Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 12:14: 1 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: ./CoxIN2x3.save/ file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per 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 64 64 17 2930 2908 409 Max 65 65 18 2938 2925 415 Sum 4675 4675 1261 211375 210103 29603 bravais-lattice index = 14 lattice parameter (alat) = 14.5383 a.u. unit-cell volume = 2172.8173 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 68.00 number of Kohn-Sham states= 82 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.538270 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 Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 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 PseudoPot. # 2 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. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Co 17.00 58.93320 Co( 1.00) I 7.00 126.90450 I( 1.00) N 5.00 14.00670 N( 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= 201 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 2) = ( 0.0172414 -0.0099543 0.0140775), wk = 0.0049751 k( 3) = ( 0.0344828 -0.0199086 0.0281551), wk = 0.0049751 k( 4) = ( 0.0517241 -0.0298629 0.0422326), wk = 0.0049751 k( 5) = ( 0.0689655 -0.0398173 0.0563101), wk = 0.0049751 k( 6) = ( 0.0862069 -0.0497716 0.0703876), wk = 0.0049751 k( 7) = ( 0.1034483 -0.0597259 0.0844652), wk = 0.0049751 k( 8) = ( 0.1206897 -0.0696802 0.0985427), wk = 0.0049751 k( 9) = ( 0.1379310 -0.0796345 0.1126202), wk = 0.0049751 k( 10) = ( 0.1551724 -0.0895888 0.1266977), wk = 0.0049751 k( 11) = ( 0.1724138 -0.0995431 0.1407753), wk = 0.0049751 k( 12) = ( 0.1896552 -0.1094975 0.1548528), wk = 0.0049751 k( 13) = ( 0.2068966 -0.1194518 0.1689303), wk = 0.0049751 k( 14) = ( 0.2241379 -0.1294061 0.1830079), wk = 0.0049751 k( 15) = ( 0.2413793 -0.1393604 0.1970854), wk = 0.0049751 k( 16) = ( 0.2586207 -0.1493147 0.2111629), wk = 0.0049751 k( 17) = ( 0.2758621 -0.1592690 0.2252404), wk = 0.0049751 k( 18) = ( 0.2931034 -0.1692234 0.2393180), wk = 0.0049751 k( 19) = ( 0.3103448 -0.1791777 0.2533955), wk = 0.0049751 k( 20) = ( 0.3275862 -0.1891320 0.2674730), wk = 0.0049751 k( 21) = ( 0.3448276 -0.1990863 0.2815505), wk = 0.0049751 k( 22) = ( 0.3620690 -0.2090406 0.2956281), wk = 0.0049751 k( 23) = ( 0.3793103 -0.2189949 0.3097056), wk = 0.0049751 k( 24) = ( 0.3965517 -0.2289492 0.3237831), wk = 0.0049751 k( 25) = ( 0.4137931 -0.2389036 0.3378607), wk = 0.0049751 k( 26) = ( 0.4310345 -0.2488579 0.3519382), wk = 0.0049751 k( 27) = ( 0.4482759 -0.2588122 0.3660157), wk = 0.0049751 k( 28) = ( 0.4655172 -0.2687665 0.3800932), wk = 0.0049751 k( 29) = ( 0.4827586 -0.2787208 0.3941708), wk = 0.0049751 k( 30) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049751 k( 31) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049751 k( 32) = ( 0.5000000 -0.2694301 0.4218566), wk = 0.0049751 k( 33) = ( 0.5000000 -0.2501851 0.4354648), wk = 0.0049751 k( 34) = ( 0.5000000 -0.2309401 0.4490731), wk = 0.0049751 k( 35) = ( 0.5000000 -0.2116951 0.4626814), wk = 0.0049751 k( 36) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0049751 k( 37) = ( 0.5000000 -0.1732051 0.4898979), wk = 0.0049751 k( 38) = ( 0.5000000 -0.1539601 0.5035062), wk = 0.0049751 k( 39) = ( 0.5000000 -0.1347151 0.5171145), wk = 0.0049751 k( 40) = ( 0.5000000 -0.1154701 0.5307228), wk = 0.0049751 k( 41) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0049751 k( 42) = ( 0.5000000 -0.0769800 0.5579393), wk = 0.0049751 k( 43) = ( 0.5000000 -0.0577350 0.5715476), wk = 0.0049751 k( 44) = ( 0.5000000 -0.0384900 0.5851559), wk = 0.0049751 k( 45) = ( 0.5000000 -0.0192450 0.5987642), wk = 0.0049751 k( 46) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049751 k( 47) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049751 k( 48) = ( 0.4886364 0.0196824 0.6123724), wk = 0.0049751 k( 49) = ( 0.4772727 0.0393648 0.6123724), wk = 0.0049751 k( 50) = ( 0.4659091 0.0590472 0.6123724), wk = 0.0049751 k( 51) = ( 0.4545455 0.0787296 0.6123724), wk = 0.0049751 k( 52) = ( 0.4431818 0.0984120 0.6123724), wk = 0.0049751 k( 53) = ( 0.4318182 0.1180944 0.6123724), wk = 0.0049751 k( 54) = ( 0.4204545 0.1377768 0.6123724), wk = 0.0049751 k( 55) = ( 0.4090909 0.1574592 0.6123724), wk = 0.0049751 k( 56) = ( 0.3977273 0.1771416 0.6123724), wk = 0.0049751 k( 57) = ( 0.3863636 0.1968239 0.6123724), wk = 0.0049751 k( 58) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049751 k( 59) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049751 k( 60) = ( 0.3629032 0.2095223 0.5926185), wk = 0.0049751 k( 61) = ( 0.3508064 0.2025382 0.5728645), wk = 0.0049751 k( 62) = ( 0.3387097 0.1955541 0.5531106), wk = 0.0049751 k( 63) = ( 0.3266129 0.1885700 0.5333566), wk = 0.0049751 k( 64) = ( 0.3145161 0.1815860 0.5136027), wk = 0.0049751 k( 65) = ( 0.3024193 0.1746019 0.4938487), wk = 0.0049751 k( 66) = ( 0.2903226 0.1676178 0.4740948), wk = 0.0049751 k( 67) = ( 0.2782258 0.1606337 0.4543408), wk = 0.0049751 k( 68) = ( 0.2661290 0.1536497 0.4345869), wk = 0.0049751 k( 69) = ( 0.2540323 0.1466656 0.4148329), wk = 0.0049751 k( 70) = ( 0.2419355 0.1396815 0.3950790), wk = 0.0049751 k( 71) = ( 0.2298387 0.1326974 0.3753250), wk = 0.0049751 k( 72) = ( 0.2177419 0.1257134 0.3555711), wk = 0.0049751 k( 73) = ( 0.2056452 0.1187293 0.3358171), wk = 0.0049751 k( 74) = ( 0.1935484 0.1117452 0.3160632), wk = 0.0049751 k( 75) = ( 0.1814516 0.1047611 0.2963093), wk = 0.0049751 k( 76) = ( 0.1693548 0.0977771 0.2765553), wk = 0.0049751 k( 77) = ( 0.1572581 0.0907930 0.2568013), wk = 0.0049751 k( 78) = ( 0.1451613 0.0838089 0.2370474), wk = 0.0049751 k( 79) = ( 0.1330645 0.0768248 0.2172934), wk = 0.0049751 k( 80) = ( 0.1209677 0.0698408 0.1975395), wk = 0.0049751 k( 81) = ( 0.1088710 0.0628567 0.1777855), wk = 0.0049751 k( 82) = ( 0.0967742 0.0558726 0.1580316), wk = 0.0049751 k( 83) = ( 0.0846774 0.0488885 0.1382776), wk = 0.0049751 k( 84) = ( 0.0725806 0.0419045 0.1185237), wk = 0.0049751 k( 85) = ( 0.0604839 0.0349204 0.0987697), wk = 0.0049751 k( 86) = ( 0.0483871 0.0279363 0.0790158), wk = 0.0049751 k( 87) = ( 0.0362903 0.0209522 0.0592619), wk = 0.0049751 k( 88) = ( 0.0241936 0.0139682 0.0395079), wk = 0.0049751 k( 89) = ( 0.0120968 0.0069841 0.0197540), wk = 0.0049751 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 92) = ( 0.0192308 0.0111029 0.0078509), wk = 0.0049751 k( 93) = ( 0.0384615 0.0222058 0.0157019), wk = 0.0049751 k( 94) = ( 0.0576923 0.0333087 0.0235528), wk = 0.0049751 k( 95) = ( 0.0769231 0.0444116 0.0314037), wk = 0.0049751 k( 96) = ( 0.0961538 0.0555145 0.0392546), wk = 0.0049751 k( 97) = ( 0.1153846 0.0666173 0.0471056), wk = 0.0049751 k( 98) = ( 0.1346154 0.0777202 0.0549565), wk = 0.0049751 k( 99) = ( 0.1538461 0.0888231 0.0628074), wk = 0.0049751 k( 100) = ( 0.1730769 0.0999260 0.0706584), wk = 0.0049751 k( 101) = ( 0.1923077 0.1110289 0.0785093), wk = 0.0049751 k( 102) = ( 0.2115385 0.1221318 0.0863602), wk = 0.0049751 k( 103) = ( 0.2307692 0.1332347 0.0942111), wk = 0.0049751 k( 104) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0049751 k( 105) = ( 0.2692308 0.1554405 0.1099130), wk = 0.0049751 k( 106) = ( 0.2884615 0.1665433 0.1177639), wk = 0.0049751 k( 107) = ( 0.3076923 0.1776462 0.1256149), wk = 0.0049751 k( 108) = ( 0.3269231 0.1887491 0.1334658), wk = 0.0049751 k( 109) = ( 0.3461538 0.1998520 0.1413167), wk = 0.0049751 k( 110) = ( 0.3653846 0.2109549 0.1491676), wk = 0.0049751 k( 111) = ( 0.3846154 0.2220578 0.1570186), wk = 0.0049751 k( 112) = ( 0.4038462 0.2331607 0.1648695), wk = 0.0049751 k( 113) = ( 0.4230769 0.2442636 0.1727204), wk = 0.0049751 k( 114) = ( 0.4423077 0.2553665 0.1805714), wk = 0.0049751 k( 115) = ( 0.4615385 0.2664694 0.1884223), wk = 0.0049751 k( 116) = ( 0.4807692 0.2775722 0.1962732), wk = 0.0049751 k( 117) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049751 k( 118) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049751 k( 119) = ( 0.5069444 0.2686283 0.2154644), wk = 0.0049751 k( 120) = ( 0.5138889 0.2485814 0.2268046), wk = 0.0049751 k( 121) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0049751 k( 122) = ( 0.5277778 0.2084876 0.2494851), wk = 0.0049751 k( 123) = ( 0.5347222 0.1884407 0.2608253), wk = 0.0049751 k( 124) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0049751 k( 125) = ( 0.5486111 0.1483469 0.2835058), wk = 0.0049751 k( 126) = ( 0.5555556 0.1283001 0.2948460), wk = 0.0049751 k( 127) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0049751 k( 128) = ( 0.5694444 0.0882063 0.3175264), wk = 0.0049751 k( 129) = ( 0.5763889 0.0681594 0.3288667), wk = 0.0049751 k( 130) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0049751 k( 131) = ( 0.5902778 0.0280656 0.3515471), wk = 0.0049751 k( 132) = ( 0.5972222 0.0080188 0.3628874), wk = 0.0049751 k( 133) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0049751 k( 134) = ( 0.6111111 -0.0320750 0.3855678), wk = 0.0049751 k( 135) = ( 0.6180556 -0.0521219 0.3969081), wk = 0.0049751 k( 136) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049751 k( 137) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049751 k( 138) = ( 0.6136364 -0.0656080 0.4268050), wk = 0.0049751 k( 139) = ( 0.6022727 -0.0590472 0.4453618), wk = 0.0049751 k( 140) = ( 0.5909091 -0.0524864 0.4639185), wk = 0.0049751 k( 141) = ( 0.5795455 -0.0459256 0.4824753), wk = 0.0049751 k( 142) = ( 0.5681818 -0.0393648 0.5010320), wk = 0.0049751 k( 143) = ( 0.5568182 -0.0328040 0.5195887), wk = 0.0049751 k( 144) = ( 0.5454545 -0.0262432 0.5381455), wk = 0.0049751 k( 145) = ( 0.5340909 -0.0196824 0.5567022), wk = 0.0049751 k( 146) = ( 0.5227273 -0.0131216 0.5752590), wk = 0.0049751 k( 147) = ( 0.5113636 -0.0065608 0.5938157), wk = 0.0049751 k( 148) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049751 k( 149) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0049751 k( 150) = ( 0.5000000 0.0137464 0.5929320), wk = 0.0049751 k( 151) = ( 0.5000000 0.0274929 0.5734917), wk = 0.0049751 k( 152) = ( 0.5000000 0.0412393 0.5540512), wk = 0.0049751 k( 153) = ( 0.5000000 0.0549857 0.5346109), wk = 0.0049751 k( 154) = ( 0.5000000 0.0687322 0.5151705), wk = 0.0049751 k( 155) = ( 0.5000000 0.0824786 0.4957301), wk = 0.0049751 k( 156) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0049751 k( 157) = ( 0.5000000 0.1099715 0.4568493), wk = 0.0049751 k( 158) = ( 0.5000000 0.1237179 0.4374089), wk = 0.0049751 k( 159) = ( 0.5000000 0.1374644 0.4179685), wk = 0.0049751 k( 160) = ( 0.5000000 0.1512108 0.3985281), wk = 0.0049751 k( 161) = ( 0.5000000 0.1649572 0.3790877), wk = 0.0049751 k( 162) = ( 0.5000000 0.1787036 0.3596473), wk = 0.0049751 k( 163) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0049751 k( 164) = ( 0.5000000 0.2061965 0.3207665), wk = 0.0049751 k( 165) = ( 0.5000000 0.2199430 0.3013261), wk = 0.0049751 k( 166) = ( 0.5000000 0.2336894 0.2818857), wk = 0.0049751 k( 167) = ( 0.5000000 0.2474358 0.2624453), wk = 0.0049751 k( 168) = ( 0.5000000 0.2611823 0.2430049), wk = 0.0049751 k( 169) = ( 0.5000000 0.2749287 0.2235645), wk = 0.0049751 k( 170) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049751 k( 171) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0049751 k( 172) = ( 0.4930556 0.2846658 0.2268046), wk = 0.0049751 k( 173) = ( 0.4861111 0.2806564 0.2494851), wk = 0.0049751 k( 174) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0049751 k( 175) = ( 0.4722222 0.2726376 0.2948460), wk = 0.0049751 k( 176) = ( 0.4652778 0.2686283 0.3175264), wk = 0.0049751 k( 177) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0049751 k( 178) = ( 0.4513889 0.2606095 0.3628874), wk = 0.0049751 k( 179) = ( 0.4444444 0.2566001 0.3855678), wk = 0.0049751 k( 180) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0049751 k( 181) = ( 0.4305556 0.2485814 0.4309287), wk = 0.0049751 k( 182) = ( 0.4236111 0.2445720 0.4536092), wk = 0.0049751 k( 183) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0049751 k( 184) = ( 0.4097222 0.2365532 0.4989701), wk = 0.0049751 k( 185) = ( 0.4027778 0.2325439 0.5216506), wk = 0.0049751 k( 186) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0049751 k( 187) = ( 0.3888889 0.2245251 0.5670115), wk = 0.0049751 k( 188) = ( 0.3819444 0.2205157 0.5896920), wk = 0.0049751 k( 189) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0049751 k( 190) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0049751 k( 191) = ( 0.6136364 -0.0918512 0.4082483), wk = 0.0049751 k( 192) = ( 0.6022727 -0.1115336 0.4082483), wk = 0.0049751 k( 193) = ( 0.5909091 -0.1312160 0.4082483), wk = 0.0049751 k( 194) = ( 0.5795455 -0.1508984 0.4082483), wk = 0.0049751 k( 195) = ( 0.5681818 -0.1705808 0.4082483), wk = 0.0049751 k( 196) = ( 0.5568182 -0.1902632 0.4082483), wk = 0.0049751 k( 197) = ( 0.5454545 -0.2099456 0.4082483), wk = 0.0049751 k( 198) = ( 0.5340909 -0.2296279 0.4082483), wk = 0.0049751 k( 199) = ( 0.5227273 -0.2493103 0.4082483), wk = 0.0049751 k( 200) = ( 0.5113636 -0.2689927 0.4082483), wk = 0.0049751 k( 201) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0049751 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 2) = ( 0.0172414 0.0000000 0.0172414), wk = 0.0049751 k( 3) = ( 0.0344828 0.0000000 0.0344828), wk = 0.0049751 k( 4) = ( 0.0517241 0.0000000 0.0517241), wk = 0.0049751 k( 5) = ( 0.0689655 0.0000000 0.0689655), wk = 0.0049751 k( 6) = ( 0.0862069 0.0000000 0.0862069), wk = 0.0049751 k( 7) = ( 0.1034483 0.0000000 0.1034483), wk = 0.0049751 k( 8) = ( 0.1206897 0.0000000 0.1206897), wk = 0.0049751 k( 9) = ( 0.1379310 0.0000000 0.1379310), wk = 0.0049751 k( 10) = ( 0.1551724 0.0000000 0.1551724), wk = 0.0049751 k( 11) = ( 0.1724138 0.0000000 0.1724138), wk = 0.0049751 k( 12) = ( 0.1896552 0.0000000 0.1896552), wk = 0.0049751 k( 13) = ( 0.2068966 0.0000000 0.2068966), wk = 0.0049751 k( 14) = ( 0.2241379 0.0000000 0.2241379), wk = 0.0049751 k( 15) = ( 0.2413793 0.0000000 0.2413793), wk = 0.0049751 k( 16) = ( 0.2586207 0.0000000 0.2586207), wk = 0.0049751 k( 17) = ( 0.2758621 0.0000000 0.2758621), wk = 0.0049751 k( 18) = ( 0.2931034 0.0000000 0.2931034), wk = 0.0049751 k( 19) = ( 0.3103448 0.0000000 0.3103448), wk = 0.0049751 k( 20) = ( 0.3275862 0.0000000 0.3275862), wk = 0.0049751 k( 21) = ( 0.3448276 0.0000000 0.3448276), wk = 0.0049751 k( 22) = ( 0.3620690 0.0000000 0.3620690), wk = 0.0049751 k( 23) = ( 0.3793103 0.0000000 0.3793103), wk = 0.0049751 k( 24) = ( 0.3965517 0.0000000 0.3965517), wk = 0.0049751 k( 25) = ( 0.4137931 0.0000000 0.4137931), wk = 0.0049751 k( 26) = ( 0.4310345 0.0000000 0.4310345), wk = 0.0049751 k( 27) = ( 0.4482759 0.0000000 0.4482759), wk = 0.0049751 k( 28) = ( 0.4655172 0.0000000 0.4655172), wk = 0.0049751 k( 29) = ( 0.4827586 0.0000000 0.4827586), wk = 0.0049751 k( 30) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0049751 k( 31) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0049751 k( 32) = ( 0.5000000 0.0166667 0.5166667), wk = 0.0049751 k( 33) = ( 0.5000000 0.0333333 0.5333333), wk = 0.0049751 k( 34) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0049751 k( 35) = ( 0.5000000 0.0666667 0.5666667), wk = 0.0049751 k( 36) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0049751 k( 37) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0049751 k( 38) = ( 0.5000000 0.1166667 0.6166667), wk = 0.0049751 k( 39) = ( 0.5000000 0.1333333 0.6333333), wk = 0.0049751 k( 40) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0049751 k( 41) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0049751 k( 42) = ( 0.5000000 0.1833333 0.6833333), wk = 0.0049751 k( 43) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0049751 k( 44) = ( 0.5000000 0.2166667 0.7166667), wk = 0.0049751 k( 45) = ( 0.5000000 0.2333333 0.7333333), wk = 0.0049751 k( 46) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049751 k( 47) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049751 k( 48) = ( 0.4886364 0.2613636 0.7500000), wk = 0.0049751 k( 49) = ( 0.4772727 0.2727273 0.7500000), wk = 0.0049751 k( 50) = ( 0.4659091 0.2840909 0.7500000), wk = 0.0049751 k( 51) = ( 0.4545455 0.2954546 0.7500000), wk = 0.0049751 k( 52) = ( 0.4431818 0.3068182 0.7500000), wk = 0.0049751 k( 53) = ( 0.4318182 0.3181818 0.7500000), wk = 0.0049751 k( 54) = ( 0.4204545 0.3295455 0.7500000), wk = 0.0049751 k( 55) = ( 0.4090909 0.3409091 0.7500000), wk = 0.0049751 k( 56) = ( 0.3977273 0.3522727 0.7500000), wk = 0.0049751 k( 57) = ( 0.3863636 0.3636364 0.7500000), wk = 0.0049751 k( 58) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049751 k( 59) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049751 k( 60) = ( 0.3629032 0.3629032 0.7258064), wk = 0.0049751 k( 61) = ( 0.3508064 0.3508064 0.7016129), wk = 0.0049751 k( 62) = ( 0.3387097 0.3387097 0.6774193), wk = 0.0049751 k( 63) = ( 0.3266129 0.3266129 0.6532258), wk = 0.0049751 k( 64) = ( 0.3145161 0.3145161 0.6290323), wk = 0.0049751 k( 65) = ( 0.3024193 0.3024193 0.6048387), wk = 0.0049751 k( 66) = ( 0.2903226 0.2903226 0.5806452), wk = 0.0049751 k( 67) = ( 0.2782258 0.2782258 0.5564516), wk = 0.0049751 k( 68) = ( 0.2661290 0.2661290 0.5322581), wk = 0.0049751 k( 69) = ( 0.2540323 0.2540323 0.5080645), wk = 0.0049751 k( 70) = ( 0.2419355 0.2419355 0.4838710), wk = 0.0049751 k( 71) = ( 0.2298387 0.2298387 0.4596774), wk = 0.0049751 k( 72) = ( 0.2177419 0.2177419 0.4354839), wk = 0.0049751 k( 73) = ( 0.2056452 0.2056452 0.4112903), wk = 0.0049751 k( 74) = ( 0.1935484 0.1935484 0.3870968), wk = 0.0049751 k( 75) = ( 0.1814516 0.1814516 0.3629032), wk = 0.0049751 k( 76) = ( 0.1693548 0.1693548 0.3387097), wk = 0.0049751 k( 77) = ( 0.1572581 0.1572581 0.3145161), wk = 0.0049751 k( 78) = ( 0.1451613 0.1451613 0.2903226), wk = 0.0049751 k( 79) = ( 0.1330645 0.1330645 0.2661290), wk = 0.0049751 k( 80) = ( 0.1209677 0.1209677 0.2419355), wk = 0.0049751 k( 81) = ( 0.1088710 0.1088710 0.2177419), wk = 0.0049751 k( 82) = ( 0.0967742 0.0967742 0.1935484), wk = 0.0049751 k( 83) = ( 0.0846774 0.0846774 0.1693548), wk = 0.0049751 k( 84) = ( 0.0725806 0.0725806 0.1451613), wk = 0.0049751 k( 85) = ( 0.0604839 0.0604839 0.1209677), wk = 0.0049751 k( 86) = ( 0.0483871 0.0483871 0.0967742), wk = 0.0049751 k( 87) = ( 0.0362903 0.0362903 0.0725806), wk = 0.0049751 k( 88) = ( 0.0241936 0.0241936 0.0483871), wk = 0.0049751 k( 89) = ( 0.0120968 0.0120968 0.0241936), wk = 0.0049751 k( 90) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 91) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049751 k( 92) = ( 0.0192308 0.0192308 0.0192308), wk = 0.0049751 k( 93) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0049751 k( 94) = ( 0.0576923 0.0576923 0.0576923), wk = 0.0049751 k( 95) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0049751 k( 96) = ( 0.0961538 0.0961538 0.0961538), wk = 0.0049751 k( 97) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0049751 k( 98) = ( 0.1346154 0.1346154 0.1346154), wk = 0.0049751 k( 99) = ( 0.1538461 0.1538461 0.1538462), wk = 0.0049751 k( 100) = ( 0.1730769 0.1730769 0.1730769), wk = 0.0049751 k( 101) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0049751 k( 102) = ( 0.2115385 0.2115385 0.2115385), wk = 0.0049751 k( 103) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0049751 k( 104) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0049751 k( 105) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0049751 k( 106) = ( 0.2884615 0.2884615 0.2884615), wk = 0.0049751 k( 107) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0049751 k( 108) = ( 0.3269231 0.3269231 0.3269231), wk = 0.0049751 k( 109) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0049751 k( 110) = ( 0.3653846 0.3653846 0.3653846), wk = 0.0049751 k( 111) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0049751 k( 112) = ( 0.4038462 0.4038462 0.4038462), wk = 0.0049751 k( 113) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0049751 k( 114) = ( 0.4423077 0.4423077 0.4423077), wk = 0.0049751 k( 115) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0049751 k( 116) = ( 0.4807692 0.4807692 0.4807692), wk = 0.0049751 k( 117) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049751 k( 118) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049751 k( 119) = ( 0.5069444 0.4861111 0.5069444), wk = 0.0049751 k( 120) = ( 0.5138889 0.4722222 0.5138889), wk = 0.0049751 k( 121) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0049751 k( 122) = ( 0.5277778 0.4444444 0.5277778), wk = 0.0049751 k( 123) = ( 0.5347222 0.4305556 0.5347222), wk = 0.0049751 k( 124) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0049751 k( 125) = ( 0.5486111 0.4027778 0.5486111), wk = 0.0049751 k( 126) = ( 0.5555556 0.3888889 0.5555556), wk = 0.0049751 k( 127) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0049751 k( 128) = ( 0.5694444 0.3611111 0.5694444), wk = 0.0049751 k( 129) = ( 0.5763889 0.3472222 0.5763889), wk = 0.0049751 k( 130) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0049751 k( 131) = ( 0.5902778 0.3194444 0.5902778), wk = 0.0049751 k( 132) = ( 0.5972222 0.3055556 0.5972222), wk = 0.0049751 k( 133) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0049751 k( 134) = ( 0.6111111 0.2777778 0.6111111), wk = 0.0049751 k( 135) = ( 0.6180556 0.2638889 0.6180556), wk = 0.0049751 k( 136) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049751 k( 137) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049751 k( 138) = ( 0.6136364 0.2500000 0.6363636), wk = 0.0049751 k( 139) = ( 0.6022727 0.2500000 0.6477273), wk = 0.0049751 k( 140) = ( 0.5909091 0.2500000 0.6590909), wk = 0.0049751 k( 141) = ( 0.5795455 0.2500000 0.6704545), wk = 0.0049751 k( 142) = ( 0.5681818 0.2500000 0.6818182), wk = 0.0049751 k( 143) = ( 0.5568182 0.2500000 0.6931818), wk = 0.0049751 k( 144) = ( 0.5454545 0.2500000 0.7045455), wk = 0.0049751 k( 145) = ( 0.5340909 0.2500000 0.7159091), wk = 0.0049751 k( 146) = ( 0.5227273 0.2500000 0.7272727), wk = 0.0049751 k( 147) = ( 0.5113636 0.2500000 0.7386364), wk = 0.0049751 k( 148) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049751 k( 149) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0049751 k( 150) = ( 0.5000000 0.2619048 0.7380952), wk = 0.0049751 k( 151) = ( 0.5000000 0.2738095 0.7261905), wk = 0.0049751 k( 152) = ( 0.5000000 0.2857143 0.7142857), wk = 0.0049751 k( 153) = ( 0.5000000 0.2976190 0.7023810), wk = 0.0049751 k( 154) = ( 0.5000000 0.3095238 0.6904762), wk = 0.0049751 k( 155) = ( 0.5000000 0.3214286 0.6785714), wk = 0.0049751 k( 156) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0049751 k( 157) = ( 0.5000000 0.3452381 0.6547619), wk = 0.0049751 k( 158) = ( 0.5000000 0.3571429 0.6428571), wk = 0.0049751 k( 159) = ( 0.5000000 0.3690476 0.6309524), wk = 0.0049751 k( 160) = ( 0.5000000 0.3809524 0.6190476), wk = 0.0049751 k( 161) = ( 0.5000000 0.3928571 0.6071429), wk = 0.0049751 k( 162) = ( 0.5000000 0.4047619 0.5952381), wk = 0.0049751 k( 163) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0049751 k( 164) = ( 0.5000000 0.4285714 0.5714286), wk = 0.0049751 k( 165) = ( 0.5000000 0.4404762 0.5595238), wk = 0.0049751 k( 166) = ( 0.5000000 0.4523810 0.5476190), wk = 0.0049751 k( 167) = ( 0.5000000 0.4642857 0.5357143), wk = 0.0049751 k( 168) = ( 0.5000000 0.4761905 0.5238095), wk = 0.0049751 k( 169) = ( 0.5000000 0.4880952 0.5119048), wk = 0.0049751 k( 170) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049751 k( 171) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0049751 k( 172) = ( 0.4930556 0.4930556 0.5138889), wk = 0.0049751 k( 173) = ( 0.4861111 0.4861111 0.5277778), wk = 0.0049751 k( 174) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0049751 k( 175) = ( 0.4722222 0.4722222 0.5555556), wk = 0.0049751 k( 176) = ( 0.4652778 0.4652778 0.5694444), wk = 0.0049751 k( 177) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0049751 k( 178) = ( 0.4513889 0.4513889 0.5972222), wk = 0.0049751 k( 179) = ( 0.4444444 0.4444444 0.6111111), wk = 0.0049751 k( 180) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0049751 k( 181) = ( 0.4305556 0.4305556 0.6388889), wk = 0.0049751 k( 182) = ( 0.4236111 0.4236111 0.6527778), wk = 0.0049751 k( 183) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0049751 k( 184) = ( 0.4097222 0.4097222 0.6805556), wk = 0.0049751 k( 185) = ( 0.4027778 0.4027778 0.6944444), wk = 0.0049751 k( 186) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0049751 k( 187) = ( 0.3888889 0.3888889 0.7222222), wk = 0.0049751 k( 188) = ( 0.3819444 0.3819444 0.7361111), wk = 0.0049751 k( 189) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0049751 k( 190) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0049751 k( 191) = ( 0.6136364 0.2272727 0.6136364), wk = 0.0049751 k( 192) = ( 0.6022727 0.2045455 0.6022727), wk = 0.0049751 k( 193) = ( 0.5909091 0.1818182 0.5909091), wk = 0.0049751 k( 194) = ( 0.5795455 0.1590909 0.5795455), wk = 0.0049751 k( 195) = ( 0.5681818 0.1363636 0.5681818), wk = 0.0049751 k( 196) = ( 0.5568182 0.1136364 0.5568182), wk = 0.0049751 k( 197) = ( 0.5454545 0.0909091 0.5454545), wk = 0.0049751 k( 198) = ( 0.5340909 0.0681818 0.5340909), wk = 0.0049751 k( 199) = ( 0.5227273 0.0454546 0.5227273), wk = 0.0049751 k( 200) = ( 0.5113636 0.0227273 0.5113636), wk = 0.0049751 k( 201) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0049751 Dense grid: 211375 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 210103 G-vectors FFT dimensions: ( 90, 90, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.93 Mb ( 744, 82) NL pseudopotentials 1.25 Mb ( 372, 220) Each V/rho on FFT grid 0.25 Mb ( 16200) Each G-vector array 0.02 Mb ( 2931) G-vector shells 0.01 Mb ( 920) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.72 Mb ( 744, 328) Each subspace H/S matrix 0.04 Mb ( 54, 54) Each matrix 0.55 Mb ( 220, 2, 82) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./CoxIN2x3.save/charge-density.dat Starting wfc are 92 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.0 secs Computing kpt #: 2 total cpu time spent up to now is 7.7 secs Computing kpt #: 3 total cpu time spent up to now is 10.5 secs Computing kpt #: 4 total cpu time spent up to now is 13.2 secs Computing kpt #: 5 total cpu time spent up to now is 16.0 secs Computing kpt #: 6 total cpu time spent up to now is 18.9 secs Computing kpt #: 7 total cpu time spent up to now is 21.8 secs Computing kpt #: 8 total cpu time spent up to now is 24.7 secs Computing kpt #: 9 total cpu time spent up to now is 27.5 secs Computing kpt #: 10 total cpu time spent up to now is 30.3 secs Computing kpt #: 11 total cpu time spent up to now is 33.2 secs Computing kpt #: 12 total cpu time spent up to now is 36.0 secs Computing kpt #: 13 total cpu time spent up to now is 38.8 secs Computing kpt #: 14 total cpu time spent up to now is 41.7 secs Computing kpt #: 15 total cpu time spent up to now is 44.6 secs Computing kpt #: 16 total cpu time spent up to now is 47.5 secs Computing kpt #: 17 total cpu time spent up to now is 50.6 secs Computing kpt #: 18 total cpu time spent up to now is 53.5 secs Computing kpt #: 19 total cpu time spent up to now is 56.4 secs Computing kpt #: 20 total cpu time spent up to now is 59.3 secs Computing kpt #: 21 total cpu time spent up to now is 62.1 secs Computing kpt #: 22 total cpu time spent up to now is 65.7 secs Computing kpt #: 23 total cpu time spent up to now is 69.3 secs Computing kpt #: 24 total cpu time spent up to now is 72.9 secs Computing kpt #: 25 total cpu time spent up to now is 75.7 secs Computing kpt #: 26 total cpu time spent up to now is 78.5 secs Computing kpt #: 27 total cpu time spent up to now is 81.4 secs Computing kpt #: 28 total cpu time spent up to now is 84.3 secs Computing kpt #: 29 total cpu time spent up to now is 87.1 secs Computing kpt #: 30 total cpu time spent up to now is 89.8 secs Computing kpt #: 31 total cpu time spent up to now is 92.7 secs Computing kpt #: 32 total cpu time spent up to now is 95.5 secs Computing kpt #: 33 total cpu time spent up to now is 98.3 secs Computing kpt #: 34 total cpu time spent up to now is 101.1 secs Computing kpt #: 35 total cpu time spent up to now is 103.9 secs Computing kpt #: 36 total cpu time spent up to now is 106.8 secs Computing kpt #: 37 total cpu time spent up to now is 109.8 secs Computing kpt #: 38 total cpu time spent up to now is 113.3 secs Computing kpt #: 39 total cpu time spent up to now is 116.2 secs Computing kpt #: 40 total cpu time spent up to now is 119.1 secs Computing kpt #: 41 total cpu time spent up to now is 122.6 secs Computing kpt #: 42 total cpu time spent up to now is 126.2 secs Computing kpt #: 43 total cpu time spent up to now is 129.1 secs Computing kpt #: 44 total cpu time spent up to now is 132.0 secs Computing kpt #: 45 total cpu time spent up to now is 135.0 secs Computing kpt #: 46 total cpu time spent up to now is 137.8 secs Computing kpt #: 47 total cpu time spent up to now is 140.6 secs Computing kpt #: 48 total cpu time spent up to now is 143.5 secs Computing kpt #: 49 total cpu time spent up to now is 147.1 secs Computing kpt #: 50 total cpu time spent up to now is 150.6 secs Computing kpt #: 51 total cpu time spent up to now is 154.2 secs Computing kpt #: 52 total cpu time spent up to now is 157.7 secs Computing kpt #: 53 total cpu time spent up to now is 161.3 secs Computing kpt #: 54 total cpu time spent up to now is 165.0 secs Computing kpt #: 55 total cpu time spent up to now is 168.8 secs Computing kpt #: 56 total cpu time spent up to now is 172.7 secs Computing kpt #: 57 total cpu time spent up to now is 175.7 secs Computing kpt #: 58 total cpu time spent up to now is 179.4 secs Computing kpt #: 59 total cpu time spent up to now is 184.0 secs Computing kpt #: 60 total cpu time spent up to now is 187.9 secs Computing kpt #: 61 total cpu time spent up to now is 190.8 secs Computing kpt #: 62 total cpu time spent up to now is 193.7 secs Computing kpt #: 63 total cpu time spent up to now is 197.1 secs Computing kpt #: 64 total cpu time spent up to now is 200.0 secs Computing kpt #: 65 total cpu time spent up to now is 202.9 secs Computing kpt #: 66 total cpu time spent up to now is 205.9 secs Computing kpt #: 67 total cpu time spent up to now is 208.9 secs Computing kpt #: 68 total cpu time spent up to now is 211.7 secs Computing kpt #: 69 total cpu time spent up to now is 214.7 secs Computing kpt #: 70 total cpu time spent up to now is 219.1 secs Computing kpt #: 71 total cpu time spent up to now is 224.3 secs Computing kpt #: 72 total cpu time spent up to now is 229.9 secs Computing kpt #: 73 total cpu time spent up to now is 234.7 secs Computing kpt #: 74 total cpu time spent up to now is 237.7 secs Computing kpt #: 75 total cpu time spent up to now is 240.6 secs Computing kpt #: 76 total cpu time spent up to now is 244.3 secs Computing kpt #: 77 total cpu time spent up to now is 247.2 secs Computing kpt #: 78 total cpu time spent up to now is 250.1 secs Computing kpt #: 79 total cpu time spent up to now is 253.1 secs Computing kpt #: 80 total cpu time spent up to now is 256.0 secs Computing kpt #: 81 total cpu time spent up to now is 259.0 secs Computing kpt #: 82 total cpu time spent up to now is 261.9 secs Computing kpt #: 83 total cpu time spent up to now is 266.0 secs Computing kpt #: 84 total cpu time spent up to now is 269.5 secs Computing kpt #: 85 total cpu time spent up to now is 272.4 secs Computing kpt #: 86 total cpu time spent up to now is 275.3 secs Computing kpt #: 87 total cpu time spent up to now is 278.2 secs Computing kpt #: 88 total cpu time spent up to now is 281.0 secs Computing kpt #: 89 total cpu time spent up to now is 283.9 secs Computing kpt #: 90 total cpu time spent up to now is 286.7 secs Computing kpt #: 91 total cpu time spent up to now is 289.5 secs Computing kpt #: 92 total cpu time spent up to now is 292.3 secs Computing kpt #: 93 total cpu time spent up to now is 296.2 secs Computing kpt #: 94 total cpu time spent up to now is 299.1 secs Computing kpt #: 95 total cpu time spent up to now is 301.9 secs Computing kpt #: 96 total cpu time spent up to now is 305.0 secs Computing kpt #: 97 total cpu time spent up to now is 307.8 secs Computing kpt #: 98 total cpu time spent up to now is 310.8 secs Computing kpt #: 99 total cpu time spent up to now is 313.8 secs Computing kpt #: 100 total cpu time spent up to now is 316.7 secs Computing kpt #: 101 total cpu time spent up to now is 319.7 secs Computing kpt #: 102 total cpu time spent up to now is 322.5 secs Computing kpt #: 103 total cpu time spent up to now is 325.4 secs Computing kpt #: 104 total cpu time spent up to now is 328.3 secs Computing kpt #: 105 total cpu time spent up to now is 331.2 secs Computing kpt #: 106 total cpu time spent up to now is 334.0 secs Computing kpt #: 107 total cpu time spent up to now is 336.8 secs Computing kpt #: 108 total cpu time spent up to now is 339.6 secs Computing kpt #: 109 total cpu time spent up to now is 342.4 secs Computing kpt #: 110 total cpu time spent up to now is 345.3 secs Computing kpt #: 111 total cpu time spent up to now is 348.0 secs Computing kpt #: 112 total cpu time spent up to now is 350.8 secs Computing kpt #: 113 total cpu time spent up to now is 353.7 secs Computing kpt #: 114 total cpu time spent up to now is 356.4 secs Computing kpt #: 115 total cpu time spent up to now is 359.3 secs Computing kpt #: 116 total cpu time spent up to now is 362.1 secs Computing kpt #: 117 total cpu time spent up to now is 364.9 secs Computing kpt #: 118 total cpu time spent up to now is 367.9 secs Computing kpt #: 119 total cpu time spent up to now is 371.0 secs Computing kpt #: 120 total cpu time spent up to now is 373.9 secs Computing kpt #: 121 total cpu time spent up to now is 376.9 secs Computing kpt #: 122 total cpu time spent up to now is 379.8 secs Computing kpt #: 123 total cpu time spent up to now is 382.7 secs Computing kpt #: 124 total cpu time spent up to now is 385.6 secs Computing kpt #: 125 total cpu time spent up to now is 388.5 secs Computing kpt #: 126 total cpu time spent up to now is 391.5 secs Computing kpt #: 127 total cpu time spent up to now is 394.6 secs Computing kpt #: 128 total cpu time spent up to now is 397.5 secs Computing kpt #: 129 total cpu time spent up to now is 400.4 secs Computing kpt #: 130 total cpu time spent up to now is 403.4 secs Computing kpt #: 131 total cpu time spent up to now is 406.3 secs Computing kpt #: 132 total cpu time spent up to now is 409.3 secs Computing kpt #: 133 total cpu time spent up to now is 413.0 secs Computing kpt #: 134 total cpu time spent up to now is 416.8 secs Computing kpt #: 135 total cpu time spent up to now is 420.7 secs Computing kpt #: 136 total cpu time spent up to now is 424.4 secs Computing kpt #: 137 total cpu time spent up to now is 428.4 secs Computing kpt #: 138 total cpu time spent up to now is 432.2 secs Computing kpt #: 139 total cpu time spent up to now is 435.9 secs Computing kpt #: 140 total cpu time spent up to now is 439.6 secs Computing kpt #: 141 total cpu time spent up to now is 443.2 secs Computing kpt #: 142 total cpu time spent up to now is 446.9 secs Computing kpt #: 143 total cpu time spent up to now is 450.5 secs Computing kpt #: 144 total cpu time spent up to now is 454.1 secs Computing kpt #: 145 total cpu time spent up to now is 457.0 secs Computing kpt #: 146 total cpu time spent up to now is 460.0 secs Computing kpt #: 147 total cpu time spent up to now is 463.6 secs Computing kpt #: 148 total cpu time spent up to now is 466.6 secs Computing kpt #: 149 total cpu time spent up to now is 470.1 secs Computing kpt #: 150 total cpu time spent up to now is 473.1 secs Computing kpt #: 151 total cpu time spent up to now is 476.0 secs Computing kpt #: 152 total cpu time spent up to now is 478.9 secs Computing kpt #: 153 total cpu time spent up to now is 482.5 secs Computing kpt #: 154 total cpu time spent up to now is 486.2 secs Computing kpt #: 155 total cpu time spent up to now is 489.7 secs Computing kpt #: 156 total cpu time spent up to now is 492.8 secs Computing kpt #: 157 total cpu time spent up to now is 496.6 secs Computing kpt #: 158 total cpu time spent up to now is 500.4 secs Computing kpt #: 159 total cpu time spent up to now is 503.3 secs Computing kpt #: 160 total cpu time spent up to now is 506.3 secs Computing kpt #: 161 total cpu time spent up to now is 509.2 secs Computing kpt #: 162 total cpu time spent up to now is 512.1 secs Computing kpt #: 163 total cpu time spent up to now is 515.1 secs Computing kpt #: 164 total cpu time spent up to now is 518.0 secs Computing kpt #: 165 total cpu time spent up to now is 521.0 secs Computing kpt #: 166 total cpu time spent up to now is 523.9 secs Computing kpt #: 167 total cpu time spent up to now is 526.8 secs Computing kpt #: 168 total cpu time spent up to now is 529.7 secs Computing kpt #: 169 total cpu time spent up to now is 532.5 secs Computing kpt #: 170 total cpu time spent up to now is 535.3 secs Computing kpt #: 171 total cpu time spent up to now is 538.1 secs Computing kpt #: 172 total cpu time spent up to now is 540.9 secs Computing kpt #: 173 total cpu time spent up to now is 543.8 secs Computing kpt #: 174 total cpu time spent up to now is 546.7 secs Computing kpt #: 175 total cpu time spent up to now is 549.5 secs Computing kpt #: 176 total cpu time spent up to now is 552.4 secs Computing kpt #: 177 total cpu time spent up to now is 555.3 secs Computing kpt #: 178 total cpu time spent up to now is 558.3 secs Computing kpt #: 179 total cpu time spent up to now is 561.2 secs Computing kpt #: 180 total cpu time spent up to now is 564.1 secs Computing kpt #: 181 total cpu time spent up to now is 567.3 secs Computing kpt #: 182 total cpu time spent up to now is 570.4 secs Computing kpt #: 183 total cpu time spent up to now is 573.4 secs Computing kpt #: 184 total cpu time spent up to now is 576.4 secs Computing kpt #: 185 total cpu time spent up to now is 579.4 secs Computing kpt #: 186 total cpu time spent up to now is 582.6 secs Computing kpt #: 187 total cpu time spent up to now is 586.4 secs Computing kpt #: 188 total cpu time spent up to now is 589.8 secs Computing kpt #: 189 total cpu time spent up to now is 592.8 secs Computing kpt #: 190 total cpu time spent up to now is 596.3 secs Computing kpt #: 191 total cpu time spent up to now is 599.3 secs Computing kpt #: 192 total cpu time spent up to now is 603.0 secs Computing kpt #: 193 total cpu time spent up to now is 606.5 secs Computing kpt #: 194 total cpu time spent up to now is 610.2 secs Computing kpt #: 195 total cpu time spent up to now is 613.1 secs Computing kpt #: 196 total cpu time spent up to now is 616.1 secs Computing kpt #: 197 total cpu time spent up to now is 619.0 secs Computing kpt #: 198 total cpu time spent up to now is 621.8 secs Computing kpt #: 199 total cpu time spent up to now is 624.7 secs Computing kpt #: 200 total cpu time spent up to now is 627.5 secs Computing kpt #: 201 total cpu time spent up to now is 630.2 secs ethr = 1.47E-08, avg # of iterations = 18.3 total cpu time spent up to now is 630.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 26301 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0220 -13.0220 -12.3047 -12.3047 -12.2993 -12.2993 -12.2993 -12.2993 -12.1508 -12.1508 -12.1508 -12.1508 -11.6951 -11.6951 -11.5292 -11.5292 -11.5142 -11.5142 -2.9380 -2.9380 -2.9380 -2.9380 -2.8061 -2.8061 -2.7860 -2.7860 -2.7393 -2.7393 -2.7159 -2.7159 -2.7159 -2.7159 -2.3602 -2.3602 -2.3602 -2.3602 -1.8073 -1.8073 -1.7844 -1.7844 -1.2183 -1.2183 -1.2183 -1.2183 -1.0072 -1.0072 -1.0072 -1.0072 -0.9084 -0.9084 -0.4916 -0.4916 -0.4916 -0.4916 -0.4818 -0.4818 -0.3116 -0.3116 -0.3116 -0.3116 -0.1009 -0.1009 -0.1005 -0.1005 -0.0169 -0.0169 -0.0065 -0.0065 -0.0065 -0.0065 0.1632 0.1632 0.1632 0.1632 k = 0.0172-0.0100 0.0141 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0217 -13.0217 -12.3049 -12.3049 -12.2997 -12.2997 -12.2993 -12.2993 -12.1508 -12.1508 -12.1507 -12.1507 -11.6947 -11.6947 -11.5292 -11.5292 -11.5143 -11.5143 -2.9421 -2.9421 -2.9379 -2.9379 -2.8055 -2.8055 -2.7887 -2.7887 -2.7346 -2.7346 -2.7155 -2.7155 -2.7154 -2.7154 -2.3596 -2.3596 -2.3557 -2.3557 -1.8070 -1.8070 -1.7850 -1.7850 -1.2194 -1.2194 -1.2184 -1.2184 -1.0066 -1.0066 -1.0057 -1.0057 -0.9091 -0.9091 -0.4917 -0.4917 -0.4915 -0.4915 -0.4818 -0.4818 -0.3143 -0.3143 -0.3129 -0.3129 -0.1022 -0.1022 -0.1006 -0.1006 -0.0167 -0.0167 -0.0064 -0.0064 -0.0058 -0.0058 0.1623 0.1623 0.1629 0.1629 k = 0.0345-0.0199 0.0282 ( 26293 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0208 -13.0208 -12.3056 -12.3056 -12.3006 -12.3006 -12.2994 -12.2994 -12.1511 -12.1511 -12.1507 -12.1507 -11.6935 -11.6935 -11.5294 -11.5294 -11.5144 -11.5144 -2.9544 -2.9544 -2.9377 -2.9377 -2.8040 -2.8040 -2.7942 -2.7942 -2.7269 -2.7269 -2.7145 -2.7145 -2.7110 -2.7110 -2.3575 -2.3575 -2.3422 -2.3422 -1.8062 -1.8062 -1.7869 -1.7869 -1.2230 -1.2230 -1.2185 -1.2185 -1.0047 -1.0047 -1.0011 -1.0011 -0.9112 -0.9112 -0.4920 -0.4920 -0.4912 -0.4912 -0.4818 -0.4818 -0.3225 -0.3225 -0.3168 -0.3168 -0.1061 -0.1061 -0.1013 -0.1013 -0.0163 -0.0163 -0.0062 -0.0062 -0.0037 -0.0037 0.1596 0.1596 0.1618 0.1618 k = 0.0517-0.0299 0.0422 ( 26285 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0194 -13.0194 -12.3075 -12.3075 -12.3016 -12.3016 -12.2994 -12.2994 -12.1515 -12.1515 -12.1507 -12.1507 -11.6914 -11.6914 -11.5296 -11.5296 -11.5147 -11.5147 -2.9719 -2.9719 -2.9377 -2.9377 -2.8014 -2.8014 -2.7993 -2.7993 -2.7253 -2.7253 -2.7129 -2.7129 -2.6977 -2.6977 -2.3542 -2.3542 -2.3209 -2.3209 -1.8049 -1.8049 -1.7901 -1.7901 -1.2287 -1.2287 -1.2188 -1.2188 -1.0015 -1.0015 -0.9937 -0.9937 -0.9148 -0.9148 -0.4925 -0.4925 -0.4907 -0.4907 -0.4818 -0.4818 -0.3360 -0.3360 -0.3229 -0.3229 -0.1123 -0.1123 -0.1025 -0.1025 -0.0156 -0.0156 -0.0058 -0.0058 -0.0003 -0.0003 0.1552 0.1552 0.1597 0.1597 k = 0.0690-0.0398 0.0563 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0175 -13.0175 -12.3106 -12.3106 -12.3022 -12.3022 -12.2995 -12.2995 -12.1522 -12.1522 -12.1507 -12.1507 -11.6886 -11.6886 -11.5298 -11.5298 -11.5150 -11.5150 -2.9931 -2.9931 -2.9378 -2.9378 -2.8034 -2.8034 -2.7977 -2.7977 -2.7265 -2.7265 -2.7105 -2.7105 -2.6806 -2.6806 -2.3496 -2.3496 -2.2929 -2.2929 -1.8030 -1.8030 -1.7944 -1.7944 -1.2360 -1.2360 -1.2189 -1.2189 -0.9972 -0.9972 -0.9836 -0.9836 -0.9203 -0.9203 -0.4932 -0.4932 -0.4900 -0.4900 -0.4816 -0.4816 -0.3547 -0.3547 -0.3311 -0.3311 -0.1208 -0.1208 -0.1042 -0.1042 -0.0150 -0.0150 -0.0051 -0.0051 0.0042 0.0042 0.1491 0.1491 0.1560 0.1560 k = 0.0862-0.0498 0.0704 ( 26237 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -13.0150 -13.0150 -12.3148 -12.3148 -12.3026 -12.3026 -12.2995 -12.2995 -12.1532 -12.1532 -12.1506 -12.1506 -11.6851 -11.6851 -11.5302 -11.5302 -11.5153 -11.5153 -3.0159 -3.0159 -2.9376 -2.9376 -2.8067 -2.8067 -2.7930 -2.7930 -2.7283 -2.7283 -2.7073 -2.7073 -2.6626 -2.6626 -2.3438 -2.3438 -2.2598 -2.2598 -1.8005 -1.8005 -1.8000 -1.8000 -1.2449 -1.2449 -1.2186 -1.2186 -0.9920 -0.9920 -0.9711 -0.9711 -0.9279 -0.9279 -0.4943 -0.4943 -0.4891 -0.4891 -0.4813 -0.4813 -0.3781 -0.3781 -0.3409 -0.3409 -0.1312 -0.1312 -0.1069 -0.1069 -0.0144 -0.0144 -0.0043 -0.0043 0.0097 0.0097 0.1414 0.1414 0.1482 0.1482 k = 0.1034-0.0597 0.0845 ( 26245 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -13.0120 -13.0120 -12.3197 -12.3197 -12.3028 -12.3028 -12.2996 -12.2996 -12.1546 -12.1546 -12.1506 -12.1506 -11.6810 -11.6810 -11.5306 -11.5306 -11.5158 -11.5158 -3.0390 -3.0390 -2.9375 -2.9375 -2.8096 -2.8096 -2.7874 -2.7874 -2.7300 -2.7300 -2.7037 -2.7037 -2.6447 -2.6447 -2.3369 -2.3369 -2.2231 -2.2231 -1.8070 -1.8070 -1.7972 -1.7972 -1.2554 -1.2554 -1.2182 -1.2182 -0.9858 -0.9858 -0.9567 -0.9567 -0.9379 -0.9379 -0.4957 -0.4957 -0.4880 -0.4880 -0.4809 -0.4809 -0.4056 -0.4056 -0.3519 -0.3519 -0.1432 -0.1432 -0.1106 -0.1106 -0.0139 -0.0139 -0.0034 -0.0034 0.0157 0.0157 0.1320 0.1320 0.1325 0.1325 k = 0.1207-0.0697 0.0985 ( 26265 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0086 -13.0086 -12.3252 -12.3252 -12.3030 -12.3030 -12.2998 -12.2998 -12.1564 -12.1564 -12.1506 -12.1506 -11.6763 -11.6763 -11.5310 -11.5310 -11.5163 -11.5163 -3.0609 -3.0609 -2.9374 -2.9374 -2.8122 -2.8122 -2.7810 -2.7810 -2.7313 -2.7313 -2.6996 -2.6996 -2.6272 -2.6272 -2.3289 -2.3289 -2.1844 -2.1844 -1.8155 -1.8155 -1.7929 -1.7929 -1.2673 -1.2673 -1.2172 -1.2172 -0.9789 -0.9789 -0.9533 -0.9533 -0.9382 -0.9382 -0.4974 -0.4974 -0.4867 -0.4867 -0.4802 -0.4802 -0.4359 -0.4359 -0.3639 -0.3639 -0.1566 -0.1566 -0.1156 -0.1156 -0.0137 -0.0137 -0.0024 -0.0024 0.0218 0.0218 0.1108 0.1108 0.1211 0.1211 k = 0.1379-0.0796 0.1126 ( 26233 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -13.0048 -13.0048 -12.3311 -12.3311 -12.3032 -12.3032 -12.2999 -12.2999 -12.1588 -12.1588 -12.1505 -12.1505 -11.6713 -11.6713 -11.5316 -11.5316 -11.5168 -11.5168 -3.0811 -3.0811 -2.9371 -2.9371 -2.8145 -2.8145 -2.7735 -2.7735 -2.7317 -2.7317 -2.6946 -2.6946 -2.6100 -2.6100 -2.3200 -2.3200 -2.1451 -2.1451 -1.8250 -1.8250 -1.7876 -1.7876 -1.2800 -1.2800 -1.2154 -1.2154 -0.9714 -0.9714 -0.9705 -0.9705 -0.9201 -0.9201 -0.4994 -0.4994 -0.4852 -0.4852 -0.4795 -0.4795 -0.4674 -0.4674 -0.3764 -0.3764 -0.1707 -0.1707 -0.1212 -0.1212 -0.0136 -0.0136 -0.0017 -0.0017 0.0278 0.0278 0.0875 0.0875 0.1093 0.1093 k = 0.1552-0.0896 0.1267 ( 26233 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -13.0006 -13.0006 -12.3371 -12.3371 -12.3034 -12.3034 -12.3000 -12.3000 -12.1617 -12.1617 -12.1504 -12.1504 -11.6658 -11.6658 -11.5321 -11.5321 -11.5173 -11.5173 -3.0989 -3.0989 -2.9368 -2.9368 -2.8167 -2.8167 -2.7652 -2.7652 -2.7314 -2.7314 -2.6892 -2.6892 -2.5934 -2.5934 -2.3102 -2.3102 -2.1066 -2.1066 -1.8359 -1.8359 -1.7808 -1.7808 -1.2942 -1.2942 -1.2128 -1.2128 -0.9932 -0.9932 -0.9634 -0.9634 -0.8998 -0.8998 -0.5017 -0.5017 -0.4989 -0.4989 -0.4830 -0.4830 -0.4786 -0.4786 -0.3892 -0.3892 -0.1853 -0.1853 -0.1280 -0.1280 -0.0137 -0.0137 -0.0013 -0.0013 0.0328 0.0328 0.0646 0.0646 0.0965 0.0965 k = 0.1724-0.0995 0.1408 ( 26265 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9961 -12.9961 -12.3432 -12.3432 -12.3036 -12.3036 -12.3002 -12.3002 -12.1653 -12.1653 -12.1504 -12.1504 -11.6601 -11.6601 -11.5328 -11.5328 -11.5178 -11.5178 -3.1142 -3.1142 -2.9367 -2.9367 -2.8190 -2.8190 -2.7562 -2.7562 -2.7303 -2.7303 -2.6833 -2.6833 -2.5774 -2.5774 -2.2998 -2.2998 -2.0701 -2.0701 -1.8481 -1.8481 -1.7721 -1.7721 -1.3100 -1.3100 -1.2093 -1.2093 -1.0215 -1.0215 -0.9552 -0.9552 -0.8782 -0.8782 -0.5277 -0.5277 -0.5042 -0.5042 -0.4811 -0.4811 -0.4776 -0.4776 -0.4020 -0.4020 -0.1994 -0.1994 -0.1357 -0.1357 -0.0141 -0.0141 -0.0017 -0.0017 0.0357 0.0357 0.0432 0.0432 0.0841 0.0841 k = 0.1897-0.1095 0.1549 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9913 -12.9913 -12.3490 -12.3490 -12.3037 -12.3037 -12.3003 -12.3003 -12.1694 -12.1694 -12.1503 -12.1503 -11.6543 -11.6543 -11.5334 -11.5334 -11.5182 -11.5182 -3.1263 -3.1263 -2.9366 -2.9366 -2.8212 -2.8212 -2.7463 -2.7463 -2.7283 -2.7283 -2.6768 -2.6768 -2.5621 -2.5621 -2.2889 -2.2889 -2.0369 -2.0369 -1.8614 -1.8614 -1.7612 -1.7612 -1.3275 -1.3275 -1.2045 -1.2045 -1.0550 -1.0550 -0.9467 -0.9467 -0.8560 -0.8560 -0.5527 -0.5527 -0.5068 -0.5068 -0.4789 -0.4789 -0.4766 -0.4766 -0.4146 -0.4146 -0.2125 -0.2125 -0.1442 -0.1442 -0.0152 -0.0152 -0.0034 -0.0034 0.0246 0.0246 0.0342 0.0342 0.0743 0.0743 k = 0.2069-0.1195 0.1689 ( 26253 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9863 -12.9863 -12.3546 -12.3546 -12.3039 -12.3039 -12.3005 -12.3005 -12.1743 -12.1743 -12.1502 -12.1502 -11.6483 -11.6483 -11.5341 -11.5341 -11.5187 -11.5187 -3.1350 -3.1350 -2.9364 -2.9364 -2.8231 -2.8231 -2.7356 -2.7356 -2.7252 -2.7252 -2.6699 -2.6699 -2.5476 -2.5476 -2.2776 -2.2776 -2.0078 -2.0078 -1.8756 -1.8756 -1.7479 -1.7479 -1.3476 -1.3476 -1.1986 -1.1986 -1.0929 -1.0929 -0.9381 -0.9381 -0.8339 -0.8339 -0.5730 -0.5730 -0.5096 -0.5096 -0.4764 -0.4764 -0.4758 -0.4758 -0.4265 -0.4265 -0.2232 -0.2232 -0.1535 -0.1535 -0.0189 -0.0189 -0.0074 -0.0074 0.0114 0.0114 0.0255 0.0255 0.0697 0.0697 k = 0.2241-0.1294 0.1830 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9812 -12.9812 -12.3597 -12.3597 -12.3041 -12.3041 -12.3007 -12.3007 -12.1797 -12.1797 -12.1501 -12.1501 -11.6424 -11.6424 -11.5348 -11.5348 -11.5191 -11.5191 -3.1405 -3.1405 -2.9365 -2.9365 -2.8249 -2.8249 -2.7242 -2.7242 -2.7213 -2.7213 -2.6627 -2.6627 -2.5342 -2.5342 -2.2662 -2.2662 -1.9835 -1.9835 -1.8907 -1.8907 -1.7322 -1.7322 -1.3715 -1.3715 -1.1916 -1.1916 -1.1332 -1.1332 -0.9297 -0.9297 -0.8129 -0.8129 -0.5887 -0.5887 -0.5125 -0.5125 -0.4754 -0.4754 -0.4736 -0.4736 -0.4373 -0.4373 -0.2305 -0.2305 -0.1636 -0.1636 -0.0295 -0.0295 -0.0107 -0.0107 0.0053 0.0053 0.0108 0.0108 0.0694 0.0694 k = 0.2414-0.1394 0.1971 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9760 -12.9760 -12.3642 -12.3642 -12.3043 -12.3043 -12.3008 -12.3008 -12.1858 -12.1858 -12.1501 -12.1501 -11.6365 -11.6365 -11.5355 -11.5355 -11.5195 -11.5195 -3.1425 -3.1425 -2.9365 -2.9365 -2.8266 -2.8266 -2.7165 -2.7165 -2.7122 -2.7122 -2.6553 -2.6553 -2.5222 -2.5222 -2.2549 -2.2549 -1.9638 -1.9638 -1.9065 -1.9065 -1.7145 -1.7145 -1.4005 -1.4005 -1.1834 -1.1834 -1.1730 -1.1730 -0.9214 -0.9214 -0.7942 -0.7942 -0.6001 -0.6001 -0.5155 -0.5155 -0.4761 -0.4761 -0.4706 -0.4706 -0.4464 -0.4464 -0.2331 -0.2331 -0.1744 -0.1744 -0.0445 -0.0445 -0.0121 -0.0121 -0.0073 -0.0073 0.0022 0.0022 0.0707 0.0707 k = 0.2586-0.1493 0.2112 ( 26273 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9708 -12.9708 -12.3681 -12.3681 -12.3044 -12.3044 -12.3010 -12.3010 -12.1926 -12.1926 -12.1500 -12.1500 -11.6307 -11.6307 -11.5362 -11.5362 -11.5198 -11.5198 -3.1409 -3.1409 -2.9361 -2.9361 -2.8282 -2.8282 -2.7108 -2.7108 -2.6996 -2.6996 -2.6475 -2.6475 -2.5116 -2.5116 -2.2438 -2.2438 -1.9483 -1.9483 -1.9227 -1.9227 -1.6960 -1.6960 -1.4359 -1.4359 -1.2092 -1.2092 -1.1741 -1.1741 -0.9135 -0.9135 -0.7790 -0.7790 -0.6082 -0.6082 -0.5185 -0.5185 -0.4785 -0.4785 -0.4674 -0.4674 -0.4526 -0.4526 -0.2297 -0.2297 -0.1858 -0.1858 -0.0596 -0.0596 -0.0271 -0.0271 -0.0128 -0.0128 -0.0002 -0.0002 0.0722 0.0722 k = 0.2759-0.1593 0.2252 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9656 -12.9656 -12.3712 -12.3712 -12.3046 -12.3046 -12.3012 -12.3012 -12.1999 -12.1999 -12.1499 -12.1499 -11.6251 -11.6251 -11.5369 -11.5369 -11.5201 -11.5201 -3.1358 -3.1358 -2.9359 -2.9359 -2.8295 -2.8295 -2.7044 -2.7044 -2.6865 -2.6865 -2.6397 -2.6397 -2.5029 -2.5029 -2.2334 -2.2334 -1.9390 -1.9390 -1.9364 -1.9364 -1.6785 -1.6785 -1.4775 -1.4775 -1.2394 -1.2394 -1.1636 -1.1636 -0.9062 -0.9062 -0.7682 -0.7682 -0.6141 -0.6141 -0.5215 -0.5215 -0.4831 -0.4831 -0.4639 -0.4639 -0.4555 -0.4555 -0.2202 -0.2202 -0.1977 -0.1977 -0.0732 -0.0732 -0.0479 -0.0479 -0.0135 -0.0135 -0.0024 -0.0024 0.0734 0.0734 k = 0.2931-0.1692 0.2393 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9606 -12.9606 -12.3734 -12.3734 -12.3048 -12.3048 -12.3013 -12.3013 -12.2079 -12.2079 -12.1498 -12.1498 -11.6197 -11.6197 -11.5376 -11.5376 -11.5203 -11.5203 -3.1271 -3.1271 -2.9359 -2.9359 -2.8305 -2.8305 -2.6972 -2.6972 -2.6731 -2.6731 -2.6317 -2.6317 -2.4963 -2.4963 -2.2240 -2.2240 -1.9552 -1.9552 -1.9271 -1.9271 -1.6652 -1.6652 -1.5223 -1.5223 -1.2627 -1.2627 -1.1522 -1.1522 -0.8995 -0.8995 -0.7626 -0.7626 -0.6182 -0.6182 -0.5245 -0.5245 -0.4889 -0.4889 -0.4601 -0.4601 -0.4560 -0.4560 -0.2102 -0.2102 -0.2064 -0.2064 -0.0829 -0.0829 -0.0693 -0.0693 -0.0141 -0.0141 -0.0045 -0.0045 0.0742 0.0742 k = 0.3103-0.1792 0.2534 ( 26289 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9558 -12.9558 -12.3747 -12.3747 -12.3049 -12.3049 -12.3015 -12.3015 -12.2163 -12.2163 -12.1498 -12.1498 -11.6146 -11.6146 -11.5383 -11.5383 -11.5205 -11.5205 -3.1153 -3.1153 -2.9357 -2.9357 -2.8313 -2.8313 -2.6895 -2.6895 -2.6595 -2.6595 -2.6236 -2.6236 -2.4920 -2.4920 -2.2159 -2.2159 -1.9706 -1.9706 -1.9202 -1.9202 -1.6634 -1.6634 -1.5613 -1.5613 -1.2797 -1.2797 -1.1399 -1.1399 -0.8936 -0.8936 -0.7625 -0.7625 -0.6208 -0.6208 -0.5273 -0.5273 -0.4944 -0.4944 -0.4560 -0.4560 -0.4552 -0.4552 -0.2230 -0.2230 -0.1932 -0.1932 -0.0910 -0.0910 -0.0845 -0.0845 -0.0149 -0.0149 -0.0064 -0.0064 0.0746 0.0746 k = 0.3276-0.1891 0.2675 ( 26317 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -12.9512 -12.9512 -12.3750 -12.3750 -12.3051 -12.3051 -12.3017 -12.3017 -12.2252 -12.2252 -12.1497 -12.1497 -11.6098 -11.6098 -11.5390 -11.5390 -11.5207 -11.5207 -3.1003 -3.1003 -2.9357 -2.9357 -2.8316 -2.8316 -2.6813 -2.6813 -2.6461 -2.6461 -2.6155 -2.6155 -2.4904 -2.4904 -2.2095 -2.2095 -1.9850 -1.9850 -1.9154 -1.9154 -1.6858 -1.6858 -1.5802 -1.5802 -1.2908 -1.2908 -1.1271 -1.1271 -0.8888 -0.8888 -0.7681 -0.7681 -0.6215 -0.6215 -0.5300 -0.5300 -0.4990 -0.4990 -0.4538 -0.4538 -0.4515 -0.4515 -0.2365 -0.2365 -0.1878 -0.1878 -0.1125 -0.1125 -0.0722 -0.0722 -0.0159 -0.0159 -0.0080 -0.0080 0.0745 0.0745 k = 0.3448-0.1991 0.2816 ( 26309 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -12.9469 -12.9469 -12.3742 -12.3742 -12.3052 -12.3052 -12.3018 -12.3018 -12.2345 -12.2345 -12.1496 -12.1496 -11.6054 -11.6054 -11.5396 -11.5396 -11.5209 -11.5209 -3.0824 -3.0824 -2.9356 -2.9356 -2.8312 -2.8312 -2.6726 -2.6726 -2.6331 -2.6331 -2.6068 -2.6068 -2.4915 -2.4915 -2.2054 -2.2054 -1.9977 -1.9977 -1.9138 -1.9138 -1.7268 -1.7268 -1.5817 -1.5817 -1.2966 -1.2966 -1.1137 -1.1137 -0.8848 -0.8848 -0.7787 -0.7787 -0.6202 -0.6202 -0.5326 -0.5326 -0.5024 -0.5024 -0.4521 -0.4521 -0.4466 -0.4466 -0.2501 -0.2501 -0.1923 -0.1923 -0.1334 -0.1334 -0.0466 -0.0466 -0.0169 -0.0169 -0.0090 -0.0090 0.0743 0.0743 k = 0.3621-0.2090 0.2956 ( 26297 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9430 -12.9430 -12.3725 -12.3725 -12.3054 -12.3054 -12.3019 -12.3019 -12.2442 -12.2442 -12.1496 -12.1496 -11.6013 -11.6013 -11.5402 -11.5402 -11.5211 -11.5211 -3.0623 -3.0623 -2.9355 -2.9355 -2.8301 -2.8301 -2.6636 -2.6636 -2.6212 -2.6212 -2.5974 -2.5974 -2.4955 -2.4955 -2.2038 -2.2038 -2.0083 -2.0083 -1.9180 -1.9180 -1.7690 -1.7690 -1.5790 -1.5790 -1.2974 -1.2974 -1.1001 -1.1001 -0.8819 -0.8819 -0.7934 -0.7934 -0.6172 -0.6172 -0.5349 -0.5349 -0.5043 -0.5043 -0.4502 -0.4502 -0.4411 -0.4411 -0.2640 -0.2640 -0.2028 -0.2028 -0.1534 -0.1534 -0.0223 -0.0223 -0.0142 -0.0142 -0.0048 -0.0048 0.0738 0.0738 k = 0.3793-0.2190 0.3097 ( 26286 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9394 -12.9394 -12.3697 -12.3697 -12.3055 -12.3055 -12.3021 -12.3021 -12.2541 -12.2541 -12.1495 -12.1495 -11.5975 -11.5975 -11.5407 -11.5407 -11.5213 -11.5213 -3.0405 -3.0405 -2.9354 -2.9354 -2.8280 -2.8280 -2.6546 -2.6546 -2.6112 -2.6112 -2.5869 -2.5869 -2.5026 -2.5026 -2.2049 -2.2049 -2.0164 -2.0164 -1.9326 -1.9326 -1.8007 -1.8007 -1.5775 -1.5775 -1.2939 -1.2939 -1.0867 -1.0867 -0.8801 -0.8801 -0.8108 -0.8108 -0.6131 -0.6131 -0.5370 -0.5370 -0.5047 -0.5047 -0.4481 -0.4481 -0.4352 -0.4352 -0.2781 -0.2781 -0.2161 -0.2161 -0.1721 -0.1721 -0.0217 -0.0217 -0.0122 -0.0122 0.0249 0.0249 0.0732 0.0732 k = 0.3966-0.2289 0.3238 ( 26302 PWs) bands (ev): -92.9989 -92.9989 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9363 -12.9363 -12.3659 -12.3659 -12.3056 -12.3056 -12.3022 -12.3022 -12.2642 -12.2642 -12.1495 -12.1495 -11.5942 -11.5942 -11.5412 -11.5412 -11.5214 -11.5214 -3.0181 -3.0181 -2.9353 -2.9353 -2.8246 -2.8246 -2.6458 -2.6458 -2.6034 -2.6034 -2.5754 -2.5754 -2.5129 -2.5129 -2.2085 -2.2085 -2.0221 -2.0221 -1.9597 -1.9597 -1.8168 -1.8168 -1.5782 -1.5782 -1.2869 -1.2869 -1.0736 -1.0736 -0.8794 -0.8794 -0.8297 -0.8297 -0.6083 -0.6083 -0.5388 -0.5388 -0.5036 -0.5036 -0.4460 -0.4460 -0.4289 -0.4289 -0.2923 -0.2923 -0.2304 -0.2304 -0.1890 -0.1890 -0.0231 -0.0231 -0.0124 -0.0124 0.0549 0.0549 0.0725 0.0725 k = 0.4138-0.2389 0.3379 ( 26282 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9336 -12.9336 -12.3612 -12.3612 -12.3057 -12.3057 -12.3023 -12.3023 -12.2744 -12.2744 -12.1494 -12.1494 -11.5914 -11.5914 -11.5416 -11.5416 -11.5216 -11.5216 -2.9961 -2.9961 -2.9350 -2.9350 -2.8194 -2.8194 -2.6373 -2.6373 -2.5972 -2.5972 -2.5636 -2.5636 -2.5260 -2.5260 -2.2140 -2.2140 -2.0257 -2.0257 -1.9937 -1.9937 -1.8213 -1.8213 -1.5810 -1.5810 -1.2774 -1.2774 -1.0614 -1.0614 -0.8795 -0.8795 -0.8488 -0.8488 -0.6034 -0.6034 -0.5404 -0.5404 -0.5014 -0.5014 -0.4438 -0.4438 -0.4221 -0.4221 -0.3062 -0.3062 -0.2448 -0.2448 -0.2037 -0.2037 -0.0246 -0.0246 -0.0126 -0.0126 0.0718 0.0718 0.0779 0.0779 k = 0.4310-0.2489 0.3519 ( 26270 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9314 -12.9314 -12.3555 -12.3555 -12.3058 -12.3058 -12.3024 -12.3024 -12.2845 -12.2845 -12.1494 -12.1494 -11.5890 -11.5890 -11.5419 -11.5419 -11.5218 -11.5218 -2.9757 -2.9757 -2.9349 -2.9349 -2.8119 -2.8119 -2.6296 -2.6296 -2.5925 -2.5925 -2.5526 -2.5526 -2.5416 -2.5416 -2.2205 -2.2205 -2.0276 -2.0276 -2.0275 -2.0275 -1.8200 -1.8200 -1.5852 -1.5852 -1.2669 -1.2669 -1.0504 -1.0504 -0.8802 -0.8802 -0.8669 -0.8669 -0.5989 -0.5989 -0.5418 -0.5418 -0.4983 -0.4983 -0.4417 -0.4417 -0.4152 -0.4152 -0.3194 -0.3194 -0.2586 -0.2586 -0.2162 -0.2162 -0.0260 -0.0260 -0.0128 -0.0128 0.0711 0.0711 0.0935 0.0935 k = 0.4483-0.2588 0.3660 ( 26290 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9297 -12.9297 -12.3491 -12.3491 -12.3059 -12.3059 -12.3024 -12.3024 -12.2945 -12.2945 -12.1493 -12.1493 -11.5871 -11.5871 -11.5422 -11.5422 -11.5219 -11.5219 -2.9590 -2.9590 -2.9349 -2.9349 -2.8023 -2.8023 -2.6227 -2.6227 -2.5890 -2.5890 -2.5588 -2.5588 -2.5430 -2.5430 -2.2271 -2.2271 -2.0567 -2.0567 -2.0284 -2.0284 -1.8166 -1.8166 -1.5899 -1.5899 -1.2566 -1.2566 -1.0411 -1.0411 -0.8829 -0.8829 -0.8814 -0.8814 -0.5950 -0.5950 -0.5428 -0.5428 -0.4948 -0.4948 -0.4397 -0.4397 -0.4085 -0.4085 -0.3314 -0.3314 -0.2710 -0.2710 -0.2261 -0.2261 -0.0271 -0.0271 -0.0130 -0.0130 0.0706 0.0706 0.1032 0.1032 k = 0.4655-0.2688 0.3801 ( 26294 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9284 -12.9284 -12.3420 -12.3420 -12.3063 -12.3063 -12.3037 -12.3037 -12.3025 -12.3025 -12.1493 -12.1493 -11.5857 -11.5857 -11.5423 -11.5423 -11.5221 -11.5221 -2.9464 -2.9464 -2.9349 -2.9349 -2.7918 -2.7918 -2.6166 -2.6166 -2.5866 -2.5866 -2.5758 -2.5758 -2.5356 -2.5356 -2.2327 -2.2327 -2.0788 -2.0788 -2.0286 -2.0286 -1.8130 -1.8130 -1.5940 -1.5940 -1.2479 -1.2479 -1.0340 -1.0340 -0.8955 -0.8955 -0.8826 -0.8826 -0.5920 -0.5920 -0.5436 -0.5436 -0.4916 -0.4916 -0.4378 -0.4378 -0.4026 -0.4026 -0.3412 -0.3412 -0.2812 -0.2812 -0.2332 -0.2332 -0.0279 -0.0279 -0.0131 -0.0131 0.0701 0.0701 0.1089 0.1089 k = 0.4828-0.2787 0.3942 ( 26294 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9277 -12.9277 -12.3347 -12.3347 -12.3131 -12.3131 -12.3057 -12.3057 -12.3025 -12.3025 -12.1493 -12.1493 -11.5849 -11.5849 -11.5425 -11.5425 -11.5221 -11.5221 -2.9391 -2.9391 -2.9348 -2.9348 -2.7830 -2.7830 -2.6109 -2.6109 -2.5903 -2.5903 -2.5850 -2.5850 -2.5308 -2.5308 -2.2365 -2.2365 -2.0925 -2.0925 -2.0286 -2.0286 -1.8104 -1.8104 -1.5968 -1.5968 -1.2420 -1.2420 -1.0295 -1.0295 -0.9036 -0.9036 -0.8835 -0.8835 -0.5902 -0.5902 -0.5440 -0.5440 -0.4893 -0.4893 -0.4363 -0.4363 -0.3983 -0.3983 -0.3476 -0.3476 -0.2881 -0.2881 -0.2376 -0.2376 -0.0284 -0.0284 -0.0132 -0.0132 0.0698 0.0698 0.1119 0.1119 k = 0.5000-0.2887 0.4082 ( 26238 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9274 -12.9274 -12.3302 -12.3302 -12.3181 -12.3181 -12.3058 -12.3058 -12.3025 -12.3025 -12.1493 -12.1493 -11.5846 -11.5846 -11.5425 -11.5425 -11.5222 -11.5222 -2.9361 -2.9361 -2.9346 -2.9346 -2.7795 -2.7795 -2.6061 -2.6061 -2.5982 -2.5982 -2.5842 -2.5842 -2.5289 -2.5289 -2.2378 -2.2378 -2.0972 -2.0972 -2.0285 -2.0285 -1.8094 -1.8094 -1.5979 -1.5979 -1.2400 -1.2400 -1.0280 -1.0280 -0.9064 -0.9064 -0.8838 -0.8838 -0.5895 -0.5895 -0.5442 -0.5442 -0.4884 -0.4884 -0.4356 -0.4356 -0.3968 -0.3968 -0.3499 -0.3499 -0.2903 -0.2903 -0.2388 -0.2388 -0.0285 -0.0285 -0.0132 -0.0132 0.0698 0.0698 0.1129 0.1129 k = 0.5000-0.2887 0.4082 ( 26238 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9274 -12.9274 -12.3302 -12.3302 -12.3181 -12.3181 -12.3058 -12.3058 -12.3025 -12.3025 -12.1493 -12.1493 -11.5846 -11.5846 -11.5425 -11.5425 -11.5222 -11.5222 -2.9361 -2.9361 -2.9346 -2.9346 -2.7795 -2.7795 -2.6061 -2.6061 -2.5982 -2.5982 -2.5842 -2.5842 -2.5289 -2.5289 -2.2378 -2.2378 -2.0972 -2.0972 -2.0285 -2.0285 -1.8094 -1.8094 -1.5979 -1.5979 -1.2400 -1.2400 -1.0280 -1.0280 -0.9064 -0.9064 -0.8838 -0.8838 -0.5895 -0.5895 -0.5442 -0.5442 -0.4884 -0.4884 -0.4356 -0.4356 -0.3968 -0.3968 -0.3499 -0.3499 -0.2903 -0.2903 -0.2388 -0.2388 -0.0285 -0.0285 -0.0132 -0.0132 0.0698 0.0698 0.1129 0.1129 k = 0.5000-0.2694 0.4219 ( 26298 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9273 -12.9273 -12.3302 -12.3302 -12.3224 -12.3224 -12.3047 -12.3047 -12.2994 -12.2994 -12.1494 -12.1494 -11.5846 -11.5846 -11.5424 -11.5424 -11.5222 -11.5222 -2.9384 -2.9384 -2.9359 -2.9359 -2.7837 -2.7837 -2.6066 -2.6066 -2.5922 -2.5922 -2.5847 -2.5847 -2.5292 -2.5292 -2.2346 -2.2346 -2.0968 -2.0968 -2.0277 -2.0277 -1.8101 -1.8101 -1.5973 -1.5973 -1.2403 -1.2403 -1.0283 -1.0283 -0.9075 -0.9075 -0.8836 -0.8836 -0.5908 -0.5908 -0.5433 -0.5433 -0.4892 -0.4892 -0.4351 -0.4351 -0.3968 -0.3968 -0.3510 -0.3510 -0.2898 -0.2898 -0.2381 -0.2381 -0.0289 -0.0289 -0.0138 -0.0138 0.0689 0.0689 0.1126 0.1126 k = 0.5000-0.2502 0.4355 ( 26288 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9271 -12.9271 -12.3310 -12.3310 -12.3292 -12.3292 -12.3046 -12.3046 -12.2920 -12.2920 -12.1495 -12.1495 -11.5846 -11.5846 -11.5423 -11.5423 -11.5224 -11.5224 -2.9464 -2.9464 -2.9361 -2.9361 -2.7938 -2.7938 -2.6068 -2.6068 -2.5850 -2.5850 -2.5772 -2.5772 -2.5293 -2.5293 -2.2253 -2.2253 -2.0957 -2.0957 -2.0253 -2.0253 -1.8119 -1.8119 -1.5955 -1.5955 -1.2414 -1.2414 -1.0292 -1.0292 -0.9105 -0.9105 -0.8831 -0.8831 -0.5949 -0.5949 -0.5408 -0.5408 -0.4909 -0.4909 -0.4329 -0.4329 -0.3972 -0.3972 -0.3535 -0.3535 -0.2881 -0.2881 -0.2356 -0.2356 -0.0299 -0.0299 -0.0154 -0.0154 0.0665 0.0665 0.1117 0.1117 k = 0.5000-0.2309 0.4491 ( 26280 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9268 -12.9268 -12.3386 -12.3386 -12.3294 -12.3294 -12.3049 -12.3049 -12.2839 -12.2839 -12.1498 -12.1498 -11.5846 -11.5846 -11.5420 -11.5420 -11.5226 -11.5226 -2.9604 -2.9604 -2.9361 -2.9361 -2.8055 -2.8055 -2.6067 -2.6067 -2.5854 -2.5854 -2.5577 -2.5577 -2.5294 -2.5294 -2.2104 -2.2104 -2.0933 -2.0933 -2.0212 -2.0212 -1.8149 -1.8149 -1.5926 -1.5926 -1.2431 -1.2431 -1.0306 -1.0306 -0.9152 -0.9152 -0.8821 -0.8821 -0.6023 -0.6023 -0.5367 -0.5367 -0.4930 -0.4930 -0.4305 -0.4305 -0.3990 -0.3990 -0.3554 -0.3554 -0.2856 -0.2856 -0.2314 -0.2314 -0.0316 -0.0316 -0.0181 -0.0181 0.0627 0.0627 0.1094 0.1094 k = 0.5000-0.2117 0.4627 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9263 -12.9263 -12.3468 -12.3468 -12.3290 -12.3290 -12.3053 -12.3053 -12.2758 -12.2758 -12.1501 -12.1501 -11.5846 -11.5846 -11.5416 -11.5416 -11.5230 -11.5230 -2.9789 -2.9789 -2.9360 -2.9360 -2.8157 -2.8157 -2.6066 -2.6066 -2.5861 -2.5861 -2.5377 -2.5377 -2.5295 -2.5295 -2.1914 -2.1914 -2.0886 -2.0886 -2.0149 -2.0149 -1.8188 -1.8188 -1.5887 -1.5887 -1.2457 -1.2457 -1.0325 -1.0325 -0.9212 -0.9212 -0.8808 -0.8808 -0.6129 -0.6129 -0.5312 -0.5312 -0.4961 -0.4961 -0.4288 -0.4288 -0.4026 -0.4026 -0.3545 -0.3545 -0.2825 -0.2825 -0.2258 -0.2258 -0.0340 -0.0340 -0.0216 -0.0216 0.0577 0.0577 0.1049 0.1049 k = 0.5000-0.1925 0.4763 ( 26256 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9257 -12.9257 -12.3547 -12.3547 -12.3284 -12.3284 -12.3059 -12.3059 -12.2679 -12.2679 -12.1506 -12.1506 -11.5845 -11.5845 -11.5411 -11.5411 -11.5235 -11.5235 -3.0008 -3.0008 -2.9361 -2.9361 -2.8236 -2.8236 -2.6064 -2.6064 -2.5870 -2.5870 -2.5298 -2.5298 -2.5191 -2.5191 -2.1717 -2.1717 -2.0800 -2.0800 -2.0059 -2.0059 -1.8233 -1.8233 -1.5839 -1.5839 -1.2491 -1.2491 -1.0349 -1.0349 -0.9280 -0.9280 -0.8792 -0.8792 -0.6266 -0.6266 -0.5248 -0.5248 -0.5022 -0.5022 -0.4280 -0.4280 -0.4061 -0.4061 -0.3506 -0.3506 -0.2790 -0.2790 -0.2188 -0.2188 -0.0372 -0.0372 -0.0258 -0.0258 0.0517 0.0517 0.0969 0.0969 k = 0.5000-0.1732 0.4899 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9250 -12.9250 -12.3623 -12.3623 -12.3277 -12.3277 -12.3067 -12.3067 -12.2604 -12.2604 -12.1511 -12.1511 -11.5845 -11.5845 -11.5405 -11.5405 -11.5240 -11.5240 -3.0243 -3.0243 -2.9361 -2.9361 -2.8294 -2.8294 -2.6063 -2.6063 -2.5881 -2.5881 -2.5301 -2.5301 -2.5030 -2.5030 -2.1554 -2.1554 -2.0659 -2.0659 -1.9927 -1.9927 -1.8279 -1.8279 -1.5782 -1.5782 -1.2535 -1.2535 -1.0375 -1.0375 -0.9352 -0.9352 -0.8774 -0.8774 -0.6427 -0.6427 -0.5179 -0.5179 -0.5139 -0.5139 -0.4278 -0.4278 -0.4062 -0.4062 -0.3447 -0.3447 -0.2753 -0.2753 -0.2109 -0.2109 -0.0412 -0.0412 -0.0301 -0.0301 0.0448 0.0448 0.0845 0.0845 k = 0.5000-0.1540 0.5035 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9243 -12.9243 -12.3694 -12.3694 -12.3269 -12.3269 -12.3075 -12.3075 -12.2534 -12.2534 -12.1517 -12.1517 -11.5845 -11.5845 -11.5398 -11.5398 -11.5247 -11.5247 -3.0480 -3.0480 -2.9362 -2.9362 -2.8334 -2.8334 -2.6061 -2.6061 -2.5894 -2.5894 -2.5304 -2.5304 -2.4895 -2.4895 -2.1450 -2.1450 -2.0481 -2.0481 -1.9736 -1.9736 -1.8318 -1.8318 -1.5719 -1.5719 -1.2588 -1.2588 -1.0405 -1.0405 -0.9424 -0.9424 -0.8757 -0.8757 -0.6604 -0.6604 -0.5322 -0.5322 -0.5103 -0.5103 -0.4284 -0.4284 -0.4016 -0.4016 -0.3377 -0.3377 -0.2713 -0.2713 -0.2021 -0.2021 -0.0461 -0.0461 -0.0344 -0.0344 0.0371 0.0371 0.0680 0.0680 k = 0.5000-0.1347 0.5171 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9235 -12.9235 -12.3758 -12.3758 -12.3260 -12.3260 -12.3085 -12.3085 -12.2469 -12.2469 -12.1524 -12.1524 -11.5845 -11.5845 -11.5390 -11.5390 -11.5254 -11.5254 -3.0706 -3.0706 -2.9362 -2.9362 -2.8364 -2.8364 -2.6058 -2.6058 -2.5907 -2.5907 -2.5307 -2.5307 -2.4784 -2.4784 -2.1394 -2.1394 -2.0308 -2.0308 -1.9492 -1.9492 -1.8326 -1.8326 -1.5651 -1.5651 -1.2650 -1.2650 -1.0435 -1.0435 -0.9493 -0.9493 -0.8746 -0.8746 -0.6788 -0.6788 -0.5550 -0.5550 -0.5027 -0.5027 -0.4298 -0.4298 -0.3929 -0.3929 -0.3305 -0.3305 -0.2669 -0.2669 -0.1929 -0.1929 -0.0519 -0.0519 -0.0384 -0.0384 0.0288 0.0288 0.0487 0.0487 k = 0.5000-0.1155 0.5307 ( 26244 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9228 -12.9228 -12.3817 -12.3817 -12.3249 -12.3249 -12.3096 -12.3096 -12.2410 -12.2410 -12.1532 -12.1532 -11.5844 -11.5844 -11.5382 -11.5382 -11.5262 -11.5262 -3.0913 -3.0913 -2.9362 -2.9362 -2.8385 -2.8385 -2.6054 -2.6054 -2.5919 -2.5919 -2.5309 -2.5309 -2.4694 -2.4694 -2.1367 -2.1367 -2.0160 -2.0160 -1.9257 -1.9257 -1.8256 -1.8256 -1.5579 -1.5579 -1.2721 -1.2721 -1.0468 -1.0468 -0.9556 -0.9556 -0.8749 -0.8749 -0.6967 -0.6967 -0.5802 -0.5802 -0.4951 -0.4951 -0.4317 -0.4317 -0.3821 -0.3821 -0.3233 -0.3233 -0.2620 -0.2620 -0.1835 -0.1835 -0.0583 -0.0583 -0.0422 -0.0422 0.0194 0.0194 0.0293 0.0293 k = 0.5000-0.0962 0.5443 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9221 -12.9221 -12.3867 -12.3867 -12.3239 -12.3239 -12.3107 -12.3107 -12.2359 -12.2359 -12.1539 -12.1539 -11.5844 -11.5844 -11.5373 -11.5373 -11.5271 -11.5271 -3.1096 -3.1096 -2.9363 -2.9363 -2.8400 -2.8400 -2.6049 -2.6049 -2.5931 -2.5931 -2.5311 -2.5311 -2.4622 -2.4622 -2.1356 -2.1356 -2.0031 -2.0031 -1.9127 -1.9127 -1.8055 -1.8055 -1.5504 -1.5504 -1.2801 -1.2801 -1.0502 -1.0502 -0.9612 -0.9612 -0.8774 -0.8774 -0.7122 -0.7122 -0.6058 -0.6058 -0.4876 -0.4876 -0.4341 -0.4341 -0.3707 -0.3707 -0.3165 -0.3165 -0.2566 -0.2566 -0.1743 -0.1743 -0.0648 -0.0648 -0.0460 -0.0460 0.0058 0.0058 0.0148 0.0148 k = 0.5000-0.0770 0.5579 ( 26244 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9215 -12.9215 -12.3910 -12.3910 -12.3227 -12.3227 -12.3119 -12.3119 -12.2315 -12.2315 -12.1546 -12.1546 -11.5844 -11.5844 -11.5363 -11.5363 -11.5280 -11.5280 -3.1249 -3.1249 -2.9364 -2.9364 -2.8410 -2.8410 -2.6046 -2.6046 -2.5944 -2.5944 -2.5314 -2.5314 -2.4565 -2.4565 -2.1353 -2.1353 -1.9913 -1.9913 -1.9110 -1.9110 -1.7750 -1.7750 -1.5428 -1.5428 -1.2885 -1.2885 -1.0538 -1.0538 -0.9659 -0.9659 -0.8829 -0.8829 -0.7234 -0.7234 -0.6303 -0.6303 -0.4804 -0.4804 -0.4371 -0.4371 -0.3600 -0.3600 -0.3104 -0.3104 -0.2508 -0.2508 -0.1660 -0.1660 -0.0712 -0.0712 -0.0506 -0.0506 -0.0094 -0.0094 0.0051 0.0051 k = 0.5000-0.0577 0.5715 ( 26250 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9209 -12.9209 -12.3943 -12.3943 -12.3215 -12.3215 -12.3131 -12.3131 -12.2279 -12.2279 -12.1552 -12.1552 -11.5844 -11.5844 -11.5353 -11.5353 -11.5290 -11.5290 -3.1372 -3.1372 -2.9364 -2.9364 -2.8419 -2.8419 -2.6041 -2.6041 -2.5956 -2.5956 -2.5316 -2.5316 -2.4522 -2.4522 -2.1353 -2.1353 -1.9801 -1.9801 -1.9156 -1.9156 -1.7427 -1.7427 -1.5353 -1.5353 -1.2969 -1.2969 -1.0575 -1.0575 -0.9695 -0.9695 -0.8910 -0.8910 -0.7289 -0.7289 -0.6528 -0.6528 -0.4734 -0.4734 -0.4406 -0.4406 -0.3509 -0.3509 -0.3051 -0.3051 -0.2446 -0.2446 -0.1589 -0.1589 -0.0768 -0.0768 -0.0569 -0.0569 -0.0202 -0.0202 -0.0033 -0.0033 k = 0.5000-0.0385 0.5852 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9206 -12.9206 -12.3968 -12.3968 -12.3203 -12.3203 -12.3143 -12.3143 -12.2254 -12.2254 -12.1557 -12.1557 -11.5844 -11.5844 -11.5343 -11.5343 -11.5300 -11.5300 -3.1460 -3.1460 -2.9363 -2.9363 -2.8423 -2.8423 -2.6036 -2.6036 -2.5965 -2.5965 -2.5317 -2.5317 -2.4492 -2.4492 -2.1355 -2.1355 -1.9695 -1.9695 -1.9229 -1.9229 -1.7154 -1.7154 -1.5284 -1.5284 -1.3046 -1.3046 -1.0610 -1.0610 -0.9721 -0.9721 -0.8996 -0.8996 -0.7285 -0.7285 -0.6723 -0.6723 -0.4670 -0.4670 -0.4444 -0.4444 -0.3442 -0.3442 -0.3011 -0.3011 -0.2387 -0.2387 -0.1538 -0.1538 -0.0808 -0.0808 -0.0647 -0.0647 -0.0251 -0.0251 -0.0108 -0.0108 k = 0.5000-0.0192 0.5988 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9203 -12.9203 -12.3983 -12.3983 -12.3192 -12.3192 -12.3154 -12.3154 -12.2238 -12.2238 -12.1560 -12.1560 -11.5844 -11.5844 -11.5332 -11.5332 -11.5311 -11.5311 -3.1514 -3.1514 -2.9363 -2.9363 -2.8427 -2.8427 -2.6032 -2.6032 -2.5972 -2.5972 -2.5318 -2.5318 -2.4474 -2.4474 -2.1357 -2.1357 -1.9601 -1.9601 -1.9307 -1.9307 -1.6973 -1.6973 -1.5233 -1.5233 -1.3102 -1.3102 -1.0635 -1.0635 -0.9736 -0.9736 -0.9062 -0.9062 -0.7241 -0.7241 -0.6878 -0.6878 -0.4613 -0.4613 -0.4485 -0.4485 -0.3401 -0.3401 -0.2985 -0.2985 -0.2343 -0.2343 -0.1509 -0.1509 -0.0825 -0.0825 -0.0716 -0.0716 -0.0255 -0.0255 -0.0172 -0.0172 k = 0.5000 0.0000 0.6124 ( 26204 PWs) bands (ev): -92.9984 -92.9984 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9202 -12.9202 -12.3988 -12.3988 -12.3187 -12.3187 -12.3159 -12.3159 -12.2232 -12.2232 -12.1561 -12.1561 -11.5844 -11.5844 -11.5322 -11.5322 -11.5321 -11.5321 -3.1531 -3.1531 -2.9361 -2.9361 -2.8427 -2.8427 -2.6029 -2.6029 -2.5972 -2.5972 -2.5317 -2.5317 -2.4468 -2.4468 -2.1357 -2.1357 -1.9553 -1.9553 -1.9350 -1.9350 -1.6910 -1.6910 -1.5214 -1.5214 -1.3123 -1.3123 -1.0644 -1.0644 -0.9740 -0.9740 -0.9087 -0.9087 -0.7205 -0.7205 -0.6949 -0.6949 -0.4582 -0.4582 -0.4510 -0.4510 -0.3386 -0.3386 -0.2974 -0.2974 -0.2325 -0.2325 -0.1499 -0.1499 -0.0824 -0.0824 -0.0748 -0.0748 -0.0238 -0.0238 -0.0210 -0.0210 k = 0.5000 0.0000 0.6124 ( 26204 PWs) bands (ev): -92.9984 -92.9984 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9202 -12.9202 -12.3988 -12.3988 -12.3187 -12.3187 -12.3159 -12.3159 -12.2232 -12.2232 -12.1561 -12.1561 -11.5844 -11.5844 -11.5322 -11.5322 -11.5321 -11.5321 -3.1531 -3.1531 -2.9361 -2.9361 -2.8427 -2.8427 -2.6029 -2.6029 -2.5972 -2.5972 -2.5317 -2.5317 -2.4468 -2.4468 -2.1357 -2.1357 -1.9553 -1.9553 -1.9350 -1.9350 -1.6910 -1.6910 -1.5214 -1.5214 -1.3123 -1.3123 -1.0644 -1.0644 -0.9740 -0.9740 -0.9087 -0.9087 -0.7205 -0.7205 -0.6949 -0.6949 -0.4582 -0.4582 -0.4510 -0.4510 -0.3386 -0.3386 -0.2974 -0.2974 -0.2325 -0.2325 -0.1499 -0.1499 -0.0824 -0.0824 -0.0748 -0.0748 -0.0238 -0.0238 -0.0210 -0.0210 k = 0.4886 0.0197 0.6124 ( 26252 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9203 -12.9203 -12.3988 -12.3988 -12.3189 -12.3189 -12.3155 -12.3155 -12.2233 -12.2233 -12.1561 -12.1561 -11.5844 -11.5844 -11.5328 -11.5328 -11.5314 -11.5314 -3.1525 -3.1525 -2.9371 -2.9371 -2.8441 -2.8441 -2.6035 -2.6035 -2.5972 -2.5972 -2.5321 -2.5321 -2.4450 -2.4450 -2.1345 -2.1345 -1.9578 -1.9578 -1.9328 -1.9328 -1.6938 -1.6938 -1.5224 -1.5224 -1.3111 -1.3111 -1.0641 -1.0641 -0.9748 -0.9748 -0.9075 -0.9075 -0.7225 -0.7225 -0.6904 -0.6904 -0.4599 -0.4599 -0.4498 -0.4498 -0.3394 -0.3394 -0.2984 -0.2984 -0.2331 -0.2331 -0.1505 -0.1505 -0.0827 -0.0827 -0.0736 -0.0736 -0.0253 -0.0253 -0.0179 -0.0179 k = 0.4773 0.0394 0.6124 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9205 -12.9205 -12.3990 -12.3990 -12.3194 -12.3194 -12.3142 -12.3142 -12.2237 -12.2237 -12.1560 -12.1560 -11.5846 -11.5846 -11.5335 -11.5335 -11.5307 -11.5307 -3.1502 -3.1502 -2.9395 -2.9395 -2.8478 -2.8478 -2.6042 -2.6042 -2.5967 -2.5967 -2.5325 -2.5325 -2.4397 -2.4397 -2.1310 -2.1310 -1.9634 -1.9634 -1.9278 -1.9278 -1.7021 -1.7021 -1.5251 -1.5251 -1.3076 -1.3076 -1.0630 -1.0630 -0.9775 -0.9775 -0.9038 -0.9038 -0.7255 -0.7255 -0.6797 -0.6797 -0.4632 -0.4632 -0.4476 -0.4476 -0.3416 -0.3416 -0.3005 -0.3005 -0.2345 -0.2345 -0.1520 -0.1520 -0.0834 -0.0834 -0.0703 -0.0703 -0.0264 -0.0264 -0.0116 -0.0116 k = 0.4659 0.0590 0.6124 ( 26232 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9207 -12.9207 -12.3994 -12.3994 -12.3201 -12.3201 -12.3124 -12.3124 -12.2242 -12.2242 -12.1558 -12.1558 -11.5850 -11.5850 -11.5340 -11.5340 -11.5301 -11.5301 -3.1463 -3.1463 -2.9436 -2.9436 -2.8532 -2.8532 -2.6054 -2.6054 -2.5961 -2.5961 -2.5331 -2.5331 -2.4313 -2.4313 -2.1253 -2.1253 -1.9701 -1.9701 -1.9223 -1.9223 -1.7155 -1.7155 -1.5287 -1.5287 -1.3027 -1.3027 -1.0609 -1.0609 -0.9824 -0.9824 -0.8979 -0.8979 -0.7266 -0.7266 -0.6658 -0.6658 -0.4670 -0.4670 -0.4459 -0.4459 -0.3449 -0.3449 -0.3039 -0.3039 -0.2364 -0.2364 -0.1548 -0.1548 -0.0841 -0.0841 -0.0662 -0.0662 -0.0259 -0.0259 -0.0035 -0.0035 k = 0.4545 0.0787 0.6124 ( 26224 PWs) bands (ev): -92.9985 -92.9985 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9210 -12.9210 -12.3998 -12.3998 -12.3208 -12.3208 -12.3103 -12.3103 -12.2248 -12.2248 -12.1555 -12.1555 -11.5853 -11.5853 -11.5345 -11.5345 -11.5295 -11.5295 -3.1409 -3.1409 -2.9499 -2.9499 -2.8593 -2.8593 -2.6067 -2.6067 -2.5956 -2.5956 -2.5338 -2.5338 -2.4206 -2.4206 -2.1176 -2.1176 -1.9769 -1.9769 -1.9170 -1.9170 -1.7331 -1.7331 -1.5325 -1.5325 -1.2971 -1.2971 -1.0582 -1.0582 -0.9891 -0.9891 -0.8907 -0.8907 -0.7253 -0.7253 -0.6499 -0.6499 -0.4710 -0.4710 -0.4448 -0.4448 -0.3493 -0.3493 -0.3083 -0.3083 -0.2387 -0.2387 -0.1589 -0.1589 -0.0846 -0.0846 -0.0623 -0.0623 -0.0229 -0.0229 0.0057 0.0057 k = 0.4432 0.0984 0.6124 ( 26236 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9214 -12.9214 -12.4003 -12.4003 -12.3214 -12.3214 -12.3080 -12.3080 -12.2256 -12.2256 -12.1553 -12.1553 -11.5857 -11.5857 -11.5349 -11.5349 -11.5289 -11.5289 -3.1343 -3.1343 -2.9584 -2.9584 -2.8653 -2.8653 -2.6081 -2.6081 -2.5952 -2.5952 -2.5346 -2.5346 -2.4086 -2.4086 -2.1079 -2.1079 -1.9834 -1.9834 -1.9126 -1.9126 -1.7539 -1.7539 -1.5360 -1.5360 -1.2913 -1.2913 -1.0551 -1.0551 -0.9966 -0.9966 -0.8833 -0.8833 -0.7215 -0.7215 -0.6327 -0.6327 -0.4749 -0.4749 -0.4447 -0.4447 -0.3545 -0.3545 -0.3135 -0.3135 -0.2411 -0.2411 -0.1639 -0.1639 -0.0850 -0.0850 -0.0596 -0.0596 -0.0173 -0.0173 0.0157 0.0157 k = 0.4318 0.1181 0.6124 ( 26232 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9217 -12.9217 -12.4007 -12.4007 -12.3219 -12.3219 -12.3058 -12.3058 -12.2265 -12.2265 -12.1550 -12.1550 -11.5862 -11.5862 -11.5352 -11.5352 -11.5284 -11.5284 -3.1264 -3.1264 -2.9688 -2.9688 -2.8703 -2.8703 -2.6094 -2.6094 -2.5947 -2.5947 -2.5352 -2.5352 -2.3963 -2.3963 -2.0962 -2.0962 -1.9893 -1.9893 -1.9097 -1.9097 -1.7761 -1.7761 -1.5389 -1.5389 -1.2859 -1.2859 -1.0523 -1.0523 -1.0039 -1.0039 -0.8766 -0.8766 -0.7157 -0.7157 -0.6148 -0.6148 -0.4786 -0.4786 -0.4454 -0.4454 -0.3599 -0.3599 -0.3191 -0.3191 -0.2434 -0.2434 -0.1694 -0.1694 -0.0851 -0.0851 -0.0580 -0.0580 -0.0098 -0.0098 0.0261 0.0261 k = 0.4205 0.1378 0.6124 ( 26237 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9220 -12.9220 -12.4012 -12.4012 -12.3224 -12.3224 -12.3037 -12.3037 -12.2274 -12.2274 -12.1548 -12.1548 -11.5866 -11.5866 -11.5355 -11.5355 -11.5280 -11.5280 -3.1176 -3.1176 -2.9807 -2.9807 -2.8743 -2.8743 -2.6106 -2.6106 -2.5944 -2.5944 -2.5358 -2.5358 -2.3847 -2.3847 -2.0828 -2.0828 -1.9946 -1.9946 -1.9091 -1.9091 -1.7978 -1.7978 -1.5413 -1.5413 -1.2811 -1.2811 -1.0500 -1.0500 -1.0104 -1.0104 -0.8709 -0.8709 -0.7089 -0.7089 -0.5972 -0.5972 -0.4821 -0.4821 -0.4469 -0.4469 -0.3653 -0.3653 -0.3248 -0.3248 -0.2456 -0.2456 -0.1748 -0.1748 -0.0851 -0.0851 -0.0573 -0.0573 -0.0015 -0.0015 0.0368 0.0368 k = 0.4091 0.1575 0.6124 ( 26243 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9223 -12.9223 -12.4016 -12.4016 -12.3227 -12.3227 -12.3019 -12.3019 -12.2281 -12.2281 -12.1546 -12.1546 -11.5869 -11.5869 -11.5357 -11.5357 -11.5277 -11.5277 -3.1083 -3.1083 -2.9930 -2.9930 -2.8772 -2.8772 -2.6117 -2.6117 -2.5942 -2.5942 -2.5363 -2.5363 -2.3748 -2.3748 -2.0680 -2.0680 -1.9992 -1.9992 -1.9115 -1.9115 -1.8166 -1.8166 -1.5431 -1.5431 -1.2772 -1.2772 -1.0487 -1.0487 -1.0153 -1.0153 -0.8666 -0.8666 -0.7020 -0.7020 -0.5809 -0.5809 -0.4850 -0.4850 -0.4487 -0.4487 -0.3704 -0.3704 -0.3303 -0.3303 -0.2475 -0.2475 -0.1796 -0.1796 -0.0849 -0.0849 -0.0570 -0.0570 0.0061 0.0061 0.0478 0.0478 k = 0.3977 0.1771 0.6124 ( 26245 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9224 -12.9224 -12.4019 -12.4019 -12.3230 -12.3230 -12.3005 -12.3005 -12.2288 -12.2288 -12.1544 -12.1544 -11.5871 -11.5871 -11.5358 -11.5358 -11.5274 -11.5274 -3.0994 -3.0994 -3.0045 -3.0045 -2.8791 -2.8791 -2.6125 -2.6125 -2.5941 -2.5941 -2.5366 -2.5366 -2.3673 -2.3673 -2.0531 -2.0531 -2.0034 -2.0034 -1.9172 -1.9172 -1.8302 -1.8302 -1.5443 -1.5443 -1.2743 -1.2743 -1.0484 -1.0484 -1.0184 -1.0184 -0.8636 -0.8636 -0.6960 -0.6960 -0.5673 -0.5673 -0.4874 -0.4874 -0.4505 -0.4505 -0.3748 -0.3748 -0.3348 -0.3348 -0.2490 -0.2490 -0.1833 -0.1833 -0.0847 -0.0847 -0.0569 -0.0569 0.0122 0.0122 0.0587 0.0587 k = 0.3864 0.1968 0.6124 ( 26234 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4020 -12.4020 -12.3231 -12.3231 -12.2996 -12.2996 -12.2292 -12.2292 -12.1543 -12.1543 -11.5873 -11.5873 -11.5359 -11.5359 -11.5273 -11.5273 -3.0924 -3.0924 -3.0131 -3.0131 -2.8802 -2.8802 -2.6129 -2.6129 -2.5939 -2.5939 -2.5368 -2.5368 -2.3625 -2.3625 -2.0403 -2.0403 -2.0071 -2.0071 -1.9238 -1.9238 -1.8379 -1.8379 -1.5451 -1.5451 -1.2725 -1.2725 -1.0486 -1.0486 -1.0199 -1.0199 -0.8618 -0.8618 -0.6920 -0.6920 -0.5583 -0.5583 -0.4889 -0.4889 -0.4518 -0.4518 -0.3780 -0.3780 -0.3378 -0.3378 -0.2498 -0.2498 -0.1856 -0.1856 -0.0846 -0.0846 -0.0568 -0.0568 0.0161 0.0161 0.0683 0.0683 k = 0.3750 0.2165 0.6124 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.3750 0.2165 0.6124 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.3629 0.2095 0.5926 ( 26220 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9225 -12.9225 -12.4088 -12.4088 -12.3220 -12.3220 -12.2985 -12.2985 -12.2230 -12.2230 -12.1550 -12.1550 -11.5884 -11.5884 -11.5347 -11.5347 -11.5281 -11.5281 -3.1075 -3.1075 -3.0291 -3.0291 -2.8832 -2.8832 -2.6153 -2.6153 -2.5956 -2.5956 -2.5397 -2.5397 -2.3469 -2.3469 -2.0213 -2.0213 -1.9819 -1.9819 -1.9109 -1.9109 -1.8304 -1.8304 -1.5389 -1.5389 -1.2752 -1.2752 -1.0526 -1.0526 -1.0335 -1.0335 -0.8725 -0.8725 -0.6897 -0.6897 -0.5743 -0.5743 -0.4832 -0.4832 -0.4553 -0.4553 -0.3778 -0.3778 -0.3313 -0.3313 -0.2443 -0.2443 -0.1813 -0.1813 -0.0965 -0.0965 -0.0582 -0.0582 0.0055 0.0055 0.0647 0.0647 k = 0.3508 0.2025 0.5729 ( 26212 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9227 -12.9227 -12.4147 -12.4147 -12.3207 -12.3207 -12.2977 -12.2977 -12.2170 -12.2170 -12.1558 -12.1558 -11.5897 -11.5897 -11.5335 -11.5335 -11.5289 -11.5289 -3.1241 -3.1241 -3.0410 -3.0410 -2.8851 -2.8851 -2.6181 -2.6181 -2.5975 -2.5975 -2.5433 -2.5433 -2.3367 -2.3367 -2.0107 -2.0107 -1.9547 -1.9547 -1.8977 -1.8977 -1.8122 -1.8122 -1.5340 -1.5340 -1.2773 -1.2773 -1.0618 -1.0618 -1.0402 -1.0402 -0.8873 -0.8873 -0.6841 -0.6841 -0.5951 -0.5951 -0.4776 -0.4776 -0.4567 -0.4567 -0.3773 -0.3773 -0.3245 -0.3245 -0.2394 -0.2394 -0.1761 -0.1761 -0.1083 -0.1083 -0.0578 -0.0578 -0.0091 -0.0091 0.0585 0.0585 k = 0.3387 0.1956 0.5531 ( 26237 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9232 -12.9232 -12.4197 -12.4197 -12.3194 -12.3194 -12.2969 -12.2969 -12.2113 -12.2113 -12.1566 -12.1566 -11.5911 -11.5911 -11.5323 -11.5323 -11.5297 -11.5297 -3.1391 -3.1391 -3.0520 -3.0520 -2.8867 -2.8867 -2.6214 -2.6214 -2.6000 -2.6000 -2.5481 -2.5481 -2.3298 -2.3298 -2.0026 -2.0026 -1.9356 -1.9356 -1.8781 -1.8781 -1.7893 -1.7893 -1.5314 -1.5314 -1.2780 -1.2780 -1.0760 -1.0760 -1.0403 -1.0403 -0.9032 -0.9032 -0.6771 -0.6771 -0.6149 -0.6149 -0.4725 -0.4725 -0.4571 -0.4571 -0.3778 -0.3778 -0.3191 -0.3191 -0.2366 -0.2366 -0.1704 -0.1704 -0.1194 -0.1194 -0.0560 -0.0560 -0.0245 -0.0245 0.0546 0.0546 k = 0.3266 0.1886 0.5334 ( 26235 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9242 -12.9242 -12.4238 -12.4238 -12.3181 -12.3181 -12.2962 -12.2962 -12.2059 -12.2059 -12.1573 -12.1573 -11.5928 -11.5928 -11.5311 -11.5311 -11.5305 -11.5305 -3.1525 -3.1525 -3.0618 -3.0618 -2.8877 -2.8877 -2.6250 -2.6250 -2.6027 -2.6027 -2.5537 -2.5537 -2.3258 -2.3258 -1.9966 -1.9966 -1.9285 -1.9285 -1.8460 -1.8460 -1.7658 -1.7658 -1.5316 -1.5316 -1.2768 -1.2768 -1.0918 -1.0918 -1.0366 -1.0366 -0.9178 -0.9178 -0.6748 -0.6748 -0.6277 -0.6277 -0.4681 -0.4681 -0.4569 -0.4569 -0.3792 -0.3792 -0.3144 -0.3144 -0.2367 -0.2367 -0.1638 -0.1638 -0.1291 -0.1291 -0.0541 -0.0541 -0.0376 -0.0376 0.0525 0.0525 k = 0.3145 0.1816 0.5136 ( 26209 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9255 -12.9255 -12.4270 -12.4270 -12.3168 -12.3168 -12.2955 -12.2955 -12.2007 -12.2007 -12.1580 -12.1580 -11.5948 -11.5948 -11.5312 -11.5312 -11.5300 -11.5300 -3.1640 -3.1640 -3.0702 -3.0702 -2.8884 -2.8884 -2.6289 -2.6289 -2.6057 -2.6057 -2.5602 -2.5602 -2.3242 -2.3242 -1.9926 -1.9926 -1.9275 -1.9275 -1.8068 -1.8068 -1.7443 -1.7443 -1.5351 -1.5351 -1.2741 -1.2741 -1.1081 -1.1081 -1.0298 -1.0298 -0.9293 -0.9293 -0.6851 -0.6851 -0.6260 -0.6260 -0.4643 -0.4643 -0.4564 -0.4564 -0.3815 -0.3815 -0.3105 -0.3105 -0.2406 -0.2406 -0.1566 -0.1566 -0.1367 -0.1367 -0.0570 -0.0570 -0.0417 -0.0417 0.0518 0.0518 k = 0.3024 0.1746 0.4938 ( 26239 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9274 -12.9274 -12.4291 -12.4291 -12.3155 -12.3155 -12.2949 -12.2949 -12.1958 -12.1958 -12.1585 -12.1585 -11.5970 -11.5970 -11.5319 -11.5319 -11.5289 -11.5289 -3.1738 -3.1738 -3.0774 -3.0774 -2.8890 -2.8890 -2.6333 -2.6333 -2.6094 -2.6094 -2.5680 -2.5680 -2.3247 -2.3247 -1.9905 -1.9905 -1.9284 -1.9284 -1.7660 -1.7660 -1.7255 -1.7255 -1.5422 -1.5422 -1.2699 -1.2699 -1.1245 -1.1245 -1.0202 -1.0202 -0.9361 -0.9361 -0.7024 -0.7024 -0.6155 -0.6155 -0.4613 -0.4613 -0.4558 -0.4558 -0.3846 -0.3846 -0.3075 -0.3075 -0.2490 -0.2490 -0.1498 -0.1498 -0.1406 -0.1406 -0.0629 -0.0629 -0.0380 -0.0380 0.0522 0.0522 k = 0.2903 0.1676 0.4741 ( 26231 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9298 -12.9298 -12.4300 -12.4300 -12.3142 -12.3142 -12.2944 -12.2944 -12.1912 -12.1912 -12.1590 -12.1590 -11.5994 -11.5994 -11.5325 -11.5325 -11.5279 -11.5279 -3.1815 -3.1815 -3.0829 -3.0829 -2.8891 -2.8891 -2.6380 -2.6380 -2.6133 -2.6133 -2.5766 -2.5766 -2.3270 -2.3270 -1.9903 -1.9903 -1.9295 -1.9295 -1.7335 -1.7335 -1.7028 -1.7028 -1.5529 -1.5529 -1.2643 -1.2643 -1.1404 -1.1404 -1.0088 -1.0088 -0.9367 -0.9367 -0.7198 -0.7198 -0.6027 -0.6027 -0.4593 -0.4593 -0.4552 -0.4552 -0.3886 -0.3886 -0.3056 -0.3056 -0.2600 -0.2600 -0.1471 -0.1471 -0.1374 -0.1374 -0.0657 -0.0657 -0.0324 -0.0324 0.0534 0.0534 k = 0.2782 0.1606 0.4543 ( 26227 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9327 -12.9327 -12.4299 -12.4299 -12.3129 -12.3129 -12.2939 -12.2939 -12.1869 -12.1869 -12.1594 -12.1594 -11.6021 -11.6021 -11.5331 -11.5331 -11.5270 -11.5270 -3.1874 -3.1874 -3.0870 -3.0870 -2.8890 -2.8890 -2.6430 -2.6430 -2.6177 -2.6177 -2.5861 -2.5861 -2.3311 -2.3311 -1.9922 -1.9922 -1.9302 -1.9302 -1.7224 -1.7224 -1.6648 -1.6648 -1.5667 -1.5667 -1.2571 -1.2571 -1.1553 -1.1553 -0.9976 -0.9976 -0.9301 -0.9301 -0.7344 -0.7344 -0.5898 -0.5898 -0.4584 -0.4584 -0.4546 -0.4546 -0.3933 -0.3933 -0.3077 -0.3077 -0.2692 -0.2692 -0.1462 -0.1462 -0.1296 -0.1296 -0.0645 -0.0645 -0.0264 -0.0264 0.0555 0.0555 k = 0.2661 0.1536 0.4346 ( 26225 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9360 -12.9360 -12.4287 -12.4287 -12.3117 -12.3117 -12.2936 -12.2936 -12.1828 -12.1828 -12.1597 -12.1597 -11.6051 -11.6051 -11.5335 -11.5335 -11.5261 -11.5261 -3.1913 -3.1913 -3.0895 -3.0895 -2.8888 -2.8888 -2.6485 -2.6485 -2.6224 -2.6224 -2.5962 -2.5962 -2.3369 -2.3369 -1.9962 -1.9962 -1.9301 -1.9301 -1.7235 -1.7235 -1.6234 -1.6234 -1.5819 -1.5819 -1.2481 -1.2481 -1.1688 -1.1688 -0.9878 -0.9878 -0.9167 -0.9167 -0.7444 -0.7444 -0.5777 -0.5777 -0.4586 -0.4586 -0.4540 -0.4540 -0.3990 -0.3990 -0.3169 -0.3169 -0.2709 -0.2709 -0.1440 -0.1440 -0.1205 -0.1205 -0.0604 -0.0604 -0.0205 -0.0205 0.0584 0.0584 k = 0.2540 0.1467 0.4148 ( 26233 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9399 -12.9399 -12.4264 -12.4264 -12.3105 -12.3105 -12.2933 -12.2933 -12.1791 -12.1791 -12.1599 -12.1599 -11.6084 -11.6084 -11.5339 -11.5339 -11.5254 -11.5254 -3.1932 -3.1932 -3.0905 -3.0905 -2.8884 -2.8884 -2.6545 -2.6545 -2.6276 -2.6276 -2.6069 -2.6069 -2.3445 -2.3445 -2.0025 -2.0025 -1.9290 -1.9290 -1.7323 -1.7323 -1.6095 -1.6095 -1.5720 -1.5720 -1.2368 -1.2368 -1.1808 -1.1808 -0.9790 -0.9790 -0.9004 -0.9004 -0.7475 -0.7475 -0.5668 -0.5668 -0.4594 -0.4594 -0.4539 -0.4539 -0.4067 -0.4067 -0.3297 -0.3297 -0.2657 -0.2657 -0.1402 -0.1402 -0.1107 -0.1107 -0.0543 -0.0543 -0.0148 -0.0148 0.0621 0.0621 k = 0.2419 0.1397 0.3951 ( 26237 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9441 -12.9441 -12.4230 -12.4230 -12.3094 -12.3094 -12.2932 -12.2932 -12.1756 -12.1756 -12.1599 -12.1599 -11.6119 -11.6119 -11.5341 -11.5341 -11.5246 -11.5246 -3.1932 -3.1932 -3.0898 -3.0898 -2.8878 -2.8878 -2.6609 -2.6609 -2.6331 -2.6331 -2.6177 -2.6177 -2.3538 -2.3538 -2.0114 -2.0114 -1.9268 -1.9268 -1.7473 -1.7473 -1.6284 -1.6284 -1.5327 -1.5327 -1.2230 -1.2230 -1.1912 -1.1912 -0.9704 -0.9704 -0.8857 -0.8857 -0.7416 -0.7416 -0.5572 -0.5572 -0.4606 -0.4606 -0.4543 -0.4543 -0.4176 -0.4176 -0.3401 -0.3401 -0.2568 -0.2568 -0.1347 -0.1347 -0.1002 -0.1002 -0.0471 -0.0471 -0.0095 -0.0095 0.0664 0.0664 k = 0.2298 0.1327 0.3753 ( 26243 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9488 -12.9488 -12.4187 -12.4187 -12.3084 -12.3084 -12.2932 -12.2932 -12.1723 -12.1723 -12.1599 -12.1599 -11.6158 -11.6158 -11.5343 -11.5343 -11.5239 -11.5239 -3.1913 -3.1913 -3.0876 -3.0876 -2.8871 -2.8871 -2.6678 -2.6678 -2.6389 -2.6389 -2.6285 -2.6285 -2.3649 -2.3649 -2.0229 -2.0229 -1.9238 -1.9238 -1.7676 -1.7676 -1.6500 -1.6500 -1.4939 -1.4939 -1.2070 -1.2070 -1.1997 -1.1997 -0.9614 -0.9614 -0.8759 -0.8759 -0.7263 -0.7263 -0.5483 -0.5483 -0.4621 -0.4621 -0.4554 -0.4554 -0.4318 -0.4318 -0.3452 -0.3452 -0.2457 -0.2457 -0.1276 -0.1276 -0.0891 -0.0891 -0.0394 -0.0394 -0.0048 -0.0048 0.0715 0.0715 k = 0.2177 0.1257 0.3556 ( 26273 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9537 -12.9537 -12.4135 -12.4135 -12.3075 -12.3075 -12.2933 -12.2933 -12.1694 -12.1694 -12.1597 -12.1597 -11.6200 -11.6200 -11.5344 -11.5344 -11.5233 -11.5233 -3.1877 -3.1877 -3.0839 -3.0839 -2.8862 -2.8862 -2.6756 -2.6756 -2.6452 -2.6452 -2.6391 -2.6391 -2.3777 -2.3777 -2.0371 -2.0371 -1.9203 -1.9203 -1.7921 -1.7921 -1.6714 -1.6714 -1.4581 -1.4581 -1.2082 -1.2082 -1.1871 -1.1871 -0.9524 -0.9524 -0.8706 -0.8706 -0.7042 -0.7042 -0.5396 -0.5396 -0.4638 -0.4638 -0.4573 -0.4573 -0.4473 -0.4473 -0.3447 -0.3447 -0.2334 -0.2334 -0.1187 -0.1187 -0.0778 -0.0778 -0.0315 -0.0315 -0.0008 -0.0008 0.0770 0.0770 k = 0.2056 0.1187 0.3358 ( 26275 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9589 -12.9589 -12.4074 -12.4074 -12.3066 -12.3066 -12.2935 -12.2935 -12.1666 -12.1666 -12.1594 -12.1594 -11.6245 -11.6245 -11.5344 -11.5344 -11.5226 -11.5226 -3.1821 -3.1821 -3.0786 -3.0786 -2.8849 -2.8849 -2.6839 -2.6839 -2.6517 -2.6517 -2.6486 -2.6486 -2.3921 -2.3921 -2.0541 -2.0541 -1.9174 -1.9174 -1.8190 -1.8190 -1.6916 -1.6916 -1.4259 -1.4259 -1.2145 -1.2145 -1.1659 -1.1659 -0.9442 -0.9442 -0.8677 -0.8677 -0.6794 -0.6794 -0.5302 -0.5302 -0.4671 -0.4671 -0.4635 -0.4635 -0.4564 -0.4564 -0.3396 -0.3396 -0.2201 -0.2201 -0.1080 -0.1080 -0.0665 -0.0665 -0.0232 -0.0232 0.0027 0.0027 0.0825 0.0825 k = 0.1935 0.1117 0.3161 ( 26267 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9643 -12.9643 -12.4007 -12.4007 -12.3058 -12.3058 -12.2938 -12.2938 -12.1642 -12.1642 -12.1590 -12.1590 -11.6292 -11.6292 -11.5343 -11.5343 -11.5220 -11.5220 -3.1746 -3.1746 -3.0717 -3.0717 -2.8834 -2.8834 -2.6931 -2.6931 -2.6591 -2.6591 -2.6565 -2.6565 -2.4080 -2.4080 -2.0736 -2.0736 -1.9180 -1.9180 -1.8447 -1.8447 -1.7099 -1.7099 -1.3977 -1.3977 -1.2197 -1.2197 -1.1428 -1.1428 -0.9379 -0.9379 -0.8653 -0.8653 -0.6556 -0.6556 -0.5194 -0.5194 -0.4779 -0.4779 -0.4660 -0.4660 -0.4589 -0.4589 -0.3302 -0.3302 -0.2064 -0.2064 -0.0953 -0.0953 -0.0559 -0.0559 -0.0144 -0.0144 0.0056 0.0056 0.0853 0.0854 k = 0.1815 0.1048 0.2963 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9698 -12.9698 -12.3933 -12.3933 -12.3051 -12.3051 -12.2941 -12.2941 -12.1620 -12.1620 -12.1585 -12.1585 -11.6342 -11.6342 -11.5341 -11.5341 -11.5214 -11.5214 -3.1655 -3.1655 -3.0635 -3.0635 -2.8816 -2.8816 -2.7031 -2.7031 -2.6669 -2.6669 -2.6631 -2.6631 -2.4254 -2.4254 -2.0955 -2.0955 -1.9292 -1.9292 -1.8616 -1.8616 -1.7261 -1.7261 -1.3732 -1.3732 -1.2239 -1.2239 -1.1188 -1.1188 -0.9344 -0.9344 -0.8632 -0.8632 -0.6348 -0.6348 -0.5077 -0.5077 -0.4860 -0.4860 -0.4669 -0.4669 -0.4607 -0.4607 -0.3170 -0.3170 -0.1928 -0.1928 -0.0808 -0.0808 -0.0466 -0.0466 -0.0051 -0.0051 0.0084 0.0084 0.0855 0.0855 k = 0.1694 0.0978 0.2766 ( 26271 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9753 -12.9753 -12.3855 -12.3855 -12.3045 -12.3045 -12.2946 -12.2946 -12.1600 -12.1600 -12.1579 -12.1579 -11.6394 -11.6394 -11.5338 -11.5338 -11.5207 -11.5207 -3.1548 -3.1548 -3.0540 -3.0540 -2.8796 -2.8796 -2.7136 -2.7136 -2.6740 -2.6740 -2.6694 -2.6694 -2.4442 -2.4442 -2.1191 -2.1191 -1.9550 -1.9550 -1.8651 -1.8651 -1.7401 -1.7401 -1.3519 -1.3519 -1.2271 -1.2271 -1.0947 -1.0947 -0.9338 -0.9338 -0.8622 -0.8622 -0.6163 -0.6163 -0.5005 -0.5005 -0.4857 -0.4857 -0.4661 -0.4661 -0.4618 -0.4618 -0.3003 -0.3003 -0.1796 -0.1796 -0.0644 -0.0644 -0.0389 -0.0389 0.0033 0.0033 0.0127 0.0127 0.0851 0.0851 k = 0.1573 0.0908 0.2568 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9807 -12.9807 -12.3774 -12.3774 -12.3040 -12.3040 -12.2951 -12.2951 -12.1583 -12.1583 -12.1572 -12.1572 -11.6448 -11.6448 -11.5335 -11.5335 -11.5201 -11.5201 -3.1425 -3.1425 -3.0433 -3.0433 -2.8771 -2.8771 -2.7241 -2.7241 -2.6804 -2.6804 -2.6755 -2.6755 -2.4643 -2.4643 -2.1441 -2.1441 -1.9892 -1.9892 -1.8610 -1.8610 -1.7521 -1.7521 -1.3335 -1.3335 -1.2293 -1.2293 -1.0714 -1.0714 -0.9356 -0.9356 -0.8638 -0.8638 -0.5982 -0.5982 -0.5000 -0.5000 -0.4801 -0.4801 -0.4647 -0.4647 -0.4576 -0.4576 -0.2806 -0.2806 -0.1673 -0.1673 -0.0464 -0.0464 -0.0328 -0.0328 0.0075 0.0075 0.0219 0.0219 0.0848 0.0848 k = 0.1452 0.0838 0.2370 ( 26279 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9860 -12.9860 -12.3690 -12.3690 -12.3035 -12.3035 -12.2956 -12.2956 -12.1568 -12.1568 -12.1565 -12.1565 -11.6503 -11.6503 -11.5331 -11.5331 -11.5194 -11.5194 -3.1287 -3.1287 -3.0317 -3.0317 -2.8742 -2.8742 -2.7347 -2.7347 -2.6862 -2.6862 -2.6814 -2.6814 -2.4855 -2.4855 -2.1697 -2.1697 -2.0267 -2.0267 -1.8540 -1.8540 -1.7623 -1.7623 -1.3173 -1.3173 -1.2308 -1.2308 -1.0497 -1.0497 -0.9389 -0.9389 -0.8691 -0.8691 -0.5785 -0.5785 -0.4995 -0.4995 -0.4784 -0.4784 -0.4652 -0.4652 -0.4447 -0.4447 -0.2590 -0.2590 -0.1558 -0.1558 -0.0290 -0.0290 -0.0270 -0.0270 0.0098 0.0098 0.0335 0.0335 0.0853 0.0853 k = 0.1331 0.0768 0.2173 ( 26267 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9912 -12.9912 -12.3605 -12.3605 -12.3031 -12.3031 -12.2962 -12.2962 -12.1559 -12.1559 -12.1554 -12.1554 -11.6559 -11.6559 -11.5327 -11.5327 -11.5188 -11.5188 -3.1135 -3.1135 -3.0194 -3.0194 -2.8706 -2.8706 -2.7449 -2.7449 -2.6914 -2.6914 -2.6869 -2.6869 -2.5077 -2.5077 -2.1954 -2.1954 -2.0653 -2.0653 -1.8458 -1.8458 -1.7710 -1.7710 -1.3027 -1.3027 -1.2315 -1.2315 -1.0301 -1.0301 -0.9430 -0.9430 -0.8780 -0.8780 -0.5568 -0.5568 -0.4981 -0.4981 -0.4785 -0.4785 -0.4650 -0.4650 -0.4295 -0.4295 -0.2367 -0.2367 -0.1453 -0.1453 -0.0245 -0.0245 -0.0119 -0.0119 0.0131 0.0131 0.0460 0.0460 0.0879 0.0880 k = 0.1210 0.0698 0.1975 ( 26257 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9961 -12.9961 -12.3521 -12.3521 -12.3028 -12.3028 -12.2967 -12.2967 -12.1551 -12.1551 -12.1543 -12.1543 -11.6614 -11.6614 -11.5322 -11.5322 -11.5181 -11.5181 -3.0971 -3.0971 -3.0068 -3.0068 -2.8662 -2.8662 -2.7546 -2.7546 -2.6961 -2.6961 -2.6920 -2.6920 -2.5309 -2.5309 -2.2206 -2.2206 -2.1042 -2.1042 -1.8372 -1.8372 -1.7783 -1.7783 -1.2896 -1.2896 -1.2315 -1.2315 -1.0133 -1.0133 -0.9473 -0.9473 -0.8898 -0.8898 -0.5348 -0.5348 -0.4959 -0.4959 -0.4791 -0.4791 -0.4625 -0.4625 -0.4139 -0.4139 -0.2149 -0.2149 -0.1360 -0.1360 -0.0216 -0.0216 -0.0035 -0.0035 0.0188 0.0188 0.0611 0.0611 0.0938 0.0938 k = 0.1089 0.0629 0.1778 ( 26275 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0007 -13.0007 -12.3439 -12.3439 -12.3026 -12.3026 -12.2972 -12.2972 -12.1544 -12.1544 -12.1534 -12.1534 -11.6668 -11.6668 -11.5318 -11.5318 -11.5175 -11.5175 -3.0797 -3.0797 -2.9944 -2.9944 -2.8609 -2.8609 -2.7639 -2.7639 -2.7004 -2.7004 -2.6967 -2.6967 -2.5549 -2.5549 -2.2448 -2.2448 -2.1425 -2.1425 -1.8287 -1.8287 -1.7844 -1.7844 -1.2776 -1.2776 -1.2310 -1.2310 -1.0004 -1.0004 -0.9509 -0.9509 -0.9030 -0.9030 -0.5161 -0.5161 -0.4936 -0.4936 -0.4797 -0.4797 -0.4549 -0.4549 -0.3985 -0.3985 -0.1944 -0.1944 -0.1279 -0.1279 -0.0193 -0.0193 -0.0013 -0.0013 0.0224 0.0224 0.0815 0.0815 0.1026 0.1026 k = 0.0968 0.0559 0.1580 ( 26297 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0049 -13.0049 -12.3361 -12.3361 -12.3024 -12.3024 -12.2977 -12.2977 -12.1538 -12.1538 -12.1527 -12.1527 -11.6720 -11.6720 -11.5313 -11.5313 -11.5169 -11.5169 -3.0613 -3.0613 -2.9825 -2.9825 -2.8543 -2.8543 -2.7724 -2.7724 -2.7043 -2.7043 -2.7011 -2.7011 -2.5795 -2.5795 -2.2675 -2.2675 -2.1797 -2.1797 -1.8205 -1.8205 -1.7896 -1.7896 -1.2667 -1.2667 -1.2300 -1.2300 -0.9924 -0.9924 -0.9531 -0.9531 -0.9158 -0.9158 -0.5044 -0.5044 -0.4917 -0.4917 -0.4802 -0.4802 -0.4394 -0.4394 -0.3836 -0.3836 -0.1756 -0.1756 -0.1210 -0.1210 -0.0176 -0.0176 -0.0014 -0.0014 0.0218 0.0218 0.1056 0.1056 0.1129 0.1129 k = 0.0847 0.0489 0.1383 ( 26283 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0087 -13.0087 -12.3288 -12.3288 -12.3023 -12.3023 -12.2981 -12.2981 -12.1531 -12.1531 -12.1521 -12.1521 -11.6768 -11.6768 -11.5309 -11.5309 -11.5163 -11.5163 -3.0420 -3.0420 -2.9716 -2.9716 -2.8464 -2.8464 -2.7800 -2.7800 -2.7075 -2.7075 -2.7049 -2.7049 -2.6045 -2.6045 -2.2883 -2.2883 -2.2153 -2.2153 -1.8128 -1.8128 -1.7939 -1.7939 -1.2567 -1.2567 -1.2284 -1.2284 -0.9900 -0.9900 -0.9556 -0.9556 -0.9249 -0.9249 -0.4986 -0.4986 -0.4906 -0.4906 -0.4807 -0.4807 -0.4176 -0.4176 -0.3692 -0.3692 -0.1588 -0.1588 -0.1151 -0.1151 -0.0164 -0.0164 -0.0023 -0.0023 0.0184 0.0184 0.1235 0.1235 0.1296 0.1296 k = 0.0726 0.0419 0.1185 ( 26275 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0121 -13.0121 -12.3221 -12.3221 -12.3022 -12.3022 -12.2985 -12.2985 -12.1525 -12.1525 -12.1516 -12.1516 -11.6813 -11.6813 -11.5305 -11.5305 -11.5158 -11.5158 -3.0224 -3.0224 -2.9620 -2.9620 -2.8372 -2.8372 -2.7867 -2.7867 -2.7103 -2.7103 -2.7082 -2.7082 -2.6295 -2.6295 -2.3068 -2.3068 -2.2487 -2.2487 -1.8059 -1.8059 -1.7974 -1.7974 -1.2475 -1.2475 -1.2266 -1.2266 -0.9916 -0.9916 -0.9627 -0.9627 -0.9266 -0.9266 -0.4956 -0.4956 -0.4903 -0.4903 -0.4812 -0.4812 -0.3938 -0.3938 -0.3557 -0.3557 -0.1440 -0.1440 -0.1104 -0.1104 -0.0156 -0.0156 -0.0035 -0.0035 0.0138 0.0138 0.1335 0.1335 0.1459 0.1459 k = 0.0605 0.0349 0.0988 ( 26255 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -13.0151 -13.0151 -12.3162 -12.3162 -12.3021 -12.3021 -12.2988 -12.2988 -12.1520 -12.1520 -12.1513 -12.1513 -11.6853 -11.6853 -11.5301 -11.5301 -11.5154 -11.5154 -3.0027 -3.0027 -2.9541 -2.9541 -2.8269 -2.8269 -2.7924 -2.7924 -2.7126 -2.7126 -2.7108 -2.7108 -2.6540 -2.6540 -2.3228 -2.3228 -2.2793 -2.2793 -1.8016 -1.8016 -1.7983 -1.7983 -1.2392 -1.2392 -1.2245 -1.2245 -0.9950 -0.9950 -0.9734 -0.9734 -0.9231 -0.9231 -0.4938 -0.4938 -0.4905 -0.4905 -0.4815 -0.4815 -0.3710 -0.3710 -0.3434 -0.3434 -0.1313 -0.1313 -0.1066 -0.1066 -0.0152 -0.0152 -0.0046 -0.0046 0.0088 0.0088 0.1424 0.1424 0.1530 0.1530 k = 0.0484 0.0279 0.0790 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0175 -13.0175 -12.3114 -12.3114 -12.3020 -12.3020 -12.2990 -12.2990 -12.1516 -12.1516 -12.1511 -12.1511 -11.6887 -11.6887 -11.5298 -11.5298 -11.5150 -11.5150 -2.9838 -2.9838 -2.9480 -2.9480 -2.8163 -2.8163 -2.7972 -2.7972 -2.7147 -2.7147 -2.7130 -2.7130 -2.6775 -2.6775 -2.3361 -2.3361 -2.3063 -2.3063 -1.8033 -1.8033 -1.7939 -1.7939 -1.2321 -1.2321 -1.2227 -1.2227 -0.9987 -0.9987 -0.9843 -0.9843 -0.9185 -0.9185 -0.4928 -0.4928 -0.4908 -0.4908 -0.4817 -0.4817 -0.3508 -0.3508 -0.3326 -0.3326 -0.1206 -0.1206 -0.1041 -0.1041 -0.0153 -0.0153 -0.0055 -0.0055 0.0040 0.0040 0.1498 0.1498 0.1570 0.1570 k = 0.0363 0.0210 0.0593 ( 26299 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0195 -13.0195 -12.3078 -12.3078 -12.3015 -12.3015 -12.2991 -12.2991 -12.1512 -12.1512 -12.1509 -12.1509 -11.6915 -11.6915 -11.5295 -11.5295 -11.5147 -11.5147 -2.9664 -2.9664 -2.9434 -2.9434 -2.8061 -2.8061 -2.8006 -2.8006 -2.7170 -2.7170 -2.7145 -2.7145 -2.6985 -2.6985 -2.3466 -2.3466 -2.3288 -2.3288 -1.8050 -1.8050 -1.7898 -1.7898 -1.2263 -1.2263 -1.2209 -1.2209 -1.0022 -1.0022 -0.9938 -0.9938 -0.9143 -0.9143 -0.4922 -0.4922 -0.4911 -0.4911 -0.4818 -0.4818 -0.3342 -0.3342 -0.3237 -0.3237 -0.1122 -0.1122 -0.1023 -0.1023 -0.0158 -0.0158 -0.0060 -0.0060 -0.0003 -0.0003 0.1556 0.1556 0.1598 0.1598 k = 0.0242 0.0140 0.0395 ( 26303 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0208 -13.0208 -12.3057 -12.3057 -12.3007 -12.3007 -12.2992 -12.2992 -12.1510 -12.1510 -12.1508 -12.1508 -11.6935 -11.6935 -11.5294 -11.5294 -11.5144 -11.5144 -2.9517 -2.9517 -2.9403 -2.9403 -2.8041 -2.8041 -2.7959 -2.7959 -2.7232 -2.7232 -2.7154 -2.7154 -2.7122 -2.7122 -2.3542 -2.3542 -2.3459 -2.3459 -1.8063 -1.8063 -1.7869 -1.7869 -1.2220 -1.2220 -1.2195 -1.2195 -1.0049 -1.0049 -1.0011 -1.0011 -0.9110 -0.9110 -0.4918 -0.4918 -0.4914 -0.4914 -0.4818 -0.4818 -0.3218 -0.3218 -0.3171 -0.3171 -0.1060 -0.1060 -0.1013 -0.1013 -0.0163 -0.0163 -0.0063 -0.0063 -0.0036 -0.0036 0.1598 0.1598 0.1617 0.1617 k = 0.0121 0.0070 0.0198 ( 26273 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0217 -13.0217 -12.3049 -12.3049 -12.2997 -12.2997 -12.2993 -12.2993 -12.1508 -12.1508 -12.1508 -12.1508 -11.6947 -11.6947 -11.5292 -11.5292 -11.5143 -11.5143 -2.9413 -2.9413 -2.9384 -2.9384 -2.8055 -2.8055 -2.7889 -2.7889 -2.7343 -2.7343 -2.7157 -2.7157 -2.7152 -2.7152 -2.3587 -2.3587 -2.3566 -2.3566 -1.8070 -1.8070 -1.7850 -1.7850 -1.2192 -1.2192 -1.2186 -1.2186 -1.0066 -1.0066 -1.0057 -1.0057 -0.9090 -0.9090 -0.4917 -0.4917 -0.4916 -0.4916 -0.4818 -0.4818 -0.3142 -0.3142 -0.3130 -0.3130 -0.1022 -0.1022 -0.1006 -0.1006 -0.0167 -0.0167 -0.0065 -0.0065 -0.0058 -0.0058 0.1624 0.1624 0.1629 0.1629 k = 0.0000 0.0000 0.0000 ( 26301 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0220 -13.0220 -12.3047 -12.3047 -12.2993 -12.2993 -12.2993 -12.2993 -12.1508 -12.1508 -12.1508 -12.1508 -11.6951 -11.6951 -11.5292 -11.5292 -11.5142 -11.5142 -2.9380 -2.9380 -2.9380 -2.9380 -2.8061 -2.8061 -2.7860 -2.7860 -2.7393 -2.7393 -2.7159 -2.7159 -2.7159 -2.7159 -2.3602 -2.3602 -2.3602 -2.3602 -1.8073 -1.8073 -1.7844 -1.7844 -1.2183 -1.2183 -1.2183 -1.2183 -1.0072 -1.0072 -1.0072 -1.0072 -0.9084 -0.9084 -0.4916 -0.4916 -0.4916 -0.4916 -0.4818 -0.4818 -0.3116 -0.3116 -0.3116 -0.3116 -0.1009 -0.1009 -0.1005 -0.1005 -0.0169 -0.0169 -0.0065 -0.0065 -0.0065 -0.0065 0.1632 0.1632 0.1632 0.1632 k = 0.0000 0.0000 0.0000 ( 26301 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0220 -13.0220 -12.3047 -12.3047 -12.2993 -12.2993 -12.2993 -12.2993 -12.1508 -12.1508 -12.1508 -12.1508 -11.6951 -11.6951 -11.5292 -11.5292 -11.5142 -11.5142 -2.9380 -2.9380 -2.9380 -2.9380 -2.8061 -2.8061 -2.7860 -2.7860 -2.7393 -2.7393 -2.7159 -2.7159 -2.7159 -2.7159 -2.3602 -2.3602 -2.3602 -2.3602 -1.8073 -1.8073 -1.7844 -1.7844 -1.2183 -1.2183 -1.2183 -1.2183 -1.0072 -1.0072 -1.0072 -1.0072 -0.9084 -0.9084 -0.4916 -0.4916 -0.4916 -0.4916 -0.4818 -0.4818 -0.3116 -0.3116 -0.3116 -0.3116 -0.1009 -0.1009 -0.1005 -0.1005 -0.0169 -0.0169 -0.0065 -0.0065 -0.0065 -0.0065 0.1632 0.1632 0.1632 0.1632 k = 0.0192 0.0111 0.0079 ( 26271 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0217 -13.0217 -12.3048 -12.3048 -12.2997 -12.2997 -12.2993 -12.2993 -12.1508 -12.1508 -12.1508 -12.1508 -11.6947 -11.6947 -11.5292 -11.5292 -11.5143 -11.5143 -2.9409 -2.9409 -2.9385 -2.9385 -2.8055 -2.8055 -2.7888 -2.7888 -2.7345 -2.7345 -2.7157 -2.7157 -2.7153 -2.7153 -2.3583 -2.3583 -2.3573 -2.3573 -1.8070 -1.8070 -1.7849 -1.7849 -1.2190 -1.2190 -1.2187 -1.2187 -1.0067 -1.0067 -1.0057 -1.0057 -0.9090 -0.9090 -0.4916 -0.4916 -0.4916 -0.4916 -0.4818 -0.4818 -0.3140 -0.3140 -0.3129 -0.3129 -0.1021 -0.1021 -0.1006 -0.1006 -0.0167 -0.0167 -0.0065 -0.0065 -0.0058 -0.0058 0.1625 0.1625 0.1629 0.1629 k = 0.0385 0.0222 0.0157 ( 26298 PWs) bands (ev): -92.9989 -92.9989 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0209 -13.0209 -12.3057 -12.3057 -12.3006 -12.3006 -12.2992 -12.2992 -12.1509 -12.1509 -12.1509 -12.1509 -11.6936 -11.6936 -11.5294 -11.5294 -11.5144 -11.5144 -2.9500 -2.9500 -2.9411 -2.9411 -2.8043 -2.8043 -2.7960 -2.7960 -2.7224 -2.7224 -2.7156 -2.7156 -2.7131 -2.7131 -2.3525 -2.3525 -2.3485 -2.3485 -1.8063 -1.8063 -1.7867 -1.7867 -1.2213 -1.2213 -1.2200 -1.2200 -1.0050 -1.0050 -1.0014 -1.0014 -0.9109 -0.9109 -0.4917 -0.4917 -0.4915 -0.4915 -0.4818 -0.4818 -0.3211 -0.3211 -0.3170 -0.3170 -0.1057 -0.1057 -0.1012 -0.1012 -0.0163 -0.0163 -0.0064 -0.0064 -0.0038 -0.0038 0.1600 0.1600 0.1617 0.1617 k = 0.0577 0.0333 0.0236 ( 26307 PWs) bands (ev): -92.9990 -92.9990 -58.6086 -58.6086 -56.8605 -56.8605 -56.8605 -56.8605 -13.0196 -13.0196 -12.3077 -12.3077 -12.3014 -12.3014 -12.2991 -12.2991 -12.1510 -12.1510 -12.1510 -12.1510 -11.6917 -11.6917 -11.5295 -11.5295 -11.5146 -11.5146 -2.9633 -2.9633 -2.9451 -2.9451 -2.8084 -2.8084 -2.8000 -2.8000 -2.7153 -2.7153 -2.7138 -2.7138 -2.7007 -2.7007 -2.3431 -2.3431 -2.3345 -2.3345 -1.8051 -1.8051 -1.7895 -1.7895 -1.2246 -1.2246 -1.2222 -1.2222 -1.0024 -1.0024 -0.9947 -0.9947 -0.9138 -0.9138 -0.4920 -0.4920 -0.4913 -0.4913 -0.4818 -0.4818 -0.3325 -0.3325 -0.3235 -0.3235 -0.1117 -0.1117 -0.1021 -0.1021 -0.0158 -0.0158 -0.0061 -0.0061 -0.0006 -0.0006 0.1562 0.1562 0.1599 0.1599 k = 0.0769 0.0444 0.0314 ( 26271 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0178 -13.0178 -12.3112 -12.3112 -12.3018 -12.3018 -12.2989 -12.2989 -12.1513 -12.1513 -12.1512 -12.1512 -11.6891 -11.6891 -11.5298 -11.5298 -11.5149 -11.5149 -2.9787 -2.9787 -2.9500 -2.9500 -2.8214 -2.8214 -2.7965 -2.7965 -2.7144 -2.7144 -2.7102 -2.7102 -2.6785 -2.6785 -2.3302 -2.3302 -2.3159 -2.3159 -1.8036 -1.8036 -1.7932 -1.7932 -1.2289 -1.2289 -1.2250 -1.2250 -0.9987 -0.9987 -0.9862 -0.9862 -0.9175 -0.9175 -0.4925 -0.4925 -0.4912 -0.4912 -0.4817 -0.4817 -0.3478 -0.3478 -0.3323 -0.3323 -0.1198 -0.1198 -0.1035 -0.1035 -0.0155 -0.0155 -0.0054 -0.0054 0.0032 0.0032 0.1508 0.1508 0.1574 0.1574 k = 0.0962 0.0555 0.0393 ( 26277 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0154 -13.0154 -12.3161 -12.3161 -12.3018 -12.3018 -12.2987 -12.2987 -12.1515 -12.1515 -12.1515 -12.1515 -11.6858 -11.6858 -11.5301 -11.5301 -11.5153 -11.5153 -2.9959 -2.9959 -2.9564 -2.9564 -2.8368 -2.8368 -2.7915 -2.7915 -2.7134 -2.7134 -2.7065 -2.7065 -2.6528 -2.6528 -2.3142 -2.3142 -2.2934 -2.2934 -1.8025 -1.8025 -1.7969 -1.7969 -1.2343 -1.2343 -1.2285 -1.2285 -0.9942 -0.9942 -0.9774 -0.9774 -0.9211 -0.9211 -0.4935 -0.4935 -0.4911 -0.4911 -0.4815 -0.4815 -0.3662 -0.3662 -0.3431 -0.3431 -0.1300 -0.1300 -0.1057 -0.1057 -0.0156 -0.0156 -0.0041 -0.0041 0.0073 0.0073 0.1437 0.1437 0.1541 0.1541 k = 0.1154 0.0666 0.0471 ( 26266 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0126 -13.0126 -12.3220 -12.3220 -12.3016 -12.3016 -12.2984 -12.2984 -12.1519 -12.1519 -12.1518 -12.1518 -11.6820 -11.6820 -11.5304 -11.5304 -11.5158 -11.5158 -3.0136 -3.0136 -2.9636 -2.9636 -2.8536 -2.8536 -2.7854 -2.7854 -2.7118 -2.7118 -2.7021 -2.7021 -2.6249 -2.6249 -2.2953 -2.2953 -2.2676 -2.2676 -1.8059 -1.8059 -1.7966 -1.7966 -1.2404 -1.2404 -1.2325 -1.2325 -0.9890 -0.9890 -0.9702 -0.9702 -0.9228 -0.9228 -0.4954 -0.4954 -0.4911 -0.4911 -0.4811 -0.4811 -0.3869 -0.3869 -0.3556 -0.3556 -0.1422 -0.1422 -0.1085 -0.1085 -0.0161 -0.0161 -0.0022 -0.0022 0.0113 0.0113 0.1350 0.1350 0.1502 0.1502 k = 0.1346 0.0777 0.0550 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0094 -13.0094 -12.3289 -12.3289 -12.3014 -12.3014 -12.2981 -12.2981 -12.1523 -12.1523 -12.1522 -12.1522 -11.6778 -11.6778 -11.5308 -11.5308 -11.5163 -11.5163 -3.0316 -3.0316 -2.9717 -2.9717 -2.8715 -2.8715 -2.7784 -2.7784 -2.7098 -2.7098 -2.6968 -2.6968 -2.5951 -2.5951 -2.2740 -2.2740 -2.2391 -2.2391 -1.8121 -1.8121 -1.7935 -1.7935 -1.2470 -1.2470 -1.2371 -1.2371 -0.9831 -0.9831 -0.9680 -0.9680 -0.9198 -0.9198 -0.4993 -0.4993 -0.4912 -0.4912 -0.4805 -0.4805 -0.4085 -0.4085 -0.3694 -0.3694 -0.1562 -0.1562 -0.1119 -0.1119 -0.0170 -0.0170 0.0001 0.0001 0.0148 0.0148 0.1244 0.1244 0.1455 0.1455 k = 0.1538 0.0888 0.0628 ( 26239 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -13.0057 -13.0057 -12.3365 -12.3365 -12.3011 -12.3011 -12.2978 -12.2978 -12.1527 -12.1527 -12.1526 -12.1526 -11.6732 -11.6732 -11.5312 -11.5312 -11.5168 -11.5168 -3.0494 -3.0494 -2.9804 -2.9804 -2.8899 -2.8899 -2.7705 -2.7705 -2.7074 -2.7074 -2.6905 -2.6905 -2.5640 -2.5640 -2.2504 -2.2504 -2.2085 -2.2085 -1.8194 -1.8194 -1.7895 -1.7895 -1.2542 -1.2542 -1.2420 -1.2420 -0.9768 -0.9768 -0.9718 -0.9718 -0.9112 -0.9112 -0.5070 -0.5070 -0.4915 -0.4915 -0.4796 -0.4796 -0.4287 -0.4287 -0.3841 -0.3841 -0.1720 -0.1720 -0.1159 -0.1159 -0.0182 -0.0182 0.0026 0.0026 0.0172 0.0172 0.1113 0.1113 0.1400 0.1401 k = 0.1731 0.0999 0.0707 ( 26269 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -13.0016 -13.0016 -12.3448 -12.3448 -12.3008 -12.3008 -12.2974 -12.2974 -12.1532 -12.1532 -12.1531 -12.1531 -11.6683 -11.6683 -11.5316 -11.5316 -11.5174 -11.5174 -3.0670 -3.0670 -2.9897 -2.9897 -2.9086 -2.9086 -2.7621 -2.7621 -2.7047 -2.7047 -2.6839 -2.6839 -2.5318 -2.5318 -2.2248 -2.2248 -2.1761 -2.1761 -1.8275 -1.8275 -1.7847 -1.7847 -1.2625 -1.2625 -1.2474 -1.2474 -0.9795 -0.9795 -0.9703 -0.9703 -0.8995 -0.8995 -0.5209 -0.5209 -0.4920 -0.4920 -0.4785 -0.4785 -0.4446 -0.4446 -0.3994 -0.3994 -0.1897 -0.1897 -0.1208 -0.1208 -0.0197 -0.0197 0.0052 0.0052 0.0182 0.0182 0.0934 0.0934 0.1191 0.1191 k = 0.1923 0.1110 0.0785 ( 26263 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9972 -12.9972 -12.3537 -12.3537 -12.3004 -12.3004 -12.2970 -12.2970 -12.1537 -12.1537 -12.1535 -12.1535 -11.6632 -11.6632 -11.5320 -11.5320 -11.5180 -11.5180 -3.0839 -3.0839 -2.9990 -2.9990 -2.9271 -2.9271 -2.7531 -2.7531 -2.7014 -2.7014 -2.6765 -2.6765 -2.4987 -2.4987 -2.1977 -2.1977 -2.1424 -2.1424 -1.8359 -1.8359 -1.7792 -1.7792 -1.2717 -1.2717 -1.2528 -1.2528 -0.9893 -0.9893 -0.9637 -0.9637 -0.8866 -0.8866 -0.5423 -0.5423 -0.4925 -0.4925 -0.4772 -0.4772 -0.4544 -0.4544 -0.4148 -0.4148 -0.2091 -0.2091 -0.1260 -0.1260 -0.0214 -0.0214 0.0076 0.0076 0.0172 0.0172 0.0702 0.0702 0.1028 0.1028 k = 0.2115 0.1221 0.0864 ( 26287 PWs) bands (ev): -92.9989 -92.9989 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9925 -12.9925 -12.3629 -12.3629 -12.2999 -12.2999 -12.2966 -12.2966 -12.1542 -12.1542 -12.1541 -12.1541 -11.6581 -11.6581 -11.5324 -11.5324 -11.5186 -11.5186 -3.1003 -3.1003 -3.0085 -3.0085 -2.9453 -2.9453 -2.7438 -2.7438 -2.6978 -2.6978 -2.6684 -2.6684 -2.4648 -2.4648 -2.1691 -2.1691 -2.1077 -2.1077 -1.8445 -1.8445 -1.7729 -1.7729 -1.2822 -1.2822 -1.2583 -1.2583 -0.9999 -0.9999 -0.9575 -0.9575 -0.8739 -0.8739 -0.5692 -0.5692 -0.4933 -0.4933 -0.4758 -0.4758 -0.4598 -0.4598 -0.4301 -0.4301 -0.2300 -0.2300 -0.1317 -0.1317 -0.0233 -0.0233 0.0095 0.0095 0.0139 0.0139 0.0441 0.0441 0.0889 0.0889 k = 0.2308 0.1332 0.0942 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9875 -12.9875 -12.3725 -12.3725 -12.2995 -12.2995 -12.2961 -12.2961 -12.1548 -12.1548 -12.1546 -12.1546 -11.6529 -11.6529 -11.5328 -11.5328 -11.5192 -11.5192 -3.1159 -3.1159 -3.0177 -3.0177 -2.9629 -2.9629 -2.7343 -2.7343 -2.6939 -2.6939 -2.6593 -2.6593 -2.4304 -2.4304 -2.1394 -2.1394 -2.0725 -2.0725 -1.8531 -1.8531 -1.7660 -1.7660 -1.2942 -1.2942 -1.2637 -1.2637 -1.0107 -1.0107 -0.9520 -0.9520 -0.8620 -0.8620 -0.5991 -0.5991 -0.4941 -0.4941 -0.4742 -0.4742 -0.4626 -0.4626 -0.4449 -0.4449 -0.2523 -0.2523 -0.1376 -0.1376 -0.0252 -0.0252 0.0080 0.0080 0.0103 0.0103 0.0173 0.0173 0.0764 0.0764 k = 0.2500 0.1443 0.1021 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9823 -12.9823 -12.3822 -12.3822 -12.2990 -12.2990 -12.2957 -12.2957 -12.1553 -12.1553 -12.1551 -12.1551 -11.6479 -11.6479 -11.5331 -11.5331 -11.5198 -11.5198 -3.1306 -3.1306 -3.0267 -3.0267 -2.9798 -2.9798 -2.7248 -2.7248 -2.6898 -2.6898 -2.6497 -2.6497 -2.3957 -2.3957 -2.1088 -2.1088 -2.0372 -2.0372 -1.8612 -1.8612 -1.7584 -1.7584 -1.3081 -1.3081 -1.2689 -1.2689 -1.0211 -1.0211 -0.9477 -0.9477 -0.8517 -0.8517 -0.6298 -0.6298 -0.4955 -0.4955 -0.4726 -0.4726 -0.4641 -0.4641 -0.4588 -0.4588 -0.2756 -0.2756 -0.1437 -0.1437 -0.0272 -0.0272 -0.0099 -0.0099 -0.0002 -0.0002 0.0101 0.0101 0.0655 0.0655 k = 0.2692 0.1554 0.1099 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9770 -12.9770 -12.3919 -12.3919 -12.2986 -12.2986 -12.2952 -12.2952 -12.1559 -12.1559 -12.1557 -12.1557 -11.6431 -11.6431 -11.5335 -11.5335 -11.5203 -11.5203 -3.1446 -3.1446 -3.0354 -3.0354 -2.9958 -2.9958 -2.7154 -2.7154 -2.6856 -2.6856 -2.6397 -2.6397 -2.3608 -2.3608 -2.0776 -2.0776 -2.0026 -2.0026 -1.8683 -1.8683 -1.7501 -1.7501 -1.3243 -1.3243 -1.2738 -1.2738 -1.0306 -1.0306 -0.9455 -0.9455 -0.8435 -0.8435 -0.6599 -0.6599 -0.4982 -0.4982 -0.4714 -0.4714 -0.4704 -0.4704 -0.4651 -0.4651 -0.2992 -0.2992 -0.1499 -0.1499 -0.0360 -0.0360 -0.0292 -0.0292 -0.0102 -0.0102 0.0070 0.0070 0.0570 0.0570 k = 0.2885 0.1665 0.1178 ( 26281 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9717 -12.9717 -12.4015 -12.4015 -12.2981 -12.2981 -12.2948 -12.2948 -12.1565 -12.1565 -12.1562 -12.1562 -11.6385 -11.6385 -11.5338 -11.5338 -11.5207 -11.5207 -3.1577 -3.1577 -3.0438 -3.0438 -3.0109 -3.0109 -2.7065 -2.7065 -2.6814 -2.6814 -2.6295 -2.6295 -2.3262 -2.3262 -2.0461 -2.0461 -1.9701 -1.9701 -1.8730 -1.8730 -1.7413 -1.7413 -1.3428 -1.3428 -1.2783 -1.2783 -1.0388 -1.0388 -0.9464 -0.9464 -0.8375 -0.8375 -0.6877 -0.6877 -0.5044 -0.5044 -0.4796 -0.4796 -0.4692 -0.4692 -0.4658 -0.4658 -0.3220 -0.3220 -0.1563 -0.1563 -0.0608 -0.0608 -0.0314 -0.0314 -0.0215 -0.0215 0.0007 0.0007 0.0516 0.0516 k = 0.3077 0.1776 0.1256 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9663 -12.9663 -12.4109 -12.4109 -12.2976 -12.2976 -12.2943 -12.2943 -12.1570 -12.1570 -12.1567 -12.1567 -11.6342 -11.6342 -11.5341 -11.5341 -11.5211 -11.5211 -3.1699 -3.1699 -3.0514 -3.0514 -3.0248 -3.0248 -2.6977 -2.6977 -2.6769 -2.6769 -2.6188 -2.6188 -2.2921 -2.2921 -2.0145 -2.0145 -1.9432 -1.9432 -1.8718 -1.8718 -1.7319 -1.7319 -1.3634 -1.3634 -1.2820 -1.2820 -1.0456 -1.0456 -0.9515 -0.9515 -0.8340 -0.8340 -0.7117 -0.7117 -0.5160 -0.5160 -0.4837 -0.4837 -0.4675 -0.4675 -0.4665 -0.4665 -0.3424 -0.3424 -0.1625 -0.1625 -0.0842 -0.0842 -0.0335 -0.0335 -0.0333 -0.0333 -0.0082 -0.0082 0.0492 0.0492 k = 0.3269 0.1887 0.1335 ( 26257 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9611 -12.9611 -12.4200 -12.4200 -12.2972 -12.2972 -12.2939 -12.2939 -12.1575 -12.1575 -12.1572 -12.1572 -11.6303 -11.6303 -11.5344 -11.5344 -11.5213 -11.5213 -3.1810 -3.1810 -3.0586 -3.0586 -3.0376 -3.0376 -2.6898 -2.6898 -2.6728 -2.6728 -2.6079 -2.6079 -2.2589 -2.2589 -1.9833 -1.9833 -1.9275 -1.9275 -1.8594 -1.8594 -1.7222 -1.7222 -1.3863 -1.3863 -1.2851 -1.2851 -1.0508 -1.0508 -0.9619 -0.9619 -0.8330 -0.8330 -0.7306 -0.7306 -0.5322 -0.5322 -0.4851 -0.4851 -0.4673 -0.4673 -0.4659 -0.4659 -0.3588 -0.3588 -0.1691 -0.1691 -0.1058 -0.1058 -0.0451 -0.0451 -0.0357 -0.0357 -0.0186 -0.0186 0.0486 0.0486 k = 0.3462 0.1999 0.1413 ( 26227 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9560 -12.9560 -12.4286 -12.4286 -12.2968 -12.2968 -12.2935 -12.2935 -12.1580 -12.1580 -12.1577 -12.1577 -11.6268 -11.6268 -11.5346 -11.5346 -11.5214 -11.5214 -3.1911 -3.1911 -3.0650 -3.0650 -3.0492 -3.0492 -2.6823 -2.6823 -2.6686 -2.6686 -2.5972 -2.5972 -2.2272 -2.2272 -1.9528 -1.9528 -1.9224 -1.9224 -1.8361 -1.8361 -1.7122 -1.7122 -1.4111 -1.4111 -1.2872 -1.2872 -1.0544 -1.0544 -0.9779 -0.9779 -0.8341 -0.8341 -0.7436 -0.7436 -0.5517 -0.5517 -0.4857 -0.4857 -0.4682 -0.4682 -0.4644 -0.4644 -0.3699 -0.3699 -0.1765 -0.1765 -0.1250 -0.1250 -0.0565 -0.0565 -0.0383 -0.0383 -0.0289 -0.0289 0.0490 0.0490 k = 0.3654 0.2110 0.1492 ( 26242 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9513 -12.9513 -12.4365 -12.4365 -12.2964 -12.2964 -12.2931 -12.2931 -12.1585 -12.1585 -12.1582 -12.1582 -11.6236 -11.6236 -11.5349 -11.5349 -11.5214 -11.5214 -3.2003 -3.2003 -3.0710 -3.0710 -3.0595 -3.0595 -2.6757 -2.6757 -2.6650 -2.6650 -2.5870 -2.5870 -2.1978 -2.1978 -1.9236 -1.9236 -1.9214 -1.9214 -1.8089 -1.8089 -1.7020 -1.7020 -1.4373 -1.4373 -1.2882 -1.2882 -1.0565 -1.0565 -0.9988 -0.9988 -0.8371 -0.8371 -0.7514 -0.7514 -0.5740 -0.5740 -0.4863 -0.4863 -0.4693 -0.4693 -0.4630 -0.4630 -0.3752 -0.3752 -0.1856 -0.1856 -0.1409 -0.1409 -0.0672 -0.0672 -0.0438 -0.0438 -0.0361 -0.0361 0.0498 0.0498 k = 0.3846 0.2221 0.1570 ( 26230 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9469 -12.9469 -12.4437 -12.4437 -12.2961 -12.2961 -12.2928 -12.2928 -12.1589 -12.1589 -12.1586 -12.1586 -11.6210 -11.6210 -11.5351 -11.5351 -11.5214 -11.5214 -3.2083 -3.2083 -3.0762 -3.0762 -3.0685 -3.0685 -2.6698 -2.6698 -2.6615 -2.6615 -2.5772 -2.5772 -2.1714 -2.1714 -1.9202 -1.9202 -1.8961 -1.8961 -1.7819 -1.7819 -1.6917 -1.6917 -1.4643 -1.4643 -1.2878 -1.2878 -1.0573 -1.0573 -1.0231 -1.0231 -0.8413 -0.8413 -0.7549 -0.7549 -0.5978 -0.5978 -0.4870 -0.4870 -0.4706 -0.4706 -0.4617 -0.4617 -0.3751 -0.3751 -0.1972 -0.1972 -0.1526 -0.1526 -0.0768 -0.0768 -0.0528 -0.0528 -0.0390 -0.0390 0.0509 0.0509 k = 0.4038 0.2332 0.1649 ( 26224 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9429 -12.9429 -12.4500 -12.4500 -12.2957 -12.2957 -12.2925 -12.2925 -12.1593 -12.1593 -12.1589 -12.1589 -11.6187 -11.6187 -11.5353 -11.5353 -11.5212 -11.5212 -3.2151 -3.2151 -3.0806 -3.0806 -3.0762 -3.0762 -2.6647 -2.6647 -2.6586 -2.6586 -2.5684 -2.5684 -2.1488 -2.1488 -1.9172 -1.9172 -1.8710 -1.8710 -1.7573 -1.7573 -1.6814 -1.6814 -1.4915 -1.4915 -1.2861 -1.2861 -1.0570 -1.0570 -1.0490 -1.0490 -0.8462 -0.8462 -0.7556 -0.7556 -0.6215 -0.6215 -0.4880 -0.4880 -0.4719 -0.4719 -0.4606 -0.4606 -0.3706 -0.3706 -0.2113 -0.2113 -0.1603 -0.1603 -0.0852 -0.0852 -0.0619 -0.0619 -0.0407 -0.0407 0.0519 0.0519 k = 0.4231 0.2443 0.1727 ( 26242 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9396 -12.9396 -12.4554 -12.4554 -12.2955 -12.2955 -12.2923 -12.2923 -12.1596 -12.1596 -12.1592 -12.1592 -11.6169 -11.6169 -11.5355 -11.5355 -11.5211 -11.5211 -3.2208 -3.2208 -3.0843 -3.0843 -3.0825 -3.0825 -2.6606 -2.6606 -2.6561 -2.6561 -2.5611 -2.5611 -2.1308 -2.1308 -1.9119 -1.9119 -1.8491 -1.8491 -1.7363 -1.7363 -1.6708 -1.6708 -1.5180 -1.5180 -1.2830 -1.2830 -1.0746 -1.0746 -1.0560 -1.0560 -0.8513 -0.8513 -0.7547 -0.7547 -0.6437 -0.6437 -0.4890 -0.4890 -0.4732 -0.4732 -0.4596 -0.4596 -0.3631 -0.3631 -0.2269 -0.2269 -0.1650 -0.1650 -0.0923 -0.0923 -0.0699 -0.0699 -0.0420 -0.0420 0.0528 0.0528 k = 0.4423 0.2554 0.1806 ( 26263 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9369 -12.9369 -12.4597 -12.4597 -12.2953 -12.2953 -12.2921 -12.2921 -12.1598 -12.1598 -12.1594 -12.1594 -11.6155 -11.6155 -11.5357 -11.5357 -11.5209 -11.5209 -3.2253 -3.2253 -3.0874 -3.0874 -3.0872 -3.0872 -2.6573 -2.6573 -2.6542 -2.6542 -2.5552 -2.5552 -2.1174 -2.1174 -1.9049 -1.9049 -1.8310 -1.8310 -1.7199 -1.7199 -1.6597 -1.6597 -1.5430 -1.5430 -1.2787 -1.2787 -1.0982 -1.0982 -1.0544 -1.0544 -0.8560 -0.8560 -0.7531 -0.7531 -0.6628 -0.6628 -0.4899 -0.4899 -0.4745 -0.4745 -0.4589 -0.4589 -0.3536 -0.3536 -0.2425 -0.2425 -0.1680 -0.1680 -0.0979 -0.0979 -0.0765 -0.0765 -0.0430 -0.0430 0.0535 0.0535 k = 0.4615 0.2665 0.1884 ( 26275 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9349 -12.9349 -12.4628 -12.4628 -12.2951 -12.2951 -12.2919 -12.2919 -12.1600 -12.1600 -12.1596 -12.1596 -11.6145 -11.6145 -11.5358 -11.5358 -11.5208 -11.5208 -3.2285 -3.2285 -3.0909 -3.0909 -3.0893 -3.0893 -2.6551 -2.6551 -2.6528 -2.6528 -2.5506 -2.5506 -2.1085 -2.1085 -1.8976 -1.8976 -1.8174 -1.8174 -1.7086 -1.7086 -1.6483 -1.6483 -1.5651 -1.5651 -1.2738 -1.2738 -1.1177 -1.1177 -1.0528 -1.0528 -0.8599 -0.8599 -0.7516 -0.7516 -0.6775 -0.6775 -0.4906 -0.4906 -0.4754 -0.4754 -0.4583 -0.4583 -0.3434 -0.3434 -0.2567 -0.2567 -0.1698 -0.1698 -0.1019 -0.1019 -0.0814 -0.0814 -0.0437 -0.0437 0.0541 0.0541 k = 0.4808 0.2776 0.1963 ( 26290 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9337 -12.9337 -12.4647 -12.4647 -12.2950 -12.2950 -12.2918 -12.2918 -12.1601 -12.1601 -12.1597 -12.1597 -11.6139 -11.6139 -11.5359 -11.5359 -11.5207 -11.5207 -3.2305 -3.2305 -3.0931 -3.0931 -3.0906 -3.0906 -2.6537 -2.6537 -2.6519 -2.6519 -2.5479 -2.5479 -2.1035 -2.1035 -1.8920 -1.8920 -1.8090 -1.8090 -1.7023 -1.7023 -1.6378 -1.6378 -1.5823 -1.5823 -1.2698 -1.2698 -1.1310 -1.1310 -1.0515 -1.0515 -0.8624 -0.8624 -0.7505 -0.7505 -0.6868 -0.6868 -0.4911 -0.4911 -0.4761 -0.4761 -0.4580 -0.4580 -0.3346 -0.3346 -0.2679 -0.2679 -0.1707 -0.1707 -0.1044 -0.1044 -0.0845 -0.0845 -0.0441 -0.0441 0.0544 0.0544 k = 0.5000 0.2887 0.2041 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9333 -12.9333 -12.4654 -12.4654 -12.2950 -12.2950 -12.2918 -12.2918 -12.1601 -12.1601 -12.1597 -12.1597 -11.6137 -11.6137 -11.5359 -11.5359 -11.5206 -11.5206 -3.2311 -3.2311 -3.0937 -3.0937 -3.0909 -3.0909 -2.6531 -2.6531 -2.6515 -2.6515 -2.5469 -2.5469 -2.1019 -2.1019 -1.8898 -1.8898 -1.8061 -1.8061 -1.7002 -1.7002 -1.6326 -1.6326 -1.5897 -1.5897 -1.2682 -1.2682 -1.1357 -1.1357 -1.0511 -1.0511 -0.8632 -0.8632 -0.7501 -0.7501 -0.6899 -0.6899 -0.4912 -0.4912 -0.4763 -0.4763 -0.4579 -0.4579 -0.3308 -0.3308 -0.2724 -0.2724 -0.1709 -0.1709 -0.1052 -0.1052 -0.0855 -0.0855 -0.0442 -0.0442 0.0545 0.0545 k = 0.5000 0.2887 0.2041 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9333 -12.9333 -12.4654 -12.4654 -12.2950 -12.2950 -12.2918 -12.2918 -12.1601 -12.1601 -12.1597 -12.1597 -11.6137 -11.6137 -11.5359 -11.5359 -11.5206 -11.5206 -3.2311 -3.2311 -3.0937 -3.0937 -3.0909 -3.0909 -2.6531 -2.6531 -2.6515 -2.6515 -2.5469 -2.5469 -2.1019 -2.1019 -1.8898 -1.8898 -1.8061 -1.8061 -1.7002 -1.7002 -1.6326 -1.6326 -1.5897 -1.5897 -1.2682 -1.2682 -1.1357 -1.1357 -1.0511 -1.0511 -0.8632 -0.8632 -0.7501 -0.7501 -0.6899 -0.6899 -0.4912 -0.4912 -0.4763 -0.4763 -0.4579 -0.4579 -0.3308 -0.3308 -0.2724 -0.2724 -0.1709 -0.1709 -0.1052 -0.1052 -0.0855 -0.0855 -0.0442 -0.0442 0.0545 0.0545 k = 0.5069 0.2686 0.2155 ( 26288 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9332 -12.9332 -12.4651 -12.4651 -12.2951 -12.2951 -12.2919 -12.2919 -12.1604 -12.1604 -12.1598 -12.1598 -11.6135 -11.6135 -11.5359 -11.5359 -11.5207 -11.5207 -3.2303 -3.2303 -3.0931 -3.0931 -3.0905 -3.0905 -2.6528 -2.6528 -2.6514 -2.6514 -2.5470 -2.5470 -2.1012 -2.1012 -1.8926 -1.8926 -1.8072 -1.8072 -1.7035 -1.7035 -1.6316 -1.6316 -1.5898 -1.5898 -1.2679 -1.2679 -1.1351 -1.1351 -1.0519 -1.0519 -0.8639 -0.8639 -0.7483 -0.7483 -0.6906 -0.6906 -0.4901 -0.4901 -0.4751 -0.4751 -0.4577 -0.4577 -0.3303 -0.3303 -0.2716 -0.2716 -0.1713 -0.1713 -0.1069 -0.1069 -0.0833 -0.0833 -0.0441 -0.0441 0.0537 0.0537 k = 0.5139 0.2486 0.2268 ( 26262 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9330 -12.9330 -12.4643 -12.4643 -12.2954 -12.2954 -12.2921 -12.2921 -12.1614 -12.1614 -12.1598 -12.1598 -11.6130 -11.6130 -11.5358 -11.5358 -11.5209 -11.5209 -3.2280 -3.2280 -3.0916 -3.0916 -3.0884 -3.0884 -2.6518 -2.6518 -2.6506 -2.6506 -2.5469 -2.5469 -2.0993 -2.0993 -1.9008 -1.9008 -1.8107 -1.8107 -1.7115 -1.7115 -1.6311 -1.6311 -1.5888 -1.5888 -1.2668 -1.2668 -1.1333 -1.1333 -1.0541 -1.0541 -0.8656 -0.8656 -0.7433 -0.7433 -0.6919 -0.6919 -0.4875 -0.4875 -0.4712 -0.4712 -0.4572 -0.4572 -0.3289 -0.3289 -0.2691 -0.2691 -0.1722 -0.1722 -0.1104 -0.1104 -0.0783 -0.0783 -0.0436 -0.0436 0.0516 0.0516 k = 0.5208 0.2285 0.2381 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9326 -12.9326 -12.4630 -12.4630 -12.2958 -12.2958 -12.2925 -12.2925 -12.1632 -12.1632 -12.1597 -12.1597 -11.6122 -11.6122 -11.5357 -11.5357 -11.5211 -11.5211 -3.2244 -3.2244 -3.0900 -3.0900 -3.0842 -3.0842 -2.6505 -2.6505 -2.6491 -2.6491 -2.5469 -2.5469 -2.0961 -2.0961 -1.9146 -1.9146 -1.8167 -1.8167 -1.7210 -1.7210 -1.6354 -1.6354 -1.5849 -1.5849 -1.2654 -1.2654 -1.1305 -1.1305 -1.0571 -1.0571 -0.8686 -0.8686 -0.7365 -0.7365 -0.6924 -0.6924 -0.4850 -0.4850 -0.4645 -0.4645 -0.4561 -0.4561 -0.3263 -0.3263 -0.2653 -0.2653 -0.1735 -0.1735 -0.1140 -0.1140 -0.0728 -0.0728 -0.0422 -0.0422 0.0486 0.0486 k = 0.5278 0.2085 0.2495 ( 26273 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9322 -12.9322 -12.4612 -12.4612 -12.2965 -12.2965 -12.2929 -12.2929 -12.1656 -12.1656 -12.1596 -12.1596 -11.6111 -11.6111 -11.5356 -11.5356 -11.5215 -11.5215 -3.2195 -3.2195 -3.0881 -3.0881 -3.0780 -3.0780 -2.6491 -2.6491 -2.6468 -2.6468 -2.5470 -2.5470 -2.0917 -2.0917 -1.9341 -1.9341 -1.8250 -1.8250 -1.7299 -1.7299 -1.6453 -1.6453 -1.5785 -1.5785 -1.2640 -1.2640 -1.1269 -1.1269 -1.0601 -1.0601 -0.8728 -0.8728 -0.7297 -0.7297 -0.6903 -0.6903 -0.4829 -0.4829 -0.4578 -0.4578 -0.4527 -0.4527 -0.3227 -0.3227 -0.2605 -0.2605 -0.1748 -0.1748 -0.1172 -0.1172 -0.0687 -0.0687 -0.0387 -0.0387 0.0452 0.0452 k = 0.5347 0.1884 0.2608 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9316 -12.9316 -12.4589 -12.4589 -12.2975 -12.2975 -12.2933 -12.2933 -12.1687 -12.1687 -12.1594 -12.1594 -11.6097 -11.6097 -11.5354 -11.5354 -11.5220 -11.5220 -3.2135 -3.2135 -3.0857 -3.0857 -3.0697 -3.0697 -2.6474 -2.6474 -2.6436 -2.6436 -2.5470 -2.5470 -2.0864 -2.0864 -1.9589 -1.9589 -1.8350 -1.8350 -1.7381 -1.7381 -1.6595 -1.6595 -1.5711 -1.5711 -1.2629 -1.2629 -1.1228 -1.1228 -1.0625 -1.0625 -0.8779 -0.8779 -0.7238 -0.7238 -0.6849 -0.6849 -0.4811 -0.4811 -0.4556 -0.4556 -0.4440 -0.4440 -0.3181 -0.3181 -0.2553 -0.2553 -0.1754 -0.1754 -0.1195 -0.1195 -0.0669 -0.0669 -0.0328 -0.0328 0.0416 0.0416 k = 0.5417 0.1684 0.2722 ( 26267 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9309 -12.9309 -12.4562 -12.4562 -12.2988 -12.2988 -12.2937 -12.2937 -12.1723 -12.1723 -12.1591 -12.1591 -11.6080 -11.6080 -11.5352 -11.5352 -11.5226 -11.5226 -3.2064 -3.2064 -3.0830 -3.0830 -3.0594 -3.0594 -2.6454 -2.6454 -2.6400 -2.6400 -2.5469 -2.5469 -2.0803 -2.0803 -1.9881 -1.9881 -1.8460 -1.8460 -1.7462 -1.7462 -1.6763 -1.6763 -1.5638 -1.5638 -1.2624 -1.2624 -1.1182 -1.1182 -1.0638 -1.0638 -0.8834 -0.8834 -0.7184 -0.7184 -0.6772 -0.6772 -0.4793 -0.4793 -0.4545 -0.4545 -0.4346 -0.4346 -0.3127 -0.3127 -0.2508 -0.2508 -0.1749 -0.1749 -0.1208 -0.1208 -0.0670 -0.0670 -0.0254 -0.0254 0.0384 0.0384 k = 0.5486 0.1483 0.2835 ( 26263 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9300 -12.9300 -12.4530 -12.4530 -12.3004 -12.3004 -12.2942 -12.2942 -12.1764 -12.1764 -12.1588 -12.1588 -11.6062 -11.6062 -11.5349 -11.5349 -11.5232 -11.5232 -3.1986 -3.1986 -3.0797 -3.0797 -3.0471 -3.0471 -2.6431 -2.6431 -2.6357 -2.6357 -2.5468 -2.5468 -2.0747 -2.0747 -2.0200 -2.0200 -1.8575 -1.8575 -1.7554 -1.7554 -1.6944 -1.6944 -1.5570 -1.5570 -1.2630 -1.2630 -1.1130 -1.1130 -1.0639 -1.0639 -0.8888 -0.8888 -0.7124 -0.7124 -0.6690 -0.6690 -0.4776 -0.4776 -0.4536 -0.4536 -0.4258 -0.4258 -0.3070 -0.3070 -0.2477 -0.2477 -0.1729 -0.1729 -0.1211 -0.1211 -0.0678 -0.0678 -0.0187 -0.0187 0.0365 0.0365 k = 0.5556 0.1283 0.2948 ( 26269 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9292 -12.9292 -12.4493 -12.4493 -12.3022 -12.3022 -12.2946 -12.2946 -12.1809 -12.1809 -12.1585 -12.1585 -11.6042 -11.6042 -11.5347 -11.5347 -11.5240 -11.5240 -3.1902 -3.1902 -3.0760 -3.0760 -3.0329 -3.0329 -2.6406 -2.6406 -2.6310 -2.6310 -2.5467 -2.5467 -2.0762 -2.0762 -2.0466 -2.0466 -1.8692 -1.8692 -1.7671 -1.7671 -1.7126 -1.7126 -1.5508 -1.5508 -1.2646 -1.2646 -1.1072 -1.1072 -1.0631 -1.0631 -0.8935 -0.8935 -0.7054 -0.7054 -0.6614 -0.6614 -0.4761 -0.4761 -0.4530 -0.4530 -0.4180 -0.4180 -0.3018 -0.3018 -0.2460 -0.2460 -0.1701 -0.1701 -0.1203 -0.1203 -0.0681 -0.0681 -0.0149 -0.0149 0.0366 0.0366 k = 0.5625 0.1083 0.3062 ( 26283 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9283 -12.9283 -12.4453 -12.4453 -12.3042 -12.3042 -12.2950 -12.2950 -12.1857 -12.1857 -12.1582 -12.1582 -11.6021 -11.6021 -11.5344 -11.5344 -11.5247 -11.5247 -3.1813 -3.1813 -3.0719 -3.0719 -3.0169 -3.0169 -2.6380 -2.6380 -2.6262 -2.6262 -2.5466 -2.5466 -2.1032 -2.1032 -2.0490 -2.0490 -1.8811 -1.8811 -1.7822 -1.7822 -1.7296 -1.7296 -1.5454 -1.5454 -1.2673 -1.2673 -1.1005 -1.1005 -1.0615 -1.0615 -0.8970 -0.8970 -0.6975 -0.6975 -0.6548 -0.6548 -0.4747 -0.4747 -0.4529 -0.4529 -0.4111 -0.4111 -0.2982 -0.2982 -0.2448 -0.2448 -0.1677 -0.1677 -0.1187 -0.1187 -0.0670 -0.0670 -0.0150 -0.0150 0.0389 0.0389 k = 0.5694 0.0882 0.3175 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9273 -12.9273 -12.4410 -12.4410 -12.3065 -12.3065 -12.2955 -12.2955 -12.1908 -12.1908 -12.1578 -12.1578 -11.6000 -11.6000 -11.5342 -11.5342 -11.5255 -11.5255 -3.1720 -3.1720 -3.0672 -3.0672 -2.9993 -2.9993 -2.6349 -2.6349 -2.6211 -2.6211 -2.5462 -2.5462 -2.1398 -2.1398 -2.0423 -2.0423 -1.8930 -1.8930 -1.8007 -1.8007 -1.7452 -1.7452 -1.5407 -1.5407 -1.2705 -1.2705 -1.0931 -1.0931 -1.0593 -1.0593 -0.8990 -0.8990 -0.6896 -0.6896 -0.6486 -0.6486 -0.4737 -0.4737 -0.4531 -0.4531 -0.4050 -0.4050 -0.2970 -0.2970 -0.2431 -0.2431 -0.1663 -0.1663 -0.1170 -0.1170 -0.0636 -0.0636 -0.0180 -0.0180 0.0424 0.0424 k = 0.5764 0.0682 0.3289 ( 26243 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9264 -12.9264 -12.4363 -12.4363 -12.3088 -12.3088 -12.2960 -12.2960 -12.1960 -12.1960 -12.1574 -12.1574 -11.5979 -11.5979 -11.5339 -11.5339 -11.5263 -11.5263 -3.1623 -3.1623 -3.0621 -3.0621 -2.9806 -2.9806 -2.6317 -2.6317 -2.6159 -2.6159 -2.5456 -2.5456 -2.1774 -2.1774 -2.0345 -2.0345 -1.9050 -1.9050 -1.8214 -1.8214 -1.7598 -1.7598 -1.5371 -1.5371 -1.2737 -1.2737 -1.0853 -1.0853 -1.0567 -1.0567 -0.8991 -0.8991 -0.6832 -0.6832 -0.6416 -0.6416 -0.4729 -0.4729 -0.4538 -0.4538 -0.3995 -0.3995 -0.2986 -0.2986 -0.2407 -0.2407 -0.1663 -0.1663 -0.1154 -0.1154 -0.0583 -0.0583 -0.0219 -0.0219 0.0460 0.0460 k = 0.5833 0.0481 0.3402 ( 26235 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9255 -12.9255 -12.4314 -12.4314 -12.3113 -12.3113 -12.2964 -12.2964 -12.2012 -12.2012 -12.1570 -12.1570 -11.5958 -11.5958 -11.5338 -11.5338 -11.5270 -11.5270 -3.1524 -3.1524 -3.0567 -3.0567 -2.9612 -2.9612 -2.6286 -2.6286 -2.6111 -2.6111 -2.5449 -2.5449 -2.2141 -2.2141 -2.0273 -2.0273 -1.9173 -1.9173 -1.8429 -1.8429 -1.7741 -1.7741 -1.5346 -1.5346 -1.2765 -1.2765 -1.0776 -1.0776 -1.0534 -1.0534 -0.8973 -0.8973 -0.6797 -0.6797 -0.6324 -0.6324 -0.4728 -0.4728 -0.4548 -0.4548 -0.3945 -0.3945 -0.3026 -0.3026 -0.2383 -0.2383 -0.1677 -0.1677 -0.1136 -0.1136 -0.0533 -0.0533 -0.0243 -0.0243 0.0494 0.0494 k = 0.5903 0.0281 0.3515 ( 26233 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9246 -12.9246 -12.4263 -12.4263 -12.3138 -12.3138 -12.2969 -12.2969 -12.2064 -12.2064 -12.1565 -12.1565 -11.5938 -11.5938 -11.5337 -11.5337 -11.5275 -11.5275 -3.1423 -3.1423 -3.0508 -3.0508 -2.9420 -2.9420 -2.6254 -2.6254 -2.6066 -2.6066 -2.5441 -2.5441 -2.2489 -2.2489 -2.0216 -2.0216 -1.9300 -1.9300 -1.8637 -1.8637 -1.7883 -1.7883 -1.5334 -1.5334 -1.2784 -1.2784 -1.0706 -1.0706 -1.0495 -1.0495 -0.8937 -0.8937 -0.6795 -0.6795 -0.6208 -0.6208 -0.4734 -0.4734 -0.4557 -0.4557 -0.3901 -0.3901 -0.3082 -0.3082 -0.2369 -0.2369 -0.1700 -0.1700 -0.1111 -0.1111 -0.0515 -0.0515 -0.0219 -0.0219 0.0527 0.0527 k = 0.5972 0.0080 0.3629 ( 26231 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9239 -12.9239 -12.4212 -12.4212 -12.3163 -12.3163 -12.2974 -12.2974 -12.2116 -12.2116 -12.1561 -12.1561 -11.5920 -11.5920 -11.5339 -11.5339 -11.5279 -11.5279 -3.1320 -3.1320 -3.0445 -3.0445 -2.9237 -2.9237 -2.6222 -2.6222 -2.6027 -2.6027 -2.5430 -2.5430 -2.2806 -2.2806 -2.0182 -2.0182 -1.9437 -1.9437 -1.8821 -1.8821 -1.8022 -1.8022 -1.5337 -1.5337 -1.2789 -1.2789 -1.0646 -1.0646 -1.0447 -1.0447 -0.8883 -0.8883 -0.6816 -0.6816 -0.6075 -0.6075 -0.4751 -0.4751 -0.4564 -0.4564 -0.3861 -0.3861 -0.3146 -0.3146 -0.2370 -0.2370 -0.1729 -0.1729 -0.1076 -0.1076 -0.0531 -0.0531 -0.0149 -0.0149 0.0560 0.0561 k = 0.6042-0.0120 0.3742 ( 26221 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9233 -12.9233 -12.4161 -12.4161 -12.3186 -12.3186 -12.2979 -12.2979 -12.2165 -12.2165 -12.1556 -12.1556 -11.5904 -11.5904 -11.5342 -11.5342 -11.5280 -11.5280 -3.1216 -3.1216 -3.0379 -3.0379 -2.9073 -2.9073 -2.6193 -2.6193 -2.5994 -2.5994 -2.5417 -2.5417 -2.3084 -2.3084 -2.0179 -2.0179 -1.9590 -1.9590 -1.8967 -1.8967 -1.8153 -1.8153 -1.5352 -1.5352 -1.2783 -1.2783 -1.0594 -1.0594 -1.0395 -1.0395 -0.8816 -0.8816 -0.6848 -0.6848 -0.5935 -0.5935 -0.4778 -0.4778 -0.4563 -0.4563 -0.3828 -0.3828 -0.3212 -0.3212 -0.2389 -0.2389 -0.1761 -0.1761 -0.1029 -0.1029 -0.0555 -0.0555 -0.0060 -0.0060 0.0596 0.0596 k = 0.6111-0.0321 0.3856 ( 26229 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9228 -12.9228 -12.4111 -12.4111 -12.3206 -12.3206 -12.2984 -12.2984 -12.2211 -12.2211 -12.1552 -12.1552 -11.5891 -11.5891 -11.5347 -11.5347 -11.5280 -11.5280 -3.1110 -3.1110 -3.0310 -3.0310 -2.8940 -2.8940 -2.6167 -2.6167 -2.5969 -2.5969 -2.5402 -2.5402 -2.3314 -2.3314 -2.0209 -2.0209 -1.9758 -1.9758 -1.9078 -1.9078 -1.8267 -1.8267 -1.5379 -1.5379 -1.2765 -1.2765 -1.0549 -1.0549 -1.0340 -1.0340 -0.8743 -0.8743 -0.6882 -0.6882 -0.5795 -0.5795 -0.4814 -0.4814 -0.4556 -0.4556 -0.3803 -0.3803 -0.3278 -0.3278 -0.2423 -0.2423 -0.1797 -0.1797 -0.0974 -0.0974 -0.0572 -0.0572 0.0028 0.0028 0.0635 0.0635 k = 0.6181-0.0521 0.3969 ( 26229 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4064 -12.4064 -12.3222 -12.3222 -12.2988 -12.2988 -12.2254 -12.2254 -12.1547 -12.1547 -11.5881 -11.5881 -11.5353 -11.5353 -11.5277 -11.5277 -3.1003 -3.1003 -3.0238 -3.0238 -2.8848 -2.8848 -2.6146 -2.6146 -2.5951 -2.5951 -2.5385 -2.5385 -2.3490 -2.3490 -2.0268 -2.0268 -1.9931 -1.9931 -1.9172 -1.9172 -1.8352 -1.8352 -1.5414 -1.5414 -1.2742 -1.2742 -1.0512 -1.0512 -1.0279 -1.0279 -0.8672 -0.8672 -0.6904 -0.6904 -0.5665 -0.5665 -0.4855 -0.4855 -0.4542 -0.4542 -0.3789 -0.3789 -0.3337 -0.3337 -0.2463 -0.2463 -0.1832 -0.1832 -0.0912 -0.0912 -0.0576 -0.0576 0.0108 0.0108 0.0679 0.0679 k = 0.6250-0.0722 0.4082 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.6250-0.0722 0.4082 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.6136-0.0656 0.4268 ( 26234 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4020 -12.4020 -12.3231 -12.3231 -12.2996 -12.2996 -12.2292 -12.2292 -12.1543 -12.1543 -11.5873 -11.5873 -11.5359 -11.5359 -11.5273 -11.5273 -3.0924 -3.0924 -3.0131 -3.0131 -2.8802 -2.8802 -2.6129 -2.6129 -2.5939 -2.5939 -2.5368 -2.5368 -2.3625 -2.3625 -2.0403 -2.0403 -2.0071 -2.0071 -1.9238 -1.9238 -1.8379 -1.8379 -1.5451 -1.5451 -1.2725 -1.2725 -1.0486 -1.0486 -1.0199 -1.0199 -0.8618 -0.8618 -0.6920 -0.6920 -0.5583 -0.5583 -0.4889 -0.4889 -0.4518 -0.4518 -0.3780 -0.3780 -0.3378 -0.3378 -0.2498 -0.2498 -0.1856 -0.1856 -0.0846 -0.0846 -0.0568 -0.0568 0.0161 0.0161 0.0683 0.0683 k = 0.6023-0.0590 0.4454 ( 26245 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9224 -12.9224 -12.4019 -12.4019 -12.3230 -12.3230 -12.3005 -12.3005 -12.2288 -12.2288 -12.1544 -12.1544 -11.5871 -11.5871 -11.5358 -11.5358 -11.5274 -11.5274 -3.0994 -3.0994 -3.0045 -3.0045 -2.8791 -2.8791 -2.6125 -2.6125 -2.5941 -2.5941 -2.5366 -2.5366 -2.3673 -2.3673 -2.0531 -2.0531 -2.0034 -2.0034 -1.9172 -1.9172 -1.8302 -1.8302 -1.5443 -1.5443 -1.2743 -1.2743 -1.0484 -1.0484 -1.0184 -1.0184 -0.8636 -0.8636 -0.6960 -0.6960 -0.5673 -0.5673 -0.4874 -0.4874 -0.4505 -0.4505 -0.3748 -0.3748 -0.3348 -0.3348 -0.2490 -0.2490 -0.1833 -0.1833 -0.0847 -0.0847 -0.0569 -0.0569 0.0122 0.0122 0.0587 0.0587 k = 0.5909-0.0525 0.4639 ( 26243 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9223 -12.9223 -12.4016 -12.4016 -12.3227 -12.3227 -12.3019 -12.3019 -12.2281 -12.2281 -12.1546 -12.1546 -11.5869 -11.5869 -11.5357 -11.5357 -11.5277 -11.5277 -3.1083 -3.1083 -2.9930 -2.9930 -2.8772 -2.8772 -2.6117 -2.6117 -2.5942 -2.5942 -2.5363 -2.5363 -2.3748 -2.3748 -2.0680 -2.0680 -1.9992 -1.9992 -1.9115 -1.9115 -1.8166 -1.8166 -1.5431 -1.5431 -1.2772 -1.2772 -1.0487 -1.0487 -1.0153 -1.0153 -0.8666 -0.8666 -0.7020 -0.7020 -0.5809 -0.5809 -0.4850 -0.4850 -0.4487 -0.4487 -0.3704 -0.3704 -0.3303 -0.3303 -0.2475 -0.2475 -0.1796 -0.1796 -0.0849 -0.0849 -0.0570 -0.0570 0.0061 0.0061 0.0478 0.0478 k = 0.5795-0.0459 0.4825 ( 26237 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9220 -12.9220 -12.4012 -12.4012 -12.3224 -12.3224 -12.3037 -12.3037 -12.2274 -12.2274 -12.1548 -12.1548 -11.5866 -11.5866 -11.5355 -11.5355 -11.5280 -11.5280 -3.1176 -3.1176 -2.9807 -2.9807 -2.8743 -2.8743 -2.6106 -2.6106 -2.5944 -2.5944 -2.5358 -2.5358 -2.3847 -2.3847 -2.0828 -2.0828 -1.9946 -1.9946 -1.9091 -1.9091 -1.7978 -1.7978 -1.5413 -1.5413 -1.2811 -1.2811 -1.0500 -1.0500 -1.0104 -1.0104 -0.8709 -0.8709 -0.7089 -0.7089 -0.5972 -0.5972 -0.4821 -0.4821 -0.4469 -0.4469 -0.3653 -0.3653 -0.3248 -0.3248 -0.2456 -0.2456 -0.1748 -0.1748 -0.0851 -0.0851 -0.0573 -0.0573 -0.0015 -0.0015 0.0368 0.0368 k = 0.5682-0.0394 0.5010 ( 26232 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9217 -12.9217 -12.4007 -12.4007 -12.3219 -12.3219 -12.3058 -12.3058 -12.2265 -12.2265 -12.1550 -12.1550 -11.5862 -11.5862 -11.5352 -11.5352 -11.5284 -11.5284 -3.1264 -3.1264 -2.9688 -2.9688 -2.8703 -2.8703 -2.6094 -2.6094 -2.5947 -2.5947 -2.5352 -2.5352 -2.3963 -2.3963 -2.0962 -2.0962 -1.9893 -1.9893 -1.9097 -1.9097 -1.7761 -1.7761 -1.5389 -1.5389 -1.2859 -1.2859 -1.0523 -1.0523 -1.0039 -1.0039 -0.8766 -0.8766 -0.7157 -0.7157 -0.6148 -0.6148 -0.4786 -0.4786 -0.4454 -0.4454 -0.3599 -0.3599 -0.3191 -0.3191 -0.2434 -0.2434 -0.1694 -0.1694 -0.0851 -0.0851 -0.0580 -0.0580 -0.0098 -0.0098 0.0261 0.0261 k = 0.5568-0.0328 0.5196 ( 26236 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9214 -12.9214 -12.4003 -12.4003 -12.3214 -12.3214 -12.3080 -12.3080 -12.2256 -12.2256 -12.1553 -12.1553 -11.5857 -11.5857 -11.5349 -11.5349 -11.5289 -11.5289 -3.1343 -3.1343 -2.9584 -2.9584 -2.8653 -2.8653 -2.6081 -2.6081 -2.5952 -2.5952 -2.5346 -2.5346 -2.4086 -2.4086 -2.1079 -2.1079 -1.9834 -1.9834 -1.9126 -1.9126 -1.7539 -1.7539 -1.5360 -1.5360 -1.2913 -1.2913 -1.0551 -1.0551 -0.9966 -0.9966 -0.8833 -0.8833 -0.7215 -0.7215 -0.6327 -0.6327 -0.4749 -0.4749 -0.4447 -0.4447 -0.3545 -0.3545 -0.3135 -0.3135 -0.2411 -0.2411 -0.1639 -0.1639 -0.0850 -0.0850 -0.0596 -0.0596 -0.0173 -0.0173 0.0157 0.0157 k = 0.5455-0.0262 0.5381 ( 26224 PWs) bands (ev): -92.9985 -92.9985 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9210 -12.9210 -12.3998 -12.3998 -12.3208 -12.3208 -12.3103 -12.3103 -12.2248 -12.2248 -12.1555 -12.1555 -11.5853 -11.5853 -11.5345 -11.5345 -11.5295 -11.5295 -3.1409 -3.1409 -2.9499 -2.9499 -2.8593 -2.8593 -2.6067 -2.6067 -2.5956 -2.5956 -2.5338 -2.5338 -2.4206 -2.4206 -2.1176 -2.1176 -1.9769 -1.9769 -1.9170 -1.9170 -1.7331 -1.7331 -1.5325 -1.5325 -1.2971 -1.2971 -1.0582 -1.0582 -0.9891 -0.9891 -0.8907 -0.8907 -0.7253 -0.7253 -0.6499 -0.6499 -0.4710 -0.4710 -0.4448 -0.4448 -0.3493 -0.3493 -0.3083 -0.3083 -0.2387 -0.2387 -0.1589 -0.1589 -0.0846 -0.0846 -0.0623 -0.0623 -0.0229 -0.0229 0.0057 0.0057 k = 0.5341-0.0197 0.5567 ( 26232 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9207 -12.9207 -12.3994 -12.3994 -12.3201 -12.3201 -12.3124 -12.3124 -12.2242 -12.2242 -12.1558 -12.1558 -11.5850 -11.5850 -11.5340 -11.5340 -11.5301 -11.5301 -3.1463 -3.1463 -2.9436 -2.9436 -2.8532 -2.8532 -2.6054 -2.6054 -2.5961 -2.5961 -2.5331 -2.5331 -2.4313 -2.4313 -2.1253 -2.1253 -1.9701 -1.9701 -1.9223 -1.9223 -1.7155 -1.7155 -1.5287 -1.5287 -1.3027 -1.3027 -1.0609 -1.0609 -0.9824 -0.9824 -0.8979 -0.8979 -0.7266 -0.7266 -0.6658 -0.6658 -0.4670 -0.4670 -0.4459 -0.4459 -0.3449 -0.3449 -0.3039 -0.3039 -0.2364 -0.2364 -0.1548 -0.1548 -0.0841 -0.0841 -0.0662 -0.0662 -0.0259 -0.0259 -0.0035 -0.0035 k = 0.5227-0.0131 0.5753 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9205 -12.9205 -12.3990 -12.3990 -12.3194 -12.3194 -12.3142 -12.3142 -12.2237 -12.2237 -12.1560 -12.1560 -11.5846 -11.5846 -11.5335 -11.5335 -11.5307 -11.5307 -3.1502 -3.1502 -2.9395 -2.9395 -2.8478 -2.8478 -2.6042 -2.6042 -2.5967 -2.5967 -2.5325 -2.5325 -2.4397 -2.4397 -2.1310 -2.1310 -1.9634 -1.9634 -1.9278 -1.9278 -1.7021 -1.7021 -1.5251 -1.5251 -1.3076 -1.3076 -1.0630 -1.0630 -0.9775 -0.9775 -0.9038 -0.9038 -0.7255 -0.7255 -0.6797 -0.6797 -0.4632 -0.4632 -0.4476 -0.4476 -0.3416 -0.3416 -0.3005 -0.3005 -0.2345 -0.2345 -0.1520 -0.1520 -0.0834 -0.0834 -0.0703 -0.0703 -0.0264 -0.0264 -0.0116 -0.0116 k = 0.5114-0.0066 0.5938 ( 26252 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9203 -12.9203 -12.3988 -12.3988 -12.3189 -12.3189 -12.3155 -12.3155 -12.2233 -12.2233 -12.1561 -12.1561 -11.5844 -11.5844 -11.5328 -11.5328 -11.5314 -11.5314 -3.1525 -3.1525 -2.9371 -2.9371 -2.8441 -2.8441 -2.6035 -2.6035 -2.5972 -2.5972 -2.5321 -2.5321 -2.4450 -2.4450 -2.1345 -2.1345 -1.9578 -1.9578 -1.9328 -1.9328 -1.6938 -1.6938 -1.5224 -1.5224 -1.3111 -1.3111 -1.0641 -1.0641 -0.9748 -0.9748 -0.9075 -0.9075 -0.7225 -0.7225 -0.6904 -0.6904 -0.4599 -0.4599 -0.4498 -0.4498 -0.3394 -0.3394 -0.2984 -0.2984 -0.2331 -0.2331 -0.1505 -0.1505 -0.0827 -0.0827 -0.0736 -0.0736 -0.0253 -0.0253 -0.0179 -0.0179 k = 0.5000 0.0000 0.6124 ( 26204 PWs) bands (ev): -92.9984 -92.9984 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9202 -12.9202 -12.3988 -12.3988 -12.3187 -12.3187 -12.3159 -12.3159 -12.2232 -12.2232 -12.1561 -12.1561 -11.5844 -11.5844 -11.5322 -11.5322 -11.5321 -11.5321 -3.1531 -3.1531 -2.9361 -2.9361 -2.8427 -2.8427 -2.6029 -2.6029 -2.5972 -2.5972 -2.5317 -2.5317 -2.4468 -2.4468 -2.1357 -2.1357 -1.9553 -1.9553 -1.9350 -1.9350 -1.6910 -1.6910 -1.5214 -1.5214 -1.3123 -1.3123 -1.0644 -1.0644 -0.9740 -0.9740 -0.9087 -0.9087 -0.7205 -0.7205 -0.6949 -0.6949 -0.4582 -0.4582 -0.4510 -0.4510 -0.3386 -0.3386 -0.2974 -0.2974 -0.2325 -0.2325 -0.1499 -0.1499 -0.0824 -0.0824 -0.0748 -0.0748 -0.0238 -0.0238 -0.0210 -0.0210 k = 0.5000 0.0000 0.6124 ( 26204 PWs) bands (ev): -92.9984 -92.9984 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9202 -12.9202 -12.3988 -12.3988 -12.3187 -12.3187 -12.3159 -12.3159 -12.2232 -12.2232 -12.1561 -12.1561 -11.5844 -11.5844 -11.5322 -11.5322 -11.5321 -11.5321 -3.1531 -3.1531 -2.9361 -2.9361 -2.8427 -2.8427 -2.6029 -2.6029 -2.5972 -2.5972 -2.5317 -2.5317 -2.4468 -2.4468 -2.1357 -2.1357 -1.9553 -1.9553 -1.9350 -1.9350 -1.6910 -1.6910 -1.5214 -1.5214 -1.3123 -1.3123 -1.0644 -1.0644 -0.9740 -0.9740 -0.9087 -0.9087 -0.7205 -0.7205 -0.6949 -0.6949 -0.4582 -0.4582 -0.4510 -0.4510 -0.3386 -0.3386 -0.2974 -0.2974 -0.2325 -0.2325 -0.1499 -0.1499 -0.0824 -0.0824 -0.0748 -0.0748 -0.0238 -0.0238 -0.0210 -0.0210 k = 0.5000 0.0137 0.5929 ( 26244 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9203 -12.9203 -12.3994 -12.3994 -12.3184 -12.3184 -12.3157 -12.3157 -12.2229 -12.2229 -12.1561 -12.1561 -11.5845 -11.5845 -11.5322 -11.5322 -11.5321 -11.5321 -3.1534 -3.1534 -2.9381 -2.9381 -2.8457 -2.8457 -2.6036 -2.6036 -2.5973 -2.5973 -2.5323 -2.5323 -2.4423 -2.4423 -2.1330 -2.1330 -1.9554 -1.9554 -1.9351 -1.9351 -1.6906 -1.6906 -1.5217 -1.5217 -1.3117 -1.3117 -1.0649 -1.0649 -0.9755 -0.9755 -0.9090 -0.9090 -0.7211 -0.7211 -0.6924 -0.6924 -0.4583 -0.4583 -0.4512 -0.4512 -0.3390 -0.3390 -0.2982 -0.2982 -0.2320 -0.2320 -0.1500 -0.1500 -0.0826 -0.0826 -0.0756 -0.0756 -0.0243 -0.0243 -0.0192 -0.0192 k = 0.5000 0.0275 0.5735 ( 26252 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9205 -12.9205 -12.4013 -12.4013 -12.3177 -12.3177 -12.3147 -12.3147 -12.2220 -12.2220 -12.1562 -12.1562 -11.5850 -11.5850 -11.5322 -11.5322 -11.5318 -11.5318 -3.1538 -3.1538 -2.9429 -2.9429 -2.8542 -2.8542 -2.6052 -2.6052 -2.5973 -2.5973 -2.5338 -2.5338 -2.4296 -2.4296 -2.1250 -2.1250 -1.9560 -1.9560 -1.9349 -1.9349 -1.6894 -1.6894 -1.5225 -1.5225 -1.3101 -1.3101 -1.0663 -1.0663 -0.9796 -0.9796 -0.9097 -0.9097 -0.7222 -0.7222 -0.6856 -0.6856 -0.4587 -0.4587 -0.4517 -0.4517 -0.3400 -0.3400 -0.3000 -0.3000 -0.2304 -0.2304 -0.1502 -0.1502 -0.0838 -0.0838 -0.0769 -0.0769 -0.0242 -0.0242 -0.0152 -0.0152 k = 0.5000 0.0412 0.5541 ( 26238 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9209 -12.9209 -12.4043 -12.4043 -12.3168 -12.3168 -12.3131 -12.3131 -12.2204 -12.2204 -12.1563 -12.1563 -11.5859 -11.5859 -11.5323 -11.5323 -11.5315 -11.5315 -3.1545 -3.1545 -2.9505 -2.9505 -2.8671 -2.8671 -2.6073 -2.6073 -2.5974 -2.5974 -2.5355 -2.5355 -2.4097 -2.4097 -2.1121 -2.1121 -1.9577 -1.9577 -1.9336 -1.9336 -1.6876 -1.6876 -1.5240 -1.5240 -1.3074 -1.3074 -1.0685 -1.0685 -0.9859 -0.9859 -0.9108 -0.9108 -0.7228 -0.7228 -0.6763 -0.6763 -0.4593 -0.4593 -0.4524 -0.4524 -0.3421 -0.3421 -0.3019 -0.3019 -0.2280 -0.2280 -0.1504 -0.1504 -0.0877 -0.0877 -0.0768 -0.0768 -0.0232 -0.0232 -0.0102 -0.0102 k = 0.5000 0.0550 0.5346 ( 26246 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9214 -12.9214 -12.4081 -12.4081 -12.3157 -12.3157 -12.3110 -12.3110 -12.2182 -12.2182 -12.1564 -12.1564 -11.5870 -11.5870 -11.5325 -11.5325 -11.5310 -11.5310 -3.1555 -3.1555 -2.9607 -2.9607 -2.8832 -2.8832 -2.6102 -2.6102 -2.5982 -2.5982 -2.5375 -2.5375 -2.3842 -2.3842 -2.0952 -2.0952 -1.9608 -1.9608 -1.9305 -1.9305 -1.6854 -1.6854 -1.5259 -1.5259 -1.3038 -1.3038 -1.0716 -1.0716 -0.9938 -0.9938 -0.9119 -0.9119 -0.7228 -0.7228 -0.6658 -0.6658 -0.4601 -0.4601 -0.4532 -0.4532 -0.3458 -0.3458 -0.3034 -0.3034 -0.2255 -0.2255 -0.1507 -0.1507 -0.0935 -0.0935 -0.0756 -0.0756 -0.0216 -0.0216 -0.0044 -0.0044 k = 0.5000 0.0687 0.5152 ( 26254 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9220 -12.9220 -12.4124 -12.4124 -12.3145 -12.3145 -12.3086 -12.3086 -12.2153 -12.2153 -12.1566 -12.1566 -11.5883 -11.5883 -11.5326 -11.5326 -11.5303 -11.5303 -3.1570 -3.1570 -2.9728 -2.9728 -2.9012 -2.9012 -2.6135 -2.6135 -2.5997 -2.5997 -2.5395 -2.5395 -2.3544 -2.3544 -2.0756 -2.0756 -1.9644 -1.9644 -1.9256 -1.9256 -1.6831 -1.6831 -1.5282 -1.5282 -1.2993 -1.2993 -1.0755 -1.0755 -1.0025 -1.0025 -0.9128 -0.9128 -0.7223 -0.7223 -0.6553 -0.6553 -0.4613 -0.4613 -0.4541 -0.4541 -0.3512 -0.3512 -0.3037 -0.3037 -0.2233 -0.2233 -0.1512 -0.1512 -0.0999 -0.0999 -0.0742 -0.0742 -0.0195 -0.0195 0.0018 0.0018 k = 0.5000 0.0825 0.4957 ( 26256 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9228 -12.9228 -12.4172 -12.4172 -12.3131 -12.3131 -12.3062 -12.3062 -12.2120 -12.2120 -12.1568 -12.1568 -11.5900 -11.5900 -11.5328 -11.5328 -11.5296 -11.5296 -3.1589 -3.1589 -2.9864 -2.9864 -2.9200 -2.9200 -2.6170 -2.6170 -2.6019 -2.6019 -2.5412 -2.5412 -2.3212 -2.3212 -2.0557 -2.0557 -1.9665 -1.9665 -1.9191 -1.9191 -1.6808 -1.6808 -1.5309 -1.5309 -1.2943 -1.2943 -1.0801 -1.0801 -1.0115 -1.0115 -0.9133 -0.9133 -0.7216 -0.7216 -0.6457 -0.6457 -0.4627 -0.4627 -0.4547 -0.4547 -0.3580 -0.3580 -0.3027 -0.3027 -0.2220 -0.2220 -0.1520 -0.1520 -0.1061 -0.1061 -0.0728 -0.0728 -0.0171 -0.0171 0.0081 0.0081 k = 0.5000 0.0962 0.4763 ( 26246 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9236 -12.9236 -12.4221 -12.4221 -12.3116 -12.3116 -12.3039 -12.3039 -12.2081 -12.2081 -12.1570 -12.1570 -11.5918 -11.5918 -11.5331 -11.5331 -11.5289 -11.5289 -3.1614 -3.1614 -3.0005 -3.0005 -2.9391 -2.9391 -2.6205 -2.6205 -2.6049 -2.6049 -2.5426 -2.5426 -2.2857 -2.2857 -2.0396 -2.0396 -1.9634 -1.9634 -1.9111 -1.9111 -1.6789 -1.6789 -1.5338 -1.5338 -1.2889 -1.2889 -1.0852 -1.0852 -1.0202 -1.0202 -0.9133 -0.9133 -0.7207 -0.7207 -0.6379 -0.6379 -0.4643 -0.4643 -0.4550 -0.4550 -0.3659 -0.3659 -0.3007 -0.3007 -0.2221 -0.2221 -0.1533 -0.1533 -0.1112 -0.1112 -0.0719 -0.0719 -0.0144 -0.0144 0.0143 0.0143 k = 0.5000 0.1100 0.4568 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9245 -12.9245 -12.4271 -12.4271 -12.3100 -12.3100 -12.3019 -12.3019 -12.2038 -12.2038 -12.1573 -12.1573 -11.5937 -11.5937 -11.5333 -11.5333 -11.5281 -11.5281 -3.1646 -3.1646 -3.0149 -3.0149 -2.9579 -2.9579 -2.6243 -2.6243 -2.6086 -2.6086 -2.5439 -2.5439 -2.2485 -2.2485 -2.0321 -2.0321 -1.9510 -1.9510 -1.9016 -1.9016 -1.6774 -1.6774 -1.5369 -1.5369 -1.2834 -1.2834 -1.0906 -1.0906 -1.0285 -1.0285 -0.9127 -0.9127 -0.7200 -0.7200 -0.6325 -0.6325 -0.4662 -0.4662 -0.4549 -0.4549 -0.3743 -0.3743 -0.2981 -0.2981 -0.2241 -0.2241 -0.1552 -0.1552 -0.1149 -0.1149 -0.0717 -0.0717 -0.0116 -0.0116 0.0198 0.0198 k = 0.5000 0.1237 0.4374 ( 26246 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9254 -12.9254 -12.4321 -12.4321 -12.3083 -12.3083 -12.3001 -12.3001 -12.1993 -12.1993 -12.1575 -12.1575 -11.5958 -11.5958 -11.5336 -11.5336 -11.5272 -11.5272 -3.1686 -3.1686 -3.0285 -3.0285 -2.9761 -2.9761 -2.6278 -2.6278 -2.6127 -2.6127 -2.5448 -2.5448 -2.2102 -2.2102 -2.0331 -2.0331 -1.9309 -1.9309 -1.8897 -1.8897 -1.6764 -1.6764 -1.5402 -1.5402 -1.2781 -1.2781 -1.0958 -1.0958 -1.0362 -1.0362 -0.9111 -0.9111 -0.7197 -0.7197 -0.6302 -0.6302 -0.4681 -0.4681 -0.4546 -0.4546 -0.3827 -0.3827 -0.2955 -0.2955 -0.2280 -0.2280 -0.1573 -0.1573 -0.1171 -0.1171 -0.0720 -0.0720 -0.0087 -0.0087 0.0244 0.0244 k = 0.5000 0.1375 0.4180 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9264 -12.9264 -12.4369 -12.4369 -12.3066 -12.3066 -12.2985 -12.2985 -12.1945 -12.1945 -12.1578 -12.1578 -11.5979 -11.5979 -11.5339 -11.5339 -11.5264 -11.5264 -3.1735 -3.1735 -3.0413 -3.0413 -2.9934 -2.9934 -2.6313 -2.6313 -2.6174 -2.6174 -2.5456 -2.5456 -2.1715 -2.1715 -2.0384 -2.0384 -1.9096 -1.9096 -1.8735 -1.8735 -1.6758 -1.6758 -1.5437 -1.5437 -1.2732 -1.2732 -1.1008 -1.1008 -1.0432 -1.0432 -0.9087 -0.9087 -0.7198 -0.7198 -0.6310 -0.6310 -0.4701 -0.4701 -0.4541 -0.4541 -0.3912 -0.3912 -0.2937 -0.2937 -0.2331 -0.2331 -0.1598 -0.1598 -0.1185 -0.1185 -0.0725 -0.0725 -0.0062 -0.0062 0.0275 0.0275 k = 0.5000 0.1512 0.3985 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9274 -12.9274 -12.4414 -12.4414 -12.3048 -12.3048 -12.2972 -12.2972 -12.1897 -12.1897 -12.1581 -12.1581 -11.6001 -11.6001 -11.5341 -11.5341 -11.5255 -11.5255 -3.1793 -3.1793 -3.0525 -3.0525 -3.0097 -3.0097 -2.6347 -2.6347 -2.6222 -2.6222 -2.5461 -2.5461 -2.1331 -2.1331 -2.0455 -2.0455 -1.8922 -1.8922 -1.8514 -1.8514 -1.6752 -1.6752 -1.5474 -1.5474 -1.2690 -1.2690 -1.1052 -1.1052 -1.0495 -1.0495 -0.9052 -0.9052 -0.7203 -0.7203 -0.6350 -0.6350 -0.4720 -0.4720 -0.4537 -0.4537 -0.3995 -0.3995 -0.2936 -0.2936 -0.2381 -0.2381 -0.1627 -0.1627 -0.1196 -0.1196 -0.0726 -0.0726 -0.0049 -0.0049 0.0293 0.0293 k = 0.5000 0.1650 0.3791 ( 26276 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9283 -12.9283 -12.4457 -12.4457 -12.3031 -12.3031 -12.2961 -12.2961 -12.1849 -12.1849 -12.1584 -12.1584 -11.6023 -11.6023 -11.5344 -11.5344 -11.5247 -11.5247 -3.1858 -3.1858 -3.0621 -3.0621 -3.0248 -3.0248 -2.6378 -2.6378 -2.6270 -2.6270 -2.5466 -2.5466 -2.0964 -2.0964 -2.0519 -2.0519 -1.8784 -1.8784 -1.8255 -1.8255 -1.6744 -1.6744 -1.5514 -1.5514 -1.2657 -1.2657 -1.1092 -1.1092 -1.0548 -1.0548 -0.9008 -0.9008 -0.7211 -0.7211 -0.6418 -0.6418 -0.4739 -0.4739 -0.4535 -0.4535 -0.4078 -0.4078 -0.2959 -0.2959 -0.2421 -0.2421 -0.1659 -0.1659 -0.1206 -0.1206 -0.0720 -0.0720 -0.0057 -0.0057 0.0304 0.0304 k = 0.5000 0.1787 0.3596 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9292 -12.9292 -12.4497 -12.4497 -12.3014 -12.3014 -12.2953 -12.2953 -12.1803 -12.1803 -12.1587 -12.1587 -11.6043 -11.6043 -11.5347 -11.5347 -11.5239 -11.5239 -3.1928 -3.1928 -3.0699 -3.0699 -3.0385 -3.0385 -2.6406 -2.6406 -2.6316 -2.6316 -2.5467 -2.5467 -2.0724 -2.0724 -2.0469 -2.0469 -1.8665 -1.8665 -1.7997 -1.7997 -1.6725 -1.6725 -1.5558 -1.5558 -1.2635 -1.2635 -1.1127 -1.1127 -1.0590 -1.0590 -0.8955 -0.8955 -0.7222 -0.7222 -0.6509 -0.6509 -0.4758 -0.4758 -0.4535 -0.4535 -0.4162 -0.4162 -0.3005 -0.3005 -0.2449 -0.2449 -0.1694 -0.1694 -0.1215 -0.1215 -0.0707 -0.0707 -0.0097 -0.0097 0.0320 0.0320 k = 0.5000 0.1925 0.3402 ( 26262 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9301 -12.9301 -12.4532 -12.4532 -12.2999 -12.2999 -12.2945 -12.2945 -12.1760 -12.1760 -12.1589 -12.1589 -11.6063 -11.6063 -11.5350 -11.5350 -11.5232 -11.5232 -3.2001 -3.2001 -3.0762 -3.0762 -3.0509 -3.0509 -2.6431 -2.6431 -2.6361 -2.6361 -2.5469 -2.5469 -2.0744 -2.0744 -2.0174 -2.0174 -1.8552 -1.8552 -1.7764 -1.7764 -1.6686 -1.6686 -1.5608 -1.5608 -1.2623 -1.2623 -1.1161 -1.1161 -1.0617 -1.0617 -0.8897 -0.8897 -0.7234 -0.7234 -0.6615 -0.6615 -0.4776 -0.4776 -0.4539 -0.4539 -0.4251 -0.4251 -0.3064 -0.3064 -0.2476 -0.2476 -0.1726 -0.1726 -0.1216 -0.1216 -0.0689 -0.0689 -0.0166 -0.0166 0.0345 0.0345 k = 0.5000 0.2062 0.3208 ( 26266 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9309 -12.9309 -12.4564 -12.4564 -12.2985 -12.2985 -12.2939 -12.2939 -12.1720 -12.1720 -12.1592 -12.1592 -11.6081 -11.6081 -11.5352 -11.5352 -11.5226 -11.5226 -3.2073 -3.2073 -3.0811 -3.0811 -3.0617 -3.0617 -2.6454 -2.6454 -2.6402 -2.6402 -2.5470 -2.5470 -2.0806 -2.0806 -1.9859 -1.9859 -1.8443 -1.8443 -1.7574 -1.7574 -1.6619 -1.6619 -1.5665 -1.5665 -1.2622 -1.2622 -1.1197 -1.1197 -1.0627 -1.0627 -0.8836 -0.8836 -0.7248 -0.7248 -0.6727 -0.6727 -0.4794 -0.4794 -0.4547 -0.4547 -0.4345 -0.4345 -0.3125 -0.3125 -0.2511 -0.2511 -0.1747 -0.1747 -0.1210 -0.1210 -0.0675 -0.0675 -0.0249 -0.0249 0.0379 0.0379 k = 0.5000 0.2199 0.3013 ( 26256 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9316 -12.9316 -12.4591 -12.4591 -12.2974 -12.2974 -12.2934 -12.2934 -12.1685 -12.1685 -12.1594 -12.1594 -11.6097 -11.6097 -11.5354 -11.5354 -11.5220 -11.5220 -3.2139 -3.2139 -3.0849 -3.0849 -3.0710 -3.0710 -2.6474 -2.6474 -2.6438 -2.6438 -2.5469 -2.5469 -2.0866 -2.0866 -1.9573 -1.9573 -1.8339 -1.8339 -1.7428 -1.7428 -1.6527 -1.6527 -1.5728 -1.5728 -1.2628 -1.2628 -1.1234 -1.1234 -1.0620 -1.0620 -0.8778 -0.8778 -0.7269 -0.7269 -0.6827 -0.6827 -0.4812 -0.4812 -0.4558 -0.4558 -0.4442 -0.4442 -0.3182 -0.3182 -0.2556 -0.2556 -0.1753 -0.1753 -0.1195 -0.1195 -0.0672 -0.0672 -0.0328 -0.0328 0.0416 0.0416 k = 0.5000 0.2337 0.2819 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9322 -12.9322 -12.4613 -12.4613 -12.2965 -12.2965 -12.2929 -12.2929 -12.1655 -12.1655 -12.1596 -12.1596 -11.6111 -11.6111 -11.5356 -11.5356 -11.5215 -11.5215 -3.2198 -3.2198 -3.0878 -3.0878 -3.0786 -3.0786 -2.6491 -2.6491 -2.6468 -2.6468 -2.5470 -2.5470 -2.0919 -2.0919 -1.9331 -1.9331 -1.8244 -1.8244 -1.7313 -1.7313 -1.6427 -1.6427 -1.5794 -1.5794 -1.2640 -1.2640 -1.1272 -1.1272 -1.0599 -1.0599 -0.8727 -0.8727 -0.7309 -0.7309 -0.6896 -0.6896 -0.4830 -0.4830 -0.4580 -0.4580 -0.4529 -0.4529 -0.3228 -0.3228 -0.2607 -0.2607 -0.1747 -0.1747 -0.1171 -0.1171 -0.0689 -0.0689 -0.0388 -0.0388 0.0453 0.0453 k = 0.5000 0.2474 0.2624 ( 26240 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9327 -12.9327 -12.4631 -12.4631 -12.2958 -12.2958 -12.2924 -12.2924 -12.1631 -12.1631 -12.1597 -12.1597 -11.6122 -11.6122 -11.5357 -11.5357 -11.5211 -11.5211 -3.2245 -3.2245 -3.0898 -3.0898 -3.0844 -3.0844 -2.6504 -2.6504 -2.6490 -2.6490 -2.5468 -2.5468 -2.0962 -2.0962 -1.9140 -1.9140 -1.8164 -1.8164 -1.7211 -1.7211 -1.6346 -1.6346 -1.5853 -1.5853 -1.2654 -1.2654 -1.1306 -1.1306 -1.0570 -1.0570 -0.8685 -0.8685 -0.7369 -0.7369 -0.6922 -0.6922 -0.4851 -0.4851 -0.4647 -0.4647 -0.4562 -0.4562 -0.3264 -0.3264 -0.2653 -0.2653 -0.1734 -0.1734 -0.1139 -0.1139 -0.0730 -0.0730 -0.0422 -0.0422 0.0487 0.0487 k = 0.5000 0.2612 0.2430 ( 26262 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9330 -12.9330 -12.4643 -12.4643 -12.2953 -12.2953 -12.2921 -12.2921 -12.1614 -12.1614 -12.1598 -12.1598 -11.6130 -11.6130 -11.5358 -11.5358 -11.5209 -11.5209 -3.2281 -3.2281 -3.0916 -3.0916 -3.0885 -3.0885 -2.6518 -2.6518 -2.6506 -2.6506 -2.5469 -2.5469 -2.0993 -2.0993 -1.9005 -1.9005 -1.8106 -1.8106 -1.7114 -1.7114 -1.6310 -1.6310 -1.5888 -1.5888 -1.2668 -1.2668 -1.1334 -1.1334 -1.0540 -1.0540 -0.8656 -0.8656 -0.7434 -0.7434 -0.6918 -0.6918 -0.4876 -0.4876 -0.4713 -0.4713 -0.4572 -0.4572 -0.3289 -0.3289 -0.2692 -0.2692 -0.1722 -0.1722 -0.1103 -0.1103 -0.0784 -0.0784 -0.0437 -0.0437 0.0516 0.0516 k = 0.5000 0.2749 0.2236 ( 26286 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9332 -12.9332 -12.4651 -12.4651 -12.2951 -12.2951 -12.2919 -12.2919 -12.1604 -12.1604 -12.1598 -12.1598 -11.6135 -11.6135 -11.5359 -11.5359 -11.5207 -11.5207 -3.2304 -3.2304 -3.0931 -3.0931 -3.0905 -3.0905 -2.6528 -2.6528 -2.6514 -2.6514 -2.5470 -2.5470 -2.1012 -2.1012 -1.8925 -1.8925 -1.8072 -1.8072 -1.7035 -1.7035 -1.6316 -1.6316 -1.5898 -1.5898 -1.2679 -1.2679 -1.1351 -1.1351 -1.0519 -1.0519 -0.8638 -0.8638 -0.7483 -0.7483 -0.6906 -0.6906 -0.4901 -0.4901 -0.4752 -0.4752 -0.4577 -0.4577 -0.3304 -0.3304 -0.2716 -0.2716 -0.1713 -0.1713 -0.1068 -0.1068 -0.0833 -0.0833 -0.0441 -0.0441 0.0537 0.0537 k = 0.5000 0.2887 0.2041 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9333 -12.9333 -12.4654 -12.4654 -12.2950 -12.2950 -12.2918 -12.2918 -12.1601 -12.1601 -12.1597 -12.1597 -11.6137 -11.6137 -11.5359 -11.5359 -11.5206 -11.5206 -3.2311 -3.2311 -3.0937 -3.0937 -3.0909 -3.0909 -2.6531 -2.6531 -2.6515 -2.6515 -2.5469 -2.5469 -2.1019 -2.1019 -1.8898 -1.8898 -1.8061 -1.8061 -1.7002 -1.7002 -1.6326 -1.6326 -1.5897 -1.5897 -1.2682 -1.2682 -1.1357 -1.1357 -1.0511 -1.0511 -0.8632 -0.8632 -0.7501 -0.7501 -0.6899 -0.6899 -0.4912 -0.4912 -0.4763 -0.4763 -0.4579 -0.4579 -0.3308 -0.3308 -0.2724 -0.2724 -0.1709 -0.1709 -0.1052 -0.1052 -0.0855 -0.0855 -0.0442 -0.0442 0.0545 0.0545 k = 0.5000 0.2887 0.2041 ( 26272 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9333 -12.9333 -12.4654 -12.4654 -12.2950 -12.2950 -12.2918 -12.2918 -12.1601 -12.1601 -12.1597 -12.1597 -11.6137 -11.6137 -11.5359 -11.5359 -11.5206 -11.5206 -3.2311 -3.2311 -3.0937 -3.0937 -3.0909 -3.0909 -2.6531 -2.6531 -2.6515 -2.6515 -2.5469 -2.5469 -2.1019 -2.1019 -1.8898 -1.8898 -1.8061 -1.8061 -1.7002 -1.7002 -1.6326 -1.6326 -1.5897 -1.5897 -1.2682 -1.2682 -1.1357 -1.1357 -1.0511 -1.0511 -0.8632 -0.8632 -0.7501 -0.7501 -0.6899 -0.6899 -0.4912 -0.4912 -0.4763 -0.4763 -0.4579 -0.4579 -0.3308 -0.3308 -0.2724 -0.2724 -0.1709 -0.1709 -0.1052 -0.1052 -0.0855 -0.0855 -0.0442 -0.0442 0.0545 0.0545 k = 0.4931 0.2847 0.2268 ( 26288 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9332 -12.9332 -12.4651 -12.4651 -12.2951 -12.2951 -12.2919 -12.2919 -12.1604 -12.1604 -12.1598 -12.1598 -11.6135 -11.6135 -11.5359 -11.5359 -11.5207 -11.5207 -3.2303 -3.2303 -3.0931 -3.0931 -3.0905 -3.0905 -2.6528 -2.6528 -2.6514 -2.6514 -2.5470 -2.5470 -2.1012 -2.1012 -1.8926 -1.8926 -1.8072 -1.8072 -1.7035 -1.7035 -1.6316 -1.6316 -1.5898 -1.5898 -1.2679 -1.2679 -1.1351 -1.1351 -1.0519 -1.0519 -0.8639 -0.8639 -0.7483 -0.7483 -0.6906 -0.6906 -0.4901 -0.4901 -0.4751 -0.4751 -0.4577 -0.4577 -0.3303 -0.3303 -0.2716 -0.2716 -0.1713 -0.1713 -0.1069 -0.1069 -0.0833 -0.0833 -0.0441 -0.0441 0.0537 0.0537 k = 0.4861 0.2807 0.2495 ( 26262 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9330 -12.9330 -12.4643 -12.4643 -12.2954 -12.2954 -12.2921 -12.2921 -12.1614 -12.1614 -12.1598 -12.1598 -11.6130 -11.6130 -11.5358 -11.5358 -11.5209 -11.5209 -3.2280 -3.2280 -3.0916 -3.0916 -3.0884 -3.0884 -2.6518 -2.6518 -2.6506 -2.6506 -2.5469 -2.5469 -2.0993 -2.0993 -1.9008 -1.9008 -1.8107 -1.8107 -1.7115 -1.7115 -1.6311 -1.6311 -1.5888 -1.5888 -1.2668 -1.2668 -1.1333 -1.1333 -1.0541 -1.0541 -0.8656 -0.8656 -0.7433 -0.7433 -0.6919 -0.6919 -0.4875 -0.4875 -0.4712 -0.4712 -0.4572 -0.4572 -0.3289 -0.3289 -0.2691 -0.2691 -0.1722 -0.1722 -0.1104 -0.1104 -0.0783 -0.0783 -0.0436 -0.0436 0.0516 0.0516 k = 0.4792 0.2766 0.2722 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9326 -12.9326 -12.4630 -12.4630 -12.2958 -12.2958 -12.2925 -12.2925 -12.1632 -12.1632 -12.1597 -12.1597 -11.6122 -11.6122 -11.5357 -11.5357 -11.5211 -11.5211 -3.2244 -3.2244 -3.0900 -3.0900 -3.0842 -3.0842 -2.6505 -2.6505 -2.6491 -2.6491 -2.5469 -2.5469 -2.0961 -2.0961 -1.9146 -1.9146 -1.8167 -1.8167 -1.7210 -1.7210 -1.6354 -1.6354 -1.5849 -1.5849 -1.2654 -1.2654 -1.1305 -1.1305 -1.0571 -1.0571 -0.8686 -0.8686 -0.7365 -0.7365 -0.6924 -0.6924 -0.4850 -0.4850 -0.4645 -0.4645 -0.4561 -0.4561 -0.3263 -0.3263 -0.2653 -0.2653 -0.1735 -0.1735 -0.1140 -0.1140 -0.0728 -0.0728 -0.0422 -0.0422 0.0486 0.0486 k = 0.4722 0.2726 0.2948 ( 26273 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9322 -12.9322 -12.4612 -12.4612 -12.2965 -12.2965 -12.2929 -12.2929 -12.1656 -12.1656 -12.1596 -12.1596 -11.6111 -11.6111 -11.5356 -11.5356 -11.5215 -11.5215 -3.2195 -3.2195 -3.0881 -3.0881 -3.0780 -3.0780 -2.6491 -2.6491 -2.6468 -2.6468 -2.5470 -2.5470 -2.0917 -2.0917 -1.9341 -1.9341 -1.8250 -1.8250 -1.7299 -1.7299 -1.6453 -1.6453 -1.5785 -1.5785 -1.2640 -1.2640 -1.1269 -1.1269 -1.0601 -1.0601 -0.8728 -0.8728 -0.7297 -0.7297 -0.6903 -0.6903 -0.4829 -0.4829 -0.4578 -0.4578 -0.4527 -0.4527 -0.3227 -0.3227 -0.2605 -0.2605 -0.1748 -0.1748 -0.1172 -0.1172 -0.0687 -0.0687 -0.0387 -0.0387 0.0452 0.0452 k = 0.4653 0.2686 0.3175 ( 26264 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9316 -12.9316 -12.4589 -12.4589 -12.2975 -12.2975 -12.2933 -12.2933 -12.1687 -12.1687 -12.1594 -12.1594 -11.6097 -11.6097 -11.5354 -11.5354 -11.5220 -11.5220 -3.2135 -3.2135 -3.0857 -3.0857 -3.0697 -3.0697 -2.6474 -2.6474 -2.6436 -2.6436 -2.5470 -2.5470 -2.0864 -2.0864 -1.9589 -1.9589 -1.8350 -1.8350 -1.7381 -1.7381 -1.6595 -1.6595 -1.5711 -1.5711 -1.2629 -1.2629 -1.1228 -1.1228 -1.0625 -1.0625 -0.8779 -0.8779 -0.7238 -0.7238 -0.6849 -0.6849 -0.4811 -0.4811 -0.4556 -0.4556 -0.4440 -0.4440 -0.3181 -0.3181 -0.2553 -0.2553 -0.1754 -0.1754 -0.1195 -0.1195 -0.0669 -0.0669 -0.0328 -0.0328 0.0416 0.0416 k = 0.4583 0.2646 0.3402 ( 26267 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9309 -12.9309 -12.4562 -12.4562 -12.2988 -12.2988 -12.2937 -12.2937 -12.1723 -12.1723 -12.1591 -12.1591 -11.6080 -11.6080 -11.5352 -11.5352 -11.5226 -11.5226 -3.2064 -3.2064 -3.0830 -3.0830 -3.0594 -3.0594 -2.6454 -2.6454 -2.6400 -2.6400 -2.5469 -2.5469 -2.0803 -2.0803 -1.9881 -1.9881 -1.8460 -1.8460 -1.7462 -1.7462 -1.6763 -1.6763 -1.5638 -1.5638 -1.2624 -1.2624 -1.1182 -1.1182 -1.0638 -1.0638 -0.8834 -0.8834 -0.7184 -0.7184 -0.6772 -0.6772 -0.4793 -0.4793 -0.4545 -0.4545 -0.4346 -0.4346 -0.3127 -0.3127 -0.2508 -0.2508 -0.1749 -0.1749 -0.1208 -0.1208 -0.0670 -0.0670 -0.0254 -0.0254 0.0384 0.0384 k = 0.4514 0.2606 0.3629 ( 26263 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9300 -12.9300 -12.4530 -12.4530 -12.3004 -12.3004 -12.2942 -12.2942 -12.1764 -12.1764 -12.1588 -12.1588 -11.6062 -11.6062 -11.5349 -11.5349 -11.5232 -11.5232 -3.1986 -3.1986 -3.0797 -3.0797 -3.0471 -3.0471 -2.6431 -2.6431 -2.6357 -2.6357 -2.5468 -2.5468 -2.0747 -2.0747 -2.0200 -2.0200 -1.8575 -1.8575 -1.7554 -1.7554 -1.6944 -1.6944 -1.5570 -1.5570 -1.2630 -1.2630 -1.1130 -1.1130 -1.0639 -1.0639 -0.8888 -0.8888 -0.7124 -0.7124 -0.6690 -0.6690 -0.4776 -0.4776 -0.4536 -0.4536 -0.4258 -0.4258 -0.3070 -0.3070 -0.2477 -0.2477 -0.1729 -0.1729 -0.1211 -0.1211 -0.0678 -0.0678 -0.0187 -0.0187 0.0365 0.0365 k = 0.4444 0.2566 0.3856 ( 26269 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9292 -12.9292 -12.4493 -12.4493 -12.3022 -12.3022 -12.2946 -12.2946 -12.1809 -12.1809 -12.1585 -12.1585 -11.6042 -11.6042 -11.5347 -11.5347 -11.5240 -11.5240 -3.1902 -3.1902 -3.0760 -3.0760 -3.0329 -3.0329 -2.6406 -2.6406 -2.6310 -2.6310 -2.5467 -2.5467 -2.0762 -2.0762 -2.0466 -2.0466 -1.8692 -1.8692 -1.7671 -1.7671 -1.7126 -1.7126 -1.5508 -1.5508 -1.2646 -1.2646 -1.1072 -1.1072 -1.0631 -1.0631 -0.8935 -0.8935 -0.7054 -0.7054 -0.6614 -0.6614 -0.4761 -0.4761 -0.4530 -0.4530 -0.4180 -0.4180 -0.3018 -0.3018 -0.2460 -0.2460 -0.1701 -0.1701 -0.1203 -0.1203 -0.0681 -0.0681 -0.0149 -0.0149 0.0366 0.0366 k = 0.4375 0.2526 0.4082 ( 26283 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8605 -56.8605 -12.9283 -12.9283 -12.4453 -12.4453 -12.3042 -12.3042 -12.2950 -12.2950 -12.1857 -12.1857 -12.1582 -12.1582 -11.6021 -11.6021 -11.5344 -11.5344 -11.5247 -11.5247 -3.1813 -3.1813 -3.0719 -3.0719 -3.0169 -3.0169 -2.6380 -2.6380 -2.6262 -2.6262 -2.5466 -2.5466 -2.1032 -2.1032 -2.0490 -2.0490 -1.8811 -1.8811 -1.7822 -1.7822 -1.7296 -1.7296 -1.5454 -1.5454 -1.2673 -1.2673 -1.1005 -1.1005 -1.0615 -1.0615 -0.8970 -0.8970 -0.6975 -0.6975 -0.6548 -0.6548 -0.4747 -0.4747 -0.4529 -0.4529 -0.4111 -0.4111 -0.2982 -0.2982 -0.2448 -0.2448 -0.1677 -0.1677 -0.1187 -0.1187 -0.0670 -0.0670 -0.0150 -0.0150 0.0389 0.0389 k = 0.4306 0.2486 0.4309 ( 26260 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9273 -12.9273 -12.4410 -12.4410 -12.3065 -12.3065 -12.2955 -12.2955 -12.1908 -12.1908 -12.1578 -12.1578 -11.6000 -11.6000 -11.5342 -11.5342 -11.5255 -11.5255 -3.1720 -3.1720 -3.0672 -3.0672 -2.9993 -2.9993 -2.6349 -2.6349 -2.6211 -2.6211 -2.5462 -2.5462 -2.1398 -2.1398 -2.0423 -2.0423 -1.8930 -1.8930 -1.8007 -1.8007 -1.7452 -1.7452 -1.5407 -1.5407 -1.2705 -1.2705 -1.0931 -1.0931 -1.0593 -1.0593 -0.8990 -0.8990 -0.6896 -0.6896 -0.6486 -0.6486 -0.4737 -0.4737 -0.4531 -0.4531 -0.4050 -0.4050 -0.2970 -0.2970 -0.2431 -0.2431 -0.1663 -0.1663 -0.1170 -0.1170 -0.0636 -0.0636 -0.0180 -0.0180 0.0424 0.0424 k = 0.4236 0.2446 0.4536 ( 26243 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9264 -12.9264 -12.4363 -12.4363 -12.3088 -12.3088 -12.2960 -12.2960 -12.1960 -12.1960 -12.1574 -12.1574 -11.5979 -11.5979 -11.5339 -11.5339 -11.5263 -11.5263 -3.1623 -3.1623 -3.0621 -3.0621 -2.9806 -2.9806 -2.6317 -2.6317 -2.6159 -2.6159 -2.5456 -2.5456 -2.1774 -2.1774 -2.0345 -2.0345 -1.9050 -1.9050 -1.8214 -1.8214 -1.7598 -1.7598 -1.5371 -1.5371 -1.2737 -1.2737 -1.0853 -1.0853 -1.0567 -1.0567 -0.8991 -0.8991 -0.6832 -0.6832 -0.6416 -0.6416 -0.4729 -0.4729 -0.4538 -0.4538 -0.3995 -0.3995 -0.2986 -0.2986 -0.2407 -0.2407 -0.1663 -0.1663 -0.1154 -0.1154 -0.0583 -0.0583 -0.0219 -0.0219 0.0460 0.0460 k = 0.4167 0.2406 0.4763 ( 26235 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9255 -12.9255 -12.4314 -12.4314 -12.3113 -12.3113 -12.2964 -12.2964 -12.2012 -12.2012 -12.1570 -12.1570 -11.5958 -11.5958 -11.5338 -11.5338 -11.5270 -11.5270 -3.1524 -3.1524 -3.0567 -3.0567 -2.9612 -2.9612 -2.6286 -2.6286 -2.6111 -2.6111 -2.5449 -2.5449 -2.2141 -2.2141 -2.0273 -2.0273 -1.9173 -1.9173 -1.8429 -1.8429 -1.7741 -1.7741 -1.5346 -1.5346 -1.2765 -1.2765 -1.0776 -1.0776 -1.0534 -1.0534 -0.8973 -0.8973 -0.6797 -0.6797 -0.6324 -0.6324 -0.4728 -0.4728 -0.4548 -0.4548 -0.3945 -0.3945 -0.3026 -0.3026 -0.2383 -0.2383 -0.1677 -0.1677 -0.1136 -0.1136 -0.0533 -0.0533 -0.0243 -0.0243 0.0494 0.0494 k = 0.4097 0.2366 0.4990 ( 26233 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9246 -12.9246 -12.4263 -12.4263 -12.3138 -12.3138 -12.2969 -12.2969 -12.2064 -12.2064 -12.1565 -12.1565 -11.5938 -11.5938 -11.5337 -11.5337 -11.5275 -11.5275 -3.1423 -3.1423 -3.0508 -3.0508 -2.9420 -2.9420 -2.6254 -2.6254 -2.6066 -2.6066 -2.5441 -2.5441 -2.2489 -2.2489 -2.0216 -2.0216 -1.9300 -1.9300 -1.8637 -1.8637 -1.7883 -1.7883 -1.5334 -1.5334 -1.2784 -1.2784 -1.0706 -1.0706 -1.0495 -1.0495 -0.8937 -0.8937 -0.6795 -0.6795 -0.6208 -0.6208 -0.4734 -0.4734 -0.4557 -0.4557 -0.3901 -0.3901 -0.3082 -0.3082 -0.2369 -0.2369 -0.1700 -0.1700 -0.1111 -0.1111 -0.0515 -0.0515 -0.0219 -0.0219 0.0527 0.0527 k = 0.4028 0.2325 0.5217 ( 26231 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9239 -12.9239 -12.4212 -12.4212 -12.3163 -12.3163 -12.2974 -12.2974 -12.2116 -12.2116 -12.1561 -12.1561 -11.5920 -11.5920 -11.5339 -11.5339 -11.5279 -11.5279 -3.1320 -3.1320 -3.0445 -3.0445 -2.9237 -2.9237 -2.6222 -2.6222 -2.6027 -2.6027 -2.5430 -2.5430 -2.2806 -2.2806 -2.0182 -2.0182 -1.9437 -1.9437 -1.8821 -1.8821 -1.8022 -1.8022 -1.5337 -1.5337 -1.2789 -1.2789 -1.0646 -1.0646 -1.0447 -1.0447 -0.8883 -0.8883 -0.6816 -0.6816 -0.6075 -0.6075 -0.4751 -0.4751 -0.4564 -0.4564 -0.3861 -0.3861 -0.3146 -0.3146 -0.2370 -0.2370 -0.1729 -0.1729 -0.1076 -0.1076 -0.0531 -0.0531 -0.0149 -0.0149 0.0560 0.0561 k = 0.3958 0.2285 0.5443 ( 26221 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9233 -12.9233 -12.4161 -12.4161 -12.3186 -12.3186 -12.2979 -12.2979 -12.2165 -12.2165 -12.1556 -12.1556 -11.5904 -11.5904 -11.5342 -11.5342 -11.5280 -11.5280 -3.1216 -3.1216 -3.0379 -3.0379 -2.9073 -2.9073 -2.6193 -2.6193 -2.5994 -2.5994 -2.5417 -2.5417 -2.3084 -2.3084 -2.0179 -2.0179 -1.9590 -1.9590 -1.8967 -1.8967 -1.8153 -1.8153 -1.5352 -1.5352 -1.2783 -1.2783 -1.0594 -1.0594 -1.0395 -1.0395 -0.8816 -0.8816 -0.6848 -0.6848 -0.5935 -0.5935 -0.4778 -0.4778 -0.4563 -0.4563 -0.3828 -0.3828 -0.3212 -0.3212 -0.2389 -0.2389 -0.1761 -0.1761 -0.1029 -0.1029 -0.0555 -0.0555 -0.0060 -0.0060 0.0596 0.0596 k = 0.3889 0.2245 0.5670 ( 26229 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9228 -12.9228 -12.4111 -12.4111 -12.3206 -12.3206 -12.2984 -12.2984 -12.2211 -12.2211 -12.1552 -12.1552 -11.5891 -11.5891 -11.5347 -11.5347 -11.5280 -11.5280 -3.1110 -3.1110 -3.0310 -3.0310 -2.8940 -2.8940 -2.6167 -2.6167 -2.5969 -2.5969 -2.5402 -2.5402 -2.3314 -2.3314 -2.0209 -2.0209 -1.9758 -1.9758 -1.9078 -1.9078 -1.8267 -1.8267 -1.5379 -1.5379 -1.2765 -1.2765 -1.0549 -1.0549 -1.0340 -1.0340 -0.8743 -0.8743 -0.6882 -0.6882 -0.5795 -0.5795 -0.4814 -0.4814 -0.4556 -0.4556 -0.3803 -0.3803 -0.3278 -0.3278 -0.2423 -0.2423 -0.1797 -0.1797 -0.0974 -0.0974 -0.0572 -0.0572 0.0028 0.0028 0.0635 0.0635 k = 0.3819 0.2205 0.5897 ( 26229 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4064 -12.4064 -12.3222 -12.3222 -12.2988 -12.2988 -12.2254 -12.2254 -12.1547 -12.1547 -11.5881 -11.5881 -11.5353 -11.5353 -11.5277 -11.5277 -3.1003 -3.1003 -3.0238 -3.0238 -2.8848 -2.8848 -2.6146 -2.6146 -2.5951 -2.5951 -2.5385 -2.5385 -2.3490 -2.3490 -2.0268 -2.0268 -1.9931 -1.9931 -1.9172 -1.9172 -1.8352 -1.8352 -1.5414 -1.5414 -1.2742 -1.2742 -1.0512 -1.0512 -1.0279 -1.0279 -0.8672 -0.8672 -0.6904 -0.6904 -0.5665 -0.5665 -0.4855 -0.4855 -0.4542 -0.4542 -0.3789 -0.3789 -0.3337 -0.3337 -0.2463 -0.2463 -0.1832 -0.1832 -0.0912 -0.0912 -0.0576 -0.0576 0.0108 0.0108 0.0680 0.0680 k = 0.3750 0.2165 0.6124 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.6250-0.0722 0.4082 ( 26228 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9226 -12.9226 -12.4021 -12.4021 -12.3232 -12.3232 -12.2993 -12.2993 -12.2293 -12.2293 -12.1543 -12.1543 -11.5874 -11.5874 -11.5359 -11.5359 -11.5273 -11.5273 -3.0897 -3.0897 -3.0165 -3.0165 -2.8805 -2.8805 -2.6130 -2.6130 -2.5938 -2.5938 -2.5368 -2.5368 -2.3609 -2.3609 -2.0347 -2.0347 -2.0092 -2.0092 -1.9268 -1.9268 -1.8403 -1.8403 -1.5453 -1.5453 -1.2719 -1.2719 -1.0488 -1.0488 -1.0203 -1.0203 -0.8612 -0.8612 -0.6906 -0.6906 -0.5550 -0.5550 -0.4894 -0.4894 -0.4522 -0.4522 -0.3792 -0.3792 -0.3388 -0.3388 -0.2501 -0.2501 -0.1864 -0.1864 -0.0845 -0.0845 -0.0568 -0.0568 0.0174 0.0174 0.0727 0.0727 k = 0.6136-0.0919 0.4082 ( 26208 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9229 -12.9229 -12.3952 -12.3952 -12.3243 -12.3243 -12.3000 -12.3000 -12.2355 -12.2355 -12.1535 -12.1535 -11.5866 -11.5866 -11.5370 -11.5370 -11.5265 -11.5265 -3.0718 -3.0718 -3.0041 -3.0041 -2.8770 -2.8770 -2.6111 -2.6111 -2.5922 -2.5922 -2.5346 -2.5346 -2.3778 -2.3778 -2.0507 -2.0507 -2.0318 -2.0318 -1.9446 -1.9446 -1.8426 -1.8426 -1.5521 -1.5521 -1.2679 -1.2679 -1.0463 -1.0463 -1.0059 -1.0059 -0.8553 -0.8553 -0.6859 -0.6859 -0.5396 -0.5396 -0.4955 -0.4955 -0.4473 -0.4473 -0.3816 -0.3816 -0.3460 -0.3460 -0.2557 -0.2557 -0.1914 -0.1914 -0.0736 -0.0736 -0.0539 -0.0539 0.0260 0.0260 0.0805 0.0805 k = 0.6023-0.1115 0.4082 ( 26216 PWs) bands (ev): -92.9985 -92.9985 -58.6084 -58.6084 -56.8604 -56.8604 -56.8604 -56.8604 -12.9234 -12.9234 -12.3879 -12.3879 -12.3253 -12.3253 -12.3007 -12.3007 -12.2419 -12.2419 -12.1528 -12.1528 -11.5859 -11.5859 -11.5380 -11.5380 -11.5258 -11.5258 -3.0532 -3.0532 -2.9918 -2.9918 -2.8725 -2.8725 -2.6097 -2.6097 -2.5910 -2.5910 -2.5330 -2.5330 -2.3982 -2.3982 -2.0712 -2.0712 -2.0499 -2.0499 -1.9623 -1.9623 -1.8409 -1.8409 -1.5592 -1.5592 -1.2637 -1.2637 -1.0440 -1.0440 -0.9910 -0.9910 -0.8541 -0.8541 -0.6763 -0.6763 -0.5275 -0.5275 -0.5019 -0.5019 -0.4403 -0.4403 -0.3855 -0.3855 -0.3528 -0.3528 -0.2612 -0.2612 -0.1970 -0.1970 -0.0634 -0.0634 -0.0498 -0.0498 0.0327 0.0328 0.0873 0.0873 k = 0.5909-0.1312 0.4082 ( 26228 PWs) bands (ev): -92.9985 -92.9985 -58.6085 -58.6085 -56.8604 -56.8604 -56.8604 -56.8604 -12.9239 -12.9239 -12.3802 -12.3802 -12.3262 -12.3262 -12.3014 -12.3014 -12.2486 -12.2486 -12.1521 -12.1521 -11.5854 -11.5854 -11.5389 -11.5389 -11.5251 -11.5251 -3.0344 -3.0344 -2.9800 -2.9800 -2.8666 -2.8666 -2.6086 -2.6086 -2.5898 -2.5898 -2.5319 -2.5319 -2.4217 -2.4217 -2.0953 -2.0953 -2.0636 -2.0636 -1.9779 -1.9779 -1.8371 -1.8371 -1.5663 -1.5663 -1.2593 -1.2593 -1.0415 -1.0415 -0.9762 -0.9762 -0.8565 -0.8565 -0.6632 -0.6632 -0.5185 -0.5185 -0.5084 -0.5084 -0.4315 -0.4315 -0.3912 -0.3912 -0.3582 -0.3582 -0.2664 -0.2664 -0.2029 -0.2029 -0.0544 -0.0544 -0.0447 -0.0447 0.0386 0.0386 0.0931 0.0931 k = 0.5795-0.1509 0.4082 ( 26244 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9246 -12.9246 -12.3721 -12.3721 -12.3271 -12.3271 -12.3020 -12.3020 -12.2555 -12.2555 -12.1515 -12.1515 -11.5851 -11.5851 -11.5398 -11.5398 -11.5244 -11.5244 -3.0157 -3.0157 -2.9691 -2.9691 -2.8588 -2.8588 -2.6079 -2.6079 -2.5888 -2.5888 -2.5310 -2.5310 -2.4477 -2.4477 -2.1211 -2.1211 -2.0740 -2.0740 -1.9909 -1.9909 -1.8324 -1.8324 -1.5730 -1.5730 -1.2551 -1.2551 -1.0390 -1.0390 -0.9618 -0.9618 -0.8611 -0.8611 -0.6485 -0.6485 -0.5154 -0.5154 -0.5113 -0.5113 -0.4220 -0.4220 -0.3985 -0.3985 -0.3618 -0.3618 -0.2711 -0.2711 -0.2092 -0.2092 -0.0471 -0.0471 -0.0387 -0.0387 0.0440 0.0440 0.0980 0.0980 k = 0.5682-0.1706 0.4082 ( 26270 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9252 -12.9252 -12.3638 -12.3638 -12.3279 -12.3279 -12.3025 -12.3025 -12.2627 -12.2627 -12.1510 -12.1510 -11.5849 -11.5849 -11.5405 -11.5405 -11.5239 -11.5239 -2.9975 -2.9975 -2.9596 -2.9596 -2.8488 -2.8488 -2.6074 -2.6074 -2.5880 -2.5880 -2.5306 -2.5306 -2.4751 -2.4751 -2.1471 -2.1471 -2.0818 -2.0818 -2.0015 -2.0015 -1.8274 -1.8274 -1.5792 -1.5792 -1.2512 -1.2512 -1.0366 -1.0366 -0.9483 -0.9483 -0.8665 -0.8665 -0.6339 -0.6339 -0.5215 -0.5215 -0.5064 -0.5064 -0.4130 -0.4130 -0.4065 -0.4065 -0.3636 -0.3636 -0.2755 -0.2755 -0.2156 -0.2156 -0.0415 -0.0415 -0.0325 -0.0325 0.0493 0.0493 0.1023 0.1023 k = 0.5568-0.1903 0.4082 ( 26258 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9258 -12.9258 -12.3553 -12.3553 -12.3285 -12.3285 -12.3030 -12.3030 -12.2700 -12.2700 -12.1505 -12.1505 -11.5847 -11.5847 -11.5411 -11.5411 -11.5234 -11.5234 -2.9804 -2.9804 -2.9518 -2.9518 -2.8366 -2.8366 -2.6070 -2.6070 -2.5869 -2.5869 -2.5300 -2.5300 -2.5030 -2.5030 -2.1718 -2.1718 -2.0874 -2.0874 -2.0100 -2.0100 -1.8225 -1.8225 -1.5846 -1.5846 -1.2478 -1.2478 -1.0342 -1.0342 -0.9359 -0.9359 -0.8720 -0.8720 -0.6205 -0.6205 -0.5275 -0.5275 -0.5020 -0.5020 -0.4146 -0.4146 -0.4054 -0.4054 -0.3633 -0.3633 -0.2793 -0.2793 -0.2217 -0.2217 -0.0372 -0.0372 -0.0267 -0.0267 0.0544 0.0544 0.1058 0.1058 k = 0.5455-0.2099 0.4082 ( 26272 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9264 -12.9264 -12.3468 -12.3468 -12.3291 -12.3291 -12.3034 -12.3034 -12.2776 -12.2776 -12.1501 -12.1501 -11.5846 -11.5846 -11.5416 -11.5416 -11.5229 -11.5229 -2.9653 -2.9653 -2.9458 -2.9458 -2.8226 -2.8226 -2.6069 -2.6069 -2.5862 -2.5862 -2.5311 -2.5311 -2.5290 -2.5290 -2.1938 -2.1938 -2.0914 -2.0914 -2.0168 -2.0168 -1.8182 -1.8182 -1.5893 -1.5893 -1.2450 -1.2450 -1.0322 -1.0322 -0.9252 -0.9252 -0.8768 -0.8768 -0.6093 -0.6093 -0.5329 -0.5329 -0.4980 -0.4980 -0.4218 -0.4218 -0.4005 -0.4005 -0.3612 -0.3612 -0.2827 -0.2827 -0.2273 -0.2273 -0.0339 -0.0339 -0.0218 -0.0218 0.0592 0.0592 0.1086 0.1086 k = 0.5341-0.2296 0.4082 ( 26272 PWs) bands (ev): -92.9987 -92.9987 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9268 -12.9268 -12.3383 -12.3383 -12.3295 -12.3295 -12.3038 -12.3038 -12.2852 -12.2852 -12.1497 -12.1497 -11.5846 -11.5846 -11.5420 -11.5420 -11.5226 -11.5226 -2.9526 -2.9526 -2.9415 -2.9415 -2.8078 -2.8078 -2.6067 -2.6067 -2.5854 -2.5854 -2.5559 -2.5559 -2.5293 -2.5293 -2.2123 -2.2123 -2.0941 -2.0941 -2.0220 -2.0220 -1.8145 -1.8145 -1.5930 -1.5930 -1.2428 -1.2428 -1.0304 -1.0304 -0.9166 -0.9166 -0.8804 -0.8804 -0.6005 -0.6005 -0.5376 -0.5376 -0.4943 -0.4943 -0.4279 -0.4279 -0.3979 -0.3979 -0.3576 -0.3576 -0.2857 -0.2857 -0.2321 -0.2321 -0.0315 -0.0315 -0.0180 -0.0180 0.0634 0.0634 0.1106 0.1106 k = 0.5227-0.2493 0.4082 ( 26280 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9271 -12.9271 -12.3307 -12.3307 -12.3290 -12.3290 -12.3041 -12.3041 -12.2928 -12.2928 -12.1495 -12.1495 -11.5846 -11.5846 -11.5423 -11.5423 -11.5224 -11.5224 -2.9431 -2.9431 -2.9384 -2.9384 -2.7939 -2.7939 -2.6068 -2.6068 -2.5849 -2.5849 -2.5774 -2.5774 -2.5292 -2.5292 -2.2262 -2.2262 -2.0959 -2.0959 -2.0256 -2.0256 -1.8117 -1.8117 -1.5957 -1.5957 -1.2412 -1.2412 -1.0291 -1.0291 -0.9107 -0.9107 -0.8827 -0.8827 -0.5943 -0.5943 -0.5412 -0.5412 -0.4912 -0.4912 -0.4322 -0.4322 -0.3970 -0.3970 -0.3538 -0.3538 -0.2882 -0.2882 -0.2358 -0.2358 -0.0298 -0.0298 -0.0153 -0.0153 0.0668 0.0668 0.1119 0.1119 k = 0.5114-0.2690 0.4082 ( 26288 PWs) bands (ev): -92.9988 -92.9988 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9274 -12.9274 -12.3302 -12.3302 -12.3222 -12.3222 -12.3046 -12.3046 -12.2997 -12.2997 -12.1494 -12.1494 -11.5846 -11.5846 -11.5424 -11.5424 -11.5222 -11.5222 -2.9375 -2.9375 -2.9364 -2.9364 -2.7835 -2.7835 -2.6066 -2.6066 -2.5926 -2.5926 -2.5846 -2.5846 -2.5292 -2.5292 -2.2349 -2.2349 -2.0969 -2.0969 -2.0278 -2.0278 -1.8100 -1.8100 -1.5973 -1.5973 -1.2403 -1.2403 -1.0283 -1.0283 -0.9074 -0.9074 -0.8836 -0.8836 -0.5907 -0.5907 -0.5434 -0.5434 -0.4892 -0.4892 -0.4350 -0.4350 -0.3968 -0.3968 -0.3510 -0.3510 -0.2899 -0.2899 -0.2382 -0.2382 -0.0289 -0.0289 -0.0137 -0.0137 0.0690 0.0690 0.1127 0.1127 k = 0.5000-0.2887 0.4082 ( 26238 PWs) bands (ev): -92.9986 -92.9986 -58.6085 -58.6085 -56.8605 -56.8605 -56.8604 -56.8604 -12.9274 -12.9274 -12.3302 -12.3302 -12.3181 -12.3181 -12.3058 -12.3058 -12.3025 -12.3025 -12.1493 -12.1493 -11.5846 -11.5846 -11.5425 -11.5425 -11.5222 -11.5222 -2.9361 -2.9361 -2.9346 -2.9346 -2.7795 -2.7795 -2.6061 -2.6061 -2.5982 -2.5982 -2.5842 -2.5842 -2.5289 -2.5289 -2.2378 -2.2378 -2.0972 -2.0972 -2.0285 -2.0285 -1.8094 -1.8094 -1.5979 -1.5979 -1.2400 -1.2400 -1.0280 -1.0280 -0.9064 -0.9064 -0.8838 -0.8838 -0.5895 -0.5895 -0.5442 -0.5442 -0.4884 -0.4884 -0.4356 -0.4356 -0.3968 -0.3968 -0.3499 -0.3499 -0.2903 -0.2903 -0.2388 -0.2388 -0.0285 -0.0285 -0.0132 -0.0132 0.0698 0.0698 0.1129 0.1129 Writing output data file CoxIN2x3.save init_run : 0.70s CPU 0.82s WALL ( 1 calls) electrons : 622.98s CPU 628.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.06s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 622.97s CPU 628.05s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.06s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.19s WALL ( 201 calls) cegterg : 568.10s CPU 571.92s WALL ( 254 calls) Called by sum_band: Called by *egterg: h_psi : 446.47s CPU 450.36s WALL ( 4138 calls) s_psi : 11.73s CPU 11.77s WALL ( 4138 calls) g_psi : 0.78s CPU 0.75s WALL ( 3683 calls) cdiaghg : 81.64s CPU 81.95s WALL ( 3884 calls) cegterg:over : 27.10s CPU 27.11s WALL ( 3683 calls) cegterg:upda : 21.02s CPU 21.18s WALL ( 3683 calls) cegterg:last : 15.69s CPU 15.60s WALL ( 805 calls) cdiaghg:chol : 3.67s CPU 3.64s WALL ( 3884 calls) cdiaghg:inve : 2.59s CPU 2.59s WALL ( 3884 calls) cdiaghg:para : 5.37s CPU 5.35s WALL ( 7768 calls) Called by h_psi: h_psi:vloc : 415.92s CPU 419.80s WALL ( 4138 calls) h_psi:vnl : 29.69s CPU 29.77s WALL ( 4138 calls) add_vuspsi : 13.82s CPU 13.95s WALL ( 4138 calls) General routines calbec : 15.82s CPU 15.81s WALL ( 4138 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 399.17s CPU 403.33s WALL ( 779124 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.24s CPU 0.56s WALL ( 402 calls) Parallel routines fft_scatter : 179.85s CPU 181.92s WALL ( 779147 calls) PWSCF : 11m37.37s CPU 12m 0.99s WALL This run was terminated on: 12:26: 2 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=