -6.5817 -6.5817 -5.7342 -5.7342 -5.7265 -5.7265 -5.7130 -5.7130 -5.7077 -5.7077 -0.4198 -0.4198 -0.2285 -0.2285 -0.0538 -0.0538 0.1252 0.1252 0.1633 0.1633 0.4581 0.4581 0.8835 0.8835 1.1430 1.1430 1.5681 1.5681 1.9956 1.9956 2.2474 2.2474 2.4121 2.4121 2.4578 2.4578 2.7633 2.7633 2.8338 2.8338 3.0195 3.0195 3.1449 3.1449 3.2375 3.2375 3.5684 3.5684 3.6222 3.6222 3.7905 3.7905 4.6084 4.6084 5.1335 5.1335 9.1558 9.1558 9.5902 9.5902 9.8009 9.8009 10.2194 10.2194 10.3779 10.3779 10.3848 10.3848 k = 0.3250 0.1876 0.5307 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3184 -8.3184 -7.8548 -7.8548 -7.6990 -7.6990 -7.6489 -7.6489 -7.5371 -7.5371 -7.5029 -7.5029 -6.5890 -6.5890 -6.5825 -6.5825 -5.7347 -5.7347 -5.7270 -5.7270 -5.7134 -5.7134 -5.7088 -5.7088 -0.4034 -0.4034 -0.2377 -0.2377 -0.0757 -0.0757 0.1299 0.1299 0.1586 0.1586 0.4564 0.4564 0.8748 0.8748 1.1283 1.1283 1.5767 1.5767 2.0027 2.0027 2.2604 2.2604 2.3972 2.3972 2.4641 2.4641 2.7452 2.7452 2.8433 2.8433 3.0230 3.0230 3.1665 3.1665 3.2608 3.2608 3.5953 3.5953 3.6335 3.6335 3.7646 3.7646 4.6550 4.6550 5.1158 5.1158 9.0840 9.0840 9.5395 9.5395 9.8240 9.8240 10.1572 10.1572 10.3533 10.3533 10.3733 10.3733 k = 0.3125 0.1804 0.5103 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3221 -8.3221 -7.8555 -7.8555 -7.6989 -7.6989 -7.6407 -7.6407 -7.5295 -7.5295 -7.5103 -7.5103 -6.5897 -6.5897 -6.5834 -6.5834 -5.7354 -5.7354 -5.7277 -5.7277 -5.7140 -5.7140 -5.7100 -5.7100 -0.3867 -0.3867 -0.2459 -0.2459 -0.0992 -0.0992 0.1310 0.1310 0.1561 0.1561 0.4550 0.4550 0.8649 0.8649 1.1129 1.1129 1.5824 1.5824 2.0110 2.0110 2.2730 2.2730 2.3839 2.3839 2.4731 2.4731 2.7295 2.7295 2.8546 2.8546 3.0251 3.0251 3.1898 3.1898 3.2849 3.2849 3.6216 3.6216 3.6399 3.6399 3.7498 3.7498 4.7012 4.7012 5.1008 5.1008 9.0054 9.0054 9.4807 9.4807 9.8494 9.8494 10.0843 10.0843 10.2582 10.2582 10.3538 10.3538 k = 0.3000 0.1732 0.4899 ( 18048 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3267 -8.3267 -7.8544 -7.8544 -7.6986 -7.6986 -7.6323 -7.6323 -7.5225 -7.5225 -7.5176 -7.5176 -6.5905 -6.5905 -6.5844 -6.5844 -5.7363 -5.7363 -5.7284 -5.7284 -5.7146 -5.7146 -5.7114 -5.7114 -0.3700 -0.3700 -0.2531 -0.2531 -0.1241 -0.1241 0.1283 0.1283 0.1559 0.1559 0.4536 0.4536 0.8540 0.8540 1.0970 1.0970 1.5842 1.5842 2.0205 2.0205 2.2846 2.2846 2.3733 2.3733 2.4842 2.4842 2.7173 2.7173 2.8678 2.8678 3.0270 3.0270 3.2138 3.2138 3.3093 3.3093 3.6357 3.6357 3.6474 3.6474 3.7519 3.7519 4.7467 4.7467 5.0889 5.0889 8.9219 8.9219 9.4152 9.4152 9.8703 9.8703 10.0118 10.0118 10.1603 10.1603 10.3228 10.3228 k = 0.2875 0.1660 0.4695 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3322 -8.3322 -7.8516 -7.8516 -7.6982 -7.6982 -7.6239 -7.6239 -7.5252 -7.5252 -7.5159 -7.5159 -6.5914 -6.5914 -6.5855 -6.5855 -5.7374 -5.7374 -5.7291 -5.7291 -5.7155 -5.7155 -5.7128 -5.7128 -0.3534 -0.3534 -0.2593 -0.2593 -0.1500 -0.1500 0.1234 0.1234 0.1564 0.1564 0.4521 0.4521 0.8426 0.8426 1.0806 1.0806 1.5817 1.5817 2.0310 2.0310 2.2935 2.2935 2.3669 2.3669 2.4961 2.4961 2.7096 2.7096 2.8827 2.8827 3.0300 3.0300 3.2376 3.2376 3.3335 3.3335 3.6244 3.6244 3.6728 3.6728 3.7686 3.7686 4.7912 4.7912 5.0804 5.0804 8.8349 8.8349 9.3444 9.3444 9.8697 9.8697 9.9515 9.9515 10.0647 10.0647 10.2755 10.2755 k = 0.2750 0.1588 0.4491 ( 18050 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3385 -8.3385 -7.8471 -7.8471 -7.6975 -7.6975 -7.6155 -7.6155 -7.5323 -7.5323 -7.5099 -7.5099 -6.5925 -6.5925 -6.5868 -6.5868 -5.7387 -5.7387 -5.7298 -5.7298 -5.7166 -5.7166 -5.7142 -5.7142 -0.3372 -0.3372 -0.2649 -0.2649 -0.1764 -0.1764 0.1177 0.1177 0.1564 0.1564 0.4503 0.4503 0.8309 0.8309 1.0639 1.0639 1.5747 1.5747 2.0424 2.0424 2.2973 2.2973 2.3676 2.3676 2.5076 2.5076 2.7069 2.7069 2.8987 2.8987 3.0354 3.0354 3.2608 3.2608 3.3565 3.3565 3.6136 3.6136 3.6981 3.6981 3.7932 3.7932 4.8344 4.8344 5.0756 5.0756 8.7454 8.7454 9.2694 9.2694 9.8246 9.8246 9.9110 9.9110 9.9764 9.9764 10.2284 10.2284 k = 0.2625 0.1516 0.4287 ( 18054 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3455 -8.3455 -7.8410 -7.8410 -7.6967 -7.6967 -7.6076 -7.6076 -7.5389 -7.5389 -7.5044 -7.5044 -6.5937 -6.5937 -6.5882 -6.5882 -5.7401 -5.7401 -5.7306 -5.7306 -5.7182 -5.7182 -5.7156 -5.7156 -0.3218 -0.3218 -0.2707 -0.2707 -0.2019 -0.2019 0.1116 0.1116 0.1553 0.1553 0.4480 0.4480 0.8194 0.8194 1.0470 1.0470 1.5630 1.5630 2.0547 2.0547 2.2949 2.2949 2.3764 2.3764 2.5179 2.5179 2.7093 2.7093 2.9141 2.9141 3.0454 3.0454 3.2825 3.2825 3.3774 3.3774 3.6088 3.6088 3.7233 3.7233 3.8214 3.8214 4.8755 4.8755 5.0750 5.0750 8.6545 8.6545 9.1915 9.1915 9.7583 9.7583 9.8471 9.8471 9.9039 9.9039 10.1985 10.1985 k = 0.2500 0.1443 0.4082 ( 18086 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3531 -8.3531 -7.8336 -7.8336 -7.6956 -7.6956 -7.6007 -7.6007 -7.5443 -7.5443 -7.4993 -7.4993 -6.5952 -6.5952 -6.5896 -6.5896 -5.7417 -5.7417 -5.7315 -5.7315 -5.7201 -5.7201 -5.7169 -5.7169 -0.3084 -0.3084 -0.2786 -0.2786 -0.2231 -0.2231 0.1057 0.1057 0.1531 0.1531 0.4451 0.4451 0.8082 0.8082 1.0300 1.0300 1.5468 1.5468 2.0675 2.0675 2.2884 2.2884 2.3913 2.3913 2.5271 2.5271 2.7159 2.7159 2.9269 2.9269 3.0622 3.0622 3.3016 3.3016 3.3964 3.3964 3.6132 3.6132 3.7485 3.7485 3.8513 3.8513 4.9141 4.9141 5.0793 5.0793 8.5630 8.5630 9.1116 9.1116 9.6889 9.6889 9.7616 9.7616 9.8288 9.8288 10.1821 10.1821 k = 0.2375 0.1371 0.3878 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3611 -8.3611 -7.8250 -7.8250 -7.6943 -7.6943 -7.5957 -7.5957 -7.5478 -7.5478 -7.4946 -7.4946 -6.5968 -6.5968 -6.5912 -6.5912 -5.7434 -5.7434 -5.7323 -5.7323 -5.7223 -5.7223 -5.7182 -5.7182 -0.3063 -0.3063 -0.2845 -0.2845 -0.2351 -0.2351 0.1000 0.1000 0.1497 0.1497 0.4416 0.4416 0.7975 0.7975 1.0129 1.0129 1.5264 1.5264 2.0807 2.0807 2.2803 2.2803 2.4098 2.4098 2.5360 2.5360 2.7257 2.7257 2.9355 2.9355 3.0869 3.0869 3.3166 3.3166 3.4151 3.4151 3.6275 3.6275 3.7737 3.7737 3.8818 3.8818 4.9493 4.9493 5.0891 5.0891 8.4716 8.4716 9.0307 9.0307 9.6200 9.6200 9.6731 9.6731 9.7412 9.7412 10.1643 10.1643 k = 0.2250 0.1299 0.3674 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9152 -21.9152 -8.3695 -8.3695 -7.8154 -7.8154 -7.6929 -7.6929 -7.5937 -7.5937 -7.5482 -7.5482 -7.4902 -7.4902 -6.5985 -6.5985 -6.5928 -6.5928 -5.7452 -5.7452 -5.7332 -5.7332 -5.7249 -5.7249 -5.7195 -5.7195 -0.3278 -0.3278 -0.2769 -0.2769 -0.2367 -0.2367 0.0947 0.0947 0.1453 0.1453 0.4374 0.4374 0.7874 0.7874 0.9957 0.9957 1.5023 1.5023 2.0940 2.0940 2.2718 2.2718 2.4298 2.4298 2.5460 2.5460 2.7372 2.7372 2.9397 2.9397 3.1186 3.1186 3.3266 3.3266 3.4363 3.4363 3.6507 3.6507 3.7987 3.7987 3.9122 3.9122 4.9806 4.9806 5.1048 5.1048 8.3811 8.3811 8.9495 8.9495 9.5523 9.5523 9.5857 9.5857 9.6460 9.6460 10.1381 10.1381 k = 0.2125 0.1227 0.3470 ( 18064 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3782 -8.3782 -7.8049 -7.8049 -7.6912 -7.6912 -7.5951 -7.5951 -7.5450 -7.5450 -7.4862 -7.4862 -6.6005 -6.6005 -6.5944 -6.5944 -5.7471 -5.7471 -5.7341 -5.7341 -5.7276 -5.7276 -5.7210 -5.7210 -0.3570 -0.3570 -0.2679 -0.2679 -0.2315 -0.2315 0.0897 0.0897 0.1401 0.1401 0.4326 0.4326 0.7780 0.7780 0.9784 0.9784 1.4749 1.4749 2.1072 2.1072 2.2637 2.2637 2.4498 2.4498 2.5585 2.5585 2.7497 2.7497 2.9407 2.9407 3.1548 3.1548 3.3328 3.3328 3.4617 3.4617 3.6807 3.6807 3.8234 3.8234 3.9422 3.9422 5.0083 5.0083 5.1262 5.1262 8.2920 8.2920 8.8689 8.8689 9.4856 9.4856 9.5006 9.5006 9.5478 9.5478 10.1048 10.1048 k = 0.2000 0.1155 0.3266 ( 18064 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3869 -8.3869 -7.7938 -7.7938 -7.6894 -7.6894 -7.5990 -7.5990 -7.5392 -7.5392 -7.4825 -7.4825 -6.6027 -6.6027 -6.5961 -6.5961 -5.7490 -5.7490 -5.7351 -5.7351 -5.7304 -5.7304 -5.7225 -5.7225 -0.3888 -0.3888 -0.2599 -0.2599 -0.2223 -0.2223 0.0852 0.0852 0.1342 0.1342 0.4273 0.4273 0.7692 0.7692 0.9611 0.9611 1.4449 1.4449 2.1200 2.1200 2.2564 2.2564 2.4680 2.4680 2.5751 2.5751 2.7625 2.7625 2.9394 2.9394 3.1920 3.1920 3.3383 3.3383 3.4913 3.4913 3.7155 3.7155 3.8478 3.8478 3.9715 3.9715 5.0334 5.0334 5.1518 5.1518 8.2049 8.2049 8.7895 8.7895 9.4113 9.4113 9.4251 9.4251 9.4506 9.4506 10.0666 10.0666 k = 0.1875 0.1083 0.3062 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3957 -8.3957 -7.7823 -7.7823 -7.6874 -7.6874 -7.6043 -7.6043 -7.5320 -7.5320 -7.4791 -7.4791 -6.6050 -6.6050 -6.5978 -6.5978 -5.7510 -5.7510 -5.7363 -5.7363 -5.7332 -5.7332 -5.7241 -5.7241 -0.4216 -0.4216 -0.2521 -0.2521 -0.2113 -0.2113 0.0811 0.0811 0.1278 0.1278 0.4217 0.4217 0.7612 0.7612 0.9436 0.9436 1.4131 1.4131 2.1322 2.1322 2.2500 2.2500 2.4834 2.4834 2.5965 2.5965 2.7753 2.7753 2.9368 2.9368 3.2260 3.2260 3.3471 3.3471 3.5249 3.5249 3.7536 3.7536 3.8720 3.8720 3.9998 3.9998 5.0576 5.0576 5.1799 5.1799 8.1205 8.1205 8.7118 8.7118 9.3232 9.3232 9.3596 9.3596 9.3620 9.3620 10.0258 10.0258 k = 0.1750 0.1010 0.2858 ( 18072 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4043 -8.4043 -7.7705 -7.7705 -7.6854 -7.6854 -7.6102 -7.6102 -7.5242 -7.5242 -7.4759 -7.4759 -6.6075 -6.6075 -6.5994 -6.5994 -5.7529 -5.7529 -5.7382 -5.7382 -5.7354 -5.7354 -5.7258 -5.7258 -0.4545 -0.4545 -0.2437 -0.2437 -0.1997 -0.1997 0.0775 0.0775 0.1210 0.1210 0.4160 0.4160 0.7539 0.7539 0.9260 0.9260 1.3801 1.3801 2.1439 2.1439 2.2446 2.2446 2.4961 2.4961 2.6219 2.6219 2.7878 2.7878 2.9332 2.9332 3.2521 3.2521 3.3635 3.3635 3.5617 3.5617 3.7933 3.7933 3.8960 3.8960 4.0269 4.0269 5.0823 5.0823 5.2089 5.2089 8.0391 8.0391 8.6365 8.6365 9.2282 9.2282 9.2806 9.2806 9.2998 9.2998 9.9837 9.9837 k = 0.1625 0.0938 0.2654 ( 18070 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4127 -8.4127 -7.7586 -7.7586 -7.6832 -7.6832 -7.6163 -7.6163 -7.5162 -7.5162 -7.4729 -7.4729 -6.6100 -6.6100 -6.6011 -6.6011 -5.7549 -5.7549 -5.7410 -5.7410 -5.7368 -5.7368 -5.7276 -5.7276 -0.4872 -0.4872 -0.2346 -0.2346 -0.1882 -0.1882 0.0743 0.0743 0.1142 0.1142 0.4103 0.4103 0.7472 0.7472 0.9080 0.9080 1.3468 1.3468 2.1549 2.1549 2.2401 2.2401 2.5066 2.5066 2.6502 2.6502 2.7999 2.7999 2.9291 2.9291 3.2682 3.2682 3.3891 3.3891 3.6016 3.6016 3.8334 3.8334 3.9202 3.9202 4.0528 4.0528 5.1084 5.1084 5.2376 5.2376 7.9612 7.9612 8.5640 8.5640 9.1310 9.1310 9.2085 9.2085 9.2398 9.2398 9.9414 9.9414 k = 0.1500 0.0866 0.2449 ( 18088 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4207 -8.4207 -7.7468 -7.7468 -7.6809 -7.6809 -7.6223 -7.6223 -7.5082 -7.5082 -7.4702 -7.4702 -6.6126 -6.6126 -6.6028 -6.6028 -5.7568 -5.7568 -5.7442 -5.7442 -5.7378 -5.7378 -5.7294 -5.7294 -0.5191 -0.5191 -0.2246 -0.2246 -0.1773 -0.1773 0.0714 0.0714 0.1072 0.1072 0.4047 0.4047 0.7411 0.7411 0.8896 0.8896 1.3139 1.3139 2.1651 2.1651 2.2366 2.2366 2.5156 2.5156 2.6798 2.6798 2.8116 2.8116 2.9248 2.9248 3.2773 3.2773 3.4207 3.4207 3.6438 3.6438 3.8718 3.8718 3.9456 3.9456 4.0771 4.0771 5.1362 5.1362 5.2653 5.2653 7.8873 7.8873 8.4948 8.4948 9.0348 9.0348 9.1420 9.1420 9.1812 9.1812 9.8996 9.8996 k = 0.1375 0.0794 0.2245 ( 18092 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9150 -21.9150 -8.4284 -8.4284 -7.7353 -7.7353 -7.6787 -7.6787 -7.6281 -7.6281 -7.5005 -7.5005 -7.4677 -7.4677 -6.6153 -6.6153 -6.6044 -6.6044 -5.7586 -5.7586 -5.7475 -5.7475 -5.7386 -5.7386 -5.7312 -5.7312 -0.5499 -0.5499 -0.2137 -0.2137 -0.1670 -0.1670 0.0690 0.0690 0.1004 0.1004 0.3995 0.3995 0.7356 0.7356 0.8708 0.8708 1.2823 1.2823 2.1747 2.1747 2.2338 2.2338 2.5237 2.5237 2.7094 2.7094 2.8228 2.8228 2.9203 2.9203 3.2829 3.2829 3.4539 3.4539 3.6879 3.6879 3.9064 3.9064 3.9736 3.9736 4.1000 4.1000 5.1659 5.1659 5.2915 5.2915 7.8178 7.8178 8.4294 8.4294 8.9411 8.9411 9.0805 9.0805 9.1242 9.1242 9.8592 9.8592 k = 0.1250 0.0722 0.2041 ( 18095 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9150 -21.9150 -8.4357 -8.4357 -7.7242 -7.7242 -7.6764 -7.6764 -7.6335 -7.6335 -7.4931 -7.4931 -7.4654 -7.4654 -6.6179 -6.6179 -6.6059 -6.6059 -5.7604 -5.7604 -5.7508 -5.7508 -5.7394 -5.7394 -5.7330 -5.7330 -0.5792 -0.5792 -0.2022 -0.2022 -0.1575 -0.1575 0.0670 0.0670 0.0939 0.0939 0.3945 0.3945 0.7306 0.7306 0.8514 0.8514 1.2526 1.2526 2.1835 2.1835 2.2316 2.2316 2.5312 2.5312 2.7380 2.7380 2.8334 2.8334 2.9159 2.9159 3.2873 3.2873 3.4865 3.4865 3.7332 3.7332 3.9351 3.9351 4.0052 4.0052 4.1212 4.1212 5.1972 5.1972 5.3159 5.3159 7.7531 7.7531 8.3681 8.3681 8.8509 8.8509 9.0240 9.0240 9.0689 9.0689 9.8205 9.8205 k = 0.1125 0.0650 0.1837 ( 18065 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4424 -8.4424 -7.7138 -7.7138 -7.6743 -7.6743 -7.6386 -7.6386 -7.4861 -7.4861 -7.4633 -7.4633 -6.6204 -6.6204 -6.6074 -6.6074 -5.7621 -5.7621 -5.7539 -5.7539 -5.7402 -5.7402 -5.7347 -5.7347 -0.6068 -0.6068 -0.1901 -0.1901 -0.1489 -0.1489 0.0652 0.0652 0.0878 0.0878 0.3900 0.3900 0.7261 0.7261 0.8316 0.8316 1.2253 1.2253 2.1916 2.1916 2.2301 2.2301 2.5380 2.5380 2.7649 2.7649 2.8433 2.8433 2.9116 2.9116 3.2914 3.2914 3.5171 3.5171 3.7788 3.7788 3.9580 3.9580 4.0394 4.0394 4.1407 4.1407 5.2296 5.2296 5.3381 5.3381 7.6934 7.6934 8.3113 8.3113 8.7652 8.7652 8.9724 8.9724 9.0158 9.0158 9.7840 9.7840 k = 0.1000 0.0577 0.1633 ( 18077 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4486 -8.4486 -7.7040 -7.7040 -7.6721 -7.6721 -7.6432 -7.6432 -7.4797 -7.4797 -7.4614 -7.4614 -6.6228 -6.6228 -6.6088 -6.6088 -5.7636 -5.7636 -5.7569 -5.7569 -5.7408 -5.7408 -5.7363 -5.7363 -0.6323 -0.6323 -0.1778 -0.1778 -0.1413 -0.1413 0.0638 0.0638 0.0820 0.0820 0.3860 0.3860 0.7221 0.7221 0.8116 0.8116 1.2010 1.2010 2.1988 2.1988 2.2290 2.2290 2.5444 2.5444 2.7895 2.7895 2.8525 2.8525 2.9075 2.9075 3.2956 3.2956 3.5451 3.5451 3.8238 3.8238 3.9766 3.9766 4.0740 4.0740 4.1583 4.1583 5.2626 5.2626 5.3581 5.3581 7.6391 7.6391 8.2595 8.2595 8.6847 8.6847 8.9259 8.9259 8.9655 8.9655 9.7503 9.7503 k = 0.0875 0.0505 0.1429 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4541 -8.4541 -7.6952 -7.6952 -7.6701 -7.6701 -7.6473 -7.6473 -7.4739 -7.4739 -7.4597 -7.4597 -6.6251 -6.6251 -6.6102 -6.6102 -5.7650 -5.7650 -5.7597 -5.7597 -5.7414 -5.7414 -5.7379 -5.7379 -0.6554 -0.6554 -0.1656 -0.1656 -0.1346 -0.1346 0.0626 0.0626 0.0769 0.0769 0.3825 0.3825 0.7185 0.7185 0.7917 0.7917 1.1798 1.1798 2.2053 2.2053 2.2283 2.2283 2.5503 2.5503 2.8115 2.8115 2.8608 2.8608 2.9038 2.9038 3.3000 3.3000 3.5701 3.5701 3.8672 3.8672 3.9919 3.9919 4.1071 4.1071 4.1741 4.1741 5.2953 5.2953 5.3757 5.3757 7.5905 7.5905 8.2129 8.2129 8.6105 8.6105 8.8845 8.8845 8.9187 8.9187 9.7194 9.7194 k = 0.0750 0.0433 0.1225 ( 18081 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4590 -8.4590 -7.6876 -7.6876 -7.6682 -7.6682 -7.6508 -7.6508 -7.4688 -7.4688 -7.4582 -7.4582 -6.6271 -6.6271 -6.6113 -6.6113 -5.7663 -5.7663 -5.7623 -5.7623 -5.7419 -5.7419 -5.7393 -5.7393 -0.6759 -0.6759 -0.1538 -0.1538 -0.1288 -0.1288 0.0616 0.0616 0.0723 0.0723 0.3795 0.3795 0.7154 0.7154 0.7725 0.7725 1.1619 1.1619 2.2111 2.2111 2.2278 2.2278 2.5555 2.5555 2.8305 2.8305 2.8681 2.8681 2.9003 2.9003 3.3044 3.3044 3.5921 3.5921 3.9079 3.9079 4.0048 4.0048 4.1373 4.1373 4.1879 4.1879 5.3267 5.3267 5.3909 5.3909 7.5478 7.5478 8.1719 8.1719 8.5434 8.5434 8.8485 8.8485 8.8761 8.8761 9.6916 9.6916 k = 0.0625 0.0361 0.1021 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4632 -8.4632 -7.6812 -7.6812 -7.6664 -7.6664 -7.6536 -7.6536 -7.4643 -7.4643 -7.4569 -7.4569 -6.6289 -6.6289 -6.6124 -6.6124 -5.7673 -5.7673 -5.7645 -5.7645 -5.7424 -5.7424 -5.7405 -5.7405 -0.6937 -0.6937 -0.1427 -0.1427 -0.1240 -0.1240 0.0608 0.0608 0.0684 0.0684 0.3770 0.3770 0.7127 0.7127 0.7545 0.7545 1.1471 1.1471 2.2159 2.2159 2.2275 2.2275 2.5601 2.5601 2.8465 2.8465 2.8745 2.8745 2.8973 2.8973 3.3088 3.3088 3.6108 3.6108 3.9449 3.9449 4.0154 4.0154 4.1638 4.1638 4.1997 4.1997 5.3559 5.3559 5.4037 5.4037 7.5113 7.5113 8.1366 8.1366 8.4845 8.4845 8.8178 8.8178 8.8386 8.8386 9.6670 9.6670 k = 0.0500 0.0289 0.0816 ( 18083 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4667 -8.4667 -7.6764 -7.6764 -7.6644 -7.6644 -7.6558 -7.6558 -7.4607 -7.4607 -7.4559 -7.4559 -6.6305 -6.6305 -6.6132 -6.6132 -5.7682 -5.7682 -5.7664 -5.7664 -5.7428 -5.7428 -5.7415 -5.7415 -0.7085 -0.7085 -0.1329 -0.1329 -0.1201 -0.1201 0.0603 0.0603 0.0651 0.0651 0.3749 0.3749 0.7105 0.7105 0.7384 0.7384 1.1355 1.1355 2.2200 2.2200 2.2274 2.2274 2.5640 2.5640 2.8595 2.8595 2.8799 2.8799 2.8948 2.8948 3.3128 3.3128 3.6261 3.6261 3.9771 3.9771 4.0239 4.0239 4.1861 4.1861 4.2094 4.2094 5.3817 5.3817 5.4141 5.4141 7.4812 7.4812 8.1075 8.1075 8.4347 8.4347 8.7926 8.7926 8.8067 8.8067 9.6453 9.6453 k = 0.0375 0.0217 0.0612 ( 18087 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4694 -8.4694 -7.6733 -7.6733 -7.6624 -7.6624 -7.6573 -7.6573 -7.4578 -7.4578 -7.4550 -7.4550 -6.6317 -6.6317 -6.6139 -6.6139 -5.7689 -5.7689 -5.7679 -5.7679 -5.7431 -5.7431 -5.7424 -5.7424 -0.7201 -0.7201 -0.1247 -0.1247 -0.1171 -0.1171 0.0598 0.0598 0.0626 0.0626 0.3734 0.3734 0.7087 0.7087 0.7250 0.7250 1.1266 1.1266 2.2231 2.2231 2.2273 2.2273 2.5671 2.5671 2.8694 2.8694 2.8842 2.8842 2.8928 2.8928 3.3162 3.3162 3.6381 3.6381 4.0034 4.0034 4.0306 4.0306 4.2038 4.2038 4.2170 4.2170 5.4030 5.4030 5.4221 5.4221 7.4576 7.4576 8.0846 8.0846 8.3949 8.3949 8.7729 8.7729 8.7813 8.7813 9.6262 9.6262 k = 0.0250 0.0144 0.0408 ( 18113 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4713 -8.4713 -7.6717 -7.6717 -7.6605 -7.6605 -7.6582 -7.6582 -7.4557 -7.4557 -7.4544 -7.4544 -6.6326 -6.6326 -6.6144 -6.6144 -5.7695 -5.7695 -5.7690 -5.7690 -5.7433 -5.7433 -5.7430 -5.7430 -0.7285 -0.7285 -0.1185 -0.1185 -0.1150 -0.1150 0.0595 0.0595 0.0607 0.0607 0.3723 0.3723 0.7074 0.7074 0.7149 0.7149 1.1205 1.1205 2.2254 2.2254 2.2272 2.2272 2.5694 2.5694 2.8763 2.8763 2.8874 2.8874 2.8913 2.8913 3.3188 3.3188 3.6467 3.6467 4.0229 4.0229 4.0353 4.0353 4.2165 4.2165 4.2224 4.2224 5.4190 5.4190 5.4277 5.4277 7.4406 7.4406 8.0681 8.0681 8.3659 8.3659 8.7589 8.7589 8.7627 8.7627 9.6101 9.6101 k = 0.0125 0.0072 0.0204 ( 18117 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4725 -8.4725 -7.6710 -7.6710 -7.6592 -7.6592 -7.6586 -7.6586 -7.4544 -7.4544 -7.4541 -7.4541 -6.6332 -6.6332 -6.6147 -6.6147 -5.7698 -5.7698 -5.7697 -5.7697 -5.7434 -5.7434 -5.7434 -5.7434 -0.7336 -0.7336 -0.1146 -0.1146 -0.1137 -0.1137 0.0593 0.0593 0.0596 0.0596 0.3716 0.3716 0.7067 0.7067 0.7086 0.7086 1.1169 1.1169 2.2268 2.2268 2.2272 2.2272 2.5708 2.5708 2.8804 2.8804 2.8894 2.8894 2.8904 2.8904 3.3205 3.3205 3.6519 3.6519 4.0350 4.0350 4.0381 4.0381 4.2242 4.2242 4.2256 4.2256 5.4289 5.4289 5.4311 5.4311 7.4304 7.4304 8.0582 8.0582 8.3482 8.3482 8.7504 8.7504 8.7514 8.7514 9.5987 9.5987 k = 0.0000 0.0000 0.0000 ( 18149 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4729 -8.4729 -7.6709 -7.6709 -7.6587 -7.6587 -7.6587 -7.6587 -7.4540 -7.4540 -7.4540 -7.4540 -6.6334 -6.6334 -6.6148 -6.6148 -5.7699 -5.7699 -5.7699 -5.7699 -5.7435 -5.7435 -5.7435 -5.7435 -0.7353 -0.7353 -0.1133 -0.1133 -0.1133 -0.1133 0.0592 0.0592 0.0592 0.0592 0.3714 0.3714 0.7064 0.7064 0.7064 0.7064 1.1157 1.1157 2.2272 2.2272 2.2272 2.2272 2.5712 2.5712 2.8817 2.8817 2.8901 2.8901 2.8901 2.8901 3.3210 3.3210 3.6536 3.6536 4.0390 4.0390 4.0390 4.0390 4.2267 4.2267 4.2267 4.2267 5.4322 5.4322 5.4322 5.4322 7.4270 7.4270 8.0548 8.0548 8.3423 8.3423 8.7476 8.7476 8.7476 8.7476 9.5945 9.5945 k = 0.0000 0.0000 0.0000 ( 18149 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4729 -8.4729 -7.6709 -7.6709 -7.6587 -7.6587 -7.6587 -7.6587 -7.4540 -7.4540 -7.4540 -7.4540 -6.6334 -6.6334 -6.6148 -6.6148 -5.7699 -5.7699 -5.7699 -5.7699 -5.7435 -5.7435 -5.7435 -5.7435 -0.7353 -0.7353 -0.1133 -0.1133 -0.1133 -0.1133 0.0592 0.0592 0.0592 0.0592 0.3714 0.3714 0.7064 0.7064 0.7064 0.7064 1.1157 1.1157 2.2272 2.2272 2.2272 2.2272 2.5712 2.5712 2.8817 2.8817 2.8901 2.8901 2.8901 2.8901 3.3210 3.3210 3.6536 3.6536 4.0390 4.0390 4.0390 4.0390 4.2267 4.2267 4.2267 4.2267 5.4322 5.4322 5.4322 5.4322 7.4270 7.4270 8.0548 8.0548 8.3423 8.3423 8.7476 8.7476 8.7476 8.7476 9.5945 9.5945 k = 0.0200 0.0115 0.0082 ( 18125 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4725 -8.4725 -7.6710 -7.6710 -7.6592 -7.6592 -7.6585 -7.6585 -7.4542 -7.4542 -7.4542 -7.4542 -6.6332 -6.6332 -6.6147 -6.6147 -5.7698 -5.7698 -5.7697 -5.7697 -5.7434 -5.7434 -5.7434 -5.7434 -0.7337 -0.7337 -0.1143 -0.1143 -0.1140 -0.1140 0.0594 0.0594 0.0596 0.0596 0.3716 0.3716 0.7066 0.7066 0.7085 0.7085 1.1169 1.1169 2.2268 2.2268 2.2273 2.2273 2.5708 2.5708 2.8804 2.8804 2.8894 2.8894 2.8905 2.8905 3.3205 3.3205 3.6520 3.6520 4.0352 4.0352 4.0381 4.0381 4.2244 4.2244 4.2256 4.2256 5.4295 5.4295 5.4307 5.4307 7.4303 7.4303 8.0580 8.0580 8.3480 8.3480 8.7507 8.7507 8.7508 8.7508 9.5985 9.5985 k = 0.0400 0.0231 0.0163 ( 18119 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4714 -8.4714 -7.6717 -7.6717 -7.6604 -7.6604 -7.6581 -7.6581 -7.4551 -7.4551 -7.4550 -7.4550 -6.6326 -6.6326 -6.6144 -6.6144 -5.7695 -5.7695 -5.7690 -5.7690 -5.7433 -5.7433 -5.7430 -5.7430 -0.7288 -0.7288 -0.1172 -0.1172 -0.1161 -0.1161 0.0597 0.0597 0.0605 0.0605 0.3722 0.3722 0.7071 0.7071 0.7148 0.7148 1.1203 1.1203 2.2254 2.2254 2.2274 2.2274 2.5695 2.5695 2.8766 2.8766 2.8871 2.8871 2.8916 2.8916 3.3189 3.3189 3.6470 3.6470 4.0237 4.0237 4.0353 4.0353 4.2174 4.2174 4.2221 4.2221 5.4214 5.4214 5.4260 5.4260 7.4401 7.4401 8.0676 8.0676 8.3649 8.3649 8.7601 8.7601 8.7603 8.7603 9.6088 9.6088 k = 0.0600 0.0346 0.0245 ( 18101 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4695 -8.4695 -7.6737 -7.6737 -7.6618 -7.6618 -7.6573 -7.6573 -7.4564 -7.4564 -7.4562 -7.4562 -6.6318 -6.6318 -6.6140 -6.6140 -5.7691 -5.7691 -5.7679 -5.7679 -5.7430 -5.7430 -5.7425 -5.7425 -0.7207 -0.7207 -0.1219 -0.1219 -0.1194 -0.1194 0.0602 0.0602 0.0620 0.0620 0.3733 0.3733 0.7076 0.7076 0.7252 0.7252 1.1263 1.1263 2.2230 2.2230 2.2276 2.2276 2.5673 2.5673 2.8700 2.8700 2.8833 2.8833 2.8936 2.8936 3.3164 3.3164 3.6388 3.6388 4.0050 4.0050 4.0307 4.0307 4.2059 4.2059 4.2162 4.2162 5.4082 5.4082 5.4185 5.4185 7.4563 7.4563 8.0834 8.0834 8.3928 8.3928 8.7757 8.7757 8.7760 8.7760 9.6209 9.6209 k = 0.0800 0.0462 0.0327 ( 18089 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4669 -8.4669 -7.6776 -7.6776 -7.6624 -7.6624 -7.6563 -7.6563 -7.4583 -7.4583 -7.4579 -7.4579 -6.6306 -6.6306 -6.6133 -6.6133 -5.7684 -5.7684 -5.7664 -5.7664 -5.7427 -5.7427 -5.7417 -5.7417 -0.7095 -0.7095 -0.1281 -0.1281 -0.1239 -0.1239 0.0610 0.0610 0.0641 0.0641 0.3748 0.3748 0.7080 0.7080 0.7393 0.7393 1.1349 1.1349 2.2198 2.2198 2.2279 2.2279 2.5642 2.5642 2.8608 2.8608 2.8782 2.8782 2.8962 2.8962 3.3132 3.3132 3.6273 3.6273 3.9798 3.9798 4.0241 4.0241 4.1900 4.1900 4.2079 4.2079 5.3904 5.3904 5.4085 5.4085 7.4790 7.4790 8.1053 8.1053 8.4309 8.4309 8.7971 8.7971 8.7977 8.7977 9.6324 9.6324 k = 0.1000 0.0577 0.0408 ( 18096 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9160 -21.9160 -21.9149 -21.9149 -8.4636 -8.4636 -7.6836 -7.6836 -7.6620 -7.6620 -7.6550 -7.6550 -7.4607 -7.4607 -7.4600 -7.4600 -6.6291 -6.6291 -6.6124 -6.6124 -5.7676 -5.7676 -5.7645 -5.7645 -5.7423 -5.7423 -5.7408 -5.7408 -0.6953 -0.6953 -0.1358 -0.1358 -0.1295 -0.1295 0.0620 0.0620 0.0669 0.0669 0.3767 0.3767 0.7077 0.7077 0.7568 0.7568 1.1464 1.1464 2.2155 2.2155 2.2284 2.2284 2.5604 2.5604 2.8487 2.8487 2.8716 2.8716 2.8995 2.8995 3.3094 3.3094 3.6127 3.6127 3.9489 3.9489 4.0155 4.0155 4.1702 4.1702 4.1972 4.1972 5.3685 5.3685 5.3962 5.3962 7.5078 7.5078 8.1332 8.1332 8.4786 8.4786 8.8240 8.8240 8.8249 8.8249 9.6445 9.6445 k = 0.1200 0.0693 0.0490 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4596 -8.4596 -7.6914 -7.6914 -7.6610 -7.6610 -7.6533 -7.6533 -7.4636 -7.4636 -7.4626 -7.4626 -6.6274 -6.6274 -6.6114 -6.6114 -5.7667 -5.7667 -5.7623 -5.7623 -5.7418 -5.7418 -5.7397 -5.7397 -0.6783 -0.6783 -0.1447 -0.1447 -0.1359 -0.1359 0.0634 0.0634 0.0702 0.0702 0.3791 0.3791 0.7066 0.7066 0.7774 0.7774 1.1609 1.1609 2.2104 2.2104 2.2292 2.2292 2.5559 2.5559 2.8338 2.8338 2.8637 2.8637 2.9033 2.9033 3.3054 3.3054 3.5950 3.5950 3.9133 3.9133 4.0046 4.0046 4.1470 4.1470 4.1841 4.1841 5.3431 5.3431 5.3823 5.3823 7.5426 7.5426 8.1669 8.1669 8.5348 8.5348 8.8560 8.8560 8.8573 8.8573 9.6580 9.6580 k = 0.1400 0.0808 0.0572 ( 18069 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4549 -8.4549 -7.7007 -7.7007 -7.6595 -7.6595 -7.6514 -7.6514 -7.4669 -7.4669 -7.4657 -7.4657 -6.6254 -6.6254 -6.6103 -6.6103 -5.7656 -5.7656 -5.7598 -5.7598 -5.7412 -5.7412 -5.7384 -5.7384 -0.6586 -0.6586 -0.1544 -0.1544 -0.1431 -0.1431 0.0651 0.0651 0.0740 0.0740 0.3820 0.3820 0.7042 0.7042 0.8007 0.8007 1.1787 1.1787 2.2044 2.2044 2.2304 2.2304 2.5506 2.5506 2.8160 2.8160 2.8546 2.8546 2.9075 2.9075 3.3014 3.3014 3.5743 3.5743 3.8740 3.8740 3.9910 3.9910 4.1213 4.1213 4.1687 4.1687 5.3150 5.3150 5.3671 5.3671 7.5833 7.5833 8.2060 8.2060 8.5984 8.5984 8.8927 8.8927 8.8945 8.8945 9.6732 9.6732 k = 0.1600 0.0924 0.0653 ( 18063 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4495 -8.4495 -7.7111 -7.7111 -7.6576 -7.6576 -7.6492 -7.6492 -7.4707 -7.4707 -7.4691 -7.4691 -6.6233 -6.6233 -6.6090 -6.6090 -5.7644 -5.7644 -5.7570 -5.7570 -5.7406 -5.7406 -5.7370 -5.7370 -0.6364 -0.6364 -0.1648 -0.1648 -0.1508 -0.1508 0.0672 0.0672 0.0783 0.0783 0.3853 0.3853 0.7003 0.7003 0.8262 0.8262 1.1997 1.1997 2.1974 2.1974 2.2321 2.2321 2.5447 2.5447 2.7953 2.7953 2.8443 2.8443 2.9118 2.9118 3.2978 3.2978 3.5507 3.5507 3.8322 3.8322 3.9737 3.9737 4.0945 4.0945 4.1511 4.1511 5.2849 5.2849 5.3512 5.3512 7.6294 7.6294 8.2501 8.2501 8.6684 8.6684 8.9335 8.9335 8.9358 8.9358 9.6901 9.6901 k = 0.1800 0.1039 0.0735 ( 18072 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9149 -21.9149 -8.4436 -8.4436 -7.7227 -7.7227 -7.6554 -7.6554 -7.6468 -7.6468 -7.4749 -7.4749 -7.4730 -7.4730 -6.6210 -6.6210 -6.6077 -6.6077 -5.7630 -5.7630 -5.7540 -5.7540 -5.7400 -5.7400 -5.7354 -5.7354 -0.6121 -0.6121 -0.1756 -0.1756 -0.1589 -0.1589 0.0697 0.0697 0.0831 0.0831 0.3891 0.3891 0.6948 0.6948 0.8535 0.8535 1.2238 1.2238 2.1895 2.1895 2.2344 2.2344 2.5383 2.5383 2.7719 2.7719 2.8329 2.8329 2.9162 2.9162 3.2948 3.2948 3.5245 3.5245 3.7891 3.7891 3.9516 3.9516 4.0684 4.0684 4.1314 4.1314 5.2535 5.2535 5.3348 5.3348 7.6808 7.6808 8.2990 8.2990 8.7435 8.7435 8.9779 8.9779 8.9807 8.9807 9.7086 9.7086 k = 0.2000 0.1155 0.0816 ( 18084 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9150 -21.9150 -8.4371 -8.4371 -7.7351 -7.7351 -7.6529 -7.6529 -7.6440 -7.6440 -7.4795 -7.4795 -7.4771 -7.4771 -6.6187 -6.6187 -6.6062 -6.6062 -5.7616 -5.7616 -5.7508 -5.7508 -5.7393 -5.7393 -5.7338 -5.7338 -0.5859 -0.5859 -0.1866 -0.1866 -0.1671 -0.1671 0.0728 0.0728 0.0882 0.0882 0.3933 0.3933 0.6877 0.6877 0.8821 0.8821 1.2509 1.2509 2.1806 2.1806 2.2376 2.2376 2.5314 2.5314 2.7459 2.7459 2.8205 2.8205 2.9203 2.9203 3.2927 3.2927 3.4957 3.4957 3.7457 3.7457 3.9235 3.9235 4.0447 4.0447 4.1097 4.1097 5.2216 5.2216 5.3185 5.3185 7.7371 7.7371 8.3520 8.3520 8.8226 8.8226 9.0254 9.0254 9.0288 9.0288 9.7286 9.7286 k = 0.2200 0.1270 0.0898 ( 18087 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9159 -21.9159 -21.9150 -21.9150 -8.4302 -8.4302 -7.7482 -7.7482 -7.6501 -7.6501 -7.6410 -7.6410 -7.4844 -7.4844 -7.4817 -7.4817 -6.6162 -6.6162 -6.6047 -6.6047 -5.7600 -5.7600 -5.7476 -5.7476 -5.7386 -5.7386 -5.7321 -5.7321 -0.5583 -0.5583 -0.1975 -0.1975 -0.1754 -0.1754 0.0765 0.0765 0.0936 0.0936 0.3978 0.3978 0.6791 0.6791 0.9116 0.9116 1.2807 1.2807 2.1708 2.1708 2.2418 2.2418 2.5242 2.5242 2.7175 2.7175 2.8072 2.8072 2.9240 2.9240 3.2916 3.2916 3.4646 3.4646 3.7031 3.7031 3.8891 3.8891 4.0243 4.0243 4.0864 4.0864 5.1898 5.1898 5.3025 5.3025 7.7979 7.7979 8.4087 8.4087 8.9042 8.9042 9.0755 9.0755 9.0795 9.0795 9.7496 9.7496 k = 0.2400 0.1386 0.0980 ( 18072 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4228 -8.4228 -7.7618 -7.7618 -7.6471 -7.6471 -7.6377 -7.6377 -7.4895 -7.4895 -7.4865 -7.4865 -6.6138 -6.6138 -6.6031 -6.6031 -5.7584 -5.7584 -5.7442 -5.7442 -5.7380 -5.7380 -5.7303 -5.7303 -0.5295 -0.5295 -0.2083 -0.2083 -0.1835 -0.1835 0.0809 0.0809 0.0993 0.0993 0.4028 0.4028 0.6691 0.6691 0.9415 0.9415 1.3128 1.3128 2.1600 2.1600 2.2472 2.2472 2.5169 2.5169 2.6872 2.6872 2.7929 2.7929 2.9270 2.9270 3.2916 3.2916 3.4315 3.4315 3.6624 3.6624 3.8496 3.8496 4.0072 4.0072 4.0616 4.0616 5.1586 5.1586 5.2871 5.2871 7.8629 7.8629 8.4683 8.4683 8.9873 8.9873 9.1277 9.1277 9.1324 9.1324 9.7712 9.7712 k = 0.2600 0.1501 0.1061 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4151 -8.4151 -7.7758 -7.7758 -7.6438 -7.6438 -7.6342 -7.6342 -7.4950 -7.4950 -7.4915 -7.4915 -6.6114 -6.6114 -6.6015 -6.6015 -5.7568 -5.7568 -5.7409 -5.7409 -5.7374 -5.7374 -5.7285 -5.7285 -0.5002 -0.5002 -0.2186 -0.2186 -0.1914 -0.1914 0.0862 0.0862 0.1051 0.1051 0.4080 0.4080 0.6578 0.6578 0.9713 0.9713 1.3467 1.3467 2.1482 2.1482 2.2541 2.2541 2.5095 2.5095 2.6554 2.6554 2.7777 2.7777 2.9293 2.9293 3.2928 3.2928 3.3968 3.3968 3.6245 3.6245 3.8063 3.8063 3.9926 3.9926 4.0355 4.0355 5.1286 5.1286 5.2725 5.2725 7.9316 7.9316 8.5300 8.5300 9.0705 9.0705 9.1817 9.1817 9.1872 9.1872 9.7928 9.7928 k = 0.2800 0.1617 0.1143 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9158 -21.9158 -21.9150 -21.9150 -8.4071 -8.4071 -7.7899 -7.7899 -7.6402 -7.6402 -7.6304 -7.6304 -7.5006 -7.5006 -7.4968 -7.4968 -6.6091 -6.6091 -6.5998 -6.5998 -5.7551 -5.7551 -5.7377 -5.7377 -5.7368 -5.7368 -5.7267 -5.7267 -0.4709 -0.4709 -0.2286 -0.2286 -0.1988 -0.1988 0.0924 0.0924 0.1109 0.1109 0.4134 0.4134 0.6454 0.6454 1.0007 1.0007 1.3819 1.3819 2.1355 2.1355 2.2627 2.2627 2.5022 2.5022 2.6227 2.6227 2.7615 2.7615 2.9305 2.9305 3.2944 3.2944 3.3615 3.3615 3.5901 3.5901 3.7608 3.7608 3.9799 3.9799 4.0085 4.0085 5.1002 5.1002 5.2588 5.2588 8.0035 8.0035 8.5930 8.5930 9.1528 9.1528 9.2371 9.2371 9.2436 9.2436 9.8135 9.8135 k = 0.3000 0.1732 0.1225 ( 18060 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3990 -8.3990 -7.8040 -7.8040 -7.6365 -7.6365 -7.6265 -7.6265 -7.5064 -7.5064 -7.5022 -7.5022 -6.6069 -6.6069 -6.5982 -6.5982 -5.7534 -5.7534 -5.7364 -5.7364 -5.7346 -5.7346 -5.7250 -5.7250 -0.4421 -0.4421 -0.2379 -0.2379 -0.2056 -0.2056 0.0997 0.0997 0.1167 0.1167 0.4190 0.4190 0.6322 0.6322 1.0290 1.0290 1.4179 1.4179 2.1218 2.1218 2.2733 2.2733 2.4951 2.4951 2.5899 2.5899 2.7444 2.7444 2.9306 2.9306 3.2934 3.2934 3.3293 3.3293 3.5597 3.5597 3.7145 3.7145 3.9687 3.9687 3.9809 3.9809 5.0736 5.0736 5.2462 5.2462 8.0781 8.0781 8.6561 8.6561 9.2328 9.2328 9.2938 9.2938 9.3014 9.3014 9.8322 9.8322 k = 0.3200 0.1848 0.1306 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3909 -8.3909 -7.8178 -7.8178 -7.6325 -7.6325 -7.6223 -7.6223 -7.5123 -7.5123 -7.5078 -7.5078 -6.6048 -6.6048 -6.5966 -6.5966 -5.7517 -5.7517 -5.7359 -5.7359 -5.7316 -5.7316 -5.7232 -5.7232 -0.4145 -0.4145 -0.2466 -0.2466 -0.2118 -0.2118 0.1080 0.1080 0.1223 0.1223 0.4247 0.4247 0.6183 0.6183 1.0560 1.0560 1.4540 1.4540 2.1073 2.1073 2.2859 2.2859 2.4886 2.4886 2.5577 2.5577 2.7262 2.7262 2.9295 2.9295 3.2746 3.2746 3.3157 3.3157 3.5336 3.5336 3.6684 3.6684 3.9530 3.9530 3.9587 3.9587 5.0491 5.0491 5.2347 5.2347 8.1549 8.1549 8.7181 8.7181 9.3094 9.3094 9.3513 9.3513 9.3607 9.3607 9.8471 9.8471 k = 0.3400 0.1963 0.1388 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9151 -21.9151 -8.3829 -8.3829 -7.8311 -7.8311 -7.6284 -7.6284 -7.6180 -7.6180 -7.5182 -7.5182 -7.5135 -7.5135 -6.6030 -6.6030 -6.5951 -6.5951 -5.7501 -5.7501 -5.7356 -5.7356 -5.7289 -5.7289 -5.7216 -5.7216 -0.3888 -0.3888 -0.2545 -0.2545 -0.2170 -0.2170 0.1175 0.1175 0.1277 0.1277 0.4304 0.4304 0.6040 0.6040 1.0813 1.0813 1.4896 1.4896 2.0922 2.0922 2.3008 2.3008 2.4826 2.4826 2.5269 2.5269 2.7069 2.7069 2.9272 2.9272 3.2413 3.2413 3.3179 3.3179 3.5122 3.5122 3.6237 3.6237 3.9254 3.9254 3.9498 3.9498 5.0270 5.0270 5.2243 5.2243 8.2332 8.2332 8.7772 8.7772 9.3813 9.3813 9.4097 9.4097 9.4213 9.4213 9.8563 9.8563 k = 0.3600 0.2078 0.1470 ( 18084 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9157 -21.9157 -21.9152 -21.9152 -8.3752 -8.3752 -7.8437 -7.8437 -7.6242 -7.6242 -7.6135 -7.6135 -7.5241 -7.5241 -7.5192 -7.5192 -6.6013 -6.6013 -6.5936 -6.5936 -5.7485 -5.7485 -5.7354 -5.7354 -5.7264 -5.7264 -5.7200 -5.7200 -0.3655 -0.3655 -0.2617 -0.2617 -0.2213 -0.2213 0.1279 0.1279 0.1327 0.1327 0.4360 0.4360 0.5894 0.5894 1.1043 1.1043 1.5238 1.5238 2.0769 2.0769 2.3181 2.3181 2.4775 2.4775 2.4982 2.4982 2.6864 2.6864 2.9235 2.9235 3.2069 3.2069 3.3231 3.3231 3.4954 3.4954 3.5815 3.5815 3.8983 3.8983 3.9420 3.9420 5.0073 5.0073 5.2152 5.2152 8.3121 8.3121 8.8317 8.8317 9.4482 9.4482 9.4687 9.4687 9.4825 9.4825 9.8576 9.8576 k = 0.3800 0.2194 0.1551 ( 18096 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3680 -8.3680 -7.8553 -7.8553 -7.6199 -7.6199 -7.6090 -7.6090 -7.5298 -7.5298 -7.5248 -7.5248 -6.5999 -6.5999 -6.5923 -6.5923 -5.7470 -5.7470 -5.7352 -5.7352 -5.7242 -5.7242 -5.7186 -5.7186 -0.3453 -0.3453 -0.2679 -0.2679 -0.2244 -0.2244 0.1373 0.1373 0.1391 0.1391 0.4417 0.4417 0.5749 0.5749 1.1249 1.1249 1.5560 1.5560 2.0617 2.0617 2.3376 2.3376 2.4718 2.4718 2.4737 2.4737 2.6646 2.6646 2.9187 2.9187 3.1744 3.1744 3.3285 3.3285 3.4833 3.4833 3.5426 3.5426 3.8725 3.8725 3.9352 3.9352 4.9901 4.9901 5.2072 5.2072 8.3907 8.3907 8.8792 8.8792 9.5101 9.5101 9.5281 9.5281 9.5431 9.5431 9.8499 9.8499 k = 0.4000 0.2309 0.1633 ( 18060 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3614 -8.3614 -7.8656 -7.8656 -7.6157 -7.6157 -7.6045 -7.6045 -7.5353 -7.5353 -7.5303 -7.5303 -6.5986 -6.5986 -6.5911 -6.5911 -5.7456 -5.7456 -5.7352 -5.7352 -5.7224 -5.7224 -5.7172 -5.7172 -0.3287 -0.3287 -0.2733 -0.2733 -0.2262 -0.2262 0.1414 0.1414 0.1506 0.1506 0.4472 0.4472 0.5607 0.5607 1.1427 1.1427 1.5851 1.5851 2.0473 2.0473 2.3594 2.3594 2.4496 2.4496 2.4700 2.4700 2.6414 2.6414 2.9129 2.9129 3.1455 3.1455 3.3333 3.3333 3.4756 3.4756 3.5080 3.5080 3.8484 3.8484 3.9295 3.9295 4.9756 4.9756 5.2005 5.2005 8.4678 8.4678 8.9175 8.9175 9.5668 9.5668 9.5875 9.5875 9.6019 9.6019 9.8337 9.8337 k = 0.4200 0.2425 0.1715 ( 18084 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3557 -8.3557 -7.8745 -7.8745 -7.6117 -7.6117 -7.6001 -7.6001 -7.5405 -7.5405 -7.5355 -7.5355 -6.5976 -6.5976 -6.5901 -6.5901 -5.7444 -5.7444 -5.7352 -5.7352 -5.7209 -5.7209 -5.7161 -5.7161 -0.3158 -0.3158 -0.2777 -0.2777 -0.2269 -0.2269 0.1448 0.1448 0.1618 0.1618 0.4527 0.4527 0.5471 0.5471 1.1575 1.1575 1.6105 1.6105 2.0342 2.0342 2.3830 2.3830 2.4307 2.4307 2.4675 2.4675 2.6170 2.6170 2.9064 2.9064 3.1210 3.1210 3.3369 3.3369 3.4718 3.4718 3.4784 3.4784 3.8269 3.8269 3.9248 3.9248 4.9637 4.9637 5.1950 5.1950 8.5417 8.5417 8.9443 8.9443 9.6169 9.6169 9.6463 9.6463 9.6592 9.6592 9.8125 9.8125 k = 0.4400 0.2540 0.1796 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3510 -8.3510 -7.8818 -7.8818 -7.6080 -7.6080 -7.5961 -7.5961 -7.5450 -7.5450 -7.5402 -7.5402 -6.5968 -6.5968 -6.5893 -6.5893 -5.7433 -5.7433 -5.7354 -5.7354 -5.7197 -5.7197 -5.7151 -5.7151 -0.3066 -0.3066 -0.2812 -0.2812 -0.2264 -0.2264 0.1475 0.1475 0.1718 0.1718 0.4580 0.4580 0.5348 0.5348 1.1692 1.1692 1.6312 1.6312 2.0233 2.0233 2.4080 2.4080 2.4158 2.4158 2.4660 2.4660 2.5917 2.5917 2.8998 2.8998 3.1018 3.1018 3.3392 3.3392 3.4547 3.4547 3.4711 3.4711 3.8087 3.8087 3.9211 3.9211 4.9544 4.9544 5.1907 5.1907 8.6099 8.6099 8.9584 8.9584 9.6584 9.6584 9.7035 9.7035 9.7147 9.7147 9.7904 9.7904 k = 0.4600 0.2656 0.1878 ( 18081 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3475 -8.3475 -7.8871 -7.8871 -7.6049 -7.6049 -7.5926 -7.5926 -7.5487 -7.5487 -7.5441 -7.5441 -6.5963 -6.5963 -6.5887 -6.5887 -5.7425 -5.7425 -5.7355 -5.7355 -5.7189 -5.7189 -5.7144 -5.7144 -0.3006 -0.3006 -0.2837 -0.2837 -0.2255 -0.2255 0.1495 0.1495 0.1799 0.1799 0.4628 0.4628 0.5243 0.5243 1.1776 1.1776 1.6465 1.6465 2.0150 2.0150 2.4050 2.4050 2.4332 2.4332 2.4650 2.4650 2.5664 2.5664 2.8941 2.8941 3.0880 3.0880 3.3405 3.3405 3.4373 3.4373 3.4720 3.4720 3.7948 3.7948 3.9184 3.9184 4.9478 4.9478 5.1877 5.1877 8.6682 8.6682 8.9606 8.9606 9.6908 9.6908 9.7565 9.7565 9.7598 9.7598 9.7777 9.7777 k = 0.4800 0.2771 0.1960 ( 18063 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3453 -8.3453 -7.8903 -7.8903 -7.6029 -7.6029 -7.5903 -7.5903 -7.5512 -7.5512 -7.5467 -7.5467 -6.5959 -6.5959 -6.5883 -6.5883 -5.7419 -5.7419 -5.7357 -5.7357 -5.7184 -5.7184 -5.7140 -5.7140 -0.2974 -0.2974 -0.2852 -0.2852 -0.2246 -0.2246 0.1508 0.1508 0.1851 0.1851 0.4667 0.4667 0.5169 0.5169 1.1827 1.1827 1.6559 1.6559 2.0098 2.0098 2.3986 2.3986 2.4560 2.4560 2.4646 2.4646 2.5437 2.5437 2.8901 2.8901 3.0798 3.0798 3.3411 3.3411 3.4267 3.4267 3.4732 3.4732 3.7859 3.7859 3.9168 3.9168 4.9438 4.9438 5.1858 5.1858 8.7100 8.7100 8.9557 8.9557 9.7149 9.7149 9.7501 9.7501 9.7990 9.7990 9.8134 9.8134 k = 0.5000 0.2887 0.2041 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3446 -8.3446 -7.8914 -7.8914 -7.6021 -7.6021 -7.5894 -7.5894 -7.5520 -7.5520 -7.5477 -7.5477 -6.5958 -6.5958 -6.5882 -6.5882 -5.7417 -5.7417 -5.7357 -5.7357 -5.7183 -5.7183 -5.7138 -5.7138 -0.2964 -0.2964 -0.2857 -0.2857 -0.2242 -0.2242 0.1512 0.1512 0.1870 0.1870 0.4682 0.4682 0.5141 0.5141 1.1844 1.1844 1.6591 1.6591 2.0081 2.0081 2.3964 2.3964 2.4644 2.4644 2.4672 2.4672 2.5325 2.5325 2.8887 2.8887 3.0771 3.0771 3.3413 3.3413 3.4232 3.4232 3.4737 3.4737 3.7829 3.7829 3.9163 3.9163 4.9425 4.9425 5.1852 5.1852 8.7258 8.7258 8.9523 8.9523 9.7305 9.7305 9.7371 9.7371 9.8170 9.8170 9.8318 9.8318 k = 0.5000 0.2887 0.2041 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3446 -8.3446 -7.8914 -7.8914 -7.6021 -7.6021 -7.5894 -7.5894 -7.5520 -7.5520 -7.5477 -7.5477 -6.5958 -6.5958 -6.5882 -6.5882 -5.7417 -5.7417 -5.7357 -5.7357 -5.7183 -5.7183 -5.7138 -5.7138 -0.2964 -0.2964 -0.2857 -0.2857 -0.2242 -0.2242 0.1512 0.1512 0.1870 0.1870 0.4682 0.4682 0.5141 0.5141 1.1844 1.1844 1.6591 1.6591 2.0081 2.0081 2.3964 2.3964 2.4644 2.4644 2.4672 2.4672 2.5325 2.5325 2.8887 2.8887 3.0771 3.0771 3.3413 3.3413 3.4232 3.4232 3.4737 3.4737 3.7829 3.7829 3.9163 3.9163 4.9425 4.9425 5.1852 5.1852 8.7258 8.7258 8.9523 8.9523 9.7305 9.7305 9.7371 9.7371 9.8170 9.8170 9.8318 9.8318 k = 0.5069 0.2686 0.2155 ( 18080 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3444 -8.3444 -7.8912 -7.8912 -7.6031 -7.6031 -7.5907 -7.5907 -7.5511 -7.5511 -7.5471 -7.5471 -6.5958 -6.5958 -6.5882 -6.5882 -5.7416 -5.7416 -5.7357 -5.7357 -5.7182 -5.7182 -5.7138 -5.7138 -0.2956 -0.2956 -0.2861 -0.2861 -0.2244 -0.2244 0.1511 0.1511 0.1867 0.1867 0.4681 0.4681 0.5170 0.5170 1.1842 1.1842 1.6586 1.6586 2.0081 2.0081 2.3950 2.3950 2.4626 2.4626 2.4672 2.4672 2.5352 2.5352 2.8887 2.8887 3.0769 3.0769 3.3373 3.3373 3.4237 3.4237 3.4760 3.4760 3.7816 3.7816 3.9144 3.9144 4.9414 4.9414 5.1831 5.1831 8.7285 8.7285 8.9556 8.9556 9.7358 9.7358 9.7413 9.7413 9.8195 9.8195 9.8346 9.8346 k = 0.5139 0.2486 0.2268 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3438 -8.3438 -7.8905 -7.8905 -7.6058 -7.6058 -7.5942 -7.5942 -7.5488 -7.5488 -7.5453 -7.5453 -6.5956 -6.5956 -6.5881 -6.5881 -5.7413 -5.7413 -5.7356 -5.7356 -5.7181 -5.7181 -5.7137 -5.7137 -0.2942 -0.2942 -0.2868 -0.2868 -0.2245 -0.2245 0.1508 0.1508 0.1858 0.1858 0.4677 0.4677 0.5257 0.5257 1.1837 1.1837 1.6569 1.6569 2.0081 2.0081 2.3909 2.3909 2.4579 2.4579 2.4672 2.4672 2.5426 2.5426 2.8886 2.8886 3.0761 3.0761 3.3266 3.3266 3.4242 3.4242 3.4828 3.4828 3.7776 3.7776 3.9088 3.9088 4.9381 4.9381 5.1770 5.1770 8.7366 8.7366 8.9657 8.9657 9.7492 9.7492 9.7561 9.7561 9.8258 9.8258 9.8444 9.8444 k = 0.5208 0.2285 0.2381 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3428 -8.3428 -7.8893 -7.8893 -7.6101 -7.6101 -7.5991 -7.5991 -7.5460 -7.5460 -7.5423 -7.5423 -6.5953 -6.5953 -6.5879 -6.5879 -5.7409 -5.7409 -5.7354 -5.7354 -5.7179 -5.7179 -5.7135 -5.7135 -0.2954 -0.2954 -0.2850 -0.2850 -0.2238 -0.2238 0.1503 0.1503 0.1846 0.1846 0.4672 0.4672 0.5398 0.5398 1.1828 1.1828 1.6542 1.6542 2.0082 2.0082 2.3842 2.3842 2.4519 2.4519 2.4673 2.4673 2.5532 2.5532 2.8884 2.8884 3.0749 3.0749 3.3115 3.3115 3.4227 3.4227 3.4934 3.4934 3.7712 3.7712 3.8997 3.8997 4.9320 4.9320 5.1678 5.1678 8.7500 8.7500 8.9823 8.9823 9.7672 9.7672 9.7836 9.7836 9.8341 9.8341 9.8628 9.8628 k = 0.5278 0.2085 0.2495 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3414 -8.3414 -7.8877 -7.8877 -7.6157 -7.6157 -7.6048 -7.6048 -7.5436 -7.5436 -7.5383 -7.5383 -6.5948 -6.5948 -6.5876 -6.5876 -5.7403 -5.7403 -5.7351 -5.7351 -5.7175 -5.7175 -5.7133 -5.7133 -0.3008 -0.3008 -0.2800 -0.2800 -0.2213 -0.2213 0.1495 0.1495 0.1830 0.1830 0.4665 0.4665 0.5587 0.5587 1.1816 1.1816 1.6503 1.6503 2.0083 2.0083 2.3753 2.3753 2.4456 2.4456 2.4672 2.4672 2.5659 2.5659 2.8881 2.8881 3.0731 3.0731 3.2940 3.2940 3.4186 3.4186 3.5066 3.5066 3.7623 3.7623 3.8877 3.8877 4.9224 4.9224 5.1567 5.1567 8.7685 8.7685 9.0053 9.0053 9.7901 9.7901 9.8216 9.8216 9.8443 9.8443 9.8897 9.8897 k = 0.5347 0.1884 0.2608 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3397 -8.3397 -7.8856 -7.8856 -7.6222 -7.6222 -7.6109 -7.6109 -7.5417 -7.5417 -7.5336 -7.5336 -6.5943 -6.5943 -6.5873 -6.5873 -5.7396 -5.7396 -5.7348 -5.7348 -5.7172 -5.7172 -5.7131 -5.7131 -0.3089 -0.3089 -0.2738 -0.2738 -0.2161 -0.2161 0.1484 0.1484 0.1812 0.1812 0.4657 0.4657 0.5820 0.5820 1.1799 1.1799 1.6455 1.6455 2.0083 2.0083 2.3646 2.3646 2.4396 2.4396 2.4669 2.4669 2.5798 2.5798 2.8875 2.8875 3.0707 3.0707 3.2752 3.2752 3.4122 3.4122 3.5209 3.5209 3.7513 3.7513 3.8734 3.8734 4.9083 4.9083 5.1453 5.1453 8.7920 8.7920 9.0344 9.0344 9.8167 9.8167 9.8555 9.8555 9.8693 9.8693 9.9243 9.9243 k = 0.5417 0.1684 0.2722 ( 18085 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3377 -8.3377 -7.8832 -7.8832 -7.6296 -7.6296 -7.6170 -7.6170 -7.5404 -7.5404 -7.5287 -7.5287 -6.5937 -6.5937 -6.5869 -6.5869 -5.7388 -5.7388 -5.7343 -5.7343 -5.7167 -5.7167 -5.7127 -5.7127 -0.3192 -0.3192 -0.2675 -0.2675 -0.2074 -0.2074 0.1468 0.1468 0.1794 0.1794 0.4648 0.4648 0.6088 0.6088 1.1779 1.1779 1.6397 1.6397 2.0081 2.0081 2.3525 2.3525 2.4343 2.4343 2.4664 2.4664 2.5949 2.5949 2.8865 2.8865 3.0678 3.0678 3.2558 3.2558 3.4034 3.4034 3.5351 3.5351 3.7386 3.7386 3.8576 3.8576 4.8889 4.8889 5.1352 5.1352 8.8202 8.8202 9.0694 9.0694 9.8438 9.8438 9.8711 9.8711 9.9225 9.9225 9.9661 9.9661 k = 0.5486 0.1483 0.2835 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3354 -8.3354 -7.8803 -7.8803 -7.6375 -7.6375 -7.6230 -7.6230 -7.5396 -7.5396 -7.5237 -7.5237 -6.5931 -6.5931 -6.5864 -6.5864 -5.7379 -5.7379 -5.7338 -5.7338 -5.7162 -5.7162 -5.7123 -5.7123 -0.3312 -0.3312 -0.2614 -0.2614 -0.1954 -0.1954 0.1448 0.1448 0.1777 0.1777 0.4639 0.4639 0.6384 0.6384 1.1754 1.1754 1.6330 1.6330 2.0078 2.0078 2.3394 2.3394 2.4297 2.4297 2.4656 2.4656 2.6107 2.6107 2.8851 2.8851 3.0642 3.0642 3.2363 3.2363 3.3924 3.3924 3.5482 3.5482 3.7247 3.7247 3.8415 3.8415 4.8639 4.8639 5.1277 5.1277 8.8528 8.8528 9.1099 9.1099 9.8651 9.8651 9.8938 9.8938 9.9804 9.9804 10.0145 10.0145 k = 0.5556 0.1283 0.2948 ( 18071 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3329 -8.3329 -7.8771 -7.8771 -7.6456 -7.6456 -7.6290 -7.6290 -7.5396 -7.5396 -7.5187 -7.5187 -6.5924 -6.5924 -6.5859 -6.5859 -5.7371 -5.7371 -5.7332 -5.7332 -5.7158 -5.7158 -5.7118 -5.7118 -0.3443 -0.3443 -0.2556 -0.2556 -0.1801 -0.1801 0.1423 0.1423 0.1762 0.1762 0.4630 0.4630 0.6701 0.6701 1.1726 1.1726 1.6254 1.6254 2.0072 2.0072 2.3256 2.3256 2.4260 2.4260 2.4646 2.4646 2.6273 2.6273 2.8831 2.8831 3.0601 3.0601 3.2171 3.2171 3.3792 3.3792 3.5589 3.5589 3.7103 3.7103 3.8262 3.8262 4.8334 4.8334 5.1233 5.1233 8.8894 8.8894 9.1554 9.1554 9.8783 9.8783 9.9245 9.9245 10.0399 10.0399 10.0687 10.0687 k = 0.5625 0.1083 0.3062 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3302 -8.3302 -7.8735 -7.8735 -7.6538 -7.6538 -7.6348 -7.6348 -7.5402 -7.5402 -7.5137 -7.5137 -6.5916 -6.5916 -6.5853 -6.5853 -5.7363 -5.7363 -5.7324 -5.7324 -5.7153 -5.7153 -5.7112 -5.7112 -0.3581 -0.3581 -0.2500 -0.2500 -0.1624 -0.1624 0.1392 0.1392 0.1751 0.1751 0.4622 0.4622 0.7031 0.7031 1.1696 1.1696 1.6170 1.6170 2.0063 2.0063 2.3115 2.3115 2.4234 2.4234 2.4633 2.4633 2.6446 2.6446 2.8804 2.8804 3.0553 3.0553 3.1987 3.1987 3.3636 3.3636 3.5662 3.5662 3.6960 3.6960 3.8133 3.8133 4.7985 4.7985 5.1221 5.1221 8.9296 8.9296 9.2055 9.2055 9.8863 9.8863 9.9590 9.9590 10.0983 10.0983 10.1280 10.1280 k = 0.5694 0.0882 0.3175 ( 18075 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3275 -8.3275 -7.8697 -7.8697 -7.6619 -7.6619 -7.6405 -7.6405 -7.5415 -7.5415 -7.5089 -7.5089 -6.5909 -6.5909 -6.5847 -6.5847 -5.7356 -5.7356 -5.7315 -5.7315 -5.7148 -5.7148 -5.7105 -5.7105 -0.3722 -0.3722 -0.2445 -0.2445 -0.1427 -0.1427 0.1356 0.1356 0.1742 0.1742 0.4614 0.4614 0.7365 0.7365 1.1666 1.1666 1.6080 1.6080 2.0049 2.0049 2.2974 2.2974 2.4220 2.4220 2.4619 2.4619 2.6625 2.6625 2.8770 2.8770 3.0501 3.0501 3.1813 3.1813 3.3456 3.3456 3.5688 3.5688 3.6824 3.6824 3.8042 3.8042 4.7603 4.7603 5.1237 5.1237 8.9727 8.9727 9.2596 9.2596 9.8896 9.8896 9.9958 9.9958 10.1531 10.1531 10.1917 10.1917 k = 0.5764 0.0682 0.3289 ( 18076 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3247 -8.3247 -7.8656 -7.8656 -7.6695 -7.6695 -7.6460 -7.6460 -7.5436 -7.5436 -7.5041 -7.5041 -6.5903 -6.5903 -6.5840 -6.5840 -5.7351 -5.7351 -5.7305 -5.7305 -5.7143 -5.7143 -5.7098 -5.7098 -0.3863 -0.3863 -0.2389 -0.2389 -0.1218 -0.1218 0.1317 0.1317 0.1736 0.1736 0.4609 0.4609 0.7693 0.7693 1.1638 1.1638 1.5984 1.5984 2.0030 2.0030 2.2835 2.2835 2.4219 2.4219 2.4604 2.4604 2.6809 2.6809 2.8727 2.8727 3.0443 3.0443 3.1652 3.1652 3.3253 3.3253 3.5664 3.5664 3.6693 3.6693 3.8005 3.8005 4.7202 4.7202 5.1279 5.1279 9.0182 9.0182 9.3170 9.3170 9.8882 9.8882 10.0344 10.0344 10.2028 10.2028 10.2588 10.2588 k = 0.5833 0.0481 0.3402 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3220 -8.3220 -7.8613 -7.8613 -7.6766 -7.6766 -7.6514 -7.6514 -7.5463 -7.5463 -7.4996 -7.4996 -6.5897 -6.5897 -6.5833 -6.5833 -5.7347 -5.7347 -5.7295 -5.7295 -5.7139 -5.7139 -5.7090 -5.7090 -0.4000 -0.4000 -0.2332 -0.2332 -0.1003 -0.1003 0.1275 0.1275 0.1734 0.1734 0.4606 0.4606 0.8005 0.8005 1.1616 1.1616 1.5885 1.5885 2.0006 2.0006 2.2701 2.2701 2.4232 2.4232 2.4590 2.4590 2.6999 2.6999 2.8674 2.8674 3.0381 3.0381 3.1507 3.1507 3.3029 3.3029 3.5599 3.5599 3.6562 3.6562 3.8026 3.8026 4.6792 4.6792 5.1341 5.1341 9.0653 9.0653 9.3769 9.3769 9.8817 9.8817 10.0744 10.0744 10.2458 10.2458 10.3279 10.3279 k = 0.5903 0.0281 0.3515 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3194 -8.3194 -7.8570 -7.8570 -7.6830 -7.6830 -7.6565 -7.6565 -7.5496 -7.5496 -7.4952 -7.4952 -6.5891 -6.5891 -6.5826 -6.5826 -5.7343 -5.7343 -5.7284 -5.7284 -5.7135 -5.7135 -5.7082 -5.7082 -0.4132 -0.4132 -0.2274 -0.2274 -0.0789 -0.0789 0.1232 0.1232 0.1734 0.1734 0.4605 0.4605 0.8289 0.8289 1.1607 1.1607 1.5783 1.5783 1.9975 1.9975 2.2574 2.2574 2.4260 2.4260 2.4578 2.4578 2.7192 2.7192 2.8613 2.8613 3.0314 3.0314 3.1381 3.1381 3.2790 3.2790 3.5505 3.5505 3.6429 3.6429 3.8100 3.8100 4.6387 4.6387 5.1421 5.1421 9.1132 9.1132 9.4383 9.4383 9.8699 9.8699 10.1146 10.1146 10.2802 10.2802 10.3913 10.3913 k = 0.5972 0.0080 0.3629 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3171 -8.3171 -7.8525 -7.8525 -7.6884 -7.6884 -7.6613 -7.6613 -7.5535 -7.5535 -7.4909 -7.4909 -6.5887 -6.5887 -6.5819 -6.5819 -5.7341 -5.7341 -5.7274 -5.7274 -5.7132 -5.7132 -5.7074 -5.7074 -0.4257 -0.4257 -0.2214 -0.2214 -0.0583 -0.0583 0.1188 0.1188 0.1739 0.1739 0.4607 0.4607 0.8534 0.8534 1.1614 1.1614 1.5681 1.5681 1.9941 1.9941 2.2456 2.2456 2.4304 2.4304 2.4568 2.4568 2.7389 2.7389 2.8543 2.8543 3.0240 3.0240 3.1276 3.1276 3.2542 3.2542 3.5396 3.5396 3.6299 3.6299 3.8215 3.8215 4.5994 4.5994 5.1515 5.1515 9.1607 9.1607 9.4998 9.4998 9.8529 9.8529 10.1530 10.1530 10.3035 10.3035 10.4190 10.4190 k = 0.6042-0.0120 0.3742 ( 18061 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3151 -8.3151 -7.8480 -7.8480 -7.6927 -7.6927 -7.6659 -7.6659 -7.5579 -7.5579 -7.4869 -7.4869 -6.5883 -6.5883 -6.5812 -6.5812 -5.7339 -5.7339 -5.7266 -5.7266 -5.7128 -5.7128 -5.7067 -5.7067 -0.4374 -0.4374 -0.2153 -0.2153 -0.0393 -0.0393 0.1146 0.1146 0.1748 0.1748 0.4613 0.4613 0.8728 0.8728 1.1641 1.1641 1.5582 1.5582 1.9903 1.9903 2.2350 2.2350 2.4364 2.4364 2.4564 2.4564 2.7588 2.7588 2.8464 2.8464 3.0157 3.0157 3.1194 3.1194 3.2297 3.2297 3.5278 3.5278 3.6180 3.6180 3.8358 3.8358 4.5623 4.5623 5.1621 5.1621 9.2064 9.2064 9.5596 9.5596 9.8315 9.8315 10.1866 10.1866 10.3127 10.3127 10.4456 10.4456 k = 0.6111-0.0321 0.3856 ( 18062 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3135 -8.3135 -7.8435 -7.8435 -7.6958 -7.6958 -7.6702 -7.6702 -7.5628 -7.5628 -7.4830 -7.4830 -6.5880 -6.5880 -6.5806 -6.5806 -5.7338 -5.7338 -5.7259 -5.7259 -5.7125 -5.7125 -5.7060 -5.7060 -0.4482 -0.4482 -0.2091 -0.2091 -0.0227 -0.0227 0.1105 0.1105 0.1764 0.1764 0.4621 0.4621 0.8866 0.8866 1.1690 1.1690 1.5490 1.5490 1.9866 1.9866 2.2255 2.2255 2.4437 2.4437 2.4566 2.4566 2.7785 2.7785 2.8377 2.8377 3.0066 3.0066 3.1136 3.1136 3.2068 3.2068 3.5153 3.5153 3.6082 3.6082 3.8520 3.8520 4.5279 4.5279 5.1737 5.1737 9.2483 9.2483 9.6149 9.6149 9.8076 9.8076 10.2117 10.2117 10.3061 10.3061 10.4773 10.4773 k = 0.6181-0.0521 0.3969 ( 18053 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3125 -8.3125 -7.8389 -7.8389 -7.6976 -7.6976 -7.6742 -7.6742 -7.5681 -7.5681 -7.4794 -7.4794 -6.5878 -6.5878 -6.5801 -6.5801 -5.7338 -5.7338 -5.7253 -5.7253 -5.7123 -5.7123 -5.7054 -5.7054 -0.4579 -0.4579 -0.2028 -0.2028 -0.0092 -0.0092 0.1064 0.1064 0.1788 0.1788 0.4633 0.4633 0.8946 0.8946 1.1752 1.1752 1.5406 1.5406 1.9834 1.9834 2.2172 2.2172 2.4517 2.4517 2.4583 2.4583 2.7974 2.7974 2.8287 2.8287 2.9967 2.9967 3.1096 3.1096 3.1873 3.1873 3.5022 3.5022 3.6014 3.6014 3.8692 3.8692 4.4969 4.4969 5.1862 5.1862 9.2833 9.2833 9.6601 9.6601 9.7864 9.7864 10.2251 10.2251 10.2853 10.2853 10.5149 10.5149 k = 0.6250-0.0722 0.4082 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1021 0.1021 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.6250-0.0722 0.4082 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1021 0.1021 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.6125-0.0650 0.4287 ( 18048 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3119 -8.3119 -7.8343 -7.8343 -7.6982 -7.6982 -7.6787 -7.6787 -7.5726 -7.5726 -7.4763 -7.4763 -6.5876 -6.5876 -6.5797 -6.5797 -5.7338 -5.7338 -5.7251 -5.7251 -5.7121 -5.7121 -5.7049 -5.7049 -0.4660 -0.4660 -0.1980 -0.1980 0.0022 0.0022 0.1021 0.1021 0.1815 0.1815 0.4646 0.4646 0.8991 0.8991 1.1812 1.1812 1.5330 1.5330 1.9809 1.9809 2.2101 2.2101 2.4543 2.4543 2.4674 2.4674 2.8080 2.8080 2.8265 2.8265 2.9854 2.9854 3.1062 3.1062 3.1741 3.1741 3.4903 3.4903 3.5958 3.5958 3.8851 3.8851 4.4719 4.4719 5.1972 5.1972 9.3095 9.3095 9.6879 9.6879 9.7830 9.7830 10.2211 10.2211 10.2580 10.2580 10.5582 10.5582 k = 0.6000-0.0577 0.4491 ( 18067 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3116 -8.3116 -7.8343 -7.8343 -7.6985 -7.6985 -7.6809 -7.6809 -7.5695 -7.5695 -7.4775 -7.4775 -6.5875 -6.5875 -6.5797 -6.5797 -5.7335 -5.7335 -5.7252 -5.7252 -5.7120 -5.7120 -5.7049 -5.7049 -0.4641 -0.4641 -0.2024 -0.2024 0.0062 0.0062 0.1021 0.1021 0.1804 0.1804 0.4644 0.4644 0.9036 0.9036 1.1790 1.1790 1.5319 1.5319 1.9807 1.9807 2.2101 2.2101 2.4503 2.4503 2.4710 2.4710 2.8067 2.8067 2.8295 2.8295 2.9817 2.9817 3.1055 3.1055 3.1765 3.1765 3.4956 3.4956 3.5894 3.5894 3.8798 3.8798 4.4782 4.4782 5.1907 5.1907 9.3159 9.3159 9.6989 9.6989 9.7938 9.7938 10.2206 10.2206 10.2562 10.2562 10.5611 10.5611 k = 0.5875-0.0505 0.4695 ( 18071 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3110 -8.3110 -7.8342 -7.8342 -7.6990 -7.6990 -7.6842 -7.6842 -7.5647 -7.5647 -7.4795 -7.4795 -6.5873 -6.5873 -6.5798 -6.5798 -5.7332 -5.7332 -5.7254 -5.7254 -5.7118 -5.7118 -5.7049 -5.7049 -0.4610 -0.4610 -0.2091 -0.2091 0.0124 0.0124 0.1019 0.1019 0.1786 0.1786 0.4642 0.4642 0.9109 0.9109 1.1755 1.1755 1.5301 1.5301 1.9804 1.9804 2.2100 2.2100 2.4459 2.4459 2.4747 2.4747 2.8055 2.8055 2.8335 2.8335 2.9754 2.9754 3.1045 3.1045 3.1809 3.1809 3.5013 3.5013 3.5819 3.5819 3.8711 3.8711 4.4880 4.4880 5.1807 5.1807 9.3262 9.3262 9.7170 9.7170 9.8114 9.8114 10.2179 10.2179 10.2527 10.2527 10.5648 10.5648 k = 0.5750-0.0433 0.4899 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3103 -8.3103 -7.8342 -7.8342 -7.6998 -7.6998 -7.6879 -7.6879 -7.5586 -7.5586 -7.4823 -7.4823 -6.5871 -6.5871 -6.5799 -6.5799 -5.7327 -5.7327 -5.7258 -5.7258 -5.7116 -5.7116 -5.7049 -5.7049 -0.4571 -0.4571 -0.2174 -0.2174 0.0203 0.0203 0.1014 0.1014 0.1762 0.1762 0.4639 0.4639 0.9205 0.9205 1.1709 1.1709 1.5277 1.5277 1.9800 1.9800 2.2101 2.2101 2.4413 2.4413 2.4782 2.4782 2.8054 2.8054 2.8383 2.8383 2.9664 2.9664 3.1032 3.1032 3.1875 3.1875 3.5017 3.5017 3.5794 3.5794 3.8591 3.8591 4.5003 4.5003 5.1677 5.1677 9.3397 9.3397 9.7416 9.7416 9.8354 9.8354 10.2108 10.2108 10.2467 10.2467 10.5683 10.5683 k = 0.5625-0.0361 0.5103 ( 18080 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3095 -8.3095 -7.8342 -7.8342 -7.7009 -7.7009 -7.6915 -7.6915 -7.5518 -7.5518 -7.4858 -7.4858 -6.5868 -6.5868 -6.5799 -6.5799 -5.7321 -5.7321 -5.7261 -5.7261 -5.7114 -5.7114 -5.7049 -5.7049 -0.4525 -0.4525 -0.2264 -0.2264 0.0293 0.0293 0.1006 0.1006 0.1734 0.1734 0.4636 0.4636 0.9316 0.9316 1.1656 1.1656 1.5250 1.5250 1.9794 1.9794 2.2101 2.2101 2.4369 2.4369 2.4811 2.4811 2.8066 2.8066 2.8436 2.8436 2.9549 2.9549 3.1018 3.1018 3.1960 3.1960 3.4920 3.4920 3.5875 3.5875 3.8440 3.8440 4.5138 4.5138 5.1531 5.1531 9.3555 9.3555 9.7720 9.7720 9.8647 9.8647 10.1971 10.1971 10.2373 10.2373 10.5688 10.5693 k = 0.5500-0.0289 0.5307 ( 18075 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3086 -8.3086 -7.8344 -7.8344 -7.7023 -7.7023 -7.6945 -7.6945 -7.5446 -7.5446 -7.4900 -7.4900 -6.5865 -6.5865 -6.5800 -6.5800 -5.7314 -5.7314 -5.7266 -5.7266 -5.7112 -5.7112 -5.7049 -5.7049 -0.4477 -0.4477 -0.2354 -0.2354 0.0389 0.0389 0.0993 0.0993 0.1703 0.1703 0.4632 0.4632 0.9433 0.9433 1.1600 1.1600 1.5221 1.5221 1.9788 1.9788 2.2103 2.2103 2.4328 2.4328 2.4834 2.4834 2.8094 2.8094 2.8493 2.8493 2.9415 2.9415 3.1004 3.1004 3.2061 3.2061 3.4748 3.4748 3.6044 3.6044 3.8261 3.8261 4.5272 4.5272 5.1380 5.1380 9.3726 9.3726 9.8068 9.8068 9.8984 9.8984 10.1754 10.1754 10.2245 10.2245 10.5568 10.5568 k = 0.5375-0.0217 0.5511 ( 18076 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3077 -8.3077 -7.8346 -7.8346 -7.7039 -7.7039 -7.6966 -7.6966 -7.5372 -7.5372 -7.4948 -7.4948 -6.5863 -6.5863 -6.5801 -6.5801 -5.7307 -5.7307 -5.7270 -5.7270 -5.7110 -5.7110 -5.7049 -5.7049 -0.4431 -0.4431 -0.2435 -0.2435 0.0484 0.0484 0.0975 0.0975 0.1671 0.1671 0.4629 0.4629 0.9546 0.9546 1.1547 1.1547 1.5194 1.5194 1.9781 1.9781 2.2104 2.2104 2.4291 2.4291 2.4850 2.4850 2.8138 2.8138 2.8555 2.8555 2.9265 2.9265 3.0992 3.0992 3.2165 3.2165 3.4553 3.4553 3.6260 3.6260 3.8060 3.8060 4.5393 4.5393 5.1241 5.1241 9.3896 9.3896 9.8438 9.8438 9.9345 9.9345 10.1469 10.1469 10.2086 10.2086 10.5476 10.5476 k = 0.5250-0.0144 0.5715 ( 18088 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3070 -8.3070 -7.8348 -7.8348 -7.7053 -7.7053 -7.6980 -7.6980 -7.5299 -7.5299 -7.5002 -7.5002 -6.5860 -6.5860 -6.5801 -6.5801 -5.7300 -5.7300 -5.7276 -5.7276 -5.7109 -5.7109 -5.7049 -5.7049 -0.4393 -0.4393 -0.2499 -0.2499 0.0570 0.0570 0.0954 0.0954 0.1643 0.1643 0.4626 0.4626 0.9640 0.9640 1.1503 1.1503 1.5171 1.5171 1.9775 1.9775 2.2106 2.2106 2.4261 2.4261 2.4859 2.4859 2.8194 2.8194 2.8623 2.8623 2.9110 2.9110 3.0981 3.0981 3.2259 3.2259 3.4377 3.4377 3.6491 3.6491 3.7847 3.7847 4.5487 4.5487 5.1128 5.1128 9.4049 9.4049 9.8792 9.8792 9.9703 9.9703 10.1158 10.1158 10.1906 10.1906 10.5426 10.5426 k = 0.5125-0.0072 0.5920 ( 18100 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3065 -8.3065 -7.8351 -7.8351 -7.7062 -7.7062 -7.6989 -7.6989 -7.5233 -7.5233 -7.5056 -7.5056 -6.5859 -6.5859 -6.5801 -6.5801 -5.7294 -5.7294 -5.7281 -5.7281 -5.7108 -5.7108 -5.7049 -5.7049 -0.4368 -0.4368 -0.2540 -0.2540 0.0633 0.0633 0.0937 0.0937 0.1621 0.1621 0.4624 0.4624 0.9703 0.9703 1.1476 1.1476 1.5156 1.5156 1.9770 1.9770 2.2108 2.2108 2.4242 2.4242 2.4862 2.4862 2.8250 2.8250 2.8693 2.8693 2.8965 2.8965 3.0974 3.0974 3.2324 3.2324 3.4255 3.4255 3.6699 3.6699 3.7651 3.7651 4.5547 4.5547 5.1054 5.1054 9.4161 9.4161 9.9062 9.9062 10.0002 10.0002 10.0905 10.0905 10.1735 10.1735 10.5426 10.5426 k = 0.5000-0.0000 0.6124 ( 18140 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3063 -8.3063 -7.8352 -7.8352 -7.7065 -7.7065 -7.6992 -7.6992 -7.5197 -7.5197 -7.5088 -7.5088 -6.5858 -6.5858 -6.5801 -6.5801 -5.7290 -5.7290 -5.7284 -5.7284 -5.7107 -5.7107 -5.7049 -5.7049 -0.4359 -0.4359 -0.2555 -0.2555 0.0656 0.0656 0.0930 0.0930 0.1613 0.1613 0.4623 0.4623 0.9725 0.9725 1.1467 1.1467 1.5151 1.5151 1.9768 1.9768 2.2108 2.2108 2.4235 2.4235 2.4863 2.4863 2.8278 2.8278 2.8737 2.8737 2.8887 2.8887 3.0971 3.0971 3.2347 3.2347 3.4212 3.4212 3.6798 3.6798 3.7555 3.7555 4.5568 4.5568 5.1028 5.1028 9.4206 9.4206 9.9164 9.9164 10.0126 10.0126 10.0817 10.0817 10.1652 10.1652 10.5460 10.5460 k = 0.5000-0.0000 0.6124 ( 18140 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3063 -8.3063 -7.8352 -7.8352 -7.7065 -7.7065 -7.6992 -7.6992 -7.5197 -7.5197 -7.5088 -7.5088 -6.5858 -6.5858 -6.5801 -6.5801 -5.7290 -5.7290 -5.7284 -5.7284 -5.7107 -5.7107 -5.7049 -5.7049 -0.4359 -0.4359 -0.2555 -0.2555 0.0656 0.0656 0.0930 0.0930 0.1613 0.1613 0.4623 0.4623 0.9725 0.9725 1.1467 1.1467 1.5151 1.5151 1.9768 1.9768 2.2108 2.2108 2.4235 2.4235 2.4863 2.4863 2.8278 2.8278 2.8737 2.8737 2.8887 2.8887 3.0971 3.0971 3.2347 3.2347 3.4212 3.4212 3.6798 3.6798 3.7555 3.7555 4.5568 4.5568 5.1028 5.1028 9.4206 9.4206 9.9164 9.9164 10.0126 10.0126 10.0817 10.0817 10.1652 10.1652 10.5460 10.5460 k = 0.5000 0.0144 0.5920 ( 18096 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3066 -8.3066 -7.8357 -7.8357 -7.7059 -7.7059 -7.6986 -7.6986 -7.5197 -7.5197 -7.5089 -7.5089 -6.5859 -6.5859 -6.5802 -6.5802 -5.7290 -5.7290 -5.7285 -5.7285 -5.7108 -5.7108 -5.7050 -5.7050 -0.4351 -0.4351 -0.2556 -0.2556 0.0610 0.0610 0.0954 0.0954 0.1616 0.1616 0.4622 0.4622 0.9702 0.9702 1.1462 1.1462 1.5167 1.5167 1.9774 1.9774 2.2116 2.2116 2.4239 2.4239 2.4850 2.4850 2.8223 2.8223 2.8679 2.8679 2.9013 2.9013 3.0973 3.0973 3.2351 3.2351 3.4251 3.4251 3.6796 3.6796 3.7552 3.7552 4.5591 4.5591 5.1028 5.1028 9.4122 9.4122 9.9012 9.9012 9.9987 9.9987 10.0894 10.0894 10.1853 10.1853 10.5429 10.5429 k = 0.5000 0.0289 0.5715 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3073 -8.3073 -7.8373 -7.8373 -7.7041 -7.7041 -7.6968 -7.6968 -7.5199 -7.5199 -7.5091 -7.5091 -6.5861 -6.5861 -6.5804 -6.5804 -5.7292 -5.7292 -5.7286 -5.7286 -5.7109 -5.7109 -5.7052 -5.7052 -0.4328 -0.4328 -0.2558 -0.2558 0.0498 0.0498 0.1003 0.1003 0.1623 0.1623 0.4619 0.4619 0.9633 0.9633 1.1452 1.1452 1.5213 1.5213 1.9791 1.9791 2.2141 2.2141 2.4250 2.4250 2.4813 2.4813 2.8088 2.8088 2.8635 2.8635 2.9228 2.9228 3.0977 3.0977 3.2367 3.2367 3.4362 3.4362 3.6790 3.6790 3.7541 3.7541 4.5662 4.5662 5.1028 5.1028 9.3884 9.3884 9.8525 9.8525 9.9933 9.9933 10.0911 10.0911 10.2323 10.2323 10.5321 10.5321 k = 0.5000 0.0433 0.5511 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3086 -8.3086 -7.8397 -7.8397 -7.7013 -7.7013 -7.6939 -7.6939 -7.5201 -7.5201 -7.5095 -7.5095 -6.5863 -6.5863 -6.5806 -6.5806 -5.7294 -5.7294 -5.7289 -5.7289 -5.7111 -5.7111 -5.7056 -5.7056 -0.4291 -0.4291 -0.2563 -0.2563 0.0345 0.0345 0.1053 0.1053 0.1635 0.1635 0.4615 0.4615 0.9514 0.9514 1.1442 1.1442 1.5285 1.5285 1.9818 1.9818 2.2182 2.2182 2.4268 2.4268 2.4756 2.4756 2.7923 2.7923 2.8618 2.8618 2.9463 2.9463 3.0985 3.0985 3.2406 3.2406 3.4531 3.4531 3.6779 3.6779 3.7527 3.7527 4.5778 4.5778 5.1028 5.1028 9.3524 9.3524 9.7846 9.7846 10.0015 10.0015 10.0849 10.0849 10.2833 10.2833 10.5122 10.5122 k = 0.5000 0.0577 0.5307 ( 18082 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3102 -8.3102 -7.8429 -7.8429 -7.6975 -7.6975 -7.6899 -7.6899 -7.5206 -7.5206 -7.5101 -7.5101 -6.5867 -6.5867 -6.5810 -6.5810 -5.7298 -5.7298 -5.7292 -5.7292 -5.7114 -5.7114 -5.7061 -5.7061 -0.4238 -0.4238 -0.2569 -0.2569 0.0162 0.0162 0.1101 0.1101 0.1647 0.1647 0.4611 0.4611 0.9343 0.9343 1.1441 1.1441 1.5376 1.5376 1.9852 1.9852 2.2240 2.2240 2.4291 2.4291 2.4689 2.4689 2.7749 2.7749 2.8616 2.8616 2.9699 2.9699 3.1000 3.1000 3.2478 3.2478 3.4741 3.4741 3.6763 3.6763 3.7513 3.7513 4.5940 4.5940 5.1028 5.1028 9.3078 9.3078 9.7104 9.7104 10.0123 10.0123 10.0748 10.0748 10.3255 10.3255 10.4826 10.4826 k = 0.5000 0.0722 0.5103 ( 18072 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3123 -8.3123 -7.8466 -7.8466 -7.6929 -7.6929 -7.6849 -7.6849 -7.5211 -7.5211 -7.5109 -7.5109 -6.5871 -6.5871 -6.5815 -6.5815 -5.7303 -5.7303 -5.7296 -5.7296 -5.7118 -5.7118 -5.7067 -5.7067 -0.4172 -0.4172 -0.2577 -0.2577 -0.0045 -0.0045 0.1146 0.1146 0.1661 0.1661 0.4607 0.4607 0.9122 0.9122 1.1451 1.1451 1.5481 1.5481 1.9890 1.9890 2.2315 2.2315 2.4316 2.4316 2.4619 2.4619 2.7573 2.7573 2.8625 2.8625 2.9919 2.9919 3.1029 3.1029 3.2585 3.2585 3.4976 3.4976 3.6741 3.6741 3.7507 3.7507 4.6144 4.6144 5.1029 5.1029 9.2577 9.2577 9.6347 9.6347 10.0186 10.0186 10.0639 10.0639 10.3516 10.3516 10.4423 10.4423 k = 0.5000 0.0866 0.4899 ( 18076 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3147 -8.3147 -7.8507 -7.8507 -7.6875 -7.6875 -7.6790 -7.6790 -7.5218 -7.5218 -7.5119 -7.5119 -6.5877 -6.5877 -6.5821 -6.5821 -5.7309 -5.7309 -5.7301 -5.7301 -5.7122 -5.7122 -5.7074 -5.7074 -0.4092 -0.4092 -0.2586 -0.2586 -0.0271 -0.0271 0.1189 0.1189 0.1674 0.1674 0.4604 0.4604 0.8857 0.8857 1.1475 1.1475 1.5593 1.5593 1.9928 1.9928 2.2407 2.2407 2.4337 2.4337 2.4559 2.4559 2.7395 2.7395 2.8644 2.8644 3.0110 3.0110 3.1085 3.1085 3.2725 3.2725 3.5216 3.5216 3.6714 3.6714 3.7518 3.7518 4.6388 4.6388 5.1030 5.1030 9.2046 9.2046 9.5597 9.5597 10.0154 10.0154 10.0553 10.0553 10.3570 10.3570 10.3920 10.3920 k = 0.5000 0.1010 0.4695 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3174 -8.3174 -7.8550 -7.8550 -7.6815 -7.6815 -7.6726 -7.6726 -7.5228 -7.5228 -7.5131 -7.5131 -6.5883 -6.5883 -6.5827 -6.5827 -5.7316 -5.7316 -5.7305 -5.7305 -5.7127 -5.7127 -5.7082 -5.7082 -0.4000 -0.4000 -0.2596 -0.2596 -0.0511 -0.0511 0.1232 0.1232 0.1687 0.1687 0.4603 0.4603 0.8555 0.8555 1.1508 1.1508 1.5708 1.5708 1.9964 1.9964 2.2514 2.2514 2.4342 2.4342 2.4523 2.4523 2.7215 2.7215 2.8671 2.8671 3.0262 3.0262 3.1177 3.1177 3.2890 3.2890 3.5445 3.5445 3.6685 3.6685 3.7552 3.7552 4.6667 4.6667 5.1034 5.1034 9.1504 9.1504 9.4865 9.4865 10.0026 10.0026 10.0482 10.0482 10.3272 10.3272 10.3500 10.3500 k = 0.5000 0.1155 0.4491 ( 18056 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3202 -8.3202 -7.8595 -7.8595 -7.6750 -7.6750 -7.6656 -7.6656 -7.5239 -7.5239 -7.5147 -7.5147 -6.5890 -6.5890 -6.5833 -6.5833 -5.7325 -5.7325 -5.7311 -5.7311 -5.7132 -5.7132 -5.7089 -5.7089 -0.3897 -0.3897 -0.2608 -0.2608 -0.0757 -0.0757 0.1274 0.1274 0.1700 0.1700 0.4604 0.4604 0.8226 0.8226 1.1548 1.1548 1.5822 1.5822 1.9996 1.9996 2.2635 2.2635 2.4327 2.4327 2.4520 2.4520 2.7034 2.7034 2.8703 2.8703 3.0371 3.0371 3.1311 3.1311 3.3071 3.3071 3.5638 3.5638 3.6669 3.6669 3.7616 3.7616 4.6975 4.6975 5.1041 5.1041 9.0965 9.0965 9.4159 9.4159 9.9846 9.9846 10.0383 10.0383 10.2682 10.2682 10.3156 10.3156 k = 0.5000 0.1299 0.4287 ( 18062 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3232 -8.3232 -7.8639 -7.8639 -7.6680 -7.6680 -7.6583 -7.6583 -7.5253 -7.5253 -7.5165 -7.5165 -6.5897 -6.5897 -6.5840 -6.5840 -5.7334 -5.7334 -5.7316 -5.7316 -5.7138 -5.7138 -5.7097 -5.7097 -0.3785 -0.3785 -0.2620 -0.2620 -0.1004 -0.1004 0.1314 0.1314 0.1712 0.1712 0.4607 0.4607 0.7879 0.7879 1.1591 1.1591 1.5933 1.5933 2.0023 2.0023 2.2768 2.2768 2.4304 2.4304 2.4539 2.4539 2.6853 2.6853 2.8737 2.8737 3.0449 3.0449 3.1479 3.1479 3.3258 3.3258 3.5766 3.5766 3.6689 3.6689 3.7712 3.7712 4.7304 4.7304 5.1053 5.1053 9.0441 9.0441 9.3486 9.3486 9.9645 9.9645 10.0228 10.0228 10.2085 10.2085 10.2660 10.2660 k = 0.5000 0.1443 0.4082 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3262 -8.3262 -7.8681 -7.8681 -7.6607 -7.6607 -7.6508 -7.6508 -7.5269 -7.5269 -7.5187 -7.5187 -6.5905 -6.5905 -6.5846 -6.5846 -5.7344 -5.7344 -5.7322 -5.7322 -5.7143 -5.7143 -5.7104 -5.7104 -0.3666 -0.3666 -0.2634 -0.2634 -0.1246 -0.1246 0.1352 0.1352 0.1725 0.1725 0.4612 0.4612 0.7521 0.7521 1.1634 1.1634 1.6038 1.6038 2.0044 2.0044 2.2909 2.2909 2.4286 2.4286 2.4565 2.4565 2.6672 2.6672 2.8771 2.8771 3.0508 3.0508 3.1668 3.1668 3.3440 3.3440 3.5804 3.5804 3.6766 3.6766 3.7840 3.7840 4.7645 4.7645 5.1073 5.1073 8.9938 8.9938 9.2851 9.2851 9.9437 9.9437 10.0008 10.0008 10.1520 10.1520 10.2050 10.2050 k = 0.5000 0.1588 0.3878 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3292 -8.3292 -7.8722 -7.8722 -7.6531 -7.6531 -7.6431 -7.6431 -7.5288 -7.5288 -7.5212 -7.5212 -6.5913 -6.5913 -6.5852 -6.5852 -5.7355 -5.7355 -5.7328 -5.7328 -5.7149 -5.7149 -5.7111 -5.7111 -0.3543 -0.3543 -0.2650 -0.2650 -0.1475 -0.1475 0.1387 0.1387 0.1738 0.1738 0.4619 0.4619 0.7163 0.7163 1.1675 1.1675 1.6136 1.6136 2.0060 2.0060 2.3056 2.3056 2.4281 2.4281 2.4592 2.4592 2.6493 2.6493 2.8801 2.8801 3.0556 3.0556 3.1870 3.1870 3.3611 3.3611 3.5762 3.5762 3.6892 3.6892 3.7994 3.7994 4.7985 4.7985 5.1105 5.1105 8.9465 8.9465 9.2259 9.2259 9.9228 9.9228 9.9726 9.9726 10.1000 10.1000 10.1385 10.1385 k = 0.5000 0.1732 0.3674 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3320 -8.3320 -7.8760 -7.8760 -7.6454 -7.6454 -7.6354 -7.6354 -7.5310 -7.5310 -7.5241 -7.5241 -6.5921 -6.5921 -6.5858 -6.5858 -5.7365 -5.7365 -5.7333 -5.7333 -5.7155 -5.7155 -5.7117 -5.7117 -0.3418 -0.3418 -0.2668 -0.2668 -0.1686 -0.1686 0.1418 0.1418 0.1754 0.1754 0.4628 0.4628 0.6810 0.6810 1.1712 1.1712 1.6227 1.6227 2.0070 2.0070 2.3204 2.3204 2.4289 2.4289 2.4617 2.4617 2.6318 2.6318 2.8827 2.8827 3.0599 3.0599 3.2080 3.2080 3.3765 3.3765 3.5666 3.5666 3.7044 3.7044 3.8166 3.8166 4.8309 4.8309 5.1153 5.1153 8.9027 8.9027 9.1715 9.1715 9.9023 9.9023 9.9395 9.9395 10.0519 10.0519 10.0709 10.0709 k = 0.5000 0.1876 0.3470 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3347 -8.3347 -7.8794 -7.8794 -7.6377 -7.6377 -7.6278 -7.6278 -7.5334 -7.5334 -7.5274 -7.5274 -6.5928 -6.5928 -6.5863 -6.5863 -5.7376 -5.7376 -5.7338 -5.7338 -5.7161 -5.7161 -5.7122 -5.7122 -0.3297 -0.3297 -0.2691 -0.2691 -0.1871 -0.1871 0.1444 0.1444 0.1770 0.1770 0.4637 0.4637 0.6472 0.6472 1.1745 1.1745 1.6309 1.6309 2.0077 2.0077 2.3351 2.3351 2.4311 2.4311 2.4637 2.4637 2.6148 2.6148 2.8847 2.8847 3.0638 3.0638 3.2291 3.2291 3.3901 3.3901 3.5538 3.5538 3.7201 3.7201 3.8347 3.8347 4.8603 4.8603 5.1222 5.1222 8.8630 8.8630 9.1223 9.1223 9.8811 9.8811 9.9056 9.9056 9.9992 9.9992 10.0121 10.0121 k = 0.5000 0.2021 0.3266 ( 18072 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3372 -8.3372 -7.8825 -7.8825 -7.6302 -7.6302 -7.6203 -7.6203 -7.5361 -7.5361 -7.5309 -7.5309 -6.5936 -6.5936 -6.5868 -6.5868 -5.7385 -5.7385 -5.7343 -5.7343 -5.7166 -5.7166 -5.7126 -5.7126 -0.3185 -0.3185 -0.2721 -0.2721 -0.2023 -0.2023 0.1465 0.1465 0.1789 0.1789 0.4646 0.4646 0.6156 0.6156 1.1772 1.1772 1.6382 1.6382 2.0081 2.0081 2.3491 2.3491 2.4346 2.4346 2.4653 2.4653 2.5983 2.5983 2.8863 2.8863 3.0673 3.0673 3.2503 3.2503 3.4016 3.4016 3.5393 3.5393 3.7352 3.7352 3.8528 3.8528 4.8855 4.8855 5.1314 5.1314 8.8277 8.8277 9.0786 9.0786 9.8552 9.8552 9.8780 9.8780 9.9373 9.9373 9.9681 9.9681 k = 0.5000 0.2165 0.3062 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3394 -8.3394 -7.8852 -7.8852 -7.6230 -7.6230 -7.6130 -7.6130 -7.5391 -7.5391 -7.5347 -7.5347 -6.5942 -6.5942 -6.5872 -6.5872 -5.7394 -5.7394 -5.7347 -5.7347 -5.7171 -5.7171 -5.7130 -5.7130 -0.3086 -0.3086 -0.2760 -0.2760 -0.2134 -0.2134 0.1482 0.1482 0.1808 0.1808 0.4656 0.4656 0.5870 0.5870 1.1795 1.1795 1.6444 1.6444 2.0082 2.0082 2.3621 2.3621 2.4393 2.4393 2.4663 2.4663 2.5826 2.5826 2.8873 2.8873 3.0703 3.0703 3.2710 3.2710 3.4109 3.4109 3.5241 3.5241 3.7489 3.7489 3.8700 3.8700 4.9057 4.9057 5.1425 5.1425 8.7972 8.7972 9.0409 9.0409 9.8243 9.8243 9.8592 9.8592 9.8799 9.8799 9.9284 9.9284 k = 0.5000 0.2309 0.2858 ( 18082 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3412 -8.3412 -7.8874 -7.8874 -7.6164 -7.6164 -7.6061 -7.6061 -7.5421 -7.5421 -7.5386 -7.5386 -6.5948 -6.5948 -6.5876 -6.5876 -5.7402 -5.7402 -5.7351 -5.7351 -5.7175 -5.7175 -5.7133 -5.7133 -0.3007 -0.3007 -0.2806 -0.2806 -0.2203 -0.2203 0.1494 0.1494 0.1827 0.1827 0.4664 0.4664 0.5621 0.5621 1.1813 1.1813 1.6496 1.6496 2.0083 2.0083 2.3737 2.3737 2.4449 2.4449 2.4670 2.4670 2.5680 2.5680 2.8880 2.8880 3.0728 3.0728 3.2910 3.2910 3.4179 3.4179 3.5089 3.5089 3.7607 3.7607 3.8854 3.8854 4.9207 4.9207 5.1547 5.1547 8.7719 8.7719 9.0095 9.0095 9.7948 9.7948 9.8282 9.8282 9.8468 9.8468 9.8935 9.8935 k = 0.5000 0.2454 0.2654 ( 18088 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3427 -8.3427 -7.8892 -7.8892 -7.6106 -7.6106 -7.5998 -7.5998 -7.5454 -7.5454 -7.5422 -7.5422 -6.5952 -6.5952 -6.5879 -6.5879 -5.7409 -5.7409 -5.7353 -5.7353 -5.7178 -5.7178 -5.7135 -5.7135 -0.2954 -0.2954 -0.2851 -0.2851 -0.2235 -0.2235 0.1502 0.1502 0.1844 0.1844 0.4672 0.4672 0.5418 0.5418 1.1827 1.1827 1.6538 1.6538 2.0082 2.0082 2.3832 2.3832 2.4512 2.4512 2.4672 2.4672 2.5546 2.5546 2.8884 2.8884 3.0747 3.0747 3.3095 3.3095 3.4223 3.4223 3.4949 3.4949 3.7702 3.7702 3.8984 3.8984 4.9311 4.9311 5.1666 5.1666 8.7519 8.7519 8.9847 8.9847 9.7698 9.7698 9.7876 9.7876 9.8354 9.8354 9.8653 9.8653 k = 0.5000 0.2598 0.2449 ( 18082 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3437 -8.3437 -7.8904 -7.8904 -7.6061 -7.6061 -7.5945 -7.5945 -7.5485 -7.5485 -7.5452 -7.5452 -6.5955 -6.5955 -6.5880 -6.5880 -5.7413 -5.7413 -5.7356 -5.7356 -5.7181 -5.7181 -5.7137 -5.7137 -0.2940 -0.2940 -0.2869 -0.2869 -0.2245 -0.2245 0.1507 0.1507 0.1858 0.1858 0.4677 0.4677 0.5266 0.5266 1.1836 1.1836 1.6567 1.6567 2.0081 2.0081 2.3904 2.3904 2.4575 2.4575 2.4672 2.4672 2.5434 2.5434 2.8886 2.8886 3.0761 3.0761 3.3255 3.3255 3.4241 3.4241 3.4835 3.4835 3.7772 3.7772 3.9082 3.9082 4.9377 4.9377 5.1764 5.1764 8.7375 8.7375 8.9667 8.9667 9.7504 9.7504 9.7578 9.7578 9.8265 9.8265 9.8455 9.8455 k = 0.5000 0.2742 0.2245 ( 18086 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3444 -8.3444 -7.8912 -7.8912 -7.6032 -7.6032 -7.5908 -7.5908 -7.5510 -7.5510 -7.5470 -7.5470 -6.5957 -6.5957 -6.5882 -6.5882 -5.7416 -5.7416 -5.7357 -5.7357 -5.7182 -5.7182 -5.7138 -5.7138 -0.2956 -0.2956 -0.2861 -0.2861 -0.2244 -0.2244 0.1510 0.1510 0.1866 0.1866 0.4681 0.4681 0.5173 0.5173 1.1842 1.1842 1.6585 1.6585 2.0081 2.0081 2.3949 2.3949 2.4625 2.4625 2.4672 2.4672 2.5354 2.5354 2.8887 2.8887 3.0769 3.0769 3.3370 3.3370 3.4238 3.4238 3.4762 3.4762 3.7815 3.7815 3.9142 3.9142 4.9413 4.9413 5.1829 5.1829 8.7287 8.7287 8.9559 8.9559 9.7362 9.7362 9.7417 9.7417 9.8197 9.8197 9.8349 9.8349 k = 0.5000 0.2887 0.2041 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3446 -8.3446 -7.8914 -7.8914 -7.6021 -7.6021 -7.5894 -7.5894 -7.5520 -7.5520 -7.5477 -7.5477 -6.5958 -6.5958 -6.5882 -6.5882 -5.7417 -5.7417 -5.7357 -5.7357 -5.7183 -5.7183 -5.7138 -5.7138 -0.2964 -0.2964 -0.2857 -0.2857 -0.2242 -0.2242 0.1512 0.1512 0.1870 0.1870 0.4682 0.4682 0.5141 0.5141 1.1844 1.1844 1.6591 1.6591 2.0081 2.0081 2.3964 2.3964 2.4644 2.4644 2.4672 2.4672 2.5325 2.5325 2.8887 2.8887 3.0771 3.0771 3.3413 3.3413 3.4232 3.4232 3.4737 3.4737 3.7829 3.7829 3.9163 3.9163 4.9425 4.9425 5.1852 5.1852 8.7258 8.7258 8.9523 8.9523 9.7305 9.7305 9.7371 9.7371 9.8170 9.8170 9.8318 9.8318 k = 0.5000 0.2887 0.2041 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3446 -8.3446 -7.8914 -7.8914 -7.6021 -7.6021 -7.5894 -7.5894 -7.5520 -7.5520 -7.5477 -7.5477 -6.5958 -6.5958 -6.5882 -6.5882 -5.7417 -5.7417 -5.7357 -5.7357 -5.7183 -5.7183 -5.7138 -5.7138 -0.2964 -0.2964 -0.2857 -0.2857 -0.2242 -0.2242 0.1512 0.1512 0.1870 0.1870 0.4682 0.4682 0.5141 0.5141 1.1844 1.1844 1.6591 1.6591 2.0081 2.0081 2.3964 2.3964 2.4644 2.4644 2.4672 2.4672 2.5325 2.5325 2.8887 2.8887 3.0771 3.0771 3.3413 3.3413 3.4232 3.4232 3.4737 3.4737 3.7829 3.7829 3.9163 3.9163 4.9425 4.9425 5.1852 5.1852 8.7258 8.7258 8.9523 8.9523 9.7305 9.7305 9.7371 9.7371 9.8170 9.8170 9.8318 9.8318 k = 0.4931 0.2847 0.2268 ( 18080 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3444 -8.3444 -7.8912 -7.8912 -7.6031 -7.6031 -7.5907 -7.5907 -7.5511 -7.5511 -7.5471 -7.5471 -6.5958 -6.5958 -6.5882 -6.5882 -5.7416 -5.7416 -5.7357 -5.7357 -5.7182 -5.7182 -5.7138 -5.7138 -0.2956 -0.2956 -0.2861 -0.2861 -0.2244 -0.2244 0.1511 0.1511 0.1867 0.1867 0.4681 0.4681 0.5170 0.5170 1.1842 1.1842 1.6586 1.6586 2.0081 2.0081 2.3950 2.3950 2.4626 2.4626 2.4672 2.4672 2.5352 2.5352 2.8887 2.8887 3.0769 3.0769 3.3373 3.3373 3.4237 3.4237 3.4760 3.4760 3.7816 3.7816 3.9144 3.9144 4.9414 4.9414 5.1831 5.1831 8.7285 8.7285 8.9556 8.9556 9.7358 9.7358 9.7413 9.7413 9.8195 9.8195 9.8346 9.8346 k = 0.4861 0.2807 0.2495 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3438 -8.3438 -7.8905 -7.8905 -7.6058 -7.6058 -7.5942 -7.5942 -7.5488 -7.5488 -7.5453 -7.5453 -6.5956 -6.5956 -6.5881 -6.5881 -5.7413 -5.7413 -5.7356 -5.7356 -5.7181 -5.7181 -5.7137 -5.7137 -0.2942 -0.2942 -0.2868 -0.2868 -0.2245 -0.2245 0.1508 0.1508 0.1858 0.1858 0.4677 0.4677 0.5257 0.5257 1.1837 1.1837 1.6569 1.6569 2.0081 2.0081 2.3909 2.3909 2.4579 2.4579 2.4672 2.4672 2.5426 2.5426 2.8886 2.8886 3.0761 3.0761 3.3266 3.3266 3.4242 3.4242 3.4828 3.4828 3.7776 3.7776 3.9088 3.9088 4.9381 4.9381 5.1770 5.1770 8.7366 8.7366 8.9657 8.9657 9.7492 9.7492 9.7561 9.7561 9.8258 9.8258 9.8444 9.8444 k = 0.4792 0.2766 0.2722 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3428 -8.3428 -7.8893 -7.8893 -7.6101 -7.6101 -7.5991 -7.5991 -7.5460 -7.5460 -7.5423 -7.5423 -6.5953 -6.5953 -6.5879 -6.5879 -5.7409 -5.7409 -5.7354 -5.7354 -5.7179 -5.7179 -5.7135 -5.7135 -0.2954 -0.2954 -0.2850 -0.2850 -0.2238 -0.2238 0.1503 0.1503 0.1846 0.1846 0.4672 0.4672 0.5398 0.5398 1.1828 1.1828 1.6542 1.6542 2.0082 2.0082 2.3842 2.3842 2.4519 2.4519 2.4673 2.4673 2.5532 2.5532 2.8884 2.8884 3.0749 3.0749 3.3115 3.3115 3.4227 3.4227 3.4934 3.4934 3.7712 3.7712 3.8997 3.8997 4.9320 4.9320 5.1678 5.1678 8.7500 8.7500 8.9823 8.9823 9.7672 9.7672 9.7836 9.7836 9.8342 9.8342 9.8628 9.8628 k = 0.4722 0.2726 0.2948 ( 18091 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3414 -8.3414 -7.8877 -7.8877 -7.6157 -7.6157 -7.6048 -7.6048 -7.5436 -7.5436 -7.5383 -7.5383 -6.5948 -6.5948 -6.5876 -6.5876 -5.7403 -5.7403 -5.7351 -5.7351 -5.7175 -5.7175 -5.7133 -5.7133 -0.3008 -0.3008 -0.2800 -0.2800 -0.2213 -0.2213 0.1495 0.1495 0.1830 0.1830 0.4665 0.4665 0.5587 0.5587 1.1816 1.1816 1.6503 1.6503 2.0083 2.0083 2.3753 2.3753 2.4456 2.4456 2.4672 2.4672 2.5659 2.5659 2.8881 2.8881 3.0731 3.0731 3.2940 3.2940 3.4186 3.4186 3.5066 3.5066 3.7623 3.7623 3.8877 3.8877 4.9224 4.9224 5.1567 5.1567 8.7685 8.7685 9.0053 9.0053 9.7901 9.7901 9.8216 9.8216 9.8443 9.8443 9.8897 9.8897 k = 0.4653 0.2686 0.3175 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3397 -8.3397 -7.8856 -7.8856 -7.6222 -7.6222 -7.6109 -7.6109 -7.5417 -7.5417 -7.5336 -7.5336 -6.5943 -6.5943 -6.5873 -6.5873 -5.7396 -5.7396 -5.7348 -5.7348 -5.7172 -5.7172 -5.7131 -5.7131 -0.3089 -0.3089 -0.2738 -0.2738 -0.2161 -0.2161 0.1484 0.1484 0.1812 0.1812 0.4657 0.4657 0.5820 0.5820 1.1799 1.1799 1.6455 1.6455 2.0083 2.0083 2.3646 2.3646 2.4396 2.4396 2.4669 2.4669 2.5799 2.5799 2.8875 2.8875 3.0707 3.0707 3.2752 3.2752 3.4122 3.4122 3.5209 3.5209 3.7513 3.7513 3.8734 3.8734 4.9083 4.9083 5.1453 5.1453 8.7920 8.7920 9.0344 9.0344 9.8167 9.8167 9.8555 9.8555 9.8693 9.8693 9.9243 9.9243 k = 0.4583 0.2646 0.3402 ( 18085 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3377 -8.3377 -7.8832 -7.8832 -7.6296 -7.6296 -7.6170 -7.6170 -7.5404 -7.5404 -7.5287 -7.5287 -6.5937 -6.5937 -6.5869 -6.5869 -5.7388 -5.7388 -5.7343 -5.7343 -5.7167 -5.7167 -5.7127 -5.7127 -0.3192 -0.3192 -0.2675 -0.2675 -0.2074 -0.2074 0.1468 0.1468 0.1794 0.1794 0.4648 0.4648 0.6088 0.6088 1.1779 1.1779 1.6397 1.6397 2.0081 2.0081 2.3525 2.3525 2.4343 2.4343 2.4664 2.4664 2.5949 2.5949 2.8865 2.8865 3.0678 3.0678 3.2558 3.2558 3.4034 3.4034 3.5351 3.5351 3.7386 3.7386 3.8576 3.8576 4.8889 4.8889 5.1352 5.1352 8.8202 8.8202 9.0694 9.0694 9.8438 9.8438 9.8711 9.8711 9.9225 9.9225 9.9661 9.9661 k = 0.4514 0.2606 0.3629 ( 18079 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3354 -8.3354 -7.8803 -7.8803 -7.6375 -7.6375 -7.6230 -7.6230 -7.5396 -7.5396 -7.5237 -7.5237 -6.5931 -6.5931 -6.5864 -6.5864 -5.7379 -5.7379 -5.7338 -5.7338 -5.7162 -5.7162 -5.7123 -5.7123 -0.3312 -0.3312 -0.2614 -0.2614 -0.1954 -0.1954 0.1448 0.1448 0.1777 0.1777 0.4639 0.4639 0.6384 0.6384 1.1754 1.1754 1.6330 1.6330 2.0078 2.0078 2.3394 2.3394 2.4297 2.4297 2.4656 2.4656 2.6107 2.6107 2.8851 2.8851 3.0642 3.0642 3.2363 3.2363 3.3924 3.3924 3.5482 3.5482 3.7247 3.7247 3.8415 3.8415 4.8639 4.8639 5.1277 5.1277 8.8528 8.8528 9.1099 9.1099 9.8651 9.8651 9.8938 9.8938 9.9804 9.9804 10.0145 10.0145 k = 0.4444 0.2566 0.3856 ( 18071 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3329 -8.3329 -7.8771 -7.8771 -7.6456 -7.6456 -7.6290 -7.6290 -7.5396 -7.5396 -7.5187 -7.5187 -6.5924 -6.5924 -6.5859 -6.5859 -5.7371 -5.7371 -5.7332 -5.7332 -5.7158 -5.7158 -5.7118 -5.7118 -0.3443 -0.3443 -0.2556 -0.2556 -0.1801 -0.1801 0.1423 0.1423 0.1762 0.1762 0.4630 0.4630 0.6701 0.6701 1.1726 1.1726 1.6254 1.6254 2.0072 2.0072 2.3256 2.3256 2.4260 2.4260 2.4646 2.4646 2.6273 2.6273 2.8831 2.8831 3.0601 3.0601 3.2171 3.2171 3.3792 3.3792 3.5589 3.5589 3.7103 3.7103 3.8262 3.8262 4.8334 4.8334 5.1233 5.1233 8.8894 8.8894 9.1554 9.1554 9.8783 9.8783 9.9245 9.9245 10.0399 10.0399 10.0687 10.0687 k = 0.4375 0.2526 0.4082 ( 18074 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3302 -8.3302 -7.8735 -7.8735 -7.6538 -7.6538 -7.6348 -7.6348 -7.5402 -7.5402 -7.5137 -7.5137 -6.5916 -6.5916 -6.5853 -6.5853 -5.7363 -5.7363 -5.7324 -5.7324 -5.7153 -5.7153 -5.7112 -5.7112 -0.3581 -0.3581 -0.2500 -0.2500 -0.1624 -0.1624 0.1392 0.1392 0.1751 0.1751 0.4622 0.4622 0.7031 0.7031 1.1696 1.1696 1.6170 1.6170 2.0063 2.0063 2.3115 2.3115 2.4234 2.4234 2.4633 2.4633 2.6446 2.6446 2.8804 2.8804 3.0553 3.0553 3.1987 3.1987 3.3636 3.3636 3.5662 3.5662 3.6960 3.6960 3.8133 3.8133 4.7985 4.7985 5.1221 5.1221 8.9296 8.9296 9.2055 9.2055 9.8863 9.8863 9.9590 9.9590 10.0983 10.0983 10.1280 10.1280 k = 0.4306 0.2486 0.4309 ( 18075 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3275 -8.3275 -7.8697 -7.8697 -7.6619 -7.6619 -7.6405 -7.6405 -7.5415 -7.5415 -7.5089 -7.5089 -6.5909 -6.5909 -6.5847 -6.5847 -5.7356 -5.7356 -5.7315 -5.7315 -5.7148 -5.7148 -5.7105 -5.7105 -0.3722 -0.3722 -0.2445 -0.2445 -0.1427 -0.1427 0.1356 0.1356 0.1742 0.1742 0.4614 0.4614 0.7365 0.7365 1.1666 1.1666 1.6080 1.6080 2.0049 2.0049 2.2974 2.2974 2.4220 2.4220 2.4619 2.4619 2.6625 2.6625 2.8770 2.8770 3.0501 3.0501 3.1813 3.1813 3.3456 3.3456 3.5688 3.5688 3.6824 3.6824 3.8042 3.8042 4.7603 4.7603 5.1237 5.1237 8.9727 8.9727 9.2596 9.2596 9.8896 9.8896 9.9958 9.9958 10.1531 10.1531 10.1917 10.1917 k = 0.4236 0.2446 0.4536 ( 18076 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3247 -8.3247 -7.8656 -7.8656 -7.6695 -7.6695 -7.6460 -7.6460 -7.5436 -7.5436 -7.5041 -7.5041 -6.5903 -6.5903 -6.5840 -6.5840 -5.7351 -5.7351 -5.7305 -5.7305 -5.7143 -5.7143 -5.7098 -5.7098 -0.3863 -0.3863 -0.2389 -0.2389 -0.1218 -0.1218 0.1317 0.1317 0.1736 0.1736 0.4609 0.4609 0.7693 0.7693 1.1638 1.1638 1.5984 1.5984 2.0030 2.0030 2.2835 2.2835 2.4219 2.4219 2.4604 2.4604 2.6809 2.6809 2.8727 2.8727 3.0443 3.0443 3.1652 3.1652 3.3253 3.3253 3.5664 3.5664 3.6693 3.6693 3.8005 3.8005 4.7202 4.7202 5.1279 5.1279 9.0182 9.0182 9.3170 9.3170 9.8882 9.8882 10.0345 10.0345 10.2028 10.2028 10.2588 10.2588 k = 0.4167 0.2406 0.4763 ( 18078 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3220 -8.3220 -7.8613 -7.8613 -7.6766 -7.6766 -7.6513 -7.6513 -7.5463 -7.5463 -7.4996 -7.4996 -6.5897 -6.5897 -6.5833 -6.5833 -5.7347 -5.7347 -5.7295 -5.7295 -5.7139 -5.7139 -5.7090 -5.7090 -0.4000 -0.4000 -0.2332 -0.2332 -0.1003 -0.1003 0.1275 0.1275 0.1734 0.1734 0.4606 0.4606 0.8005 0.8005 1.1616 1.1616 1.5885 1.5885 2.0006 2.0006 2.2701 2.2701 2.4232 2.4232 2.4590 2.4590 2.6999 2.6999 2.8674 2.8674 3.0381 3.0381 3.1507 3.1507 3.3029 3.3029 3.5599 3.5599 3.6562 3.6562 3.8026 3.8026 4.6792 4.6792 5.1341 5.1341 9.0653 9.0653 9.3769 9.3769 9.8817 9.8817 10.0744 10.0744 10.2458 10.2458 10.3279 10.3279 k = 0.4097 0.2366 0.4990 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3194 -8.3194 -7.8570 -7.8570 -7.6830 -7.6830 -7.6565 -7.6565 -7.5496 -7.5496 -7.4952 -7.4952 -6.5891 -6.5891 -6.5826 -6.5826 -5.7343 -5.7343 -5.7284 -5.7284 -5.7135 -5.7135 -5.7082 -5.7082 -0.4132 -0.4132 -0.2274 -0.2274 -0.0789 -0.0789 0.1232 0.1232 0.1734 0.1734 0.4605 0.4605 0.8289 0.8289 1.1607 1.1607 1.5783 1.5783 1.9975 1.9975 2.2574 2.2574 2.4260 2.4260 2.4578 2.4578 2.7192 2.7192 2.8613 2.8613 3.0314 3.0314 3.1381 3.1381 3.2790 3.2790 3.5505 3.5505 3.6429 3.6429 3.8100 3.8100 4.6387 4.6387 5.1421 5.1421 9.1132 9.1132 9.4383 9.4383 9.8699 9.8699 10.1146 10.1146 10.2802 10.2802 10.3913 10.3913 k = 0.4028 0.2325 0.5217 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9154 -21.9154 -8.3171 -8.3171 -7.8525 -7.8525 -7.6884 -7.6884 -7.6613 -7.6613 -7.5535 -7.5535 -7.4909 -7.4909 -6.5887 -6.5887 -6.5819 -6.5819 -5.7341 -5.7341 -5.7274 -5.7274 -5.7132 -5.7132 -5.7074 -5.7074 -0.4257 -0.4257 -0.2214 -0.2214 -0.0583 -0.0583 0.1188 0.1188 0.1739 0.1739 0.4607 0.4607 0.8534 0.8534 1.1614 1.1614 1.5681 1.5681 1.9941 1.9941 2.2456 2.2456 2.4304 2.4304 2.4568 2.4568 2.7389 2.7389 2.8543 2.8543 3.0240 3.0240 3.1276 3.1276 3.2542 3.2542 3.5396 3.5396 3.6299 3.6299 3.8215 3.8215 4.5994 4.5994 5.1515 5.1515 9.1607 9.1607 9.4998 9.4998 9.8529 9.8529 10.1530 10.1530 10.3035 10.3035 10.4190 10.4190 k = 0.3958 0.2285 0.5443 ( 18061 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9154 -21.9154 -21.9153 -21.9153 -8.3151 -8.3151 -7.8480 -7.8480 -7.6927 -7.6927 -7.6659 -7.6659 -7.5579 -7.5579 -7.4869 -7.4869 -6.5883 -6.5883 -6.5812 -6.5812 -5.7339 -5.7339 -5.7266 -5.7266 -5.7128 -5.7128 -5.7067 -5.7067 -0.4374 -0.4374 -0.2153 -0.2153 -0.0393 -0.0393 0.1146 0.1146 0.1748 0.1748 0.4613 0.4613 0.8728 0.8728 1.1641 1.1641 1.5582 1.5582 1.9903 1.9903 2.2350 2.2350 2.4364 2.4364 2.4564 2.4564 2.7588 2.7588 2.8464 2.8464 3.0157 3.0157 3.1194 3.1194 3.2297 3.2297 3.5278 3.5278 3.6180 3.6180 3.8358 3.8358 4.5623 4.5623 5.1621 5.1621 9.2064 9.2064 9.5596 9.5596 9.8315 9.8315 10.1866 10.1866 10.3127 10.3127 10.4456 10.4456 k = 0.3889 0.2245 0.5670 ( 18062 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3135 -8.3135 -7.8435 -7.8435 -7.6958 -7.6958 -7.6702 -7.6702 -7.5628 -7.5628 -7.4830 -7.4830 -6.5880 -6.5880 -6.5806 -6.5806 -5.7338 -5.7338 -5.7259 -5.7259 -5.7125 -5.7125 -5.7060 -5.7060 -0.4482 -0.4482 -0.2091 -0.2091 -0.0227 -0.0227 0.1105 0.1105 0.1764 0.1764 0.4621 0.4621 0.8866 0.8866 1.1690 1.1690 1.5490 1.5490 1.9866 1.9866 2.2255 2.2255 2.4437 2.4437 2.4566 2.4566 2.7785 2.7785 2.8377 2.8377 3.0066 3.0066 3.1136 3.1136 3.2068 3.2068 3.5153 3.5153 3.6082 3.6082 3.8520 3.8520 4.5279 4.5279 5.1737 5.1737 9.2483 9.2483 9.6149 9.6149 9.8076 9.8076 10.2117 10.2117 10.3061 10.3061 10.4773 10.4773 k = 0.3819 0.2205 0.5897 ( 18053 PWs) bands (ev): -80.9668 -80.9668 -49.7747 -49.7747 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3125 -8.3125 -7.8389 -7.8389 -7.6976 -7.6976 -7.6742 -7.6742 -7.5681 -7.5681 -7.4794 -7.4794 -6.5878 -6.5878 -6.5801 -6.5801 -5.7338 -5.7338 -5.7253 -5.7253 -5.7123 -5.7123 -5.7054 -5.7054 -0.4579 -0.4579 -0.2028 -0.2028 -0.0092 -0.0092 0.1064 0.1064 0.1788 0.1788 0.4633 0.4633 0.8946 0.8946 1.1752 1.1752 1.5406 1.5406 1.9834 1.9834 2.2172 2.2172 2.4517 2.4517 2.4583 2.4583 2.7974 2.7974 2.8287 2.8287 2.9967 2.9967 3.1096 3.1096 3.1873 3.1873 3.5022 3.5022 3.6014 3.6014 3.8692 3.8692 4.4969 4.4969 5.1862 5.1862 9.2834 9.2834 9.6601 9.6601 9.7864 9.7864 10.2251 10.2251 10.2853 10.2853 10.5149 10.5149 k = 0.3750 0.2165 0.6124 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1022 0.1022 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.6250-0.0722 0.4082 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3120 -8.3120 -7.8343 -7.8343 -7.6982 -7.6982 -7.6779 -7.6779 -7.5737 -7.5737 -7.4759 -7.4759 -6.5877 -6.5877 -6.5797 -6.5797 -5.7338 -5.7338 -5.7250 -5.7250 -5.7121 -5.7121 -5.7049 -5.7049 -0.4666 -0.4666 -0.1964 -0.1964 0.0008 0.0008 0.1021 0.1021 0.1819 0.1819 0.4646 0.4646 0.8975 0.8975 1.1819 1.1819 1.5334 1.5334 1.9810 1.9810 2.2101 2.2101 2.4563 2.4563 2.4655 2.4655 2.8087 2.8087 2.8253 2.8253 2.9866 2.9866 3.1065 3.1065 3.1733 3.1733 3.4883 3.4883 3.5982 3.5982 3.8869 3.8869 4.4697 4.4697 5.1994 5.1994 9.3074 9.3074 9.6841 9.6841 9.7793 9.7793 10.2211 10.2211 10.2586 10.2586 10.5571 10.5571 k = 0.6125-0.0938 0.4082 ( 18060 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3121 -8.3121 -7.8253 -7.8253 -7.6979 -7.6979 -7.6837 -7.6837 -7.5844 -7.5844 -7.4701 -7.4701 -6.5876 -6.5876 -6.5792 -6.5792 -5.7340 -5.7340 -5.7246 -5.7246 -5.7119 -5.7119 -5.7041 -5.7041 -0.4808 -0.4808 -0.1848 -0.1848 0.0143 0.0143 0.0945 0.0945 0.1880 0.1880 0.4673 0.4673 0.8974 0.8974 1.1929 1.1929 1.5221 1.5221 1.9783 1.9783 2.1986 2.1986 2.4614 2.4614 2.4851 2.4851 2.8053 2.8053 2.8398 2.8398 2.9672 2.9672 3.1021 3.1021 3.1562 3.1562 3.4632 3.4632 3.5986 3.5986 3.9178 3.9178 4.4250 4.4250 5.2240 5.2240 9.3302 9.3302 9.6983 9.6983 9.7900 9.7900 10.1862 10.1862 10.2198 10.2198 10.6139 10.6139 k = 0.6000-0.1155 0.4082 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3126 -8.3126 -7.8149 -7.8149 -7.6981 -7.6981 -7.6886 -7.6886 -7.5958 -7.5958 -7.4648 -7.4648 -6.5876 -6.5876 -6.5787 -6.5787 -5.7343 -5.7343 -5.7243 -5.7243 -5.7117 -5.7117 -5.7035 -5.7035 -0.4941 -0.4941 -0.1732 -0.1732 0.0246 0.0246 0.0886 0.0886 0.1939 0.1939 0.4700 0.4700 0.8948 0.8948 1.2029 1.2029 1.5121 1.5121 1.9765 1.9765 2.1878 2.1878 2.4680 2.4680 2.5060 2.5060 2.8007 2.8007 2.8527 2.8527 2.9461 2.9461 3.0958 3.0958 3.1457 3.1457 3.4395 3.4395 3.6041 3.6041 3.9458 3.9458 4.3819 4.3819 5.2489 5.2489 9.3400 9.3400 9.7050 9.7050 9.8071 9.8071 10.1464 10.1464 10.1872 10.1872 10.6069 10.6069 k = 0.5875-0.1371 0.4082 ( 18068 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9153 -21.9153 -8.3134 -8.3134 -7.8035 -7.8035 -7.6992 -7.6992 -7.6920 -7.6920 -7.6077 -7.6077 -7.4600 -7.4600 -6.5877 -6.5877 -6.5782 -6.5782 -5.7346 -5.7346 -5.7240 -5.7240 -5.7115 -5.7115 -5.7029 -5.7029 -0.5063 -0.5063 -0.1618 -0.1618 0.0305 0.0305 0.0857 0.0857 0.1992 0.1992 0.4728 0.4728 0.8900 0.8900 1.2118 1.2118 1.5039 1.5039 1.9756 1.9756 2.1779 2.1779 2.4758 2.4758 2.5279 2.5279 2.7957 2.7957 2.8618 2.8618 2.9255 2.9255 3.0835 3.0835 3.1446 3.1446 3.4175 3.4175 3.6148 3.6148 3.9697 3.9697 4.3411 4.3411 5.2736 5.2736 9.3403 9.3403 9.7035 9.7035 9.8288 9.8288 10.1051 10.1051 10.1620 10.1620 10.6016 10.6016 k = 0.5750-0.1588 0.4082 ( 18066 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9155 -21.9155 -21.9152 -21.9152 -8.3144 -8.3144 -7.7911 -7.7911 -7.7018 -7.7018 -7.6933 -7.6933 -7.6202 -7.6202 -7.4557 -7.4557 -6.5878 -6.5878 -6.5779 -6.5779 -5.7350 -5.7350 -5.7238 -5.7238 -5.7114 -5.7114 -5.7024 -5.7024 -0.5172 -0.5172 -0.1510 -0.1510 0.0320 0.0320 0.0863 0.0863 0.2041 0.2041 0.4755 0.4755 0.8836 0.8836 1.2196 1.2196 1.4975 1.4975 1.9754 1.9754 2.1688 2.1688 2.4843 2.4843 2.5507 2.5507 2.7897 2.7897 2.8654 2.8654 2.9081 2.9081 3.0674 3.0674 3.1501 3.1501 3.3972 3.3972 3.6302 3.6302 3.9883 3.9883 4.3039 4.3039 5.2971 5.2971 9.3346 9.3346 9.6948 9.6948 9.8520 9.8520 10.0653 10.0653 10.1436 10.1436 10.5979 10.5979 k = 0.5625-0.1804 0.4082 ( 18058 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3154 -8.3154 -7.7780 -7.7780 -7.7048 -7.7048 -7.6935 -7.6935 -7.6332 -7.6332 -7.4521 -7.4521 -6.5879 -6.5879 -6.5775 -6.5775 -5.7353 -5.7353 -5.7236 -5.7236 -5.7113 -5.7113 -5.7019 -5.7019 -0.5267 -0.5267 -0.1410 -0.1410 0.0302 0.0302 0.0896 0.0896 0.2083 0.2083 0.4780 0.4780 0.8762 0.8762 1.2264 1.2264 1.4927 1.4927 1.9756 1.9756 2.1608 2.1608 2.4929 2.4929 2.5742 2.5742 2.7819 2.7819 2.8616 2.8616 2.8976 2.8976 3.0506 3.0506 3.1584 3.1584 3.3790 3.3790 3.6496 3.6496 4.0003 4.0003 4.2717 4.2717 5.3189 5.3189 9.3259 9.3259 9.6819 9.6819 9.8733 9.8733 10.0293 10.0293 10.1306 10.1306 10.5956 10.5956 k = 0.5500-0.2021 0.4082 ( 18084 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3164 -8.3164 -7.7642 -7.7642 -7.7076 -7.7076 -7.6933 -7.6933 -7.6467 -7.6467 -7.4491 -7.4491 -6.5881 -6.5881 -6.5773 -6.5773 -5.7357 -5.7357 -5.7234 -5.7234 -5.7112 -5.7112 -5.7016 -5.7016 -0.5347 -0.5347 -0.1323 -0.1323 0.0269 0.0269 0.0939 0.0939 0.2119 0.2119 0.4802 0.4802 0.8687 0.8687 1.2320 1.2320 1.4895 1.4895 1.9762 1.9762 2.1539 2.1539 2.5011 2.5011 2.5980 2.5980 2.7713 2.7713 2.8526 2.8526 2.8932 2.8932 3.0353 3.0353 3.1674 3.1674 3.3630 3.3630 3.6716 3.6716 4.0047 4.0047 4.2459 4.2459 5.3379 5.3379 9.3165 9.3165 9.6675 9.6675 9.8902 9.8902 9.9993 9.9993 10.1218 10.1218 10.5942 10.5942 k = 0.5375-0.2237 0.4082 ( 18082 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3173 -8.3173 -7.7501 -7.7501 -7.7099 -7.7099 -7.6931 -7.6931 -7.6605 -7.6605 -7.4467 -7.4467 -6.5882 -6.5882 -6.5770 -6.5770 -5.7360 -5.7360 -5.7233 -5.7233 -5.7111 -5.7111 -5.7013 -5.7013 -0.5410 -0.5410 -0.1252 -0.1252 0.0235 0.0235 0.0979 0.0979 0.2147 0.2147 0.4821 0.4821 0.8618 0.8618 1.2365 1.2365 1.4874 1.4874 1.9769 1.9769 2.1483 2.1483 2.5084 2.5084 2.6221 2.6221 2.7571 2.7571 2.8442 2.8442 2.8907 2.8907 3.0227 3.0227 3.1758 3.1758 3.3497 3.3497 3.6943 3.6943 4.0019 4.0019 4.2276 4.2276 5.3536 5.3536 9.3078 9.3078 9.6540 9.6540 9.9009 9.9009 9.9771 9.9771 10.1160 10.1160 10.5935 10.5935 k = 0.5250-0.2454 0.4082 ( 18088 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3180 -8.3180 -7.7359 -7.7359 -7.7116 -7.7116 -7.6930 -7.6930 -7.6744 -7.6744 -7.4450 -7.4450 -6.5883 -6.5883 -6.5769 -6.5769 -5.7362 -5.7362 -5.7232 -5.7232 -5.7110 -5.7110 -5.7011 -5.7011 -0.5456 -0.5456 -0.1198 -0.1198 0.0208 0.0208 0.1010 0.1010 0.2167 0.2167 0.4834 0.4834 0.8563 0.8563 1.2397 1.2397 1.4861 1.4861 1.9776 1.9776 2.1443 2.1443 2.5141 2.5141 2.6458 2.6458 2.7399 2.7399 2.8384 2.8384 2.8886 2.8886 3.0134 3.0134 3.1827 3.1827 3.3395 3.3395 3.7149 3.7149 3.9941 3.9941 4.2165 4.2165 5.3653 5.3653 9.3009 9.3009 9.6433 9.6433 9.9049 9.9049 9.9639 9.9639 10.1124 10.1124 10.5932 10.5932 k = 0.5125-0.2670 0.4082 ( 18100 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3184 -8.3184 -7.7222 -7.7222 -7.7124 -7.7124 -7.6933 -7.6933 -7.6876 -7.6876 -7.4440 -7.4440 -6.5884 -6.5884 -6.5768 -6.5768 -5.7364 -5.7364 -5.7232 -5.7232 -5.7110 -5.7110 -5.7010 -5.7010 -0.5484 -0.5484 -0.1165 -0.1165 0.0190 0.0190 0.1030 0.1030 0.2180 0.2180 0.4842 0.4842 0.8527 0.8527 1.2417 1.2417 1.4854 1.4854 1.9780 1.9780 2.1417 2.1417 2.5178 2.5178 2.6680 2.6680 2.7211 2.7211 2.8354 2.8354 2.8869 2.8869 3.0078 3.0078 3.1873 3.1873 3.3330 3.3330 3.7298 3.7298 3.9861 3.9861 4.2108 4.2108 5.3726 5.3726 9.2966 9.2966 9.6364 9.6364 9.9045 9.9045 9.9584 9.9584 10.1104 10.1104 10.5931 10.5931 k = 0.5000-0.2887 0.4082 ( 18102 PWs) bands (ev): -80.9668 -80.9668 -49.7748 -49.7748 -45.3005 -45.3005 -45.3005 -45.3005 -21.9156 -21.9156 -21.9152 -21.9152 -8.3185 -8.3185 -7.7147 -7.7147 -7.7114 -7.7114 -7.6978 -7.6978 -7.6919 -7.6919 -7.4436 -7.4436 -6.5884 -6.5884 -6.5768 -6.5768 -5.7364 -5.7364 -5.7231 -5.7231 -5.7110 -5.7110 -5.7009 -5.7009 -0.5494 -0.5494 -0.1154 -0.1154 0.0184 0.0184 0.1037 0.1037 0.2184 0.2184 0.4845 0.4845 0.8515 0.8515 1.2423 1.2423 1.4852 1.4852 1.9782 1.9782 2.1409 2.1409 2.5190 2.5190 2.6815 2.6815 2.7088 2.7088 2.8344 2.8344 2.8862 2.8862 3.0059 3.0059 3.1889 3.1889 3.3307 3.3307 3.7353 3.7353 3.9827 3.9827 4.2091 4.2091 5.3750 5.3750 9.2951 9.2951 9.6340 9.6340 9.9037 9.9037 9.9571 9.9571 10.1097 10.1097 10.5931 10.5931 Writing output data file Rb2PdI6.save init_run : 0.99s CPU 1.28s WALL ( 1 calls) electrons : 717.48s CPU 722.27s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.12s CPU 0.16s WALL ( 1 calls) Called by electrons: c_bands : 717.47s CPU 722.26s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.03s CPU 0.03s WALL ( 1 calls) newd : 0.28s CPU 0.46s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.15s WALL ( 195 calls) cegterg : 664.86s CPU 668.79s WALL ( 400 calls) Called by sum_band: Called by *egterg: h_psi : 461.64s CPU 465.38s WALL ( 5893 calls) s_psi : 19.88s CPU 19.83s WALL ( 5893 calls) g_psi : 0.64s CPU 0.56s WALL ( 5298 calls) cdiaghg : 158.62s CPU 158.95s WALL ( 5493 calls) cegterg:over : 26.69s CPU 26.65s WALL ( 5298 calls) cegterg:upda : 22.26s CPU 22.33s WALL ( 5298 calls) cegterg:last : 10.76s CPU 10.80s WALL ( 790 calls) cdiaghg:chol : 6.26s CPU 6.17s WALL ( 5493 calls) cdiaghg:inve : 4.55s CPU 4.74s WALL ( 5493 calls) cdiaghg:para : 10.06s CPU 10.11s WALL ( 10986 calls) Called by h_psi: h_psi:vloc : 417.04s CPU 420.79s WALL ( 5893 calls) h_psi:vnl : 43.82s CPU 43.83s WALL ( 5893 calls) add_vuspsi : 22.56s CPU 22.57s WALL ( 5893 calls) General routines calbec : 21.21s CPU 21.24s WALL ( 5893 calls) fft : 0.03s CPU 0.04s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 394.41s CPU 398.20s WALL ( 927560 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.22s CPU 0.43s WALL ( 390 calls) Parallel routines fft_scatter : 201.36s CPU 202.37s WALL ( 927583 calls) PWSCF : 13m 9.93s CPU 13m31.96s WALL This run was terminated on: 2:58:59 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=