Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:23:23 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./SrxMnPx2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 38 38 10 1924 1924 286 Max 39 39 11 1930 1930 297 Sum 1369 1369 379 69353 69353 10451 bravais-lattice index = 14 lattice parameter (alat) = 7.8541 a.u. unit-cell volume = 716.3638 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 50.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.854079 celldm(2)= 1.000000 celldm(3)= 1.707329 celldm(4)= 0.000000 celldm(5)= 0.000000 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) = ( 0.000000 0.000000 1.707329 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.585710 ) PseudoPot. # 1 for Mn read from file: /users/gautes/Pseudo/Mn.rel-pbe-oncvpsp.UPF MD5 check sum: d838f0974ec4eb0180564ac5264e0bcc Pseudo is Norm-conserving, Zval = 15.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1464 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 Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Mn 15.00 54.93800 Mn( 1.00) Sr 10.00 87.62000 Sr( 1.00) P 5.00 30.97380 P( 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 ) ( 0 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) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 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) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 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) = ( -1 -1 0 ) ( 0 1 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) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -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 ) ( 0 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) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 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) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -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) = ( 1 1 0 ) ( 0 -1 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) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 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= 320 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0113636 0.0065608 -0.0000000), wk = 0.0031250 k( 3) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0031250 k( 4) = ( 0.0340909 0.0196824 -0.0000000), wk = 0.0031250 k( 5) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0031250 k( 6) = ( 0.0568182 0.0328040 -0.0000000), wk = 0.0031250 k( 7) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0031250 k( 8) = ( 0.0795455 0.0459256 -0.0000000), wk = 0.0031250 k( 9) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0031250 k( 10) = ( 0.1022727 0.0590472 -0.0000000), wk = 0.0031250 k( 11) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0031250 k( 12) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0031250 k( 13) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0031250 k( 14) = ( 0.1477273 0.0852904 -0.0000000), wk = 0.0031250 k( 15) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0031250 k( 16) = ( 0.1704546 0.0984120 -0.0000000), wk = 0.0031250 k( 17) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0031250 k( 18) = ( 0.1931818 0.1115336 -0.0000000), wk = 0.0031250 k( 19) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0031250 k( 20) = ( 0.2159091 0.1246552 -0.0000000), wk = 0.0031250 k( 21) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0031250 k( 22) = ( 0.2386364 0.1377768 -0.0000000), wk = 0.0031250 k( 23) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0031250 k( 24) = ( 0.2613636 0.1508984 -0.0000000), wk = 0.0031250 k( 25) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0031250 k( 26) = ( 0.2840909 0.1640200 -0.0000000), wk = 0.0031250 k( 27) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0031250 k( 28) = ( 0.3068182 0.1771416 -0.0000000), wk = 0.0031250 k( 29) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0031250 k( 30) = ( 0.3295455 0.1902632 -0.0000000), wk = 0.0031250 k( 31) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0031250 k( 32) = ( 0.3522727 0.2033848 -0.0000000), wk = 0.0031250 k( 33) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0031250 k( 34) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0031250 k( 35) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0031250 k( 36) = ( 0.3977273 0.2296279 -0.0000000), wk = 0.0031250 k( 37) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0031250 k( 38) = ( 0.4204545 0.2427495 -0.0000000), wk = 0.0031250 k( 39) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0031250 k( 40) = ( 0.4431818 0.2558711 -0.0000000), wk = 0.0031250 k( 41) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0031250 k( 42) = ( 0.4659091 0.2689927 -0.0000000), wk = 0.0031250 k( 43) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0031250 k( 44) = ( 0.4886364 0.2821143 -0.0000000), wk = 0.0031250 k( 45) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031250 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031250 k( 47) = ( 0.4935897 0.2997780 -0.0000000), wk = 0.0031250 k( 48) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0031250 k( 49) = ( 0.4807692 0.3219838 -0.0000000), wk = 0.0031250 k( 50) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0031250 k( 51) = ( 0.4679487 0.3441896 -0.0000000), wk = 0.0031250 k( 52) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0031250 k( 53) = ( 0.4551282 0.3663954 -0.0000000), wk = 0.0031250 k( 54) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0031250 k( 55) = ( 0.4423077 0.3886011 -0.0000000), wk = 0.0031250 k( 56) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0031250 k( 57) = ( 0.4294872 0.4108069 -0.0000000), wk = 0.0031250 k( 58) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0031250 k( 59) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0031250 k( 60) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0031250 k( 61) = ( 0.4038462 0.4552185 -0.0000000), wk = 0.0031250 k( 62) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0031250 k( 63) = ( 0.3910256 0.4774243 -0.0000000), wk = 0.0031250 k( 64) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0031250 k( 65) = ( 0.3782051 0.4996300 -0.0000000), wk = 0.0031250 k( 66) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0031250 k( 67) = ( 0.3653846 0.5218358 -0.0000000), wk = 0.0031250 k( 68) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0031250 k( 69) = ( 0.3525641 0.5440416 -0.0000000), wk = 0.0031250 k( 70) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0031250 k( 71) = ( 0.3397436 0.5662474 -0.0000000), wk = 0.0031250 k( 72) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031250 k( 73) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031250 k( 74) = ( 0.3267974 0.5660297 -0.0000000), wk = 0.0031250 k( 75) = ( 0.3202614 0.5547091 -0.0000000), wk = 0.0031250 k( 76) = ( 0.3137255 0.5433885 -0.0000000), wk = 0.0031250 k( 77) = ( 0.3071895 0.5320679 -0.0000000), wk = 0.0031250 k( 78) = ( 0.3006536 0.5207473 -0.0000000), wk = 0.0031250 k( 79) = ( 0.2941177 0.5094267 -0.0000000), wk = 0.0031250 k( 80) = ( 0.2875817 0.4981061 -0.0000000), wk = 0.0031250 k( 81) = ( 0.2810457 0.4867855 -0.0000000), wk = 0.0031250 k( 82) = ( 0.2745098 0.4754649 -0.0000000), wk = 0.0031250 k( 83) = ( 0.2679739 0.4641443 -0.0000000), wk = 0.0031250 k( 84) = ( 0.2614379 0.4528237 -0.0000000), wk = 0.0031250 k( 85) = ( 0.2549020 0.4415031 -0.0000000), wk = 0.0031250 k( 86) = ( 0.2483660 0.4301825 -0.0000000), wk = 0.0031250 k( 87) = ( 0.2418301 0.4188620 -0.0000000), wk = 0.0031250 k( 88) = ( 0.2352941 0.4075414 -0.0000000), wk = 0.0031250 k( 89) = ( 0.2287582 0.3962208 -0.0000000), wk = 0.0031250 k( 90) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0031250 k( 91) = ( 0.2156863 0.3735796 -0.0000000), wk = 0.0031250 k( 92) = ( 0.2091503 0.3622590 -0.0000000), wk = 0.0031250 k( 93) = ( 0.2026144 0.3509384 -0.0000000), wk = 0.0031250 k( 94) = ( 0.1960784 0.3396178 -0.0000000), wk = 0.0031250 k( 95) = ( 0.1895425 0.3282972 -0.0000000), wk = 0.0031250 k( 96) = ( 0.1830065 0.3169766 -0.0000000), wk = 0.0031250 k( 97) = ( 0.1764706 0.3056560 -0.0000000), wk = 0.0031250 k( 98) = ( 0.1699346 0.2943354 -0.0000000), wk = 0.0031250 k( 99) = ( 0.1633987 0.2830148 -0.0000000), wk = 0.0031250 k( 100) = ( 0.1568627 0.2716943 -0.0000000), wk = 0.0031250 k( 101) = ( 0.1503268 0.2603737 -0.0000000), wk = 0.0031250 k( 102) = ( 0.1437908 0.2490531 -0.0000000), wk = 0.0031250 k( 103) = ( 0.1372549 0.2377325 -0.0000000), wk = 0.0031250 k( 104) = ( 0.1307190 0.2264119 -0.0000000), wk = 0.0031250 k( 105) = ( 0.1241830 0.2150913 -0.0000000), wk = 0.0031250 k( 106) = ( 0.1176471 0.2037707 -0.0000000), wk = 0.0031250 k( 107) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0031250 k( 108) = ( 0.1045752 0.1811295 -0.0000000), wk = 0.0031250 k( 109) = ( 0.0980392 0.1698089 -0.0000000), wk = 0.0031250 k( 110) = ( 0.0915033 0.1584883 -0.0000000), wk = 0.0031250 k( 111) = ( 0.0849673 0.1471677 -0.0000000), wk = 0.0031250 k( 112) = ( 0.0784314 0.1358471 -0.0000000), wk = 0.0031250 k( 113) = ( 0.0718954 0.1245265 -0.0000000), wk = 0.0031250 k( 114) = ( 0.0653595 0.1132059 -0.0000000), wk = 0.0031250 k( 115) = ( 0.0588235 0.1018853 -0.0000000), wk = 0.0031250 k( 116) = ( 0.0522876 0.0905647 -0.0000000), wk = 0.0031250 k( 117) = ( 0.0457516 0.0792441 -0.0000000), wk = 0.0031250 k( 118) = ( 0.0392157 0.0679236 -0.0000000), wk = 0.0031250 k( 119) = ( 0.0326797 0.0566030 -0.0000000), wk = 0.0031250 k( 120) = ( 0.0261438 0.0452824 -0.0000000), wk = 0.0031250 k( 121) = ( 0.0196078 0.0339618 -0.0000000), wk = 0.0031250 k( 122) = ( 0.0130719 0.0226412 -0.0000000), wk = 0.0031250 k( 123) = ( 0.0065359 0.0113206 -0.0000000), wk = 0.0031250 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 126) = ( 0.0000000 0.0000000 0.0127328), wk = 0.0031250 k( 127) = ( 0.0000000 0.0000000 0.0254657), wk = 0.0031250 k( 128) = ( 0.0000000 0.0000000 0.0381985), wk = 0.0031250 k( 129) = ( 0.0000000 0.0000000 0.0509313), wk = 0.0031250 k( 130) = ( 0.0000000 0.0000000 0.0636642), wk = 0.0031250 k( 131) = ( 0.0000000 0.0000000 0.0763970), wk = 0.0031250 k( 132) = ( 0.0000000 0.0000000 0.0891298), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.1018627), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.1145955), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.1273283), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.1400611), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.1527940), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.1655268), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.1782596), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.1909925), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.2037253), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.2164581), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.2291910), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.2419238), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.2546566), wk = 0.0031250 k( 146) = ( 0.0000000 0.0000000 0.2673895), wk = 0.0031250 k( 147) = ( 0.0000000 0.0000000 0.2801223), wk = 0.0031250 k( 148) = ( 0.0000000 0.0000000 0.2928551), wk = 0.0031250 k( 149) = ( 0.0000000 0.0000000 0.2928551), wk = 0.0031250 k( 150) = ( 0.0113636 0.0065608 0.2928551), wk = 0.0031250 k( 151) = ( 0.0227273 0.0131216 0.2928551), wk = 0.0031250 k( 152) = ( 0.0340909 0.0196824 0.2928551), wk = 0.0031250 k( 153) = ( 0.0454546 0.0262432 0.2928551), wk = 0.0031250 k( 154) = ( 0.0568182 0.0328040 0.2928551), wk = 0.0031250 k( 155) = ( 0.0681818 0.0393648 0.2928551), wk = 0.0031250 k( 156) = ( 0.0795455 0.0459256 0.2928551), wk = 0.0031250 k( 157) = ( 0.0909091 0.0524864 0.2928551), wk = 0.0031250 k( 158) = ( 0.1022727 0.0590472 0.2928551), wk = 0.0031250 k( 159) = ( 0.1136364 0.0656080 0.2928551), wk = 0.0031250 k( 160) = ( 0.1250000 0.0721688 0.2928551), wk = 0.0031250 k( 161) = ( 0.1363636 0.0787296 0.2928551), wk = 0.0031250 k( 162) = ( 0.1477273 0.0852904 0.2928551), wk = 0.0031250 k( 163) = ( 0.1590909 0.0918512 0.2928551), wk = 0.0031250 k( 164) = ( 0.1704546 0.0984120 0.2928551), wk = 0.0031250 k( 165) = ( 0.1818182 0.1049728 0.2928551), wk = 0.0031250 k( 166) = ( 0.1931818 0.1115336 0.2928551), wk = 0.0031250 k( 167) = ( 0.2045454 0.1180944 0.2928551), wk = 0.0031250 k( 168) = ( 0.2159091 0.1246552 0.2928551), wk = 0.0031250 k( 169) = ( 0.2272727 0.1312160 0.2928551), wk = 0.0031250 k( 170) = ( 0.2386364 0.1377768 0.2928551), wk = 0.0031250 k( 171) = ( 0.2500000 0.1443376 0.2928551), wk = 0.0031250 k( 172) = ( 0.2613636 0.1508984 0.2928551), wk = 0.0031250 k( 173) = ( 0.2727273 0.1574592 0.2928551), wk = 0.0031250 k( 174) = ( 0.2840909 0.1640200 0.2928551), wk = 0.0031250 k( 175) = ( 0.2954545 0.1705808 0.2928551), wk = 0.0031250 k( 176) = ( 0.3068182 0.1771416 0.2928551), wk = 0.0031250 k( 177) = ( 0.3181818 0.1837024 0.2928551), wk = 0.0031250 k( 178) = ( 0.3295455 0.1902632 0.2928551), wk = 0.0031250 k( 179) = ( 0.3409091 0.1968240 0.2928551), wk = 0.0031250 k( 180) = ( 0.3522727 0.2033848 0.2928551), wk = 0.0031250 k( 181) = ( 0.3636364 0.2099456 0.2928551), wk = 0.0031250 k( 182) = ( 0.3750000 0.2165064 0.2928551), wk = 0.0031250 k( 183) = ( 0.3863636 0.2230672 0.2928551), wk = 0.0031250 k( 184) = ( 0.3977273 0.2296279 0.2928551), wk = 0.0031250 k( 185) = ( 0.4090909 0.2361887 0.2928551), wk = 0.0031250 k( 186) = ( 0.4204545 0.2427495 0.2928551), wk = 0.0031250 k( 187) = ( 0.4318182 0.2493103 0.2928551), wk = 0.0031250 k( 188) = ( 0.4431818 0.2558711 0.2928551), wk = 0.0031250 k( 189) = ( 0.4545455 0.2624319 0.2928551), wk = 0.0031250 k( 190) = ( 0.4659091 0.2689927 0.2928551), wk = 0.0031250 k( 191) = ( 0.4772727 0.2755535 0.2928551), wk = 0.0031250 k( 192) = ( 0.4886364 0.2821143 0.2928551), wk = 0.0031250 k( 193) = ( 0.5000000 0.2886751 0.2928551), wk = 0.0031250 k( 194) = ( 0.5000000 0.2886751 0.2928551), wk = 0.0031250 k( 195) = ( 0.4935897 0.2997780 0.2928551), wk = 0.0031250 k( 196) = ( 0.4871795 0.3108809 0.2928551), wk = 0.0031250 k( 197) = ( 0.4807692 0.3219838 0.2928551), wk = 0.0031250 k( 198) = ( 0.4743590 0.3330867 0.2928551), wk = 0.0031250 k( 199) = ( 0.4679487 0.3441896 0.2928551), wk = 0.0031250 k( 200) = ( 0.4615385 0.3552925 0.2928551), wk = 0.0031250 k( 201) = ( 0.4551282 0.3663954 0.2928551), wk = 0.0031250 k( 202) = ( 0.4487179 0.3774983 0.2928551), wk = 0.0031250 k( 203) = ( 0.4423077 0.3886011 0.2928551), wk = 0.0031250 k( 204) = ( 0.4358974 0.3997040 0.2928551), wk = 0.0031250 k( 205) = ( 0.4294872 0.4108069 0.2928551), wk = 0.0031250 k( 206) = ( 0.4230769 0.4219098 0.2928551), wk = 0.0031250 k( 207) = ( 0.4166667 0.4330127 0.2928551), wk = 0.0031250 k( 208) = ( 0.4102564 0.4441156 0.2928551), wk = 0.0031250 k( 209) = ( 0.4038462 0.4552185 0.2928551), wk = 0.0031250 k( 210) = ( 0.3974359 0.4663214 0.2928551), wk = 0.0031250 k( 211) = ( 0.3910256 0.4774243 0.2928551), wk = 0.0031250 k( 212) = ( 0.3846154 0.4885271 0.2928551), wk = 0.0031250 k( 213) = ( 0.3782051 0.4996300 0.2928551), wk = 0.0031250 k( 214) = ( 0.3717949 0.5107329 0.2928551), wk = 0.0031250 k( 215) = ( 0.3653846 0.5218358 0.2928551), wk = 0.0031250 k( 216) = ( 0.3589744 0.5329387 0.2928551), wk = 0.0031250 k( 217) = ( 0.3525641 0.5440416 0.2928551), wk = 0.0031250 k( 218) = ( 0.3461538 0.5551445 0.2928551), wk = 0.0031250 k( 219) = ( 0.3397436 0.5662474 0.2928551), wk = 0.0031250 k( 220) = ( 0.3333333 0.5773503 0.2928551), wk = 0.0031250 k( 221) = ( 0.3333333 0.5773503 0.2928551), wk = 0.0031250 k( 222) = ( 0.3267974 0.5660297 0.2928551), wk = 0.0031250 k( 223) = ( 0.3202614 0.5547091 0.2928551), wk = 0.0031250 k( 224) = ( 0.3137255 0.5433885 0.2928551), wk = 0.0031250 k( 225) = ( 0.3071895 0.5320679 0.2928551), wk = 0.0031250 k( 226) = ( 0.3006536 0.5207473 0.2928551), wk = 0.0031250 k( 227) = ( 0.2941177 0.5094267 0.2928551), wk = 0.0031250 k( 228) = ( 0.2875817 0.4981061 0.2928551), wk = 0.0031250 k( 229) = ( 0.2810457 0.4867855 0.2928551), wk = 0.0031250 k( 230) = ( 0.2745098 0.4754649 0.2928551), wk = 0.0031250 k( 231) = ( 0.2679739 0.4641443 0.2928551), wk = 0.0031250 k( 232) = ( 0.2614379 0.4528237 0.2928551), wk = 0.0031250 k( 233) = ( 0.2549020 0.4415031 0.2928551), wk = 0.0031250 k( 234) = ( 0.2483660 0.4301825 0.2928551), wk = 0.0031250 k( 235) = ( 0.2418301 0.4188620 0.2928551), wk = 0.0031250 k( 236) = ( 0.2352941 0.4075414 0.2928551), wk = 0.0031250 k( 237) = ( 0.2287582 0.3962208 0.2928551), wk = 0.0031250 k( 238) = ( 0.2222222 0.3849002 0.2928551), wk = 0.0031250 k( 239) = ( 0.2156863 0.3735796 0.2928551), wk = 0.0031250 k( 240) = ( 0.2091503 0.3622590 0.2928551), wk = 0.0031250 k( 241) = ( 0.2026144 0.3509384 0.2928551), wk = 0.0031250 k( 242) = ( 0.1960784 0.3396178 0.2928551), wk = 0.0031250 k( 243) = ( 0.1895425 0.3282972 0.2928551), wk = 0.0031250 k( 244) = ( 0.1830065 0.3169766 0.2928551), wk = 0.0031250 k( 245) = ( 0.1764706 0.3056560 0.2928551), wk = 0.0031250 k( 246) = ( 0.1699346 0.2943354 0.2928551), wk = 0.0031250 k( 247) = ( 0.1633987 0.2830148 0.2928551), wk = 0.0031250 k( 248) = ( 0.1568627 0.2716943 0.2928551), wk = 0.0031250 k( 249) = ( 0.1503268 0.2603737 0.2928551), wk = 0.0031250 k( 250) = ( 0.1437908 0.2490531 0.2928551), wk = 0.0031250 k( 251) = ( 0.1372549 0.2377325 0.2928551), wk = 0.0031250 k( 252) = ( 0.1307190 0.2264119 0.2928551), wk = 0.0031250 k( 253) = ( 0.1241830 0.2150913 0.2928551), wk = 0.0031250 k( 254) = ( 0.1176471 0.2037707 0.2928551), wk = 0.0031250 k( 255) = ( 0.1111111 0.1924501 0.2928551), wk = 0.0031250 k( 256) = ( 0.1045752 0.1811295 0.2928551), wk = 0.0031250 k( 257) = ( 0.0980392 0.1698089 0.2928551), wk = 0.0031250 k( 258) = ( 0.0915033 0.1584883 0.2928551), wk = 0.0031250 k( 259) = ( 0.0849673 0.1471677 0.2928551), wk = 0.0031250 k( 260) = ( 0.0784314 0.1358471 0.2928551), wk = 0.0031250 k( 261) = ( 0.0718954 0.1245265 0.2928551), wk = 0.0031250 k( 262) = ( 0.0653595 0.1132059 0.2928551), wk = 0.0031250 k( 263) = ( 0.0588235 0.1018853 0.2928551), wk = 0.0031250 k( 264) = ( 0.0522876 0.0905647 0.2928551), wk = 0.0031250 k( 265) = ( 0.0457516 0.0792441 0.2928551), wk = 0.0031250 k( 266) = ( 0.0392157 0.0679236 0.2928551), wk = 0.0031250 k( 267) = ( 0.0326797 0.0566030 0.2928551), wk = 0.0031250 k( 268) = ( 0.0261438 0.0452824 0.2928551), wk = 0.0031250 k( 269) = ( 0.0196078 0.0339618 0.2928551), wk = 0.0031250 k( 270) = ( 0.0130719 0.0226412 0.2928551), wk = 0.0031250 k( 271) = ( 0.0065359 0.0113206 0.2928551), wk = 0.0031250 k( 272) = ( 0.0000000 0.0000000 0.2928551), wk = 0.0031250 k( 273) = ( 0.5000000 0.2886751 0.2928551), wk = 0.0031250 k( 274) = ( 0.5000000 0.2886751 0.2801223), wk = 0.0031250 k( 275) = ( 0.5000000 0.2886751 0.2673895), wk = 0.0031250 k( 276) = ( 0.5000000 0.2886751 0.2546566), wk = 0.0031250 k( 277) = ( 0.5000000 0.2886751 0.2419238), wk = 0.0031250 k( 278) = ( 0.5000000 0.2886751 0.2291910), wk = 0.0031250 k( 279) = ( 0.5000000 0.2886751 0.2164581), wk = 0.0031250 k( 280) = ( 0.5000000 0.2886751 0.2037253), wk = 0.0031250 k( 281) = ( 0.5000000 0.2886751 0.1909925), wk = 0.0031250 k( 282) = ( 0.5000000 0.2886751 0.1782596), wk = 0.0031250 k( 283) = ( 0.5000000 0.2886751 0.1655268), wk = 0.0031250 k( 284) = ( 0.5000000 0.2886751 0.1527940), wk = 0.0031250 k( 285) = ( 0.5000000 0.2886751 0.1400611), wk = 0.0031250 k( 286) = ( 0.5000000 0.2886751 0.1273283), wk = 0.0031250 k( 287) = ( 0.5000000 0.2886751 0.1145955), wk = 0.0031250 k( 288) = ( 0.5000000 0.2886751 0.1018627), wk = 0.0031250 k( 289) = ( 0.5000000 0.2886751 0.0891298), wk = 0.0031250 k( 290) = ( 0.5000000 0.2886751 0.0763970), wk = 0.0031250 k( 291) = ( 0.5000000 0.2886751 0.0636642), wk = 0.0031250 k( 292) = ( 0.5000000 0.2886751 0.0509313), wk = 0.0031250 k( 293) = ( 0.5000000 0.2886751 0.0381985), wk = 0.0031250 k( 294) = ( 0.5000000 0.2886751 0.0254657), wk = 0.0031250 k( 295) = ( 0.5000000 0.2886751 0.0127328), wk = 0.0031250 k( 296) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031250 k( 297) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031250 k( 298) = ( 0.3333333 0.5773503 0.0127328), wk = 0.0031250 k( 299) = ( 0.3333333 0.5773503 0.0254657), wk = 0.0031250 k( 300) = ( 0.3333333 0.5773503 0.0381985), wk = 0.0031250 k( 301) = ( 0.3333333 0.5773503 0.0509313), wk = 0.0031250 k( 302) = ( 0.3333333 0.5773503 0.0636642), wk = 0.0031250 k( 303) = ( 0.3333333 0.5773503 0.0763970), wk = 0.0031250 k( 304) = ( 0.3333333 0.5773503 0.0891298), wk = 0.0031250 k( 305) = ( 0.3333333 0.5773503 0.1018627), wk = 0.0031250 k( 306) = ( 0.3333333 0.5773503 0.1145955), wk = 0.0031250 k( 307) = ( 0.3333333 0.5773503 0.1273283), wk = 0.0031250 k( 308) = ( 0.3333333 0.5773503 0.1400611), wk = 0.0031250 k( 309) = ( 0.3333333 0.5773503 0.1527940), wk = 0.0031250 k( 310) = ( 0.3333333 0.5773503 0.1655268), wk = 0.0031250 k( 311) = ( 0.3333333 0.5773503 0.1782596), wk = 0.0031250 k( 312) = ( 0.3333333 0.5773503 0.1909925), wk = 0.0031250 k( 313) = ( 0.3333333 0.5773503 0.2037253), wk = 0.0031250 k( 314) = ( 0.3333333 0.5773503 0.2164581), wk = 0.0031250 k( 315) = ( 0.3333333 0.5773503 0.2291910), wk = 0.0031250 k( 316) = ( 0.3333333 0.5773503 0.2419238), wk = 0.0031250 k( 317) = ( 0.3333333 0.5773503 0.2546566), wk = 0.0031250 k( 318) = ( 0.3333333 0.5773503 0.2673895), wk = 0.0031250 k( 319) = ( 0.3333333 0.5773503 0.2801223), wk = 0.0031250 k( 320) = ( 0.3333333 0.5773503 0.2928551), wk = 0.0031250 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0113636 0.0000000 0.0000000), wk = 0.0031250 k( 3) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0031250 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0031250 k( 5) = ( 0.0454546 0.0000000 -0.0000000), wk = 0.0031250 k( 6) = ( 0.0568182 0.0000000 0.0000000), wk = 0.0031250 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0031250 k( 8) = ( 0.0795455 0.0000000 -0.0000000), wk = 0.0031250 k( 9) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0031250 k( 10) = ( 0.1022727 0.0000000 -0.0000000), wk = 0.0031250 k( 11) = ( 0.1136364 0.0000000 0.0000000), wk = 0.0031250 k( 12) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0031250 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0031250 k( 14) = ( 0.1477273 -0.0000000 -0.0000000), wk = 0.0031250 k( 15) = ( 0.1590909 0.0000000 0.0000000), wk = 0.0031250 k( 16) = ( 0.1704546 0.0000000 -0.0000000), wk = 0.0031250 k( 17) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0031250 k( 18) = ( 0.1931818 0.0000000 0.0000000), wk = 0.0031250 k( 19) = ( 0.2045454 0.0000000 0.0000000), wk = 0.0031250 k( 20) = ( 0.2159091 0.0000000 0.0000000), wk = 0.0031250 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0031250 k( 22) = ( 0.2386364 0.0000000 0.0000000), wk = 0.0031250 k( 23) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0031250 k( 24) = ( 0.2613636 0.0000000 -0.0000000), wk = 0.0031250 k( 25) = ( 0.2727273 0.0000000 -0.0000000), wk = 0.0031250 k( 26) = ( 0.2840909 0.0000000 0.0000000), wk = 0.0031250 k( 27) = ( 0.2954545 0.0000000 0.0000000), wk = 0.0031250 k( 28) = ( 0.3068182 0.0000000 0.0000000), wk = 0.0031250 k( 29) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0031250 k( 30) = ( 0.3295455 0.0000000 -0.0000000), wk = 0.0031250 k( 31) = ( 0.3409091 0.0000000 -0.0000000), wk = 0.0031250 k( 32) = ( 0.3522727 0.0000000 0.0000000), wk = 0.0031250 k( 33) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0031250 k( 34) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0031250 k( 35) = ( 0.3863636 0.0000000 0.0000000), wk = 0.0031250 k( 36) = ( 0.3977273 0.0000000 0.0000000), wk = 0.0031250 k( 37) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0031250 k( 38) = ( 0.4204545 0.0000000 0.0000000), wk = 0.0031250 k( 39) = ( 0.4318182 0.0000000 0.0000000), wk = 0.0031250 k( 40) = ( 0.4431818 0.0000000 0.0000000), wk = 0.0031250 k( 41) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0031250 k( 42) = ( 0.4659091 0.0000000 -0.0000000), wk = 0.0031250 k( 43) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0031250 k( 44) = ( 0.4886364 0.0000000 -0.0000000), wk = 0.0031250 k( 45) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0031250 k( 46) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0031250 k( 47) = ( 0.4935897 0.0128205 0.0000000), wk = 0.0031250 k( 48) = ( 0.4871795 0.0256410 0.0000000), wk = 0.0031250 k( 49) = ( 0.4807692 0.0384615 0.0000000), wk = 0.0031250 k( 50) = ( 0.4743590 0.0512821 0.0000000), wk = 0.0031250 k( 51) = ( 0.4679487 0.0641026 -0.0000000), wk = 0.0031250 k( 52) = ( 0.4615385 0.0769231 -0.0000000), wk = 0.0031250 k( 53) = ( 0.4551282 0.0897436 0.0000000), wk = 0.0031250 k( 54) = ( 0.4487179 0.1025641 0.0000000), wk = 0.0031250 k( 55) = ( 0.4423077 0.1153846 0.0000000), wk = 0.0031250 k( 56) = ( 0.4358974 0.1282051 0.0000000), wk = 0.0031250 k( 57) = ( 0.4294872 0.1410256 -0.0000000), wk = 0.0031250 k( 58) = ( 0.4230769 0.1538461 -0.0000000), wk = 0.0031250 k( 59) = ( 0.4166667 0.1666667 -0.0000000), wk = 0.0031250 k( 60) = ( 0.4102564 0.1794872 0.0000000), wk = 0.0031250 k( 61) = ( 0.4038462 0.1923077 0.0000000), wk = 0.0031250 k( 62) = ( 0.3974359 0.2051282 0.0000000), wk = 0.0031250 k( 63) = ( 0.3910256 0.2179487 0.0000000), wk = 0.0031250 k( 64) = ( 0.3846154 0.2307692 -0.0000000), wk = 0.0031250 k( 65) = ( 0.3782051 0.2435897 0.0000000), wk = 0.0031250 k( 66) = ( 0.3717949 0.2564103 0.0000000), wk = 0.0031250 k( 67) = ( 0.3653846 0.2692308 0.0000000), wk = 0.0031250 k( 68) = ( 0.3589744 0.2820513 -0.0000000), wk = 0.0031250 k( 69) = ( 0.3525641 0.2948718 0.0000000), wk = 0.0031250 k( 70) = ( 0.3461538 0.3076923 0.0000000), wk = 0.0031250 k( 71) = ( 0.3397436 0.3205128 -0.0000000), wk = 0.0031250 k( 72) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031250 k( 73) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031250 k( 74) = ( 0.3267974 0.3267974 0.0000000), wk = 0.0031250 k( 75) = ( 0.3202614 0.3202614 0.0000000), wk = 0.0031250 k( 76) = ( 0.3137255 0.3137255 0.0000000), wk = 0.0031250 k( 77) = ( 0.3071895 0.3071895 0.0000000), wk = 0.0031250 k( 78) = ( 0.3006536 0.3006536 0.0000000), wk = 0.0031250 k( 79) = ( 0.2941177 0.2941177 0.0000000), wk = 0.0031250 k( 80) = ( 0.2875817 0.2875817 0.0000000), wk = 0.0031250 k( 81) = ( 0.2810457 0.2810457 -0.0000000), wk = 0.0031250 k( 82) = ( 0.2745098 0.2745098 0.0000000), wk = 0.0031250 k( 83) = ( 0.2679739 0.2679739 0.0000000), wk = 0.0031250 k( 84) = ( 0.2614379 0.2614379 0.0000000), wk = 0.0031250 k( 85) = ( 0.2549020 0.2549020 0.0000000), wk = 0.0031250 k( 86) = ( 0.2483660 0.2483660 0.0000000), wk = 0.0031250 k( 87) = ( 0.2418301 0.2418301 0.0000000), wk = 0.0031250 k( 88) = ( 0.2352941 0.2352941 0.0000000), wk = 0.0031250 k( 89) = ( 0.2287582 0.2287582 0.0000000), wk = 0.0031250 k( 90) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0031250 k( 91) = ( 0.2156863 0.2156863 0.0000000), wk = 0.0031250 k( 92) = ( 0.2091503 0.2091503 0.0000000), wk = 0.0031250 k( 93) = ( 0.2026144 0.2026144 0.0000000), wk = 0.0031250 k( 94) = ( 0.1960784 0.1960784 -0.0000000), wk = 0.0031250 k( 95) = ( 0.1895425 0.1895425 0.0000000), wk = 0.0031250 k( 96) = ( 0.1830065 0.1830065 0.0000000), wk = 0.0031250 k( 97) = ( 0.1764706 0.1764706 0.0000000), wk = 0.0031250 k( 98) = ( 0.1699346 0.1699346 0.0000000), wk = 0.0031250 k( 99) = ( 0.1633987 0.1633987 0.0000000), wk = 0.0031250 k( 100) = ( 0.1568627 0.1568628 0.0000000), wk = 0.0031250 k( 101) = ( 0.1503268 0.1503268 0.0000000), wk = 0.0031250 k( 102) = ( 0.1437908 0.1437909 0.0000000), wk = 0.0031250 k( 103) = ( 0.1372549 0.1372549 0.0000000), wk = 0.0031250 k( 104) = ( 0.1307190 0.1307190 0.0000000), wk = 0.0031250 k( 105) = ( 0.1241830 0.1241830 0.0000000), wk = 0.0031250 k( 106) = ( 0.1176471 0.1176471 0.0000000), wk = 0.0031250 k( 107) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0031250 k( 108) = ( 0.1045752 0.1045752 0.0000000), wk = 0.0031250 k( 109) = ( 0.0980392 0.0980392 0.0000000), wk = 0.0031250 k( 110) = ( 0.0915033 0.0915033 0.0000000), wk = 0.0031250 k( 111) = ( 0.0849673 0.0849673 0.0000000), wk = 0.0031250 k( 112) = ( 0.0784314 0.0784314 0.0000000), wk = 0.0031250 k( 113) = ( 0.0718954 0.0718954 0.0000000), wk = 0.0031250 k( 114) = ( 0.0653595 0.0653595 -0.0000000), wk = 0.0031250 k( 115) = ( 0.0588235 0.0588235 0.0000000), wk = 0.0031250 k( 116) = ( 0.0522876 0.0522876 0.0000000), wk = 0.0031250 k( 117) = ( 0.0457516 0.0457516 0.0000000), wk = 0.0031250 k( 118) = ( 0.0392157 0.0392157 0.0000000), wk = 0.0031250 k( 119) = ( 0.0326797 0.0326797 -0.0000000), wk = 0.0031250 k( 120) = ( 0.0261438 0.0261438 0.0000000), wk = 0.0031250 k( 121) = ( 0.0196078 0.0196078 0.0000000), wk = 0.0031250 k( 122) = ( 0.0130719 0.0130719 0.0000000), wk = 0.0031250 k( 123) = ( 0.0065359 0.0065360 0.0000000), wk = 0.0031250 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 126) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0031250 k( 127) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0031250 k( 128) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0031250 k( 129) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0031250 k( 130) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0031250 k( 131) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0031250 k( 132) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0031250 k( 146) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0031250 k( 147) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0031250 k( 148) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 149) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 150) = ( 0.0113636 0.0000000 0.5000000), wk = 0.0031250 k( 151) = ( 0.0227273 0.0000000 0.5000000), wk = 0.0031250 k( 152) = ( 0.0340909 0.0000000 0.5000000), wk = 0.0031250 k( 153) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0031250 k( 154) = ( 0.0568182 0.0000000 0.5000000), wk = 0.0031250 k( 155) = ( 0.0681818 0.0000000 0.5000000), wk = 0.0031250 k( 156) = ( 0.0795455 0.0000000 0.5000000), wk = 0.0031250 k( 157) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0031250 k( 158) = ( 0.1022727 0.0000000 0.5000000), wk = 0.0031250 k( 159) = ( 0.1136364 0.0000000 0.5000000), wk = 0.0031250 k( 160) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0031250 k( 161) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0031250 k( 162) = ( 0.1477273 -0.0000000 0.5000000), wk = 0.0031250 k( 163) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0031250 k( 164) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0031250 k( 165) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0031250 k( 166) = ( 0.1931818 0.0000000 0.5000000), wk = 0.0031250 k( 167) = ( 0.2045454 0.0000000 0.5000000), wk = 0.0031250 k( 168) = ( 0.2159091 0.0000000 0.5000000), wk = 0.0031250 k( 169) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0031250 k( 170) = ( 0.2386364 0.0000000 0.5000000), wk = 0.0031250 k( 171) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0031250 k( 172) = ( 0.2613636 0.0000000 0.5000000), wk = 0.0031250 k( 173) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0031250 k( 174) = ( 0.2840909 0.0000000 0.5000000), wk = 0.0031250 k( 175) = ( 0.2954545 0.0000000 0.5000000), wk = 0.0031250 k( 176) = ( 0.3068182 0.0000000 0.5000000), wk = 0.0031250 k( 177) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0031250 k( 178) = ( 0.3295455 0.0000000 0.5000000), wk = 0.0031250 k( 179) = ( 0.3409091 0.0000000 0.5000000), wk = 0.0031250 k( 180) = ( 0.3522727 0.0000000 0.5000000), wk = 0.0031250 k( 181) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0031250 k( 182) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0031250 k( 183) = ( 0.3863636 0.0000000 0.5000000), wk = 0.0031250 k( 184) = ( 0.3977273 0.0000000 0.5000000), wk = 0.0031250 k( 185) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0031250 k( 186) = ( 0.4204545 0.0000000 0.5000000), wk = 0.0031250 k( 187) = ( 0.4318182 0.0000000 0.5000000), wk = 0.0031250 k( 188) = ( 0.4431818 0.0000000 0.5000000), wk = 0.0031250 k( 189) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0031250 k( 190) = ( 0.4659091 0.0000000 0.5000000), wk = 0.0031250 k( 191) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0031250 k( 192) = ( 0.4886364 0.0000000 0.5000000), wk = 0.0031250 k( 193) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 k( 194) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 k( 195) = ( 0.4935897 0.0128205 0.5000000), wk = 0.0031250 k( 196) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0031250 k( 197) = ( 0.4807692 0.0384615 0.5000000), wk = 0.0031250 k( 198) = ( 0.4743590 0.0512821 0.5000000), wk = 0.0031250 k( 199) = ( 0.4679487 0.0641026 0.5000000), wk = 0.0031250 k( 200) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0031250 k( 201) = ( 0.4551282 0.0897436 0.5000000), wk = 0.0031250 k( 202) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0031250 k( 203) = ( 0.4423077 0.1153846 0.5000000), wk = 0.0031250 k( 204) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0031250 k( 205) = ( 0.4294872 0.1410256 0.5000000), wk = 0.0031250 k( 206) = ( 0.4230769 0.1538461 0.5000000), wk = 0.0031250 k( 207) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0031250 k( 208) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0031250 k( 209) = ( 0.4038462 0.1923077 0.5000000), wk = 0.0031250 k( 210) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0031250 k( 211) = ( 0.3910256 0.2179487 0.5000000), wk = 0.0031250 k( 212) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0031250 k( 213) = ( 0.3782051 0.2435897 0.5000000), wk = 0.0031250 k( 214) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0031250 k( 215) = ( 0.3653846 0.2692308 0.5000000), wk = 0.0031250 k( 216) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0031250 k( 217) = ( 0.3525641 0.2948718 0.5000000), wk = 0.0031250 k( 218) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0031250 k( 219) = ( 0.3397436 0.3205128 0.5000000), wk = 0.0031250 k( 220) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031250 k( 221) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031250 k( 222) = ( 0.3267974 0.3267974 0.5000000), wk = 0.0031250 k( 223) = ( 0.3202614 0.3202614 0.5000000), wk = 0.0031250 k( 224) = ( 0.3137255 0.3137255 0.5000000), wk = 0.0031250 k( 225) = ( 0.3071895 0.3071895 0.5000000), wk = 0.0031250 k( 226) = ( 0.3006536 0.3006536 0.5000000), wk = 0.0031250 k( 227) = ( 0.2941177 0.2941177 0.5000000), wk = 0.0031250 k( 228) = ( 0.2875817 0.2875817 0.5000000), wk = 0.0031250 k( 229) = ( 0.2810457 0.2810457 0.5000000), wk = 0.0031250 k( 230) = ( 0.2745098 0.2745098 0.5000000), wk = 0.0031250 k( 231) = ( 0.2679739 0.2679739 0.5000000), wk = 0.0031250 k( 232) = ( 0.2614379 0.2614379 0.5000000), wk = 0.0031250 k( 233) = ( 0.2549020 0.2549020 0.5000000), wk = 0.0031250 k( 234) = ( 0.2483660 0.2483660 0.5000000), wk = 0.0031250 k( 235) = ( 0.2418301 0.2418301 0.5000000), wk = 0.0031250 k( 236) = ( 0.2352941 0.2352941 0.5000000), wk = 0.0031250 k( 237) = ( 0.2287582 0.2287582 0.5000000), wk = 0.0031250 k( 238) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0031250 k( 239) = ( 0.2156863 0.2156863 0.5000000), wk = 0.0031250 k( 240) = ( 0.2091503 0.2091503 0.5000000), wk = 0.0031250 k( 241) = ( 0.2026144 0.2026144 0.5000000), wk = 0.0031250 k( 242) = ( 0.1960784 0.1960784 0.5000000), wk = 0.0031250 k( 243) = ( 0.1895425 0.1895425 0.5000000), wk = 0.0031250 k( 244) = ( 0.1830065 0.1830065 0.5000000), wk = 0.0031250 k( 245) = ( 0.1764706 0.1764706 0.5000000), wk = 0.0031250 k( 246) = ( 0.1699346 0.1699346 0.5000000), wk = 0.0031250 k( 247) = ( 0.1633987 0.1633987 0.5000000), wk = 0.0031250 k( 248) = ( 0.1568627 0.1568628 0.5000000), wk = 0.0031250 k( 249) = ( 0.1503268 0.1503268 0.5000000), wk = 0.0031250 k( 250) = ( 0.1437908 0.1437909 0.5000000), wk = 0.0031250 k( 251) = ( 0.1372549 0.1372549 0.5000000), wk = 0.0031250 k( 252) = ( 0.1307190 0.1307190 0.5000000), wk = 0.0031250 k( 253) = ( 0.1241830 0.1241830 0.5000000), wk = 0.0031250 k( 254) = ( 0.1176471 0.1176471 0.5000000), wk = 0.0031250 k( 255) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0031250 k( 256) = ( 0.1045752 0.1045752 0.5000000), wk = 0.0031250 k( 257) = ( 0.0980392 0.0980392 0.5000000), wk = 0.0031250 k( 258) = ( 0.0915033 0.0915033 0.5000000), wk = 0.0031250 k( 259) = ( 0.0849673 0.0849673 0.5000000), wk = 0.0031250 k( 260) = ( 0.0784314 0.0784314 0.5000000), wk = 0.0031250 k( 261) = ( 0.0718954 0.0718954 0.5000000), wk = 0.0031250 k( 262) = ( 0.0653595 0.0653595 0.5000000), wk = 0.0031250 k( 263) = ( 0.0588235 0.0588235 0.5000000), wk = 0.0031250 k( 264) = ( 0.0522876 0.0522876 0.5000000), wk = 0.0031250 k( 265) = ( 0.0457516 0.0457516 0.5000000), wk = 0.0031250 k( 266) = ( 0.0392157 0.0392157 0.5000000), wk = 0.0031250 k( 267) = ( 0.0326797 0.0326797 0.5000000), wk = 0.0031250 k( 268) = ( 0.0261438 0.0261438 0.5000000), wk = 0.0031250 k( 269) = ( 0.0196078 0.0196078 0.5000000), wk = 0.0031250 k( 270) = ( 0.0130719 0.0130719 0.5000000), wk = 0.0031250 k( 271) = ( 0.0065359 0.0065360 0.5000000), wk = 0.0031250 k( 272) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 273) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 k( 274) = ( 0.5000000 0.0000000 0.4782609), wk = 0.0031250 k( 275) = ( 0.5000000 0.0000000 0.4565217), wk = 0.0031250 k( 276) = ( 0.5000000 0.0000000 0.4347826), wk = 0.0031250 k( 277) = ( 0.5000000 0.0000000 0.4130435), wk = 0.0031250 k( 278) = ( 0.5000000 0.0000000 0.3913044), wk = 0.0031250 k( 279) = ( 0.5000000 0.0000000 0.3695652), wk = 0.0031250 k( 280) = ( 0.5000000 0.0000000 0.3478261), wk = 0.0031250 k( 281) = ( 0.5000000 0.0000000 0.3260870), wk = 0.0031250 k( 282) = ( 0.5000000 0.0000000 0.3043478), wk = 0.0031250 k( 283) = ( 0.5000000 0.0000000 0.2826087), wk = 0.0031250 k( 284) = ( 0.5000000 0.0000000 0.2608696), wk = 0.0031250 k( 285) = ( 0.5000000 0.0000000 0.2391304), wk = 0.0031250 k( 286) = ( 0.5000000 0.0000000 0.2173913), wk = 0.0031250 k( 287) = ( 0.5000000 0.0000000 0.1956522), wk = 0.0031250 k( 288) = ( 0.5000000 0.0000000 0.1739130), wk = 0.0031250 k( 289) = ( 0.5000000 0.0000000 0.1521739), wk = 0.0031250 k( 290) = ( 0.5000000 0.0000000 0.1304348), wk = 0.0031250 k( 291) = ( 0.5000000 0.0000000 0.1086957), wk = 0.0031250 k( 292) = ( 0.5000000 0.0000000 0.0869565), wk = 0.0031250 k( 293) = ( 0.5000000 0.0000000 0.0652174), wk = 0.0031250 k( 294) = ( 0.5000000 0.0000000 0.0434783), wk = 0.0031250 k( 295) = ( 0.5000000 0.0000000 0.0217391), wk = 0.0031250 k( 296) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0031250 k( 297) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031250 k( 298) = ( 0.3333333 0.3333333 0.0217391), wk = 0.0031250 k( 299) = ( 0.3333333 0.3333333 0.0434783), wk = 0.0031250 k( 300) = ( 0.3333333 0.3333333 0.0652174), wk = 0.0031250 k( 301) = ( 0.3333333 0.3333333 0.0869565), wk = 0.0031250 k( 302) = ( 0.3333333 0.3333333 0.1086956), wk = 0.0031250 k( 303) = ( 0.3333333 0.3333333 0.1304348), wk = 0.0031250 k( 304) = ( 0.3333333 0.3333333 0.1521739), wk = 0.0031250 k( 305) = ( 0.3333333 0.3333333 0.1739130), wk = 0.0031250 k( 306) = ( 0.3333333 0.3333333 0.1956522), wk = 0.0031250 k( 307) = ( 0.3333333 0.3333333 0.2173913), wk = 0.0031250 k( 308) = ( 0.3333333 0.3333333 0.2391304), wk = 0.0031250 k( 309) = ( 0.3333333 0.3333333 0.2608696), wk = 0.0031250 k( 310) = ( 0.3333333 0.3333333 0.2826087), wk = 0.0031250 k( 311) = ( 0.3333333 0.3333333 0.3043478), wk = 0.0031250 k( 312) = ( 0.3333333 0.3333333 0.3260870), wk = 0.0031250 k( 313) = ( 0.3333333 0.3333333 0.3478261), wk = 0.0031250 k( 314) = ( 0.3333333 0.3333333 0.3695652), wk = 0.0031250 k( 315) = ( 0.3333333 0.3333333 0.3913044), wk = 0.0031250 k( 316) = ( 0.3333333 0.3333333 0.4130435), wk = 0.0031250 k( 317) = ( 0.3333333 0.3333333 0.4347826), wk = 0.0031250 k( 318) = ( 0.3333333 0.3333333 0.4565217), wk = 0.0031250 k( 319) = ( 0.3333333 0.3333333 0.4782609), wk = 0.0031250 k( 320) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031250 Dense grid: 69353 G-vectors FFT dimensions: ( 45, 45, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.46 Mb ( 500, 60) NL pseudopotentials 0.65 Mb ( 250, 170) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.01 Mb ( 1926) G-vector shells 0.01 Mb ( 917) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.83 Mb ( 500, 240) Each subspace H/S matrix 0.05 Mb ( 60, 60) Each matrix 0.31 Mb ( 170, 2, 60) The potential is recalculated from file : ./SrxMnPx2.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.1 secs Computing kpt #: 2 total cpu time spent up to now is 4.1 secs Computing kpt #: 3 total cpu time spent up to now is 4.8 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.3 secs Computing kpt #: 6 total cpu time spent up to now is 7.0 secs Computing kpt #: 7 total cpu time spent up to now is 7.8 secs Computing kpt #: 8 total cpu time spent up to now is 8.5 secs Computing kpt #: 9 total cpu time spent up to now is 9.3 secs Computing kpt #: 10 total cpu time spent up to now is 10.1 secs Computing kpt #: 11 total cpu time spent up to now is 10.9 secs Computing kpt #: 12 total cpu time spent up to now is 11.6 secs Computing kpt #: 13 total cpu time spent up to now is 12.4 secs Computing kpt #: 14 total cpu time spent up to now is 13.2 secs Computing kpt #: 15 total cpu time spent up to now is 13.9 secs Computing kpt #: 16 total cpu time spent up to now is 14.7 secs Computing kpt #: 17 total cpu time spent up to now is 15.4 secs Computing kpt #: 18 total cpu time spent up to now is 16.2 secs Computing kpt #: 19 total cpu time spent up to now is 16.9 secs Computing kpt #: 20 total cpu time spent up to now is 17.7 secs Computing kpt #: 21 total cpu time spent up to now is 18.4 secs Computing kpt #: 22 total cpu time spent up to now is 19.1 secs Computing kpt #: 23 total cpu time spent up to now is 19.9 secs Computing kpt #: 24 total cpu time spent up to now is 20.6 secs Computing kpt #: 25 total cpu time spent up to now is 21.3 secs Computing kpt #: 26 total cpu time spent up to now is 22.0 secs Computing kpt #: 27 total cpu time spent up to now is 22.7 secs Computing kpt #: 28 total cpu time spent up to now is 23.4 secs Computing kpt #: 29 total cpu time spent up to now is 24.1 secs Computing kpt #: 30 total cpu time spent up to now is 24.8 secs Computing kpt #: 31 total cpu time spent up to now is 25.5 secs Computing kpt #: 32 total cpu time spent up to now is 26.2 secs Computing kpt #: 33 total cpu time spent up to now is 26.8 secs Computing kpt #: 34 total cpu time spent up to now is 27.5 secs Computing kpt #: 35 total cpu time spent up to now is 28.2 secs Computing kpt #: 36 total cpu time spent up to now is 28.9 secs Computing kpt #: 37 total cpu time spent up to now is 29.6 secs Computing kpt #: 38 total cpu time spent up to now is 30.3 secs Computing kpt #: 39 total cpu time spent up to now is 31.0 secs Computing kpt #: 40 total cpu time spent up to now is 31.7 secs Computing kpt #: 41 total cpu time spent up to now is 32.4 secs Computing kpt #: 42 total cpu time spent up to now is 33.0 secs Computing kpt #: 43 total cpu time spent up to now is 33.7 secs Computing kpt #: 44 total cpu time spent up to now is 34.4 secs Computing kpt #: 45 total cpu time spent up to now is 35.1 secs Computing kpt #: 46 total cpu time spent up to now is 35.7 secs Computing kpt #: 47 total cpu time spent up to now is 36.4 secs Computing kpt #: 48 total cpu time spent up to now is 37.1 secs Computing kpt #: 49 total cpu time spent up to now is 37.8 secs Computing kpt #: 50 total cpu time spent up to now is 38.5 secs Computing kpt #: 51 total cpu time spent up to now is 39.1 secs Computing kpt #: 52 total cpu time spent up to now is 39.8 secs Computing kpt #: 53 total cpu time spent up to now is 40.5 secs Computing kpt #: 54 total cpu time spent up to now is 41.3 secs Computing kpt #: 55 total cpu time spent up to now is 42.0 secs Computing kpt #: 56 total cpu time spent up to now is 42.7 secs Computing kpt #: 57 total cpu time spent up to now is 43.4 secs Computing kpt #: 58 total cpu time spent up to now is 44.1 secs Computing kpt #: 59 total cpu time spent up to now is 44.8 secs Computing kpt #: 60 total cpu time spent up to now is 45.5 secs Computing kpt #: 61 total cpu time spent up to now is 46.2 secs Computing kpt #: 62 total cpu time spent up to now is 46.9 secs Computing kpt #: 63 total cpu time spent up to now is 47.6 secs Computing kpt #: 64 total cpu time spent up to now is 48.3 secs Computing kpt #: 65 total cpu time spent up to now is 49.0 secs Computing kpt #: 66 total cpu time spent up to now is 49.7 secs Computing kpt #: 67 total cpu time spent up to now is 50.4 secs Computing kpt #: 68 total cpu time spent up to now is 51.1 secs Computing kpt #: 69 total cpu time spent up to now is 51.8 secs Computing kpt #: 70 total cpu time spent up to now is 52.5 secs Computing kpt #: 71 total cpu time spent up to now is 53.2 secs Computing kpt #: 72 total cpu time spent up to now is 53.9 secs Computing kpt #: 73 total cpu time spent up to now is 54.6 secs Computing kpt #: 74 total cpu time spent up to now is 55.3 secs Computing kpt #: 75 total cpu time spent up to now is 56.0 secs Computing kpt #: 76 total cpu time spent up to now is 56.7 secs Computing kpt #: 77 total cpu time spent up to now is 57.4 secs Computing kpt #: 78 total cpu time spent up to now is 58.1 secs Computing kpt #: 79 total cpu time spent up to now is 58.8 secs Computing kpt #: 80 total cpu time spent up to now is 59.5 secs Computing kpt #: 81 total cpu time spent up to now is 60.2 secs Computing kpt #: 82 total cpu time spent up to now is 60.9 secs Computing kpt #: 83 total cpu time spent up to now is 61.6 secs Computing kpt #: 84 total cpu time spent up to now is 62.3 secs Computing kpt #: 85 total cpu time spent up to now is 63.0 secs Computing kpt #: 86 total cpu time spent up to now is 63.7 secs Computing kpt #: 87 total cpu time spent up to now is 64.5 secs Computing kpt #: 88 total cpu time spent up to now is 65.2 secs Computing kpt #: 89 total cpu time spent up to now is 65.9 secs Computing kpt #: 90 total cpu time spent up to now is 66.6 secs Computing kpt #: 91 total cpu time spent up to now is 67.3 secs Computing kpt #: 92 total cpu time spent up to now is 68.0 secs Computing kpt #: 93 total cpu time spent up to now is 68.7 secs Computing kpt #: 94 total cpu time spent up to now is 69.4 secs Computing kpt #: 95 total cpu time spent up to now is 70.1 secs Computing kpt #: 96 total cpu time spent up to now is 70.8 secs Computing kpt #: 97 total cpu time spent up to now is 71.5 secs Computing kpt #: 98 total cpu time spent up to now is 72.2 secs Computing kpt #: 99 total cpu time spent up to now is 73.0 secs Computing kpt #: 100 total cpu time spent up to now is 73.7 secs Computing kpt #: 101 total cpu time spent up to now is 74.4 secs Computing kpt #: 102 total cpu time spent up to now is 75.2 secs Computing kpt #: 103 total cpu time spent up to now is 75.9 secs Computing kpt #: 104 total cpu time spent up to now is 76.6 secs Computing kpt #: 105 total cpu time spent up to now is 77.4 secs Computing kpt #: 106 total cpu time spent up to now is 78.1 secs Computing kpt #: 107 total cpu time spent up to now is 78.8 secs Computing kpt #: 108 total cpu time spent up to now is 79.6 secs Computing kpt #: 109 total cpu time spent up to now is 80.3 secs Computing kpt #: 110 total cpu time spent up to now is 81.1 secs Computing kpt #: 111 total cpu time spent up to now is 81.8 secs Computing kpt #: 112 total cpu time spent up to now is 82.6 secs Computing kpt #: 113 total cpu time spent up to now is 83.3 secs Computing kpt #: 114 total cpu time spent up to now is 84.1 secs Computing kpt #: 115 total cpu time spent up to now is 84.8 secs Computing kpt #: 116 total cpu time spent up to now is 85.6 secs Computing kpt #: 117 total cpu time spent up to now is 86.3 secs Computing kpt #: 118 total cpu time spent up to now is 87.1 secs Computing kpt #: 119 total cpu time spent up to now is 87.8 secs Computing kpt #: 120 total cpu time spent up to now is 88.6 secs Computing kpt #: 121 total cpu time spent up to now is 89.3 secs Computing kpt #: 122 total cpu time spent up to now is 90.1 secs Computing kpt #: 123 total cpu time spent up to now is 90.8 secs Computing kpt #: 124 total cpu time spent up to now is 91.5 secs Computing kpt #: 125 total cpu time spent up to now is 92.2 secs Computing kpt #: 126 total cpu time spent up to now is 92.9 secs Computing kpt #: 127 total cpu time spent up to now is 93.7 secs Computing kpt #: 128 total cpu time spent up to now is 94.4 secs Computing kpt #: 129 total cpu time spent up to now is 95.1 secs Computing kpt #: 130 total cpu time spent up to now is 95.9 secs Computing kpt #: 131 total cpu time spent up to now is 96.6 secs Computing kpt #: 132 total cpu time spent up to now is 97.4 secs Computing kpt #: 133 total cpu time spent up to now is 98.1 secs Computing kpt #: 134 total cpu time spent up to now is 98.8 secs Computing kpt #: 135 total cpu time spent up to now is 99.6 secs Computing kpt #: 136 total cpu time spent up to now is 100.3 secs Computing kpt #: 137 total cpu time spent up to now is 101.1 secs Computing kpt #: 138 total cpu time spent up to now is 101.8 secs Computing kpt #: 139 total cpu time spent up to now is 102.5 secs Computing kpt #: 140 total cpu time spent up to now is 103.2 secs Computing kpt #: 141 total cpu time spent up to now is 103.9 secs Computing kpt #: 142 total cpu time spent up to now is 104.6 secs Computing kpt #: 143 total cpu time spent up to now is 105.4 secs Computing kpt #: 144 total cpu time spent up to now is 106.1 secs Computing kpt #: 145 total cpu time spent up to now is 106.8 secs Computing kpt #: 146 total cpu time spent up to now is 107.5 secs Computing kpt #: 147 total cpu time spent up to now is 108.1 secs Computing kpt #: 148 total cpu time spent up to now is 108.8 secs Computing kpt #: 149 total cpu time spent up to now is 109.5 secs Computing kpt #: 150 total cpu time spent up to now is 110.2 secs Computing kpt #: 151 total cpu time spent up to now is 110.9 secs Computing kpt #: 152 total cpu time spent up to now is 111.6 secs Computing kpt #: 153 total cpu time spent up to now is 112.3 secs Computing kpt #: 154 total cpu time spent up to now is 113.0 secs Computing kpt #: 155 total cpu time spent up to now is 113.8 secs Computing kpt #: 156 total cpu time spent up to now is 114.5 secs Computing kpt #: 157 total cpu time spent up to now is 115.2 secs Computing kpt #: 158 total cpu time spent up to now is 116.0 secs Computing kpt #: 159 total cpu time spent up to now is 116.7 secs Computing kpt #: 160 total cpu time spent up to now is 117.5 secs Computing kpt #: 161 total cpu time spent up to now is 118.2 secs Computing kpt #: 162 total cpu time spent up to now is 118.9 secs Computing kpt #: 163 total cpu time spent up to now is 119.7 secs Computing kpt #: 164 total cpu time spent up to now is 120.4 secs Computing kpt #: 165 total cpu time spent up to now is 121.2 secs Computing kpt #: 166 total cpu time spent up to now is 121.9 secs Computing kpt #: 167 total cpu time spent up to now is 122.6 secs Computing kpt #: 168 total cpu time spent up to now is 123.3 secs Computing kpt #: 169 total cpu time spent up to now is 124.1 secs Computing kpt #: 170 total cpu time spent up to now is 124.8 secs Computing kpt #: 171 total cpu time spent up to now is 125.5 secs Computing kpt #: 172 total cpu time spent up to now is 126.3 secs Computing kpt #: 173 total cpu time spent up to now is 127.0 secs Computing kpt #: 174 total cpu time spent up to now is 127.7 secs Computing kpt #: 175 total cpu time spent up to now is 128.5 secs Computing kpt #: 176 total cpu time spent up to now is 129.2 secs Computing kpt #: 177 total cpu time spent up to now is 129.9 secs Computing kpt #: 178 total cpu time spent up to now is 130.7 secs Computing kpt #: 179 total cpu time spent up to now is 131.4 secs Computing kpt #: 180 total cpu time spent up to now is 132.1 secs Computing kpt #: 181 total cpu time spent up to now is 132.8 secs Computing kpt #: 182 total cpu time spent up to now is 133.6 secs Computing kpt #: 183 total cpu time spent up to now is 134.3 secs Computing kpt #: 184 total cpu time spent up to now is 135.0 secs Computing kpt #: 185 total cpu time spent up to now is 135.8 secs Computing kpt #: 186 total cpu time spent up to now is 136.5 secs Computing kpt #: 187 total cpu time spent up to now is 137.2 secs Computing kpt #: 188 total cpu time spent up to now is 137.9 secs Computing kpt #: 189 total cpu time spent up to now is 138.7 secs Computing kpt #: 190 total cpu time spent up to now is 139.4 secs Computing kpt #: 191 total cpu time spent up to now is 140.1 secs Computing kpt #: 192 total cpu time spent up to now is 140.8 secs Computing kpt #: 193 total cpu time spent up to now is 141.6 secs Computing kpt #: 194 total cpu time spent up to now is 142.3 secs Computing kpt #: 195 total cpu time spent up to now is 143.0 secs Computing kpt #: 196 total cpu time spent up to now is 143.7 secs Computing kpt #: 197 total cpu time spent up to now is 144.4 secs Computing kpt #: 198 total cpu time spent up to now is 145.2 secs Computing kpt #: 199 total cpu time spent up to now is 145.9 secs Computing kpt #: 200 total cpu time spent up to now is 146.6 secs Computing kpt #: 201 total cpu time spent up to now is 147.3 secs Computing kpt #: 202 total cpu time spent up to now is 148.1 secs Computing kpt #: 203 total cpu time spent up to now is 148.8 secs Computing kpt #: 204 total cpu time spent up to now is 149.5 secs Computing kpt #: 205 total cpu time spent up to now is 150.2 secs Computing kpt #: 206 total cpu time spent up to now is 150.9 secs Computing kpt #: 207 total cpu time spent up to now is 151.6 secs Computing kpt #: 208 total cpu time spent up to now is 152.3 secs Computing kpt #: 209 total cpu time spent up to now is 153.0 secs Computing kpt #: 210 total cpu time spent up to now is 153.7 secs Computing kpt #: 211 total cpu time spent up to now is 154.4 secs Computing kpt #: 212 total cpu time spent up to now is 155.1 secs Computing kpt #: 213 total cpu time spent up to now is 155.7 secs Computing kpt #: 214 total cpu time spent up to now is 156.4 secs Computing kpt #: 215 total cpu time spent up to now is 157.1 secs Computing kpt #: 216 total cpu time spent up to now is 157.7 secs Computing kpt #: 217 total cpu time spent up to now is 158.4 secs Computing kpt #: 218 total cpu time spent up to now is 159.0 secs Computing kpt #: 219 total cpu time spent up to now is 159.7 secs Computing kpt #: 220 total cpu time spent up to now is 160.4 secs Computing kpt #: 221 total cpu time spent up to now is 161.0 secs Computing kpt #: 222 total cpu time spent up to now is 161.7 secs Computing kpt #: 223 total cpu time spent up to now is 162.4 secs Computing kpt #: 224 total cpu time spent up to now is 163.0 secs Computing kpt #: 225 total cpu time spent up to now is 163.7 secs Computing kpt #: 226 total cpu time spent up to now is 164.3 secs Computing kpt #: 227 total cpu time spent up to now is 165.0 secs Computing kpt #: 228 total cpu time spent up to now is 165.7 secs Computing kpt #: 229 total cpu time spent up to now is 166.4 secs Computing kpt #: 230 total cpu time spent up to now is 167.0 secs Computing kpt #: 231 total cpu time spent up to now is 167.7 secs Computing kpt #: 232 total cpu time spent up to now is 168.4 secs Computing kpt #: 233 total cpu time spent up to now is 169.1 secs Computing kpt #: 234 total cpu time spent up to now is 169.8 secs Computing kpt #: 235 total cpu time spent up to now is 170.5 secs Computing kpt #: 236 total cpu time spent up to now is 171.2 secs Computing kpt #: 237 total cpu time spent up to now is 171.9 secs Computing kpt #: 238 total cpu time spent up to now is 172.6 secs Computing kpt #: 239 total cpu time spent up to now is 173.3 secs Computing kpt #: 240 total cpu time spent up to now is 174.1 secs Computing kpt #: 241 total cpu time spent up to now is 174.8 secs Computing kpt #: 242 total cpu time spent up to now is 175.5 secs Computing kpt #: 243 total cpu time spent up to now is 176.2 secs Computing kpt #: 244 total cpu time spent up to now is 176.9 secs Computing kpt #: 245 total cpu time spent up to now is 177.7 secs Computing kpt #: 246 total cpu time spent up to now is 178.4 secs Computing kpt #: 247 total cpu time spent up to now is 179.1 secs Computing kpt #: 248 total cpu time spent up to now is 179.9 secs Computing kpt #: 249 total cpu time spent up to now is 180.6 secs Computing kpt #: 250 total cpu time spent up to now is 181.4 secs Computing kpt #: 251 total cpu time spent up to now is 182.1 secs Computing kpt #: 252 total cpu time spent up to now is 182.8 secs Computing kpt #: 253 total cpu time spent up to now is 183.6 secs Computing kpt #: 254 total cpu time spent up to now is 184.3 secs Computing kpt #: 255 total cpu time spent up to now is 185.1 secs Computing kpt #: 256 total cpu time spent up to now is 185.8 secs Computing kpt #: 257 total cpu time spent up to now is 186.5 secs Computing kpt #: 258 total cpu time spent up to now is 187.3 secs Computing kpt #: 259 total cpu time spent up to now is 188.0 secs Computing kpt #: 260 total cpu time spent up to now is 188.7 secs Computing kpt #: 261 total cpu time spent up to now is 189.5 secs Computing kpt #: 262 total cpu time spent up to now is 190.2 secs Computing kpt #: 263 total cpu time spent up to now is 191.0 secs Computing kpt #: 264 total cpu time spent up to now is 191.7 secs Computing kpt #: 265 total cpu time spent up to now is 192.4 secs Computing kpt #: 266 total cpu time spent up to now is 193.2 secs Computing kpt #: 267 total cpu time spent up to now is 193.9 secs Computing kpt #: 268 total cpu time spent up to now is 194.6 secs Computing kpt #: 269 total cpu time spent up to now is 195.3 secs Computing kpt #: 270 total cpu time spent up to now is 196.0 secs Computing kpt #: 271 total cpu time spent up to now is 196.7 secs Computing kpt #: 272 total cpu time spent up to now is 197.4 secs Computing kpt #: 273 total cpu time spent up to now is 198.1 secs Computing kpt #: 274 total cpu time spent up to now is 198.8 secs Computing kpt #: 275 total cpu time spent up to now is 199.6 secs Computing kpt #: 276 total cpu time spent up to now is 200.3 secs Computing kpt #: 277 total cpu time spent up to now is 201.0 secs Computing kpt #: 278 total cpu time spent up to now is 201.7 secs Computing kpt #: 279 total cpu time spent up to now is 202.5 secs Computing kpt #: 280 total cpu time spent up to now is 203.2 secs Computing kpt #: 281 total cpu time spent up to now is 203.9 secs Computing kpt #: 282 total cpu time spent up to now is 204.6 secs Computing kpt #: 283 total cpu time spent up to now is 205.4 secs Computing kpt #: 284 total cpu time spent up to now is 206.1 secs Computing kpt #: 285 total cpu time spent up to now is 206.8 secs Computing kpt #: 286 total cpu time spent up to now is 207.4 secs Computing kpt #: 287 total cpu time spent up to now is 208.1 secs Computing kpt #: 288 total cpu time spent up to now is 208.8 secs Computing kpt #: 289 total cpu time spent up to now is 209.5 secs Computing kpt #: 290 total cpu time spent up to now is 210.2 secs Computing kpt #: 291 total cpu time spent up to now is 210.9 secs Computing kpt #: 292 total cpu time spent up to now is 211.5 secs Computing kpt #: 293 total cpu time spent up to now is 212.2 secs Computing kpt #: 294 total cpu time spent up to now is 212.9 secs Computing kpt #: 295 total cpu time spent up to now is 213.6 secs Computing kpt #: 296 total cpu time spent up to now is 214.2 secs Computing kpt #: 297 total cpu time spent up to now is 214.9 secs Computing kpt #: 298 total cpu time spent up to now is 215.6 secs Computing kpt #: 299 total cpu time spent up to now is 216.3 secs Computing kpt #: 300 total cpu time spent up to now is 217.0 secs Computing kpt #: 301 total cpu time spent up to now is 217.7 secs Computing kpt #: 302 total cpu time spent up to now is 218.4 secs Computing kpt #: 303 total cpu time spent up to now is 219.1 secs Computing kpt #: 304 total cpu time spent up to now is 219.8 secs Computing kpt #: 305 total cpu time spent up to now is 220.5 secs Computing kpt #: 306 total cpu time spent up to now is 221.2 secs Computing kpt #: 307 total cpu time spent up to now is 221.8 secs Computing kpt #: 308 total cpu time spent up to now is 222.5 secs Computing kpt #: 309 total cpu time spent up to now is 223.2 secs Computing kpt #: 310 total cpu time spent up to now is 223.9 secs Computing kpt #: 311 total cpu time spent up to now is 224.5 secs Computing kpt #: 312 total cpu time spent up to now is 225.2 secs Computing kpt #: 313 total cpu time spent up to now is 225.9 secs Computing kpt #: 314 total cpu time spent up to now is 226.5 secs Computing kpt #: 315 total cpu time spent up to now is 227.2 secs Computing kpt #: 316 total cpu time spent up to now is 227.9 secs Computing kpt #: 317 total cpu time spent up to now is 228.5 secs Computing kpt #: 318 total cpu time spent up to now is 229.2 secs Computing kpt #: 319 total cpu time spent up to now is 229.9 secs Computing kpt #: 320 total cpu time spent up to now is 230.5 secs ethr = 2.00E-08, avg # of iterations = 12.5 total cpu time spent up to now is 230.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8655 PWs) bands (ev): -69.7792 -69.7792 -69.7511 -69.7511 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4540 -7.4540 -1.8770 -1.8770 -0.7869 -0.7869 4.3692 4.3692 6.2637 6.2637 6.3378 6.3378 6.3396 6.3396 6.4711 6.4711 6.4721 6.4721 7.7713 7.7713 7.8029 7.8029 8.7346 8.7346 8.9589 8.9589 8.9708 8.9708 9.7228 9.7228 9.7609 9.7609 10.0711 10.0711 10.5059 10.5059 10.5425 10.5425 k = 0.0114 0.0066-0.0000 ( 8661 PWs) bands (ev): -69.7796 -69.7796 -69.7514 -69.7514 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3237 -38.3237 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4543 -7.4543 -1.8759 -1.8759 -0.7869 -0.7869 4.3706 4.3706 6.2635 6.2635 6.3359 6.3359 6.3383 6.3383 6.4706 6.4706 6.4726 6.4726 7.7705 7.7705 7.8020 7.8020 8.7345 8.7345 8.9548 8.9548 8.9668 8.9668 9.7142 9.7142 9.7537 9.7537 10.0836 10.0836 10.4993 10.4993 10.5366 10.5366 k = 0.0227 0.0131-0.0000 ( 8683 PWs) bands (ev): -69.7804 -69.7804 -69.7530 -69.7530 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3238 -38.3238 -38.3011 -38.3011 -38.2583 -38.2583 -25.7934 -25.7934 -8.6581 -8.6581 -7.5938 -7.5938 -7.4551 -7.4551 -1.8727 -1.8727 -0.7869 -0.7869 4.3748 4.3748 6.2610 6.2610 6.3257 6.3257 6.3351 6.3351 6.4681 6.4681 6.4755 6.4755 7.7671 7.7671 7.7988 7.7988 8.7315 8.7315 8.9435 8.9435 8.9576 8.9576 9.6881 9.6881 9.7443 9.7443 10.1143 10.1143 10.4724 10.4724 10.5240 10.5240 k = 0.0341 0.0197-0.0000 ( 8671 PWs) bands (ev): -69.7795 -69.7795 -69.7527 -69.7527 -39.5500 -39.5500 -39.5018 -39.5018 -38.3834 -38.3834 -38.3240 -38.3240 -38.3009 -38.3009 -38.2584 -38.2584 -25.7933 -25.7933 -8.6585 -8.6585 -7.5939 -7.5939 -7.4566 -7.4566 -1.8672 -1.8672 -0.7869 -0.7869 4.3820 4.3820 6.2610 6.2610 6.3145 6.3145 6.3325 6.3325 6.4668 6.4668 6.4829 6.4829 7.7643 7.7643 7.7954 7.7954 8.7362 8.7362 8.9354 8.9354 8.9519 8.9519 9.6547 9.6547 9.7455 9.7455 10.1607 10.1607 10.4309 10.4309 10.5125 10.5125 k = 0.0455 0.0262-0.0000 ( 8657 PWs) bands (ev): -69.7784 -69.7784 -69.7522 -69.7522 -39.5499 -39.5499 -39.5019 -39.5019 -38.3833 -38.3833 -38.3243 -38.3243 -38.3006 -38.3006 -38.2584 -38.2584 -25.7931 -25.7931 -8.6591 -8.6591 -7.5941 -7.5941 -7.4586 -7.4586 -1.8596 -1.8596 -0.7868 -0.7868 4.3920 4.3920 6.2598 6.2598 6.2973 6.2973 6.3314 6.3314 6.4613 6.4613 6.4921 6.4921 7.7648 7.7648 7.7955 7.7955 8.7384 8.7384 8.9237 8.9237 8.9472 8.9472 9.6110 9.6110 9.7485 9.7485 10.2103 10.2103 10.3781 10.3781 10.5033 10.5033 k = 0.0568 0.0328-0.0000 ( 8647 PWs) bands (ev): -69.7773 -69.7773 -69.7523 -69.7523 -39.5498 -39.5498 -39.5020 -39.5020 -38.3832 -38.3832 -38.3247 -38.3247 -38.3002 -38.3002 -38.2584 -38.2584 -25.7929 -25.7929 -8.6599 -8.6599 -7.5944 -7.5944 -7.4611 -7.4611 -1.8499 -1.8499 -0.7868 -0.7868 4.4049 4.4049 6.2582 6.2582 6.2760 6.2760 6.3276 6.3276 6.4533 6.4533 6.5018 6.5018 7.7653 7.7653 7.7953 7.7953 8.7443 8.7443 8.9076 8.9076 8.9378 8.9378 9.5653 9.5653 9.7505 9.7505 10.2514 10.2514 10.3278 10.3278 10.4896 10.4896 k = 0.0682 0.0394-0.0000 ( 8645 PWs) bands (ev): -69.7773 -69.7773 -69.7522 -69.7522 -39.5496 -39.5496 -39.5022 -39.5022 -38.3830 -38.3830 -38.3252 -38.3252 -38.2998 -38.2998 -38.2585 -38.2585 -25.7927 -25.7927 -8.6608 -8.6608 -7.5948 -7.5948 -7.4640 -7.4640 -1.8381 -1.8381 -0.7867 -0.7867 4.4204 4.4204 6.2501 6.2501 6.2563 6.2563 6.3243 6.3243 6.4424 6.4424 6.5118 6.5118 7.7640 7.7640 7.7933 7.7933 8.7404 8.7404 8.8907 8.8907 8.9285 8.9285 9.5173 9.5173 9.7491 9.7491 10.2284 10.2284 10.3367 10.3367 10.4761 10.4761 k = 0.0795 0.0459-0.0000 ( 8649 PWs) bands (ev): -69.7774 -69.7774 -69.7525 -69.7525 -39.5495 -39.5495 -39.5024 -39.5024 -38.3829 -38.3829 -38.3257 -38.3257 -38.2993 -38.2993 -38.2586 -38.2586 -25.7924 -25.7924 -8.6619 -8.6619 -7.5952 -7.5952 -7.4675 -7.4675 -1.8243 -1.8243 -0.7866 -0.7866 4.4386 4.4386 6.2217 6.2217 6.2517 6.2517 6.3201 6.3201 6.4277 6.4277 6.5229 6.5229 7.7615 7.7615 7.7901 7.7901 8.7370 8.7370 8.8684 8.8684 8.9179 8.9179 9.4697 9.4697 9.7485 9.7485 10.1634 10.1634 10.3795 10.3795 10.4600 10.4600 k = 0.0909 0.0525-0.0000 ( 8649 PWs) bands (ev): -69.7768 -69.7768 -69.7532 -69.7532 -39.5493 -39.5493 -39.5026 -39.5026 -38.3828 -38.3828 -38.3263 -38.3263 -38.2988 -38.2988 -38.2586 -38.2586 -25.7921 -25.7921 -8.6632 -8.6632 -7.5957 -7.5957 -7.4714 -7.4714 -1.8085 -1.8085 -0.7866 -0.7866 4.4593 4.4593 6.1910 6.1910 6.2467 6.2467 6.3148 6.3148 6.4118 6.4118 6.5346 6.5346 7.7608 7.7608 7.7884 7.7884 8.7323 8.7323 8.8455 8.8455 8.9037 8.9037 9.4264 9.4264 9.7484 9.7484 10.0938 10.0938 10.4219 10.4219 10.4412 10.4412 k = 0.1023 0.0590-0.0000 ( 8637 PWs) bands (ev): -69.7758 -69.7758 -69.7529 -69.7529 -39.5491 -39.5491 -39.5028 -39.5028 -38.3826 -38.3826 -38.3269 -38.3269 -38.2982 -38.2982 -38.2587 -38.2587 -25.7917 -25.7917 -8.6646 -8.6646 -7.5964 -7.5964 -7.4756 -7.4756 -1.7907 -1.7907 -0.7864 -0.7864 4.4827 4.4827 6.1580 6.1580 6.2415 6.2415 6.3123 6.3123 6.3924 6.3924 6.5489 6.5489 7.7615 7.7615 7.7879 7.7879 8.7254 8.7254 8.8225 8.8225 8.8939 8.8939 9.3820 9.3820 9.7517 9.7517 10.0248 10.0248 10.4235 10.4235 10.4619 10.4619 k = 0.1136 0.0656-0.0000 ( 8641 PWs) bands (ev): -69.7756 -69.7756 -69.7536 -69.7536 -39.5489 -39.5489 -39.5031 -39.5031 -38.3824 -38.3824 -38.3276 -38.3276 -38.2976 -38.2976 -38.2588 -38.2588 -25.7913 -25.7913 -8.6662 -8.6662 -7.5972 -7.5972 -7.4801 -7.4801 -1.7712 -1.7712 -0.7864 -0.7864 4.5083 4.5083 6.1221 6.1221 6.2343 6.2343 6.3073 6.3073 6.3706 6.3706 6.5635 6.5635 7.7588 7.7588 7.7843 7.7843 8.7105 8.7105 8.8031 8.8031 8.8770 8.8770 9.3392 9.3392 9.7524 9.7524 9.9543 9.9543 10.4030 10.4030 10.4927 10.4927 k = 0.1250 0.0722-0.0000 ( 8637 PWs) bands (ev): -69.7752 -69.7752 -69.7536 -69.7536 -39.5486 -39.5486 -39.5034 -39.5034 -38.3822 -38.3822 -38.3283 -38.3283 -38.2970 -38.2970 -38.2590 -38.2590 -25.7909 -25.7909 -8.6680 -8.6680 -7.5981 -7.5981 -7.4849 -7.4849 -1.7498 -1.7498 -0.7863 -0.7863 4.5361 4.5361 6.0857 6.0857 6.2253 6.2253 6.3041 6.3041 6.3475 6.3475 6.5786 6.5786 7.7571 7.7571 7.7817 7.7817 8.6890 8.6890 8.7890 8.7890 8.8622 8.8622 9.2967 9.2967 9.7532 9.7532 9.8902 9.8902 10.3821 10.3821 10.5149 10.5149 k = 0.1364 0.0787-0.0000 ( 8641 PWs) bands (ev): -69.7754 -69.7754 -69.7539 -69.7539 -39.5483 -39.5483 -39.5037 -39.5037 -38.3819 -38.3819 -38.3291 -38.3291 -38.2963 -38.2963 -38.2591 -38.2591 -25.7904 -25.7904 -8.6699 -8.6699 -7.5992 -7.5992 -7.4898 -7.4898 -1.7267 -1.7267 -0.7861 -0.7861 4.5661 4.5661 6.0476 6.0476 6.2141 6.2141 6.2989 6.2989 6.3246 6.3246 6.5928 6.5928 7.7531 7.7531 7.7763 7.7763 8.6627 8.6627 8.7780 8.7780 8.8428 8.8428 9.2572 9.2572 9.7506 9.7506 9.8282 9.8282 10.3577 10.3577 10.5303 10.5303 k = 0.1477 0.0853-0.0000 ( 8639 PWs) bands (ev): -69.7754 -69.7754 -69.7538 -69.7538 -39.5481 -39.5481 -39.5041 -39.5041 -38.3817 -38.3817 -38.3299 -38.3299 -38.2957 -38.2957 -38.2593 -38.2593 -25.7900 -25.7900 -8.6720 -8.6720 -7.6006 -7.6006 -7.4948 -7.4948 -1.7021 -1.7021 -0.7860 -0.7860 4.5979 4.5979 6.0080 6.0080 6.1983 6.1983 6.2951 6.2951 6.3034 6.3034 6.6087 6.6087 7.7499 7.7499 7.7719 7.7719 8.6322 8.6322 8.7695 8.7695 8.8261 8.8261 9.2184 9.2184 9.7478 9.7478 9.7708 9.7708 10.3351 10.3351 10.5351 10.5351 k = 0.1591 0.0919-0.0000 ( 8627 PWs) bands (ev): -69.7747 -69.7747 -69.7533 -69.7533 -39.5477 -39.5477 -39.5045 -39.5045 -38.3813 -38.3813 -38.3307 -38.3307 -38.2950 -38.2950 -38.2594 -38.2594 -25.7894 -25.7894 -8.6742 -8.6742 -7.6021 -7.6021 -7.4999 -7.4999 -1.6759 -1.6759 -0.7859 -0.7859 4.6315 4.6315 5.9677 5.9677 6.1762 6.1762 6.2844 6.2844 6.2941 6.2941 6.6262 6.6262 7.7480 7.7480 7.7689 7.7689 8.6006 8.6006 8.7617 8.7617 8.8136 8.8136 9.1827 9.1827 9.7127 9.7127 9.7536 9.7536 10.3128 10.3128 10.5291 10.5291 k = 0.1705 0.0984-0.0000 ( 8623 PWs) bands (ev): -69.7742 -69.7742 -69.7534 -69.7534 -39.5474 -39.5474 -39.5049 -39.5049 -38.3810 -38.3810 -38.3315 -38.3315 -38.2943 -38.2943 -38.2596 -38.2596 -25.7889 -25.7889 -8.6766 -8.6766 -7.6040 -7.6040 -7.5049 -7.5049 -1.6483 -1.6483 -0.7858 -0.7858 4.6665 4.6665 5.9248 5.9248 6.1479 6.1479 6.2703 6.2703 6.2916 6.2916 6.6442 6.6442 7.7464 7.7464 7.7660 7.7660 8.5639 8.5639 8.7534 8.7534 8.7972 8.7972 9.1473 9.1473 9.6603 9.6603 9.7536 9.7536 10.2904 10.2904 10.5127 10.5127 k = 0.1818 0.1050-0.0000 ( 8633 PWs) bands (ev): -69.7745 -69.7745 -69.7543 -69.7543 -39.5470 -39.5470 -39.5053 -39.5053 -38.3807 -38.3807 -38.3324 -38.3324 -38.2936 -38.2936 -38.2598 -38.2598 -25.7883 -25.7883 -8.6791 -8.6791 -7.6062 -7.6062 -7.5097 -7.5097 -1.6194 -1.6194 -0.7856 -0.7856 4.7027 4.7027 5.8808 5.8808 6.1144 6.1144 6.2589 6.2589 6.2879 6.2879 6.6606 6.6606 7.7428 7.7428 7.7614 7.7614 8.5252 8.5252 8.7423 8.7423 8.7769 8.7769 9.1115 9.1115 9.6113 9.6113 9.7489 9.7489 10.2660 10.2660 10.4863 10.4863 k = 0.1932 0.1115-0.0000 ( 8635 PWs) bands (ev): -69.7743 -69.7743 -69.7548 -69.7548 -39.5467 -39.5467 -39.5058 -39.5058 -38.3804 -38.3804 -38.3332 -38.3332 -38.2929 -38.2929 -38.2600 -38.2600 -25.7878 -25.7878 -8.6818 -8.6818 -7.6088 -7.6088 -7.5142 -7.5142 -1.5893 -1.5893 -0.7855 -0.7855 4.7399 4.7399 5.8363 5.8363 6.0781 6.0781 6.2491 6.2491 6.2851 6.2851 6.6775 6.6775 7.7411 7.7411 7.7593 7.7593 8.4862 8.4862 8.7312 8.7312 8.7594 8.7594 9.0775 9.0775 9.5688 9.5688 9.7448 9.7448 10.2426 10.2426 10.4516 10.4516 k = 0.2045 0.1181-0.0000 ( 8639 PWs) bands (ev): -69.7743 -69.7743 -69.7553 -69.7553 -39.5463 -39.5463 -39.5063 -39.5063 -38.3801 -38.3801 -38.3341 -38.3341 -38.2922 -38.2922 -38.2602 -38.2602 -25.7872 -25.7872 -8.6846 -8.6846 -7.6117 -7.6117 -7.5185 -7.5185 -1.5581 -1.5581 -0.7854 -0.7854 4.7776 4.7776 5.7902 5.7902 6.0402 6.0402 6.2415 6.2415 6.2831 6.2831 6.6948 6.6948 7.7383 7.7383 7.7552 7.7552 8.4469 8.4469 8.7180 8.7180 8.7427 8.7427 9.0434 9.0434 9.5287 9.5287 9.7399 9.7399 10.2209 10.2209 10.4103 10.4103 k = 0.2159 0.1247-0.0000 ( 8637 PWs) bands (ev): -69.7739 -69.7739 -69.7556 -69.7556 -39.5459 -39.5459 -39.5068 -39.5068 -38.3797 -38.3797 -38.3349 -38.3349 -38.2915 -38.2915 -38.2604 -38.2604 -25.7866 -25.7866 -8.6874 -8.6874 -7.6151 -7.6151 -7.5224 -7.5224 -1.5260 -1.5260 -0.7853 -0.7853 4.8155 4.8155 5.7437 5.7437 6.0021 6.0021 6.2351 6.2351 6.2811 6.2811 6.7127 6.7127 7.7364 7.7364 7.7530 7.7530 8.4081 8.4081 8.7059 8.7059 8.7285 8.7285 9.0117 9.0117 9.4945 9.4945 9.7341 9.7341 10.1986 10.1986 10.3628 10.3628 k = 0.2273 0.1312-0.0000 ( 8639 PWs) bands (ev): -69.7738 -69.7738 -69.7560 -69.7560 -39.5454 -39.5454 -39.5073 -39.5073 -38.3793 -38.3793 -38.3358 -38.3358 -38.2908 -38.2908 -38.2606 -38.2606 -25.7859 -25.7859 -8.6904 -8.6904 -7.6189 -7.6189 -7.5259 -7.5259 -1.4932 -1.4932 -0.7851 -0.7851 4.8529 4.8529 5.6961 5.6961 5.9647 5.9647 6.2300 6.2300 6.2779 6.2779 6.7304 6.7304 7.7333 7.7333 7.7507 7.7507 8.3696 8.3696 8.6908 8.6908 8.7131 8.7131 8.9815 8.9815 9.4632 9.4632 9.7268 9.7268 10.1771 10.1771 10.3101 10.3101 k = 0.2386 0.1378-0.0000 ( 8651 PWs) bands (ev): -69.7742 -69.7742 -69.7570 -69.7570 -39.5450 -39.5450 -39.5079 -39.5079 -38.3790 -38.3790 -38.3367 -38.3367 -38.2901 -38.2901 -38.2608 -38.2608 -25.7853 -25.7853 -8.6935 -8.6935 -7.6230 -7.6230 -7.5289 -7.5289 -1.4596 -1.4596 -0.7850 -0.7850 4.8894 4.8894 5.6476 5.6476 5.9292 5.9292 6.2241 6.2241 6.2747 6.2747 6.7464 6.7464 7.7305 7.7305 7.7489 7.7489 8.3316 8.3316 8.6720 8.6720 8.6959 8.6959 8.9501 8.9501 9.4366 9.4366 9.7108 9.7108 10.1570 10.1570 10.2519 10.2519 k = 0.2500 0.1443-0.0000 ( 8647 PWs) bands (ev): -69.7737 -69.7737 -69.7572 -69.7572 -39.5445 -39.5445 -39.5084 -39.5084 -38.3786 -38.3786 -38.3376 -38.3376 -38.2894 -38.2894 -38.2611 -38.2611 -25.7847 -25.7847 -8.6966 -8.6966 -7.6275 -7.6275 -7.5315 -7.5315 -1.4256 -1.4256 -0.7849 -0.7849 4.9245 4.9245 5.5989 5.5989 5.8972 5.8972 6.2193 6.2193 6.2723 6.2723 6.7638 6.7638 7.7279 7.7279 7.7483 7.7483 8.2966 8.2966 8.6560 8.6560 8.6819 8.6819 8.9224 8.9224 9.4167 9.4167 9.6963 9.6963 10.1389 10.1389 10.1958 10.1958 k = 0.2614 0.1509-0.0000 ( 8651 PWs) bands (ev): -69.7737 -69.7737 -69.7576 -69.7576 -39.5441 -39.5441 -39.5090 -39.5090 -38.3782 -38.3782 -38.3384 -38.3384 -38.2888 -38.2888 -38.2613 -38.2613 -25.7841 -25.7841 -8.6998 -8.6998 -7.6323 -7.6323 -7.5336 -7.5336 -1.3912 -1.3912 -0.7847 -0.7847 4.9570 4.9570 5.5492 5.5492 5.8685 5.8685 6.2146 6.2146 6.2702 6.2702 6.7804 6.7804 7.7255 7.7255 7.7478 7.7478 8.2607 8.2607 8.6393 8.6393 8.6667 8.6667 8.8943 8.8943 9.3972 9.3972 9.6763 9.6763 10.1212 10.1212 10.1378 10.1378 k = 0.2727 0.1575-0.0000 ( 8651 PWs) bands (ev): -69.7735 -69.7735 -69.7579 -69.7579 -39.5436 -39.5436 -39.5096 -39.5096 -38.3777 -38.3777 -38.3393 -38.3393 -38.2881 -38.2881 -38.2616 -38.2616 -25.7834 -25.7834 -8.7030 -8.7030 -7.6374 -7.6374 -7.5354 -7.5354 -1.3566 -1.3566 -0.7846 -0.7846 4.9862 4.9862 5.4995 5.4995 5.8440 5.8440 6.2107 6.2107 6.2689 6.2689 6.7981 6.7981 7.7238 7.7238 7.7460 7.7460 8.2260 8.2260 8.6261 8.6261 8.6527 8.6527 8.8673 8.8673 9.3792 9.3792 9.6566 9.6566 10.0702 10.0702 10.1147 10.1147 k = 0.2841 0.1640-0.0000 ( 8661 PWs) bands (ev): -69.7735 -69.7735 -69.7590 -69.7590 -39.5431 -39.5431 -39.5102 -39.5102 -38.3773 -38.3773 -38.3402 -38.3402 -38.2875 -38.2875 -38.2618 -38.2618 -25.7828 -25.7828 -8.7063 -8.7063 -7.6426 -7.6426 -7.5368 -7.5368 -1.3220 -1.3220 -0.7845 -0.7845 5.0107 5.0107 5.4504 5.4504 5.8245 5.8245 6.2059 6.2059 6.2670 6.2670 6.8144 6.8144 7.7212 7.7212 7.7443 7.7443 8.1914 8.1914 8.6124 8.6124 8.6382 8.6382 8.8392 8.8392 9.3651 9.3651 9.6304 9.6304 10.0050 10.0050 10.1031 10.1031 k = 0.2955 0.1706-0.0000 ( 8665 PWs) bands (ev): -69.7735 -69.7735 -69.7595 -69.7595 -39.5426 -39.5426 -39.5108 -39.5108 -38.3768 -38.3768 -38.3410 -38.3410 -38.2869 -38.2869 -38.2621 -38.2621 -25.7822 -25.7822 -8.7095 -8.7095 -7.6479 -7.6479 -7.5379 -7.5379 -1.2876 -1.2876 -0.7843 -0.7843 5.0294 5.0294 5.4030 5.4030 5.8102 5.8102 6.2031 6.2031 6.2658 6.2658 6.8302 6.8302 7.7192 7.7192 7.7426 7.7426 8.1596 8.1596 8.5988 8.5988 8.6251 8.6251 8.8152 8.8152 9.3524 9.3524 9.6015 9.6015 9.9416 9.9416 10.0959 10.0959 k = 0.3068 0.1771-0.0000 ( 8665 PWs) bands (ev): -69.7732 -69.7732 -69.7598 -69.7598 -39.5421 -39.5421 -39.5114 -39.5114 -38.3764 -38.3764 -38.3419 -38.3419 -38.2862 -38.2862 -38.2623 -38.2623 -25.7816 -25.7816 -8.7128 -8.7128 -7.6533 -7.6533 -7.5387 -7.5387 -1.2536 -1.2536 -0.7842 -0.7842 5.0407 5.0407 5.3582 5.3582 5.8017 5.8017 6.2017 6.2017 6.2653 6.2653 6.8458 6.8458 7.7183 7.7183 7.7421 7.7421 8.1293 8.1293 8.5868 8.5868 8.6160 8.6160 8.7934 8.7934 9.3392 9.3392 9.5711 9.5711 9.8764 9.8764 10.0926 10.0926 k = 0.3182 0.1837-0.0000 ( 8662 PWs) bands (ev): -69.7729 -69.7729 -69.7598 -69.7598 -39.5415 -39.5415 -39.5120 -39.5120 -38.3759 -38.3759 -38.3427 -38.3427 -38.2856 -38.2856 -38.2626 -38.2626 -25.7810 -25.7810 -8.7160 -8.7160 -7.6586 -7.6586 -7.5393 -7.5393 -1.2201 -1.2201 -0.7840 -0.7840 5.0435 5.0435 5.3192 5.3192 5.7989 5.7989 6.2009 6.2009 6.2644 6.2644 6.8598 6.8598 7.7168 7.7168 7.7428 7.7428 8.1030 8.1030 8.5739 8.5739 8.6088 8.6088 8.7735 8.7735 9.3332 9.3332 9.5339 9.5339 9.8158 9.8158 10.0893 10.0893 k = 0.3295 0.1903-0.0000 ( 8654 PWs) bands (ev): -69.7720 -69.7720 -69.7597 -69.7597 -39.5410 -39.5410 -39.5126 -39.5126 -38.3754 -38.3754 -38.3435 -38.3435 -38.2850 -38.2850 -38.2628 -38.2628 -25.7805 -25.7805 -8.7191 -8.7191 -7.6638 -7.6638 -7.5397 -7.5397 -1.1872 -1.1872 -0.7838 -0.7838 5.0365 5.0365 5.2864 5.2864 5.8019 5.8019 6.2015 6.2015 6.2636 6.2636 6.8735 6.8735 7.7158 7.7158 7.7440 7.7440 8.0791 8.0791 8.5597 8.5597 8.6045 8.6045 8.7542 8.7542 9.3312 9.3312 9.4970 9.4970 9.7578 9.7578 10.0879 10.0879 k = 0.3409 0.1968-0.0000 ( 8658 PWs) bands (ev): -69.7723 -69.7723 -69.7600 -69.7600 -39.5404 -39.5404 -39.5133 -39.5133 -38.3750 -38.3750 -38.3443 -38.3443 -38.2845 -38.2845 -38.2631 -38.2631 -25.7799 -25.7799 -8.7222 -8.7222 -7.6689 -7.6689 -7.5399 -7.5399 -1.1554 -1.1554 -0.7835 -0.7835 5.0189 5.0189 5.2606 5.2606 5.8083 5.8083 6.2032 6.2032 6.2627 6.2627 6.8866 6.8866 7.7132 7.7132 7.7424 7.7424 8.0542 8.0542 8.5448 8.5448 8.6025 8.6025 8.7357 8.7357 9.3230 9.3230 9.4594 9.4594 9.6988 9.6988 10.0873 10.0873 k = 0.3523 0.2034-0.0000 ( 8660 PWs) bands (ev): -69.7719 -69.7719 -69.7606 -69.7606 -39.5399 -39.5399 -39.5139 -39.5139 -38.3745 -38.3745 -38.3450 -38.3450 -38.2839 -38.2839 -38.2633 -38.2633 -25.7794 -25.7794 -8.7251 -8.7251 -7.6738 -7.6738 -7.5400 -7.5400 -1.1246 -1.1246 -0.7833 -0.7833 4.9930 4.9930 5.2413 5.2413 5.8181 5.8181 6.2062 6.2062 6.2616 6.2616 6.8988 6.8988 7.7116 7.7116 7.7421 7.7421 8.0306 8.0306 8.5298 8.5298 8.6008 8.6008 8.7188 8.7188 9.3203 9.3203 9.4197 9.4197 9.6433 9.6433 10.0876 10.0876 k = 0.3636 0.2099-0.0000 ( 8656 PWs) bands (ev): -69.7716 -69.7716 -69.7604 -69.7604 -39.5394 -39.5394 -39.5145 -39.5145 -38.3741 -38.3741 -38.3457 -38.3457 -38.2834 -38.2834 -38.2636 -38.2636 -25.7789 -25.7789 -8.7279 -8.7279 -7.6785 -7.6785 -7.5400 -7.5400 -1.0952 -1.0952 -0.7829 -0.7829 4.9615 4.9615 5.2271 5.2271 5.8302 5.8302 6.2110 6.2110 6.2610 6.2610 6.9106 6.9106 7.7100 7.7100 7.7407 7.7407 8.0106 8.0106 8.5158 8.5158 8.6065 8.6065 8.7044 8.7044 9.3164 9.3164 9.3797 9.3797 9.5933 9.5933 10.0885 10.0885 k = 0.3750 0.2165-0.0000 ( 8654 PWs) bands (ev): -69.7712 -69.7712 -69.7606 -69.7606 -39.5388 -39.5388 -39.5151 -39.5151 -38.3736 -38.3736 -38.3464 -38.3464 -38.2829 -38.2829 -38.2639 -38.2639 -25.7785 -25.7785 -8.7306 -8.7306 -7.6829 -7.6829 -7.5399 -7.5399 -1.0673 -1.0673 -0.7826 -0.7826 4.9268 4.9268 5.2158 5.2158 5.8435 5.8435 6.2172 6.2172 6.2605 6.2605 6.9215 6.9215 7.7093 7.7093 7.7391 7.7391 7.9908 7.9908 8.5030 8.5030 8.6144 8.6144 8.6911 8.6911 9.3100 9.3100 9.3402 9.3402 9.5458 9.5458 10.0904 10.0904 k = 0.3864 0.2231-0.0000 ( 8658 PWs) bands (ev): -69.7711 -69.7711 -69.7612 -69.7612 -39.5383 -39.5383 -39.5156 -39.5156 -38.3732 -38.3732 -38.3471 -38.3471 -38.2825 -38.2825 -38.2641 -38.2641 -25.7780 -25.7780 -8.7332 -8.7332 -7.6870 -7.6870 -7.5398 -7.5398 -1.0412 -1.0412 -0.7821 -0.7821 4.8911 4.8911 5.2058 5.2058 5.8568 5.8568 6.2251 6.2251 6.2600 6.2600 6.9311 6.9311 7.7086 7.7086 7.7351 7.7351 7.9735 7.9735 8.4909 8.4909 8.6232 8.6232 8.6774 8.6774 9.2963 9.2963 9.3060 9.3060 9.5001 9.5001 10.0923 10.0923 k = 0.3977 0.2296-0.0000 ( 8674 PWs) bands (ev): -69.7721 -69.7721 -69.7620 -69.7620 -39.5378 -39.5378 -39.5162 -39.5162 -38.3728 -38.3728 -38.3478 -38.3478 -38.2820 -38.2820 -38.2644 -38.2644 -25.7776 -25.7776 -8.7355 -8.7355 -7.6908 -7.6908 -7.5396 -7.5396 -1.0170 -1.0170 -0.7817 -0.7817 4.8560 4.8560 5.1966 5.1966 5.8694 5.8694 6.2341 6.2341 6.2595 6.2595 6.9384 6.9384 7.7068 7.7068 7.7299 7.7299 7.9576 7.9576 8.4756 8.4756 8.6319 8.6319 8.6640 8.6640 9.2512 9.2512 9.2952 9.2952 9.4576 9.4576 10.0941 10.0941 k = 0.4091 0.2362-0.0000 ( 8660 PWs) bands (ev): -69.7714 -69.7714 -69.7611 -69.7611 -39.5374 -39.5374 -39.5168 -39.5168 -38.3724 -38.3724 -38.3484 -38.3484 -38.2816 -38.2816 -38.2646 -38.2646 -25.7773 -25.7773 -8.7377 -8.7377 -7.6942 -7.6942 -7.5394 -7.5394 -0.9949 -0.9949 -0.7811 -0.7811 4.8231 4.8231 5.1889 5.1889 5.8814 5.8814 6.2451 6.2451 6.2597 6.2597 6.9466 6.9466 7.7076 7.7076 7.7261 7.7261 7.9492 7.9492 8.4671 8.4671 8.6475 8.6475 8.6590 8.6590 9.2122 9.2122 9.2883 9.2883 9.4289 9.4289 10.0972 10.0972 k = 0.4205 0.2427-0.0000 ( 8666 PWs) bands (ev): -69.7715 -69.7715 -69.7617 -69.7617 -39.5369 -39.5369 -39.5173 -39.5173 -38.3720 -38.3720 -38.3489 -38.3489 -38.2813 -38.2813 -38.2648 -38.2648 -25.7770 -25.7770 -8.7396 -8.7396 -7.6973 -7.6973 -7.5392 -7.5392 -0.9751 -0.9751 -0.7805 -0.7805 4.7927 4.7927 5.1816 5.1816 5.8915 5.8915 6.2561 6.2561 6.2595 6.2595 6.9529 6.9529 7.7070 7.7070 7.7217 7.7217 7.9385 7.9385 8.4581 8.4581 8.6474 8.6474 8.6647 8.6647 9.1685 9.1685 9.2744 9.2744 9.4020 9.4020 10.0990 10.0990 k = 0.4318 0.2493-0.0000 ( 8662 PWs) bands (ev): -69.7713 -69.7713 -69.7614 -69.7614 -39.5365 -39.5365 -39.5177 -39.5177 -38.3717 -38.3717 -38.3494 -38.3494 -38.2809 -38.2809 -38.2649 -38.2649 -25.7767 -25.7767 -8.7413 -8.7413 -7.7000 -7.7000 -7.5389 -7.5389 -0.9577 -0.9577 -0.7798 -0.7798 4.7655 4.7655 5.1753 5.1753 5.9004 5.9004 6.2590 6.2590 6.2677 6.2677 6.9588 6.9588 7.7067 7.7067 7.7198 7.7198 7.9312 7.9312 8.4507 8.4507 8.6425 8.6425 8.6826 8.6826 9.1287 9.1287 9.2591 9.2591 9.3840 9.3840 10.1010 10.1010 k = 0.4432 0.2559-0.0000 ( 8672 PWs) bands (ev): -69.7714 -69.7714 -69.7624 -69.7624 -39.5361 -39.5361 -39.5181 -39.5181 -38.3714 -38.3714 -38.3498 -38.3498 -38.2807 -38.2807 -38.2651 -38.2651 -25.7764 -25.7764 -8.7428 -8.7428 -7.7024 -7.7024 -7.5387 -7.5387 -0.9428 -0.9428 -0.7791 -0.7791 4.7417 4.7417 5.1698 5.1698 5.9070 5.9070 6.2583 6.2583 6.2784 6.2784 6.9636 6.9636 7.7060 7.7060 7.7147 7.7147 7.9216 7.9216 8.4441 8.4441 8.6350 8.6350 8.7001 8.7001 9.0891 9.0891 9.2407 9.2407 9.3706 9.3706 10.1008 10.1008 k = 0.4545 0.2624-0.0000 ( 8668 PWs) bands (ev): -69.7710 -69.7710 -69.7624 -69.7624 -39.5358 -39.5358 -39.5185 -39.5185 -38.3711 -38.3711 -38.3502 -38.3502 -38.2804 -38.2804 -38.2652 -38.2652 -25.7762 -25.7762 -8.7440 -8.7440 -7.7043 -7.7043 -7.5386 -7.5386 -0.9306 -0.9306 -0.7784 -0.7784 4.7218 4.7218 5.1651 5.1651 5.9123 5.9123 6.2588 6.2588 6.2883 6.2883 6.9681 6.9681 7.7078 7.7078 7.7110 7.7110 7.9161 7.9161 8.4396 8.4396 8.6304 8.6304 8.7218 8.7218 9.0561 9.0561 9.2245 9.2245 9.3624 9.3624 10.1033 10.1033 k = 0.4659 0.2690-0.0000 ( 8670 PWs) bands (ev): -69.7708 -69.7708 -69.7628 -69.7628 -39.5356 -39.5356 -39.5187 -39.5187 -38.3709 -38.3709 -38.3505 -38.3505 -38.2803 -38.2803 -38.2653 -38.2653 -25.7761 -25.7761 -8.7450 -8.7450 -7.7058 -7.7058 -7.5384 -7.5384 -0.9211 -0.9211 -0.7777 -0.7777 4.7061 4.7061 5.1611 5.1611 5.9164 5.9164 6.2590 6.2590 6.2965 6.2965 6.9713 6.9713 7.7054 7.7054 7.7096 7.7096 7.9118 7.9118 8.4353 8.4353 8.6260 8.6260 8.7427 8.7427 9.0239 9.0239 9.2096 9.2096 9.3577 9.3577 10.1051 10.1051 k = 0.4773 0.2756-0.0000 ( 8656 PWs) bands (ev): -69.7704 -69.7704 -69.7615 -69.7615 -39.5353 -39.5353 -39.5189 -39.5189 -38.3707 -38.3707 -38.3506 -38.3506 -38.2801 -38.2801 -38.2654 -38.2654 -25.7760 -25.7760 -8.7457 -8.7457 -7.7068 -7.7068 -7.5383 -7.5383 -0.9143 -0.9143 -0.7772 -0.7772 4.6949 4.6949 5.1586 5.1586 5.9193 5.9193 6.2598 6.2598 6.3031 6.3031 6.9735 6.9735 7.7044 7.7044 7.7095 7.7095 7.9150 7.9150 8.4326 8.4326 8.6278 8.6278 8.7624 8.7624 9.0000 9.0000 9.2027 9.2027 9.3554 9.3554 10.1086 10.1086 k = 0.4886 0.2821-0.0000 ( 8672 PWs) bands (ev): -69.7719 -69.7719 -69.7619 -69.7619 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7461 -8.7461 -7.7075 -7.7075 -7.5382 -7.5382 -0.9102 -0.9102 -0.7769 -0.7769 4.6881 4.6881 5.1565 5.1565 5.9212 5.9212 6.2594 6.2594 6.3064 6.3064 6.9738 6.9738 7.7033 7.7033 7.7053 7.7053 7.9118 7.9118 8.4290 8.4290 8.6248 8.6248 8.7731 8.7731 8.9784 8.9784 9.1892 9.1892 9.3499 9.3499 10.1079 10.1079 k = 0.5000 0.2887-0.0000 ( 8680 PWs) bands (ev): -69.7726 -69.7726 -69.7621 -69.7621 -39.5352 -39.5352 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9088 -0.9088 -0.7768 -0.7768 4.6858 4.6858 5.1560 5.1560 5.9216 5.9216 6.2591 6.2591 6.3076 6.3076 6.9738 6.9738 7.7012 7.7012 7.7026 7.7026 7.9110 7.9110 8.4272 8.4272 8.6242 8.6242 8.7758 8.7758 8.9710 8.9710 9.1840 9.1840 9.3489 9.3489 10.1073 10.1073 k = 0.5000 0.2887-0.0000 ( 8680 PWs) bands (ev): -69.7726 -69.7726 -69.7621 -69.7621 -39.5352 -39.5352 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9088 -0.9088 -0.7768 -0.7768 4.6858 4.6858 5.1560 5.1560 5.9216 5.9216 6.2591 6.2591 6.3076 6.3076 6.9738 6.9738 7.7012 7.7012 7.7026 7.7026 7.9110 7.9110 8.4272 8.4272 8.6242 8.6242 8.7758 8.7758 8.9710 8.9710 9.1840 9.1840 9.3489 9.3489 10.1073 10.1073 k = 0.4936 0.2998-0.0000 ( 8672 PWs) bands (ev): -69.7716 -69.7716 -69.7622 -69.7622 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7076 -7.7076 -7.5384 -7.5384 -0.9084 -0.9084 -0.7768 -0.7768 4.6869 4.6869 5.1559 5.1559 5.9214 5.9214 6.2563 6.2563 6.3098 6.3098 6.9711 6.9711 7.7017 7.7017 7.7056 7.7056 7.9116 7.9116 8.4280 8.4280 8.6244 8.6244 8.7806 8.7806 8.9701 8.9701 9.1889 9.1889 9.3479 9.3479 10.1096 10.1096 k = 0.4872 0.3109-0.0000 ( 8672 PWs) bands (ev): -69.7714 -69.7714 -69.7624 -69.7624 -39.5352 -39.5352 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7463 -8.7463 -7.7075 -7.7075 -7.5390 -7.5390 -0.9071 -0.9071 -0.7766 -0.7766 4.6904 4.6904 5.1557 5.1557 5.9206 5.9206 6.2496 6.2496 6.3149 6.3149 6.9618 6.9618 7.6996 7.6996 7.7056 7.7056 7.9124 7.9124 8.4257 8.4257 8.6264 8.6264 8.7866 8.7866 8.9676 8.9676 9.1892 9.1892 9.3439 9.3439 10.1167 10.1167 k = 0.4808 0.3220-0.0000 ( 8672 PWs) bands (ev): -69.7710 -69.7710 -69.7628 -69.7628 -39.5351 -39.5351 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7463 -8.7463 -7.7072 -7.7072 -7.5399 -7.5399 -0.9049 -0.9049 -0.7764 -0.7764 4.6960 4.6960 5.1555 5.1555 5.9206 5.9206 6.2403 6.2403 6.3215 6.3215 6.9463 6.9463 7.6966 7.6966 7.7043 7.7043 7.9138 7.9138 8.4221 8.4221 8.6271 8.6271 8.7958 8.7958 8.9626 8.9626 9.1915 9.1915 9.3380 9.3380 10.1279 10.1279 k = 0.4744 0.3331-0.0000 ( 8666 PWs) bands (ev): -69.7705 -69.7705 -69.7626 -69.7626 -39.5350 -39.5350 -39.5193 -39.5193 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7463 -8.7463 -7.7068 -7.7068 -7.5413 -7.5413 -0.9019 -0.9019 -0.7760 -0.7760 4.7040 4.7040 5.1548 5.1548 5.9207 5.9207 6.2298 6.2298 6.3285 6.3285 6.9248 6.9248 7.6922 7.6922 7.7037 7.7037 7.9187 7.9187 8.4179 8.4179 8.6286 8.6286 8.8080 8.8080 8.9602 8.9602 9.1973 9.1973 9.3277 9.3277 10.1435 10.1435 k = 0.4679 0.3442-0.0000 ( 8676 PWs) bands (ev): -69.7712 -69.7712 -69.7631 -69.7631 -39.5349 -39.5349 -39.5195 -39.5195 -38.3705 -38.3705 -38.3510 -38.3510 -38.2800 -38.2800 -38.2655 -38.2655 -25.7757 -25.7757 -8.7463 -8.7463 -7.7063 -7.7063 -7.5429 -7.5429 -0.8981 -0.8981 -0.7756 -0.7756 4.7142 4.7142 5.1538 5.1538 5.9210 5.9210 6.2179 6.2179 6.3349 6.3349 6.8967 6.8967 7.6832 7.6832 7.7023 7.7023 7.9231 7.9231 8.4100 8.4100 8.6311 8.6311 8.8193 8.8193 8.9506 8.9506 9.1993 9.1993 9.3112 9.3112 10.1614 10.1614 k = 0.4615 0.3553-0.0000 ( 8672 PWs) bands (ev): -69.7709 -69.7709 -69.7629 -69.7629 -39.5348 -39.5348 -39.5196 -39.5196 -38.3705 -38.3705 -38.3511 -38.3511 -38.2800 -38.2800 -38.2655 -38.2655 -25.7756 -25.7756 -8.7464 -8.7464 -7.7057 -7.7057 -7.5449 -7.5449 -0.8935 -0.8935 -0.7751 -0.7751 4.7266 4.7266 5.1528 5.1528 5.9198 5.9198 6.2068 6.2068 6.3417 6.3417 6.8639 6.8639 7.6805 7.6805 7.7000 7.7000 7.9303 7.9303 8.4021 8.4021 8.6371 8.6371 8.8344 8.8344 8.9434 8.9434 9.2005 9.2005 9.2965 9.2965 10.1865 10.1865 k = 0.4551 0.3664-0.0000 ( 8672 PWs) bands (ev): -69.7704 -69.7704 -69.7634 -69.7634 -39.5346 -39.5346 -39.5198 -39.5198 -38.3704 -38.3704 -38.3511 -38.3511 -38.2799 -38.2799 -38.2655 -38.2655 -25.7755 -25.7755 -8.7464 -8.7464 -7.7050 -7.7050 -7.5471 -7.5471 -0.8882 -0.8882 -0.7745 -0.7745 4.7411 4.7411 5.1517 5.1517 5.9182 5.9182 6.1946 6.1946 6.3474 6.3474 6.8266 6.8266 7.6764 7.6764 7.6983 7.6983 7.9366 7.9366 8.3934 8.3934 8.6421 8.6421 8.8514 8.8514 8.9349 8.9349 9.2050 9.2050 9.2804 9.2804 10.2084 10.2084 k = 0.4487 0.3775-0.0000 ( 8678 PWs) bands (ev): -69.7704 -69.7704 -69.7641 -69.7641 -39.5344 -39.5344 -39.5200 -39.5200 -38.3704 -38.3704 -38.3512 -38.3512 -38.2799 -38.2799 -38.2655 -38.2655 -25.7754 -25.7754 -8.7465 -8.7465 -7.7042 -7.7042 -7.5497 -7.5497 -0.8822 -0.8822 -0.7739 -0.7739 4.7576 4.7576 5.1504 5.1504 5.9156 5.9156 6.1829 6.1829 6.3525 6.3525 6.7853 6.7853 7.6720 7.6720 7.6956 7.6956 7.9409 7.9409 8.3833 8.3833 8.6469 8.6469 8.8674 8.8674 8.9262 8.9262 9.2048 9.2048 9.2635 9.2635 10.2336 10.2336 k = 0.4423 0.3886-0.0000 ( 8674 PWs) bands (ev): -69.7701 -69.7701 -69.7640 -69.7640 -39.5342 -39.5342 -39.5202 -39.5202 -38.3703 -38.3703 -38.3513 -38.3513 -38.2799 -38.2799 -38.2655 -38.2655 -25.7753 -25.7753 -8.7465 -8.7465 -7.7034 -7.7034 -7.5524 -7.5524 -0.8756 -0.8756 -0.7732 -0.7732 4.7761 4.7761 5.1489 5.1489 5.9129 5.9129 6.1714 6.1714 6.3570 6.3570 6.7411 6.7411 7.6685 7.6685 7.6943 7.6943 7.9481 7.9481 8.3739 8.3739 8.6548 8.6548 8.8862 8.8862 8.9185 8.9185 9.2047 9.2047 9.2489 9.2489 10.2600 10.2600 k = 0.4359 0.3997-0.0000 ( 8674 PWs) bands (ev): -69.7697 -69.7697 -69.7644 -69.7644 -39.5340 -39.5340 -39.5204 -39.5204 -38.3702 -38.3702 -38.3514 -38.3514 -38.2799 -38.2799 -38.2655 -38.2655 -25.7752 -25.7752 -8.7466 -8.7466 -7.7025 -7.7025 -7.5553 -7.5553 -0.8686 -0.8686 -0.7724 -0.7724 4.7967 4.7967 5.1475 5.1475 5.9073 5.9073 6.1602 6.1602 6.3605 6.3605 6.6950 6.6950 7.6642 7.6642 7.6922 7.6922 7.9559 7.9559 8.3638 8.3638 8.6642 8.6642 8.9024 8.9024 8.9108 8.9108 9.1997 9.1997 9.2381 9.2381 10.2871 10.2871 k = 0.4295 0.4108-0.0000 ( 8676 PWs) bands (ev): -69.7698 -69.7698 -69.7645 -69.7645 -39.5337 -39.5337 -39.5207 -39.5207 -38.3701 -38.3701 -38.3516 -38.3516 -38.2798 -38.2798 -38.2656 -38.2656 -25.7751 -25.7751 -8.7467 -8.7467 -7.7016 -7.7016 -7.5584 -7.5584 -0.8610 -0.8610 -0.7717 -0.7717 4.8189 4.8189 5.1457 5.1457 5.9003 5.9003 6.1495 6.1495 6.3634 6.3634 6.6479 6.6479 7.6621 7.6621 7.6892 7.6892 7.9644 7.9644 8.3509 8.3509 8.6751 8.6751 8.8982 8.8982 8.9256 8.9256 9.1844 9.1844 9.2314 9.2314 10.3128 10.3128 k = 0.4231 0.4219-0.0000 ( 8672 PWs) bands (ev): -69.7692 -69.7692 -69.7646 -69.7646 -39.5335 -39.5335 -39.5210 -39.5210 -38.3700 -38.3700 -38.3517 -38.3517 -38.2798 -38.2798 -38.2656 -38.2656 -25.7750 -25.7750 -8.7468 -8.7468 -7.7007 -7.7007 -7.5615 -7.5615 -0.8532 -0.8532 -0.7709 -0.7709 4.8429 4.8429 5.1443 5.1443 5.8910 5.8910 6.1391 6.1391 6.3653 6.3653 6.6015 6.6015 7.6612 7.6612 7.6892 7.6892 7.9715 7.9715 8.3385 8.3385 8.6871 8.6871 8.8921 8.8921 8.9464 8.9464 9.1696 9.1696 9.2280 9.2280 10.3364 10.3364 k = 0.4167 0.4330-0.0000 ( 8668 PWs) bands (ev): -69.7689 -69.7689 -69.7645 -69.7645 -39.5331 -39.5331 -39.5213 -39.5213 -38.3699 -38.3699 -38.3518 -38.3518 -38.2797 -38.2797 -38.2656 -38.2656 -25.7748 -25.7748 -8.7470 -8.7470 -7.6998 -7.6998 -7.5647 -7.5647 -0.8450 -0.8450 -0.7700 -0.7700 4.8685 4.8685 5.1428 5.1428 5.8789 5.8789 6.1299 6.1299 6.3668 6.3668 6.5566 6.5566 7.6596 7.6596 7.6878 7.6878 7.9802 7.9802 8.3268 8.3268 8.6992 8.6992 8.8856 8.8856 8.9670 8.9670 9.1508 9.1508 9.2262 9.2262 10.3608 10.3608 k = 0.4103 0.4441-0.0000 ( 8668 PWs) bands (ev): -69.7690 -69.7690 -69.7644 -69.7644 -39.5328 -39.5328 -39.5217 -39.5217 -38.3697 -38.3697 -38.3520 -38.3520 -38.2797 -38.2797 -38.2656 -38.2656 -25.7747 -25.7747 -8.7471 -8.7471 -7.6989 -7.6989 -7.5678 -7.5678 -0.8368 -0.8368 -0.7692 -0.7692 4.8954 4.8954 5.1415 5.1415 5.8624 5.8624 6.1212 6.1212 6.3673 6.3673 6.5147 6.5147 7.6547 7.6547 7.6891 7.6891 7.9906 7.9906 8.3126 8.3126 8.7120 8.7120 8.8785 8.8785 8.9853 8.9853 9.1318 9.1318 9.2225 9.2225 10.3841 10.3841 k = 0.4038 0.4552-0.0000 ( 8675 PWs) bands (ev): -69.7694 -69.7694 -69.7648 -69.7648 -39.5325 -39.5325 -39.5221 -39.5221 -38.3696 -38.3696 -38.3522 -38.3522 -38.2796 -38.2796 -38.2656 -38.2656 -25.7746 -25.7746 -8.7473 -8.7473 -7.6980 -7.6980 -7.5709 -7.5709 -0.8285 -0.8285 -0.7684 -0.7684 4.9235 4.9235 5.1402 5.1402 5.8419 5.8419 6.1132 6.1132 6.3667 6.3667 6.4771 6.4771 7.6490 7.6490 7.6884 7.6884 7.9997 7.9997 8.2982 8.2982 8.7233 8.7233 8.8711 8.8711 9.0039 9.0039 9.1119 9.1119 9.2149 9.2149 10.4053 10.4053 k = 0.3974 0.4663-0.0000 ( 8663 PWs) bands (ev): -69.7688 -69.7688 -69.7641 -69.7641 -39.5321 -39.5321 -39.5224 -39.5224 -38.3695 -38.3695 -38.3523 -38.3523 -38.2796 -38.2796 -38.2656 -38.2656 -25.7745 -25.7745 -8.7475 -8.7475 -7.6972 -7.6972 -7.5739 -7.5739 -0.8204 -0.8204 -0.7676 -0.7676 4.9528 4.9528 5.1393 5.1393 5.8165 5.8165 6.1071 6.1071 6.3656 6.3656 6.4446 6.4446 7.6463 7.6463 7.6911 7.6911 8.0138 8.0138 8.2842 8.2842 8.7405 8.7405 8.8691 8.8691 9.0215 9.0215 9.0947 9.0947 9.2119 9.2119 10.4292 10.4292 k = 0.3910 0.4774-0.0000 ( 8661 PWs) bands (ev): -69.7684 -69.7684 -69.7643 -69.7643 -39.5317 -39.5317 -39.5229 -39.5229 -38.3694 -38.3694 -38.3524 -38.3524 -38.2795 -38.2795 -38.2657 -38.2657 -25.7743 -25.7743 -8.7476 -8.7476 -7.6964 -7.6964 -7.5767 -7.5767 -0.8125 -0.8125 -0.7667 -0.7667 4.9827 4.9827 5.1386 5.1386 5.7867 5.7867 6.1008 6.1008 6.3628 6.3628 6.4181 6.4181 7.6422 7.6422 7.6938 7.6938 8.0254 8.0254 8.2708 8.2708 8.7551 8.7551 8.8642 8.8642 9.0361 9.0361 9.0781 9.0781 9.2077 9.2077 10.4464 10.4464 k = 0.3846 0.4885-0.0000 ( 8663 PWs) bands (ev): -69.7681 -69.7681 -69.7648 -69.7648 -39.5313 -39.5313 -39.5233 -39.5233 -38.3692 -38.3692 -38.3526 -38.3526 -38.2795 -38.2795 -38.2657 -38.2657 -25.7742 -25.7742 -8.7478 -8.7478 -7.6958 -7.6958 -7.5793 -7.5793 -0.8050 -0.8050 -0.7659 -0.7659 5.0130 5.0130 5.1386 5.1386 5.7532 5.7532 6.0952 6.0952 6.3579 6.3579 6.3985 6.3985 7.6381 7.6381 7.6958 7.6958 8.0364 8.0364 8.2567 8.2567 8.7702 8.7702 8.8579 8.8579 9.0421 9.0421 9.0691 9.0691 9.2015 9.2015 10.4611 10.4611 k = 0.3782 0.4996-0.0000 ( 8659 PWs) bands (ev): -69.7677 -69.7677 -69.7647 -69.7647 -39.5309 -39.5309 -39.5237 -39.5237 -38.3691 -38.3691 -38.3527 -38.3527 -38.2794 -38.2794 -38.2657 -38.2657 -25.7741 -25.7741 -8.7481 -8.7481 -7.6952 -7.6952 -7.5817 -7.5817 -0.7979 -0.7979 -0.7650 -0.7650 5.0433 5.0433 5.1387 5.1387 5.7169 5.7169 6.0910 6.0910 6.3513 6.3513 6.3858 6.3858 7.6333 7.6333 7.6986 7.6986 8.0501 8.0501 8.2420 8.2420 8.7862 8.7862 8.8572 8.8572 9.0302 9.0302 9.0766 9.0766 9.1957 9.1957 10.4758 10.4758 k = 0.3718 0.5107-0.0000 ( 8659 PWs) bands (ev): -69.7672 -69.7672 -69.7653 -69.7653 -39.5304 -39.5304 -39.5242 -39.5242 -38.3690 -38.3690 -38.3529 -38.3529 -38.2793 -38.2793 -38.2657 -38.2657 -25.7740 -25.7740 -8.7483 -8.7483 -7.6947 -7.6947 -7.5837 -7.5837 -0.7916 -0.7916 -0.7640 -0.7640 5.0726 5.0726 5.1400 5.1400 5.6788 5.6788 6.0875 6.0875 6.3437 6.3437 6.3779 6.3779 7.6280 7.6280 7.7022 7.7022 8.0628 8.0628 8.2284 8.2284 8.8016 8.8016 8.8521 8.8521 9.0138 9.0138 9.0867 9.0867 9.1904 9.1904 10.4877 10.4877 k = 0.3654 0.5218-0.0000 ( 8663 PWs) bands (ev): -69.7673 -69.7673 -69.7656 -69.7656 -39.5299 -39.5299 -39.5247 -39.5247 -38.3689 -38.3689 -38.3530 -38.3530 -38.2793 -38.2793 -38.2658 -38.2658 -25.7739 -25.7739 -8.7485 -8.7485 -7.6944 -7.6944 -7.5855 -7.5855 -0.7862 -0.7862 -0.7629 -0.7629 5.1002 5.1002 5.1421 5.1421 5.6406 5.6406 6.0842 6.0842 6.3372 6.3372 6.3729 6.3729 7.6231 7.6231 7.7036 7.7036 8.0752 8.0752 8.2131 8.2131 8.8161 8.8161 8.8522 8.8522 8.9939 8.9939 9.0967 9.0967 9.1837 9.1837 10.4956 10.4956 k = 0.3590 0.5329-0.0000 ( 8663 PWs) bands (ev): -69.7674 -69.7674 -69.7656 -69.7656 -39.5295 -39.5295 -39.5252 -39.5252 -38.3688 -38.3688 -38.3531 -38.3531 -38.2793 -38.2793 -38.2658 -38.2658 -25.7738 -25.7738 -8.7486 -8.7486 -7.6942 -7.6942 -7.5870 -7.5870 -0.7819 -0.7819 -0.7617 -0.7617 5.1245 5.1245 5.1456 5.1456 5.6045 5.6045 6.0819 6.0819 6.3324 6.3324 6.3693 6.3693 7.6215 7.6215 7.7057 7.7057 8.0882 8.0882 8.1987 8.1987 8.8282 8.8282 8.8541 8.8541 8.9750 8.9750 9.1046 9.1046 9.1786 9.1786 10.5022 10.5022 k = 0.3526 0.5440-0.0000 ( 8661 PWs) bands (ev): -69.7668 -69.7668 -69.7659 -69.7659 -39.5289 -39.5289 -39.5257 -39.5257 -38.3687 -38.3687 -38.3532 -38.3532 -38.2792 -38.2792 -38.2658 -38.2658 -25.7738 -25.7738 -8.7488 -8.7488 -7.6940 -7.6940 -7.5881 -7.5881 -0.7786 -0.7786 -0.7603 -0.7603 5.1413 5.1413 5.1533 5.1533 5.5726 5.5726 6.0798 6.0798 6.3295 6.3295 6.3667 6.3667 7.6194 7.6194 7.7089 7.7089 8.1017 8.1017 8.1856 8.1856 8.8355 8.8355 8.8618 8.8618 8.9575 8.9575 9.1115 9.1115 9.1747 9.1747 10.5055 10.5055 k = 0.3462 0.5551-0.0000 ( 8667 PWs) bands (ev): -69.7673 -69.7673 -69.7662 -69.7662 -39.5284 -39.5284 -39.5262 -39.5262 -38.3687 -38.3687 -38.3533 -38.3533 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7489 -8.7489 -7.6939 -7.6939 -7.5889 -7.5889 -0.7765 -0.7765 -0.7590 -0.7590 5.1490 5.1490 5.1646 5.1646 5.5476 5.5476 6.0784 6.0784 6.3277 6.3277 6.3644 6.3644 7.6163 7.6163 7.7098 7.7098 8.1146 8.1146 8.1711 8.1711 8.8371 8.8371 8.8732 8.8732 8.9386 8.9386 9.1139 9.1139 9.1708 9.1708 10.5076 10.5076 k = 0.3397 0.5662-0.0000 ( 8667 PWs) bands (ev): -69.7672 -69.7672 -69.7663 -69.7663 -39.5279 -39.5279 -39.5268 -39.5268 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5893 -7.5893 -0.7753 -0.7753 -0.7581 -0.7581 5.1548 5.1548 5.1710 5.1710 5.5318 5.5318 6.0781 6.0781 6.3270 6.3270 6.3630 6.3630 7.6142 7.6142 7.7104 7.7104 8.1283 8.1283 8.1567 8.1567 8.8394 8.8394 8.8883 8.8883 8.9206 8.9206 9.1159 9.1159 9.1691 9.1691 10.5104 10.5104 k = 0.3333 0.5774-0.0000 ( 8667 PWs) bands (ev): -69.7667 -69.7667 -69.7667 -69.7667 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7750 -0.7750 -0.7577 -0.7577 5.1584 5.1584 5.1714 5.1714 5.5265 5.5265 6.0779 6.0779 6.3268 6.3268 6.3624 6.3624 7.6145 7.6145 7.7114 7.7114 8.1376 8.1376 8.1456 8.1456 8.8399 8.8399 8.8995 8.8995 8.9084 8.9084 9.1163 9.1163 9.1687 9.1687 10.5114 10.5114 k = 0.3333 0.5774-0.0000 ( 8667 PWs) bands (ev): -69.7667 -69.7667 -69.7667 -69.7667 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7750 -0.7750 -0.7577 -0.7577 5.1584 5.1584 5.1714 5.1714 5.5265 5.5265 6.0779 6.0779 6.3268 6.3268 6.3624 6.3624 7.6145 7.6145 7.7114 7.7114 8.1376 8.1376 8.1456 8.1456 8.8399 8.8399 8.8995 8.8995 8.9084 8.9084 9.1163 9.1163 9.1687 9.1687 10.5114 10.5114 k = 0.3268 0.5660-0.0000 ( 8671 PWs) bands (ev): -69.7673 -69.7673 -69.7667 -69.7667 -39.5279 -39.5279 -39.5267 -39.5267 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5893 -7.5893 -0.7754 -0.7754 -0.7581 -0.7581 5.1511 5.1511 5.1750 5.1750 5.5314 5.5314 6.0779 6.0779 6.3268 6.3268 6.3629 6.3629 7.6142 7.6142 7.7102 7.7102 8.1259 8.1259 8.1560 8.1560 8.8389 8.8389 8.8873 8.8873 8.9204 8.9204 9.1158 9.1158 9.1688 9.1688 10.5097 10.5097 k = 0.3203 0.5547-0.0000 ( 8667 PWs) bands (ev): -69.7672 -69.7672 -69.7663 -69.7663 -39.5285 -39.5285 -39.5261 -39.5261 -38.3687 -38.3687 -38.3533 -38.3533 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7489 -8.7489 -7.6938 -7.6938 -7.5889 -7.5889 -0.7766 -0.7766 -0.7593 -0.7593 5.1337 5.1337 5.1837 5.1837 5.5446 5.5446 6.0782 6.0782 6.3270 6.3270 6.3648 6.3648 7.6171 7.6171 7.7097 7.7097 8.1133 8.1133 8.1726 8.1726 8.8345 8.8345 8.8771 8.8771 8.9366 8.9366 9.1163 9.1163 9.1699 9.1699 10.5077 10.5077 k = 0.3137 0.5434-0.0000 ( 8657 PWs) bands (ev): -69.7670 -69.7670 -69.7653 -69.7653 -39.5291 -39.5291 -39.5255 -39.5255 -38.3688 -38.3688 -38.3532 -38.3532 -38.2792 -38.2792 -38.2658 -38.2658 -25.7738 -25.7738 -8.7487 -8.7487 -7.6937 -7.6937 -7.5882 -7.5882 -0.7790 -0.7790 -0.7611 -0.7611 5.1118 5.1118 5.1947 5.1947 5.5632 5.5632 6.0794 6.0794 6.3274 6.3274 6.3678 6.3678 7.6200 7.6200 7.7086 7.7086 8.1023 8.1023 8.1886 8.1886 8.8280 8.8280 8.8727 8.8727 8.9545 8.9545 9.1187 9.1187 9.1721 9.1721 10.5081 10.5081 k = 0.3072 0.5321-0.0000 ( 8657 PWs) bands (ev): -69.7673 -69.7673 -69.7650 -69.7650 -39.5297 -39.5297 -39.5249 -39.5249 -38.3689 -38.3689 -38.3531 -38.3531 -38.2793 -38.2793 -38.2657 -38.2657 -25.7739 -25.7739 -8.7484 -8.7484 -7.6935 -7.6935 -7.5874 -7.5874 -0.7831 -0.7831 -0.7631 -0.7631 5.0882 5.0882 5.2072 5.2072 5.5847 5.5847 6.0799 6.0799 6.3277 6.3277 6.3717 6.3717 7.6244 7.6244 7.7056 7.7056 8.0871 8.0871 8.2031 8.2031 8.8175 8.8175 8.8696 8.8696 8.9694 8.9694 9.1219 9.1219 9.1750 9.1750 10.5051 10.5051 k = 0.3007 0.5207-0.0000 ( 8651 PWs) bands (ev): -69.7671 -69.7671 -69.7645 -69.7645 -39.5303 -39.5303 -39.5243 -39.5243 -38.3690 -38.3690 -38.3528 -38.3528 -38.2794 -38.2794 -38.2657 -38.2657 -25.7740 -25.7740 -8.7479 -8.7479 -7.6931 -7.6931 -7.5863 -7.5863 -0.7892 -0.7892 -0.7650 -0.7650 5.0646 5.0646 5.2214 5.2214 5.6071 5.6071 6.0808 6.0808 6.3283 6.3283 6.3765 6.3765 7.6300 7.6300 7.7044 7.7044 8.0738 8.0738 8.2195 8.2195 8.8035 8.8035 8.8713 8.8713 8.9861 8.9861 9.1269 9.1269 9.1788 9.1788 10.5017 10.5017 k = 0.2941 0.5094-0.0000 ( 8651 PWs) bands (ev): -69.7672 -69.7672 -69.7644 -69.7644 -39.5309 -39.5309 -39.5236 -39.5236 -38.3692 -38.3692 -38.3526 -38.3526 -38.2795 -38.2795 -38.2656 -38.2656 -25.7741 -25.7741 -8.7474 -8.7474 -7.6925 -7.6925 -7.5851 -7.5851 -0.7974 -0.7974 -0.7667 -0.7667 5.0425 5.0425 5.2370 5.2370 5.6290 5.6290 6.0812 6.0812 6.3293 6.3293 6.3824 6.3824 7.6347 7.6347 7.7011 7.7011 8.0592 8.0592 8.2344 8.2344 8.7898 8.7898 8.8724 8.8724 9.0004 9.0004 9.1341 9.1341 9.1845 9.1845 10.4968 10.4968 k = 0.2876 0.4981-0.0000 ( 8645 PWs) bands (ev): -69.7675 -69.7675 -69.7634 -69.7634 -39.5316 -39.5316 -39.5230 -39.5230 -38.3694 -38.3694 -38.3523 -38.3523 -38.2796 -38.2796 -38.2655 -38.2655 -25.7743 -25.7743 -8.7467 -8.7467 -7.6917 -7.6917 -7.5838 -7.5838 -0.8079 -0.8079 -0.7681 -0.7681 5.0226 5.0226 5.2542 5.2542 5.6494 5.6494 6.0815 6.0815 6.3308 6.3308 6.3893 6.3893 7.6439 7.6439 7.6982 7.6982 8.0455 8.0455 8.2507 8.2507 8.7760 8.7760 8.8746 8.8746 9.0149 9.0149 9.1441 9.1441 9.1936 9.1936 10.4911 10.4911 k = 0.2810 0.4868-0.0000 ( 8641 PWs) bands (ev): -69.7671 -69.7671 -69.7633 -69.7633 -39.5322 -39.5322 -39.5223 -39.5223 -38.3697 -38.3697 -38.3519 -38.3519 -38.2798 -38.2798 -38.2654 -38.2654 -25.7745 -25.7745 -8.7459 -8.7459 -7.6908 -7.6908 -7.5823 -7.5823 -0.8206 -0.8206 -0.7693 -0.7693 5.0054 5.0054 5.2729 5.2729 5.6671 5.6671 6.0822 6.0822 6.3330 6.3330 6.3971 6.3971 7.6513 7.6513 7.6956 7.6956 8.0313 8.0313 8.2671 8.2671 8.7574 8.7574 8.8781 8.8781 9.0309 9.0309 9.1554 9.1554 9.2062 9.2062 10.4867 10.4867 k = 0.2745 0.4755-0.0000 ( 8641 PWs) bands (ev): -69.7674 -69.7674 -69.7631 -69.7631 -39.5328 -39.5328 -39.5216 -39.5216 -38.3700 -38.3700 -38.3516 -38.3516 -38.2800 -38.2800 -38.2653 -38.2653 -25.7747 -25.7747 -8.7449 -8.7449 -7.6895 -7.6895 -7.5808 -7.5808 -0.8353 -0.8353 -0.7704 -0.7704 4.9913 4.9913 5.2931 5.2931 5.6813 5.6813 6.0827 6.0827 6.3359 6.3359 6.4060 6.4060 7.6601 7.6601 7.6926 7.6926 8.0172 8.0172 8.2829 8.2829 8.7417 8.7417 8.8783 8.8783 9.0442 9.0442 9.1669 9.1669 9.2215 9.2215 10.4812 10.4812 k = 0.2680 0.4641-0.0000 ( 8653 PWs) bands (ev): -69.7684 -69.7684 -69.7634 -69.7634 -39.5335 -39.5335 -39.5210 -39.5210 -38.3703 -38.3703 -38.3511 -38.3511 -38.2802 -38.2802 -38.2652 -38.2652 -25.7750 -25.7750 -8.7437 -8.7437 -7.6881 -7.6881 -7.5792 -7.5792 -0.8522 -0.8522 -0.7715 -0.7715 4.9803 4.9803 5.3145 5.3145 5.6916 5.6916 6.0825 6.0825 6.3390 6.3390 6.4160 6.4160 7.6664 7.6664 7.6897 7.6897 8.0009 8.0009 8.2979 8.2979 8.7246 8.7246 8.8775 8.8775 9.0548 9.0548 9.1781 9.1781 9.2379 9.2379 10.4726 10.4726 k = 0.2614 0.4528-0.0000 ( 8657 PWs) bands (ev): -69.7692 -69.7692 -69.7631 -69.7631 -39.5341 -39.5341 -39.5203 -39.5203 -38.3707 -38.3707 -38.3507 -38.3507 -38.2805 -38.2805 -38.2651 -38.2651 -25.7753 -25.7753 -8.7424 -8.7424 -7.6863 -7.6863 -7.5775 -7.5775 -0.8709 -0.8709 -0.7725 -0.7725 4.9727 4.9727 5.3373 5.3373 5.6976 5.6976 6.0827 6.0827 6.3425 6.3425 6.4273 6.4273 7.6709 7.6709 7.6940 7.6940 7.9863 7.9863 8.3130 8.3130 8.7105 8.7105 8.8784 8.8784 9.0655 9.0655 9.1929 9.1929 9.2593 9.2593 10.4643 10.4643 k = 0.2549 0.4415-0.0000 ( 8661 PWs) bands (ev): -69.7697 -69.7697 -69.7630 -69.7630 -39.5348 -39.5348 -39.5196 -39.5196 -38.3711 -38.3711 -38.3502 -38.3502 -38.2808 -38.2808 -38.2649 -38.2649 -25.7756 -25.7756 -8.7409 -8.7409 -7.6844 -7.6844 -7.5759 -7.5759 -0.8916 -0.8916 -0.7735 -0.7735 4.9685 4.9685 5.3615 5.3615 5.6992 5.6992 6.0831 6.0831 6.3466 6.3466 6.4395 6.4395 7.6681 7.6681 7.7046 7.7046 7.9717 7.9717 8.3298 8.3298 8.6967 8.6967 8.8810 8.8810 9.0769 9.0769 9.2094 9.2094 9.2845 9.2845 10.4568 10.4568 k = 0.2484 0.4302-0.0000 ( 8669 PWs) bands (ev): -69.7702 -69.7702 -69.7634 -69.7634 -39.5354 -39.5354 -39.5189 -39.5189 -38.3715 -38.3715 -38.3496 -38.3496 -38.2811 -38.2811 -38.2647 -38.2647 -25.7760 -25.7760 -8.7393 -8.7393 -7.6821 -7.6821 -7.5742 -7.5742 -0.9141 -0.9141 -0.7744 -0.7744 4.9674 4.9674 5.3869 5.3869 5.6961 5.6961 6.0832 6.0832 6.3510 6.3510 6.4525 6.4525 7.6633 7.6633 7.7197 7.7197 7.9564 7.9564 8.3476 8.3476 8.6840 8.6840 8.8826 8.8826 9.0858 9.0858 9.2254 9.2254 9.3128 9.3128 10.4481 10.4481 k = 0.2418 0.4189-0.0000 ( 8665 PWs) bands (ev): -69.7701 -69.7701 -69.7630 -69.7630 -39.5360 -39.5360 -39.5182 -39.5182 -38.3719 -38.3719 -38.3490 -38.3490 -38.2815 -38.2815 -38.2645 -38.2645 -25.7763 -25.7763 -8.7375 -8.7375 -7.6796 -7.6796 -7.5724 -7.5724 -0.9384 -0.9384 -0.7753 -0.7753 4.9699 4.9699 5.4138 5.4138 5.6889 5.6889 6.0839 6.0839 6.3563 6.3563 6.4665 6.4665 7.6606 7.6606 7.7385 7.7385 7.9431 7.9431 8.3663 8.3663 8.6714 8.6714 8.8870 8.8870 9.0997 9.0997 9.2448 9.2448 9.3453 9.3453 10.4429 10.4429 k = 0.2353 0.4075-0.0000 ( 8655 PWs) bands (ev): -69.7698 -69.7698 -69.7622 -69.7622 -39.5367 -39.5367 -39.5175 -39.5175 -38.3723 -38.3723 -38.3484 -38.3484 -38.2818 -38.2818 -38.2643 -38.2643 -25.7768 -25.7768 -8.7355 -8.7355 -7.6768 -7.6768 -7.5707 -7.5707 -0.9642 -0.9642 -0.7762 -0.7762 4.9752 4.9752 5.4421 5.4421 5.6778 5.6778 6.0854 6.0854 6.3619 6.3619 6.4811 6.4811 7.6590 7.6590 7.7601 7.7601 7.9308 7.9308 8.3857 8.3857 8.6625 8.6625 8.8923 8.8923 9.1145 9.1145 9.2667 9.2667 9.3826 9.3826 10.4382 10.4382 k = 0.2288 0.3962-0.0000 ( 8647 PWs) bands (ev): -69.7697 -69.7697 -69.7614 -69.7614 -39.5373 -39.5373 -39.5168 -39.5168 -38.3727 -38.3727 -38.3477 -38.3477 -38.2822 -38.2822 -38.2641 -38.2641 -25.7772 -25.7772 -8.7333 -8.7333 -7.6737 -7.6737 -7.5689 -7.5689 -0.9917 -0.9917 -0.7770 -0.7770 4.9832 4.9832 5.4713 5.4713 5.6632 5.6632 6.0872 6.0872 6.3675 6.3675 6.4958 6.4958 7.6566 7.6566 7.7831 7.7831 7.9182 7.9182 8.4075 8.4075 8.6569 8.6569 8.8974 8.8974 9.1293 9.1293 9.2900 9.2900 9.4199 9.4199 10.4338 10.4338 k = 0.2222 0.3849-0.0000 ( 8655 PWs) bands (ev): -69.7707 -69.7707 -69.7612 -69.7612 -39.5379 -39.5379 -39.5161 -39.5161 -38.3732 -38.3732 -38.3471 -38.3471 -38.2827 -38.2827 -38.2639 -38.2639 -25.7777 -25.7777 -8.7310 -8.7310 -7.6705 -7.6705 -7.5671 -7.5671 -1.0205 -1.0205 -0.7779 -0.7779 4.9927 4.9927 5.5009 5.5009 5.6456 5.6456 6.0893 6.0893 6.3728 6.3728 6.5100 6.5100 7.6544 7.6544 7.8064 7.8064 7.9037 7.9037 8.4259 8.4259 8.6495 8.6495 8.9011 8.9011 9.1407 9.1407 9.3114 9.3114 9.4556 9.4556 10.4274 10.4274 k = 0.2157 0.3736-0.0000 ( 8647 PWs) bands (ev): -69.7703 -69.7703 -69.7607 -69.7607 -39.5385 -39.5385 -39.5154 -39.5154 -38.3737 -38.3737 -38.3464 -38.3464 -38.2831 -38.2831 -38.2636 -38.2636 -25.7782 -25.7782 -8.7286 -8.7286 -7.6670 -7.6670 -7.5652 -7.5652 -1.0507 -1.0507 -0.7786 -0.7786 5.0042 5.0042 5.5320 5.5320 5.6267 5.6267 6.0921 6.0921 6.3779 6.3779 6.5239 6.5239 7.6537 7.6537 7.8335 7.8335 7.8936 7.8936 8.4494 8.4494 8.6454 8.6454 8.9059 8.9059 9.1545 9.1545 9.3373 9.3373 9.4986 9.4986 10.4240 10.4240 k = 0.2092 0.3623-0.0000 ( 8637 PWs) bands (ev): -69.7702 -69.7702 -69.7597 -69.7597 -39.5391 -39.5391 -39.5148 -39.5148 -38.3741 -38.3741 -38.3456 -38.3456 -38.2836 -38.2836 -38.2634 -38.2634 -25.7787 -25.7787 -8.7260 -8.7260 -7.6633 -7.6633 -7.5634 -7.5634 -1.0820 -1.0820 -0.7793 -0.7793 5.0159 5.0159 5.5638 5.5638 5.6075 5.6075 6.0958 6.0958 6.3837 6.3837 6.5369 6.5369 7.6542 7.6542 7.8582 7.8582 7.8882 7.8882 8.4706 8.4706 8.6411 8.6411 8.9146 8.9146 9.1679 9.1679 9.3656 9.3656 9.5442 9.5442 10.4226 10.4226 k = 0.2026 0.3509-0.0000 ( 8629 PWs) bands (ev): -69.7699 -69.7699 -69.7590 -69.7590 -39.5397 -39.5397 -39.5141 -39.5141 -38.3745 -38.3745 -38.3449 -38.3449 -38.2841 -38.2841 -38.2632 -38.2632 -25.7792 -25.7792 -8.7233 -8.7233 -7.6594 -7.6594 -7.5614 -7.5614 -1.1143 -1.1143 -0.7800 -0.7800 5.0273 5.0273 5.5848 5.5848 5.5996 5.5996 6.0998 6.0998 6.3890 6.3890 6.5490 6.5490 7.6564 7.6564 7.8601 7.8601 7.9068 7.9068 8.4918 8.4918 8.6401 8.6401 8.9243 8.9243 9.1824 9.1824 9.3946 9.3946 9.5895 9.5895 10.4207 10.4207 k = 0.1961 0.3396-0.0000 ( 8629 PWs) bands (ev): -69.7701 -69.7701 -69.7588 -69.7588 -39.5403 -39.5403 -39.5134 -39.5134 -38.3750 -38.3750 -38.3441 -38.3441 -38.2846 -38.2846 -38.2629 -38.2629 -25.7798 -25.7798 -8.7205 -8.7205 -7.6553 -7.6553 -7.5594 -7.5594 -1.1475 -1.1475 -0.7806 -0.7806 5.0369 5.0369 5.5694 5.5694 5.6308 5.6308 6.1043 6.1043 6.3936 6.3936 6.5599 6.5599 7.6576 7.6576 7.8512 7.8512 7.9369 7.9369 8.5131 8.5131 8.6400 8.6400 8.9321 8.9321 9.1941 9.1941 9.4237 9.4237 9.6352 9.6352 10.4186 10.4186 k = 0.1895 0.3283-0.0000 ( 8633 PWs) bands (ev): -69.7707 -69.7707 -69.7587 -69.7587 -39.5409 -39.5409 -39.5127 -39.5127 -38.3755 -38.3755 -38.3433 -38.3433 -38.2852 -38.2852 -38.2627 -38.2627 -25.7804 -25.7804 -8.7176 -8.7176 -7.6512 -7.6512 -7.5573 -7.5573 -1.1815 -1.1815 -0.7812 -0.7812 5.0429 5.0429 5.5558 5.5558 5.6641 5.6641 6.1092 6.1092 6.3979 6.3979 6.5691 6.5691 7.6600 7.6600 7.8396 7.8396 7.9704 7.9704 8.5335 8.5335 8.6403 8.6403 8.9416 8.9416 9.2065 9.2065 9.4514 9.4514 9.6814 9.6814 10.4168 10.4168 k = 0.1830 0.3170-0.0000 ( 8637 PWs) bands (ev): -69.7712 -69.7712 -69.7585 -69.7585 -39.5414 -39.5414 -39.5121 -39.5121 -38.3760 -38.3760 -38.3425 -38.3425 -38.2858 -38.2858 -38.2624 -38.2624 -25.7809 -25.7809 -8.7146 -8.7146 -7.6469 -7.6469 -7.5551 -7.5551 -1.2160 -1.2160 -0.7817 -0.7817 5.0443 5.0443 5.5477 5.5477 5.6982 5.6982 6.1144 6.1144 6.4022 6.4022 6.5769 6.5769 7.6627 7.6627 7.8288 7.8288 8.0057 8.0057 8.5526 8.5526 8.6417 8.6417 8.9516 8.9516 9.2209 9.2209 9.4794 9.4794 9.7275 9.7275 10.4179 10.4179 k = 0.1765 0.3057-0.0000 ( 8639 PWs) bands (ev): -69.7715 -69.7715 -69.7585 -69.7585 -39.5420 -39.5420 -39.5114 -39.5114 -38.3764 -38.3764 -38.3417 -38.3417 -38.2864 -38.2864 -38.2622 -38.2622 -25.7816 -25.7816 -8.7115 -8.7115 -7.6426 -7.6426 -7.5527 -7.5527 -1.2509 -1.2509 -0.7822 -0.7822 5.0396 5.0396 5.5466 5.5466 5.7331 5.7331 6.1201 6.1201 6.4059 6.4059 6.5827 6.5827 7.6666 7.6666 7.8188 7.8188 8.0430 8.0430 8.5735 8.5735 8.6436 8.6436 8.9637 8.9637 9.2365 9.2365 9.5066 9.5066 9.7758 9.7758 10.4197 10.4197 k = 0.1699 0.2943-0.0000 ( 8635 PWs) bands (ev): -69.7712 -69.7712 -69.7582 -69.7582 -39.5425 -39.5425 -39.5108 -39.5108 -38.3769 -38.3769 -38.3408 -38.3408 -38.2870 -38.2870 -38.2619 -38.2619 -25.7822 -25.7822 -8.7084 -8.7084 -7.6383 -7.6383 -7.5502 -7.5502 -1.2861 -1.2861 -0.7827 -0.7827 5.0281 5.0281 5.5532 5.5532 5.7678 5.7678 6.1268 6.1268 6.4095 6.4095 6.5885 6.5885 7.6732 7.6732 7.8104 7.8104 8.0817 8.0817 8.5941 8.5941 8.6496 8.6496 8.9769 8.9769 9.2531 9.2531 9.5381 9.5381 9.8231 9.8231 10.4232 10.4232 k = 0.1634 0.2830-0.0000 ( 8635 PWs) bands (ev): -69.7714 -69.7714 -69.7580 -69.7580 -39.5431 -39.5431 -39.5102 -39.5102 -38.3773 -38.3773 -38.3400 -38.3400 -38.2876 -38.2876 -38.2617 -38.2617 -25.7828 -25.7828 -8.7053 -8.7053 -7.6341 -7.6341 -7.5474 -7.5474 -1.3214 -1.3214 -0.7831 -0.7831 5.0098 5.0098 5.5672 5.5672 5.8031 5.8031 6.1335 6.1335 6.4126 6.4126 6.5916 6.5916 7.6790 7.6790 7.8019 7.8019 8.1228 8.1228 8.6122 8.6122 8.6577 8.6577 8.9927 8.9927 9.2704 9.2704 9.5648 9.5648 9.8701 9.8701 10.4291 10.4291 k = 0.1569 0.2717-0.0000 ( 8639 PWs) bands (ev): -69.7716 -69.7716 -69.7583 -69.7583 -39.5436 -39.5436 -39.5096 -39.5096 -38.3778 -38.3778 -38.3392 -38.3392 -38.2882 -38.2882 -38.2615 -38.2615 -25.7834 -25.7834 -8.7022 -8.7022 -7.6299 -7.6299 -7.5444 -7.5444 -1.3567 -1.3567 -0.7835 -0.7835 4.9858 4.9858 5.5882 5.5882 5.8380 5.8380 6.1406 6.1406 6.4147 6.4147 6.5936 6.5936 7.6849 7.6849 7.7951 7.7951 8.1630 8.1630 8.6287 8.6287 8.6671 8.6671 9.0067 9.0067 9.2909 9.2909 9.5909 9.5909 9.9152 9.9152 10.4355 10.4355 k = 0.1503 0.2604-0.0000 ( 8639 PWs) bands (ev): -69.7716 -69.7716 -69.7582 -69.7582 -39.5441 -39.5441 -39.5090 -39.5090 -38.3782 -38.3782 -38.3383 -38.3383 -38.2889 -38.2889 -38.2612 -38.2612 -25.7841 -25.7841 -8.6991 -8.6991 -7.6259 -7.6259 -7.5412 -7.5412 -1.3918 -1.3918 -0.7838 -0.7838 4.9567 4.9567 5.6154 5.6154 5.8729 5.8729 6.1482 6.1482 6.4172 6.4172 6.5941 6.5941 7.6920 7.6920 7.7901 7.7901 8.2054 8.2054 8.6448 8.6448 8.6784 8.6784 9.0233 9.0233 9.3127 9.3127 9.6156 9.6156 9.9597 9.9597 10.4447 10.4447 k = 0.1438 0.2491-0.0000 ( 8645 PWs) bands (ev): -69.7718 -69.7718 -69.7587 -69.7587 -39.5446 -39.5446 -39.5084 -39.5084 -38.3786 -38.3786 -38.3374 -38.3374 -38.2896 -38.2896 -38.2610 -38.2610 -25.7847 -25.7847 -8.6960 -8.6960 -7.6222 -7.6222 -7.5377 -7.5377 -1.4266 -1.4266 -0.7842 -0.7842 4.9241 4.9241 5.6470 5.6470 5.9080 5.9080 6.1552 6.1552 6.4184 6.4184 6.5935 6.5935 7.6988 7.6988 7.7837 7.7837 8.2484 8.2484 8.6595 8.6595 8.6906 8.6906 9.0398 9.0398 9.3349 9.3349 9.6396 9.6396 10.0023 10.0023 10.4553 10.4553 k = 0.1373 0.2377-0.0000 ( 8625 PWs) bands (ev): -69.7713 -69.7713 -69.7568 -69.7568 -39.5450 -39.5450 -39.5078 -39.5078 -38.3790 -38.3790 -38.3365 -38.3365 -38.2902 -38.2902 -38.2607 -38.2607 -25.7853 -25.7853 -8.6929 -8.6929 -7.6186 -7.6186 -7.5338 -7.5338 -1.4609 -1.4609 -0.7844 -0.7844 4.8890 4.8890 5.6840 5.6840 5.9432 5.9432 6.1647 6.1647 6.4211 6.4211 6.5921 6.5921 7.7085 7.7085 7.7804 7.7804 8.2966 8.2966 8.6768 8.6768 8.7066 8.7066 9.0625 9.0625 9.3657 9.3657 9.6655 9.6655 10.0455 10.0455 10.4716 10.4716 k = 0.1307 0.2264-0.0000 ( 8629 PWs) bands (ev): -69.7722 -69.7722 -69.7563 -69.7563 -39.5455 -39.5455 -39.5073 -39.5073 -38.3794 -38.3794 -38.3357 -38.3357 -38.2909 -38.2909 -38.2605 -38.2605 -25.7860 -25.7860 -8.6900 -8.6900 -7.6153 -7.6153 -7.5297 -7.5297 -1.4946 -1.4946 -0.7847 -0.7847 4.8521 4.8521 5.7224 5.7224 5.9768 5.9768 6.1731 6.1731 6.4228 6.4228 6.5899 6.5899 7.7137 7.7137 7.7755 7.7755 8.3397 8.3397 8.6900 8.6900 8.7193 8.7193 9.0826 9.0826 9.3936 9.3936 9.6900 9.6900 10.0835 10.0835 10.4856 10.4856 k = 0.1242 0.2151-0.0000 ( 8633 PWs) bands (ev): -69.7728 -69.7728 -69.7561 -69.7561 -39.5459 -39.5459 -39.5068 -39.5068 -38.3798 -38.3798 -38.3348 -38.3348 -38.2916 -38.2916 -38.2603 -38.2603 -25.7866 -25.7866 -8.6870 -8.6870 -7.6123 -7.6123 -7.5253 -7.5253 -1.5276 -1.5276 -0.7849 -0.7849 4.8143 4.8143 5.7631 5.7631 6.0099 6.0099 6.1813 6.1813 6.4235 6.4235 6.5855 6.5855 7.7202 7.7202 7.7723 7.7723 8.3828 8.3828 8.7042 8.7042 8.7327 8.7327 9.1027 9.1027 9.4256 9.4256 9.7100 9.7100 10.1208 10.1208 10.4994 10.4994 k = 0.1176 0.2038-0.0000 ( 8629 PWs) bands (ev): -69.7729 -69.7729 -69.7555 -69.7555 -39.5463 -39.5463 -39.5062 -39.5062 -38.3801 -38.3801 -38.3340 -38.3340 -38.2923 -38.2923 -38.2601 -38.2601 -25.7872 -25.7872 -8.6842 -8.6842 -7.6096 -7.6096 -7.5206 -7.5206 -1.5597 -1.5597 -0.7851 -0.7851 4.7763 4.7763 5.8057 5.8057 6.0428 6.0428 6.1896 6.1896 6.4247 6.4247 6.5813 6.5813 7.7272 7.7272 7.7706 7.7706 8.4279 8.4279 8.7185 8.7185 8.7465 8.7465 9.1248 9.1248 9.4610 9.4610 9.7323 9.7323 10.1568 10.1568 10.5147 10.5147 k = 0.1111 0.1925-0.0000 ( 8625 PWs) bands (ev): -69.7732 -69.7732 -69.7547 -69.7547 -39.5467 -39.5467 -39.5058 -39.5058 -38.3805 -38.3805 -38.3331 -38.3331 -38.2930 -38.2930 -38.2599 -38.2599 -25.7878 -25.7878 -8.6815 -8.6815 -7.6072 -7.6072 -7.5157 -7.5157 -1.5908 -1.5908 -0.7853 -0.7853 4.7384 4.7384 5.8483 5.8483 6.0748 6.0748 6.1982 6.1982 6.4264 6.4264 6.5766 6.5766 7.7337 7.7337 7.7696 7.7696 8.4712 8.4712 8.7317 8.7317 8.7627 8.7627 9.1478 9.1478 9.4984 9.4984 9.7532 9.7532 10.1922 10.1922 10.5296 10.5296 k = 0.1046 0.1811-0.0000 ( 8625 PWs) bands (ev): -69.7737 -69.7737 -69.7540 -69.7540 -39.5471 -39.5471 -39.5053 -39.5053 -38.3808 -38.3808 -38.3323 -38.3323 -38.2936 -38.2936 -38.2597 -38.2597 -25.7884 -25.7884 -8.6789 -8.6789 -7.6051 -7.6051 -7.5106 -7.5106 -1.6209 -1.6209 -0.7855 -0.7855 4.7012 4.7012 5.8911 5.8911 6.1055 6.1055 6.2070 6.2070 6.4277 6.4277 6.5710 6.5710 7.7385 7.7385 7.7677 7.7677 8.5146 8.5146 8.7431 8.7431 8.7785 8.7785 9.1725 9.1725 9.5374 9.5374 9.7731 9.7731 10.2233 10.2233 10.5421 10.5421 k = 0.0980 0.1698-0.0000 ( 8629 PWs) bands (ev): -69.7742 -69.7742 -69.7540 -69.7540 -39.5474 -39.5474 -39.5049 -39.5049 -38.3811 -38.3811 -38.3315 -38.3315 -38.2943 -38.2943 -38.2596 -38.2596 -25.7889 -25.7889 -8.6764 -8.6764 -7.6032 -7.6032 -7.5054 -7.5054 -1.6497 -1.6497 -0.7857 -0.7857 4.6650 4.6650 5.9335 5.9335 6.1339 6.1339 6.2145 6.2145 6.4283 6.4283 6.5659 6.5659 7.7409 7.7409 7.7686 7.7686 8.5535 8.5535 8.7543 8.7543 8.7963 8.7963 9.1977 9.1977 9.5776 9.5776 9.7970 9.7970 10.2503 10.2503 10.5482 10.5482 k = 0.0915 0.1585-0.0000 ( 8623 PWs) bands (ev): -69.7742 -69.7742 -69.7532 -69.7532 -39.5477 -39.5477 -39.5045 -39.5045 -38.3814 -38.3814 -38.3306 -38.3306 -38.2950 -38.2950 -38.2594 -38.2594 -25.7895 -25.7895 -8.6741 -8.6741 -7.6016 -7.6016 -7.5002 -7.5002 -1.6772 -1.6772 -0.7858 -0.7858 4.6300 4.6300 5.9761 5.9761 6.1611 6.1611 6.2225 6.2225 6.4302 6.4302 6.5599 6.5599 7.7459 7.7459 7.7714 7.7714 8.5929 8.5929 8.7635 8.7635 8.8150 8.8150 9.2268 9.2268 9.6159 9.6159 9.8254 9.8254 10.2799 10.2799 10.5516 10.5516 k = 0.0850 0.1472-0.0000 ( 8629 PWs) bands (ev): -69.7746 -69.7746 -69.7535 -69.7535 -39.5481 -39.5481 -39.5041 -39.5041 -38.3817 -38.3817 -38.3298 -38.3298 -38.2957 -38.2957 -38.2592 -38.2592 -25.7900 -25.7900 -8.6719 -8.6719 -7.6002 -7.6002 -7.4950 -7.4950 -1.7032 -1.7032 -0.7860 -0.7860 4.5965 4.5965 6.0167 6.0167 6.1862 6.1862 6.2295 6.2295 6.4314 6.4314 6.5533 6.5533 7.7497 7.7497 7.7740 7.7740 8.6282 8.6282 8.7714 8.7714 8.8309 8.8309 9.2556 9.2556 9.6499 9.6499 9.8556 9.8556 10.3056 10.3056 10.5482 10.5482 k = 0.0784 0.1358-0.0000 ( 8639 PWs) bands (ev): -69.7752 -69.7752 -69.7539 -69.7539 -39.5484 -39.5484 -39.5037 -39.5037 -38.3819 -38.3819 -38.3291 -38.3291 -38.2964 -38.2964 -38.2591 -38.2591 -25.7905 -25.7905 -8.6698 -8.6698 -7.5990 -7.5990 -7.4898 -7.4898 -1.7278 -1.7278 -0.7861 -0.7861 4.5648 4.5648 6.0561 6.0561 6.2076 6.2076 6.2373 6.2373 6.4328 6.4328 6.5456 6.5456 7.7515 7.7515 7.7761 7.7761 8.6603 8.6603 8.7799 8.7799 8.8455 8.8455 9.2865 9.2865 9.6772 9.6772 9.8929 9.8929 10.3293 10.3293 10.5388 10.5388 k = 0.0719 0.1245-0.0000 ( 8633 PWs) bands (ev): -69.7749 -69.7749 -69.7534 -69.7534 -39.5486 -39.5486 -39.5034 -39.5034 -38.3822 -38.3822 -38.3283 -38.3283 -38.2970 -38.2970 -38.2589 -38.2589 -25.7909 -25.7909 -8.6679 -8.6679 -7.5980 -7.5980 -7.4848 -7.4848 -1.7507 -1.7507 -0.7862 -0.7862 4.5350 4.5350 6.0956 6.0956 6.2251 6.2251 6.2483 6.2483 6.4353 6.4353 6.5386 6.5386 7.7557 7.7557 7.7810 7.7810 8.6918 8.6918 8.7926 8.7926 8.8604 8.8604 9.3225 9.3225 9.6994 9.6994 9.9408 9.9408 10.3517 10.3517 10.5255 10.5255 k = 0.0654 0.1132-0.0000 ( 8639 PWs) bands (ev): -69.7755 -69.7755 -69.7535 -69.7535 -39.5489 -39.5489 -39.5031 -39.5031 -38.3824 -38.3824 -38.3276 -38.3276 -38.2976 -38.2976 -38.2588 -38.2588 -25.7913 -25.7913 -8.6662 -8.6662 -7.5971 -7.5971 -7.4800 -7.4800 -1.7719 -1.7719 -0.7864 -0.7864 4.5073 4.5073 6.1318 6.1318 6.2347 6.2347 6.2633 6.2633 6.4379 6.4379 6.5312 6.5312 7.7572 7.7572 7.7832 7.7832 8.7133 8.7133 8.8072 8.8072 8.8761 8.8761 9.3571 9.3571 9.7157 9.7157 9.9937 9.9937 10.3705 10.3705 10.5046 10.5046 k = 0.0588 0.1019-0.0000 ( 8657 PWs) bands (ev): -69.7769 -69.7769 -69.7540 -69.7540 -39.5491 -39.5491 -39.5028 -39.5028 -38.3826 -38.3826 -38.3269 -38.3269 -38.2983 -38.2983 -38.2588 -38.2588 -25.7917 -25.7917 -8.6646 -8.6646 -7.5963 -7.5963 -7.4755 -7.4755 -1.7914 -1.7914 -0.7865 -0.7865 4.4818 4.4818 6.1655 6.1655 6.2406 6.2406 6.2780 6.2780 6.4408 6.4408 6.5235 6.5235 7.7569 7.7569 7.7836 7.7836 8.7239 8.7239 8.8225 8.8225 8.8886 8.8886 9.3919 9.3919 9.7251 9.7251 10.0522 10.0522 10.3824 10.3824 10.4805 10.4805 k = 0.0523 0.0906-0.0000 ( 8653 PWs) bands (ev): -69.7769 -69.7769 -69.7534 -69.7534 -39.5493 -39.5493 -39.5026 -39.5026 -38.3828 -38.3828 -38.3263 -38.3263 -38.2988 -38.2988 -38.2586 -38.2586 -25.7921 -25.7921 -8.6631 -8.6631 -7.5957 -7.5957 -7.4713 -7.4713 -1.8090 -1.8090 -0.7866 -0.7866 4.4587 4.4587 6.1978 6.1978 6.2456 6.2456 6.2921 6.2921 6.4452 6.4452 6.5166 6.5166 7.7596 7.7596 7.7871 7.7871 8.7327 8.7327 8.8471 8.8471 8.9029 8.9029 9.4338 9.4338 9.7343 9.7343 10.1175 10.1175 10.3796 10.3796 10.4663 10.4663 k = 0.0458 0.0792-0.0000 ( 8655 PWs) bands (ev): -69.7773 -69.7773 -69.7532 -69.7532 -39.5495 -39.5495 -39.5024 -39.5024 -38.3829 -38.3829 -38.3257 -38.3257 -38.2993 -38.2993 -38.2586 -38.2586 -25.7924 -25.7924 -8.6619 -8.6619 -7.5952 -7.5952 -7.4674 -7.4674 -1.8247 -1.8247 -0.7867 -0.7867 4.4380 4.4380 6.2275 6.2275 6.2501 6.2501 6.3047 6.3047 6.4505 6.4505 6.5089 6.5089 7.7613 7.7613 7.7898 7.7898 8.7370 8.7370 8.8683 8.8683 8.9159 8.9159 9.4777 9.4777 9.7381 9.7381 10.1833 10.1833 10.3528 10.3528 10.4678 10.4678 k = 0.0392 0.0679-0.0000 ( 8651 PWs) bands (ev): -69.7775 -69.7775 -69.7526 -69.7526 -39.5496 -39.5496 -39.5022 -39.5022 -38.3831 -38.3831 -38.3252 -38.3252 -38.2998 -38.2998 -38.2585 -38.2585 -25.7927 -25.7927 -8.6608 -8.6608 -7.5948 -7.5948 -7.4640 -7.4640 -1.8384 -1.8384 -0.7867 -0.7867 4.4200 4.4200 6.2531 6.2531 6.2562 6.2562 6.3151 6.3151 6.4561 6.4561 6.5021 6.5021 7.7632 7.7632 7.7925 7.7925 8.7397 8.7397 8.8898 8.8898 8.9281 8.9281 9.5227 9.5227 9.7418 9.7418 10.2508 10.2508 10.3119 10.3119 10.4795 10.4795 k = 0.0327 0.0566-0.0000 ( 8657 PWs) bands (ev): -69.7778 -69.7778 -69.7529 -69.7529 -39.5498 -39.5498 -39.5020 -39.5020 -38.3832 -38.3832 -38.3247 -38.3247 -38.3002 -38.3002 -38.2584 -38.2584 -25.7929 -25.7929 -8.6599 -8.6599 -7.5944 -7.5944 -7.4610 -7.4610 -1.8501 -1.8501 -0.7868 -0.7868 4.4046 4.4046 6.2571 6.2571 6.2781 6.2781 6.3224 6.3224 6.4606 6.4606 6.4953 6.4953 7.7646 7.7646 7.7946 7.7946 8.7405 8.7405 8.9070 8.9070 8.9365 8.9365 9.5682 9.5682 9.7441 9.7441 10.2621 10.2621 10.3158 10.3158 10.4906 10.4906 k = 0.0261 0.0453-0.0000 ( 8661 PWs) bands (ev): -69.7783 -69.7783 -69.7528 -69.7528 -39.5499 -39.5499 -39.5019 -39.5019 -38.3833 -38.3833 -38.3243 -38.3243 -38.3006 -38.3006 -38.2584 -38.2584 -25.7931 -25.7931 -8.6591 -8.6591 -7.5941 -7.5941 -7.4585 -7.4585 -1.8597 -1.8597 -0.7869 -0.7869 4.3918 4.3918 6.2589 6.2589 6.2983 6.2983 6.3285 6.3285 6.4649 6.4649 6.4889 6.4889 7.7653 7.7653 7.7960 7.7960 8.7380 8.7380 8.9224 8.9224 8.9469 8.9469 9.6132 9.6132 9.7473 9.7473 10.2107 10.2107 10.3769 10.3769 10.5024 10.5024 k = 0.0196 0.0340-0.0000 ( 8667 PWs) bands (ev): -69.7791 -69.7791 -69.7526 -69.7526 -39.5500 -39.5500 -39.5018 -39.5018 -38.3834 -38.3834 -38.3240 -38.3240 -38.3009 -38.3009 -38.2583 -38.2583 -25.7933 -25.7933 -8.6585 -8.6585 -7.5939 -7.5939 -7.4566 -7.4566 -1.8672 -1.8672 -0.7869 -0.7869 4.3819 4.3819 6.2604 6.2604 6.3149 6.3149 6.3330 6.3330 6.4675 6.4675 6.4825 6.4825 7.7669 7.7669 7.7980 7.7980 8.7350 8.7350 8.9343 8.9343 8.9547 8.9547 9.6539 9.6539 9.7480 9.7480 10.1591 10.1591 10.4316 10.4316 10.5139 10.5139 k = 0.0131 0.0226-0.0000 ( 8679 PWs) bands (ev): -69.7805 -69.7805 -69.7526 -69.7526 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3238 -38.3238 -38.3011 -38.3011 -38.2583 -38.2583 -25.7934 -25.7934 -8.6581 -8.6581 -7.5938 -7.5938 -7.4551 -7.4551 -1.8727 -1.8727 -0.7869 -0.7869 4.3748 4.3748 6.2615 6.2615 6.3269 6.3269 6.3348 6.3348 6.4684 6.4684 6.4754 6.4754 7.7665 7.7665 7.7982 7.7982 8.7310 8.7310 8.9455 8.9455 8.9600 8.9600 9.6883 9.6883 9.7459 9.7459 10.1147 10.1147 10.4736 10.4736 10.5239 10.5239 k = 0.0065 0.0113-0.0000 ( 8663 PWs) bands (ev): -69.7798 -69.7798 -69.7515 -69.7515 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3237 -38.3237 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4543 -7.4543 -1.8759 -1.8759 -0.7869 -0.7869 4.3706 4.3706 6.2632 6.2632 6.3359 6.3359 6.3386 6.3386 6.4705 6.4705 6.4727 6.4727 7.7698 7.7698 7.8014 7.8014 8.7335 8.7335 8.9543 8.9543 8.9670 8.9670 9.7137 9.7137 9.7537 9.7537 10.0832 10.0832 10.4993 10.4993 10.5367 10.5367 k = 0.0000 0.0000 0.0000 ( 8655 PWs) bands (ev): -69.7792 -69.7792 -69.7511 -69.7511 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4540 -7.4540 -1.8770 -1.8770 -0.7869 -0.7869 4.3692 4.3692 6.2637 6.2637 6.3378 6.3378 6.3396 6.3396 6.4711 6.4711 6.4721 6.4721 7.7713 7.7713 7.8029 7.8029 8.7346 8.7346 8.9589 8.9589 8.9708 8.9708 9.7228 9.7228 9.7609 9.7609 10.0711 10.0711 10.5059 10.5059 10.5425 10.5425 k = 0.0000 0.0000 0.0000 ( 8655 PWs) bands (ev): -69.7792 -69.7792 -69.7511 -69.7511 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4540 -7.4540 -1.8770 -1.8770 -0.7869 -0.7869 4.3692 4.3692 6.2637 6.2637 6.3378 6.3378 6.3396 6.3396 6.4711 6.4711 6.4721 6.4721 7.7713 7.7713 7.8029 7.8029 8.7346 8.7346 8.9589 8.9589 8.9708 8.9708 9.7228 9.7228 9.7609 9.7609 10.0711 10.0711 10.5059 10.5059 10.5425 10.5425 k = 0.0000 0.0000 0.0127 ( 8691 PWs) bands (ev): -69.7813 -69.7813 -69.7530 -69.7530 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3237 -38.3237 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4540 -7.4540 -1.8759 -1.8759 -0.7886 -0.7886 4.3711 4.3711 6.2582 6.2582 6.3338 6.3338 6.3356 6.3356 6.4734 6.4734 6.4746 6.4746 7.7662 7.7662 7.7979 7.7979 8.7252 8.7252 8.9508 8.9508 8.9627 8.9627 9.7164 9.7164 9.7543 9.7543 10.0585 10.0585 10.5031 10.5031 10.5393 10.5393 k = 0.0000 0.0000 0.0255 ( 8685 PWs) bands (ev): -69.7813 -69.7813 -69.7524 -69.7524 -39.5501 -39.5501 -39.5017 -39.5017 -38.3834 -38.3834 -38.3237 -38.3237 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5937 -7.5937 -7.4540 -7.4540 -1.8727 -1.8727 -0.7932 -0.7932 4.3775 4.3775 6.2529 6.2529 6.3266 6.3266 6.3286 6.3286 6.4819 6.4819 6.4832 6.4832 7.7685 7.7685 7.8004 7.8004 8.7251 8.7251 8.9515 8.9515 8.9635 8.9635 9.7145 9.7145 9.7516 9.7516 10.0328 10.0328 10.5011 10.5011 10.5363 10.5363 k = 0.0000 0.0000 0.0382 ( 8673 PWs) bands (ev): -69.7800 -69.7800 -69.7525 -69.7525 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5938 -7.5938 -7.4540 -7.4540 -1.8674 -1.8674 -0.8009 -0.8009 4.3884 4.3884 6.2449 6.2449 6.3148 6.3148 6.3168 6.3168 6.4948 6.4948 6.4963 6.4963 7.7771 7.7771 7.8091 7.8091 8.7332 8.7332 8.9466 8.9466 8.9587 8.9587 9.7119 9.7119 9.7477 9.7477 9.9948 9.9948 10.4961 10.4961 10.5298 10.5298 k = 0.0000 0.0000 0.0509 ( 8685 PWs) bands (ev): -69.7809 -69.7809 -69.7529 -69.7529 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3237 -38.3237 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6578 -8.6578 -7.5939 -7.5939 -7.4540 -7.4540 -1.8599 -1.8599 -0.8116 -0.8116 4.4032 4.4032 6.2318 6.2318 6.3001 6.3001 6.3023 6.3023 6.5084 6.5084 6.5103 6.5103 7.7784 7.7784 7.8107 7.8107 8.7328 8.7328 8.9414 8.9414 8.9537 8.9537 9.7052 9.7052 9.7393 9.7393 9.9469 9.9469 10.4875 10.4875 10.5192 10.5192 k = 0.0000 0.0000 0.0637 ( 8678 PWs) bands (ev): -69.7806 -69.7806 -69.7526 -69.7526 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3237 -38.3237 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6579 -8.6579 -7.5940 -7.5940 -7.4540 -7.4540 -1.8504 -1.8504 -0.8252 -0.8252 4.4222 4.4222 6.2157 6.2157 6.2852 6.2852 6.2875 6.2875 6.5247 6.5247 6.5268 6.5268 7.7861 7.7861 7.8187 7.8187 8.7356 8.7356 8.9380 8.9380 8.9506 8.9506 9.6999 9.6999 9.7317 9.7317 9.8949 9.8949 10.4796 10.4796 10.5086 10.5086 k = 0.0000 0.0000 0.0764 ( 8678 PWs) bands (ev): -69.7806 -69.7806 -69.7526 -69.7526 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3237 -38.3237 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6579 -8.6579 -7.5942 -7.5942 -7.4540 -7.4540 -1.8387 -1.8387 -0.8415 -0.8415 4.4450 4.4450 6.1953 6.1953 6.2695 6.2695 6.2720 6.2720 6.5414 6.5414 6.5439 6.5439 7.7938 7.7938 7.8268 7.8268 8.7350 8.7350 8.9331 8.9331 8.9461 8.9461 9.6924 9.6924 9.7214 9.7214 9.8402 9.8402 10.4703 10.4703 10.4962 10.4962 k = 0.0000 0.0000 0.0891 ( 8684 PWs) bands (ev): -69.7808 -69.7808 -69.7531 -69.7531 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3237 -38.3237 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6580 -8.6580 -7.5943 -7.5943 -7.4540 -7.4540 -1.8251 -1.8251 -0.8605 -0.8605 4.4715 4.4715 6.1727 6.1727 6.2530 6.2530 6.2556 6.2556 6.5579 6.5579 6.5608 6.5608 7.8015 7.8015 7.8351 7.8351 8.7349 8.7349 8.9249 8.9249 8.9381 8.9381 9.6829 9.6829 9.7085 9.7085 9.7872 9.7872 10.4587 10.4587 10.4810 10.4810 k = 0.0000 0.0000 0.1019 ( 8672 PWs) bands (ev): -69.7801 -69.7801 -69.7524 -69.7524 -39.5501 -39.5501 -39.5017 -39.5017 -38.3835 -38.3835 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7935 -25.7935 -8.6581 -8.6581 -7.5945 -7.5945 -7.4540 -7.4540 -1.8095 -1.8095 -0.8821 -0.8821 4.5015 4.5015 6.1459 6.1459 6.2389 6.2389 6.2418 6.2418 6.5754 6.5754 6.5786 6.5786 7.8129 7.8129 7.8470 7.8470 8.7356 8.7356 8.9207 8.9207 8.9344 8.9344 9.6760 9.6760 9.6973 9.6973 9.7354 9.7354 10.4484 10.4484 10.4669 10.4669 k = 0.0000 0.0000 0.1146 ( 8672 PWs) bands (ev): -69.7792 -69.7792 -69.7534 -69.7534 -39.5501 -39.5501 -39.5016 -39.5016 -38.3835 -38.3835 -38.3236 -38.3236 -38.3013 -38.3013 -38.2582 -38.2582 -25.7935 -25.7935 -8.6581 -8.6581 -7.5947 -7.5947 -7.4540 -7.4540 -1.7919 -1.7919 -0.9060 -0.9060 4.5347 4.5347 6.1112 6.1112 6.2237 6.2237 6.2268 6.2268 6.5926 6.5926 6.5962 6.5962 7.8290 7.8290 7.8635 7.8635 8.7341 8.7341 8.9130 8.9130 8.9271 8.9271 9.6676 9.6676 9.6719 9.6719 9.6921 9.6921 10.4374 10.4374 10.4516 10.4516 k = 0.0000 0.0000 0.1273 ( 8660 PWs) bands (ev): -69.7788 -69.7788 -69.7525 -69.7525 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2582 -38.2582 -25.7935 -25.7935 -8.6582 -8.6582 -7.5949 -7.5949 -7.4540 -7.4540 -1.7724 -1.7724 -0.9320 -0.9320 4.5711 4.5711 6.0778 6.0778 6.2103 6.2103 6.2135 6.2135 6.6092 6.6092 6.6131 6.6131 7.8423 7.8423 7.8775 7.8775 8.7332 8.7332 8.9099 8.9099 8.9246 8.9246 9.6268 9.6268 9.6554 9.6554 9.6730 9.6730 10.4301 10.4301 10.4400 10.4400 k = 0.0000 0.0000 0.1401 ( 8666 PWs) bands (ev): -69.7792 -69.7792 -69.7528 -69.7528 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6583 -8.6583 -7.5951 -7.5951 -7.4540 -7.4540 -1.7512 -1.7512 -0.9600 -0.9600 4.6098 4.6098 6.0409 6.0409 6.1966 6.1966 6.1999 6.1999 6.6244 6.6244 6.6287 6.6287 7.8547 7.8547 7.8907 7.8907 8.7263 8.7263 8.9021 8.9021 8.9176 8.9176 9.5806 9.5806 9.6417 9.6417 9.6549 9.6549 10.4202 10.4202 10.4259 10.4259 k = 0.0000 0.0000 0.1528 ( 8672 PWs) bands (ev): -69.7794 -69.7794 -69.7533 -69.7533 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6584 -8.6584 -7.5953 -7.5953 -7.4540 -7.4540 -1.7282 -1.7282 -0.9897 -0.9897 4.6512 4.6512 6.0021 6.0021 6.1834 6.1834 6.1869 6.1869 6.6388 6.6388 6.6434 6.6434 7.8672 7.8672 7.9040 7.9040 8.7253 8.7253 8.8919 8.8919 8.9080 8.9080 9.5394 9.5394 9.6258 9.6258 9.6350 9.6350 10.4106 10.4106 10.4121 10.4121 k = 0.0000 0.0000 0.1655 ( 8648 PWs) bands (ev): -69.7780 -69.7780 -69.7520 -69.7520 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3235 -38.3235 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6585 -8.6585 -7.5955 -7.5955 -7.4540 -7.4540 -1.7035 -1.7035 -1.0210 -1.0210 4.6948 4.6948 5.9618 5.9618 6.1740 6.1740 6.1777 6.1777 6.6559 6.6559 6.6607 6.6607 7.8807 7.8807 7.9182 7.9182 8.7297 8.7297 8.8867 8.8867 8.9034 8.9034 9.5037 9.5037 9.6144 9.6144 9.6199 9.6199 10.4037 10.4037 10.4064 10.4064 k = 0.0000 0.0000 0.1783 ( 8672 PWs) bands (ev): -69.7794 -69.7794 -69.7534 -69.7534 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6585 -8.6585 -7.5957 -7.5957 -7.4540 -7.4540 -1.6773 -1.6773 -1.0536 -1.0536 4.7393 4.7393 5.9173 5.9173 6.1619 6.1619 6.1655 6.1655 6.6669 6.6669 6.6721 6.6721 7.8916 7.8916 7.9300 7.9300 8.7177 8.7177 8.8754 8.8754 8.8930 8.8930 9.4659 9.4659 9.5993 9.5993 9.6012 9.6012 10.3891 10.3891 10.3955 10.3955 k = 0.0000 0.0000 0.1910 ( 8666 PWs) bands (ev): -69.7790 -69.7790 -69.7532 -69.7532 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3235 -38.3235 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6586 -8.6586 -7.5959 -7.5959 -7.4540 -7.4540 -1.6496 -1.6496 -1.0874 -1.0874 4.7851 4.7851 5.8723 5.8723 6.1529 6.1529 6.1566 6.1566 6.6796 6.6796 6.6850 6.6850 7.9067 7.9067 7.9459 7.9459 8.7125 8.7125 8.8687 8.8687 8.8872 8.8872 9.4340 9.4340 9.5855 9.5855 9.5870 9.5870 10.3798 10.3798 10.3898 10.3898 k = 0.0000 0.0000 0.2037 ( 8654 PWs) bands (ev): -69.7784 -69.7784 -69.7525 -69.7525 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3235 -38.3235 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6587 -8.6587 -7.5961 -7.5961 -7.4540 -7.4540 -1.6206 -1.6206 -1.1220 -1.1220 4.8316 4.8316 5.8282 5.8282 6.1446 6.1446 6.1484 6.1484 6.6900 6.6900 6.6957 6.6957 7.9216 7.9216 7.9616 7.9616 8.7134 8.7134 8.8641 8.8641 8.8835 8.8835 9.4088 9.4088 9.5693 9.5693 9.5739 9.5739 10.3721 10.3721 10.3853 10.3853 k = 0.0000 0.0000 0.2165 ( 8642 PWs) bands (ev): -69.7777 -69.7777 -69.7519 -69.7519 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3235 -38.3235 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6587 -8.6587 -7.5963 -7.5963 -7.4540 -7.4540 -1.5903 -1.5903 -1.1573 -1.1573 4.8788 4.8788 5.7843 5.7843 6.1369 6.1369 6.1408 6.1408 6.6990 6.6990 6.7050 6.7050 7.9344 7.9344 7.9750 7.9750 8.7221 8.7221 8.8575 8.8575 8.8778 8.8778 9.3900 9.3900 9.5541 9.5541 9.5613 9.5613 10.3642 10.3642 10.3802 10.3802 k = 0.0000 0.0000 0.2292 ( 8648 PWs) bands (ev): -69.7777 -69.7777 -69.7527 -69.7527 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3235 -38.3235 -38.3013 -38.3013 -38.2582 -38.2582 -25.7935 -25.7935 -8.6588 -8.6588 -7.5964 -7.5964 -7.4540 -7.4540 -1.5590 -1.5590 -1.1931 -1.1931 4.9232 4.9232 5.7408 5.7408 6.1293 6.1293 6.1332 6.1332 6.7063 6.7063 6.7125 6.7125 7.9443 7.9443 7.9856 7.9856 8.7232 8.7232 8.8501 8.8501 8.8711 8.8711 9.3702 9.3702 9.5380 9.5380 9.5475 9.5475 10.3575 10.3575 10.3759 10.3759 k = 0.0000 0.0000 0.2419 ( 8660 PWs) bands (ev): -69.7790 -69.7790 -69.7528 -69.7528 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6588 -8.6588 -7.5965 -7.5965 -7.4540 -7.4540 -1.5268 -1.5268 -1.2290 -1.2290 4.9648 4.9648 5.6999 5.6999 6.1237 6.1237 6.1277 6.1277 6.7118 6.7118 6.7182 6.7182 7.9475 7.9475 7.9895 7.9895 8.7191 8.7191 8.8445 8.8445 8.8663 8.8663 9.3549 9.3549 9.5252 9.5252 9.5366 9.5366 10.3506 10.3506 10.3710 10.3710 k = 0.0000 0.0000 0.2547 ( 8672 PWs) bands (ev): -69.7801 -69.7801 -69.7531 -69.7531 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5966 -7.5966 -7.4540 -7.4540 -1.4943 -1.4943 -1.2645 -1.2645 5.0017 5.0017 5.6637 5.6637 6.1190 6.1190 6.1230 6.1230 6.7149 6.7149 6.7215 6.7215 7.9523 7.9523 7.9949 7.9949 8.7170 8.7170 8.8387 8.8387 8.8611 8.8611 9.3428 9.3428 9.5145 9.5145 9.5274 9.5274 10.3433 10.3433 10.3651 10.3651 k = 0.0000 0.0000 0.2674 ( 8672 PWs) bands (ev): -69.7801 -69.7801 -69.7531 -69.7531 -39.5500 -39.5500 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5967 -7.5967 -7.4540 -7.4540 -1.4622 -1.4622 -1.2988 -1.2988 5.0313 5.0313 5.6346 5.6346 6.1159 6.1159 6.1199 6.1199 6.7184 6.7184 6.7252 6.7252 7.9577 7.9577 8.0007 8.0007 8.7162 8.7162 8.8354 8.8354 8.8583 8.8583 9.3345 9.3345 9.5075 9.5075 9.5214 9.5214 10.3402 10.3402 10.3631 10.3631 k = 0.0000 0.0000 0.2801 ( 8678 PWs) bands (ev): -69.7804 -69.7804 -69.7536 -69.7536 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5967 -7.5967 -7.4540 -7.4540 -1.4333 -1.4333 -1.3290 -1.3290 5.0508 5.0508 5.6154 5.6154 6.1135 6.1135 6.1175 6.1175 6.7201 6.7201 6.7269 6.7269 7.9602 7.9602 8.0034 8.0034 8.7156 8.7156 8.8320 8.8320 8.8551 8.8551 9.3293 9.3293 9.5022 9.5022 9.5168 9.5168 10.3377 10.3377 10.3612 10.3612 k = 0.0000 0.0000 0.2929 ( 8678 PWs) bands (ev): -69.7804 -69.7804 -69.7536 -69.7536 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5967 -7.5967 -7.4540 -7.4540 -1.4187 -1.4187 -1.3440 -1.3440 5.0576 5.0576 5.6087 5.6087 6.1129 6.1129 6.1169 6.1169 6.7208 6.7208 6.7276 6.7276 7.9613 7.9613 8.0046 8.0046 8.7155 8.7155 8.8313 8.8313 8.8545 8.8545 9.3276 9.3276 9.5008 9.5008 9.5156 9.5156 10.3370 10.3370 10.3608 10.3608 k = 0.0000 0.0000 0.2929 ( 8678 PWs) bands (ev): -69.7804 -69.7804 -69.7536 -69.7536 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5967 -7.5967 -7.4540 -7.4540 -1.4187 -1.4187 -1.3440 -1.3440 5.0576 5.0576 5.6087 5.6087 6.1129 6.1129 6.1169 6.1169 6.7208 6.7208 6.7276 6.7276 7.9613 7.9613 8.0046 8.0046 8.7155 8.7155 8.8313 8.8313 8.8545 8.8545 9.3276 9.3276 9.5008 9.5008 9.5156 9.5156 10.3370 10.3370 10.3608 10.3608 k = 0.0114 0.0066 0.2929 ( 8670 PWs) bands (ev): -69.7801 -69.7801 -69.7530 -69.7530 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7934 -25.7934 -8.6590 -8.6590 -7.5968 -7.5968 -7.4543 -7.4543 -1.4177 -1.4177 -1.3437 -1.3437 5.0585 5.0585 5.6049 5.6049 6.1150 6.1150 6.1198 6.1198 6.7207 6.7207 6.7277 6.7277 7.9610 7.9610 8.0042 8.0042 8.7136 8.7136 8.8334 8.8334 8.8564 8.8564 9.3289 9.3289 9.5022 9.5022 9.5169 9.5169 10.3352 10.3352 10.3593 10.3593 k = 0.0227 0.0131 0.2929 ( 8662 PWs) bands (ev): -69.7795 -69.7795 -69.7527 -69.7527 -39.5500 -39.5500 -39.5017 -39.5017 -38.3833 -38.3833 -38.3238 -38.3238 -38.3011 -38.3011 -38.2583 -38.2583 -25.7934 -25.7934 -8.6593 -8.6593 -7.5968 -7.5968 -7.4551 -7.4551 -1.4149 -1.4149 -1.3425 -1.3425 5.0606 5.0606 5.5940 5.5940 6.1178 6.1178 6.1276 6.1276 6.7173 6.7173 6.7288 6.7288 7.9599 7.9599 8.0029 8.0029 8.7068 8.7068 8.8350 8.8350 8.8575 8.8575 9.3303 9.3303 9.5039 9.5039 9.5191 9.5191 10.3268 10.3268 10.3554 10.3554 k = 0.0341 0.0197 0.2929 ( 8670 PWs) bands (ev): -69.7800 -69.7800 -69.7531 -69.7531 -39.5499 -39.5499 -39.5018 -39.5018 -38.3833 -38.3833 -38.3240 -38.3240 -38.3009 -38.3009 -38.2584 -38.2584 -25.7933 -25.7933 -8.6597 -8.6597 -7.5970 -7.5970 -7.4566 -7.4566 -1.4102 -1.4102 -1.3407 -1.3407 5.0635 5.0635 5.5768 5.5768 6.1194 6.1194 6.1410 6.1410 6.7094 6.7094 6.7274 6.7274 7.9553 7.9553 7.9979 7.9979 8.6937 8.6937 8.8333 8.8333 8.8555 8.8555 9.3308 9.3308 9.5053 9.5053 9.5225 9.5225 10.3075 10.3075 10.3438 10.3438 k = 0.0455 0.0262 0.2929 ( 8670 PWs) bands (ev): -69.7798 -69.7798 -69.7533 -69.7533 -39.5499 -39.5499 -39.5019 -39.5019 -38.3832 -38.3832 -38.3243 -38.3243 -38.3006 -38.3006 -38.2584 -38.2584 -25.7931 -25.7931 -8.6603 -8.6603 -7.5971 -7.5971 -7.4585 -7.4585 -1.4037 -1.4037 -1.3381 -1.3381 5.0677 5.0677 5.5542 5.5542 6.1216 6.1216 6.1587 6.1587 6.6999 6.6999 6.7279 6.7279 7.9493 7.9493 7.9913 7.9913 8.6794 8.6794 8.8321 8.8321 8.8545 8.8545 9.3324 9.3324 9.5067 9.5067 9.5279 9.5279 10.2838 10.2838 10.3334 10.3334 k = 0.0568 0.0328 0.2929 ( 8670 PWs) bands (ev): -69.7793 -69.7793 -69.7537 -69.7537 -39.5498 -39.5498 -39.5020 -39.5020 -38.3832 -38.3832 -38.3247 -38.3247 -38.3003 -38.3003 -38.2585 -38.2585 -25.7929 -25.7929 -8.6610 -8.6610 -7.5974 -7.5974 -7.4610 -7.4610 -1.3954 -1.3954 -1.3347 -1.3347 5.0730 5.0730 5.5275 5.5275 6.1243 6.1243 6.1786 6.1786 6.6864 6.6864 6.7299 6.7299 7.9427 7.9427 7.9845 7.9845 8.6635 8.6635 8.8284 8.8284 8.8521 8.8521 9.3342 9.3342 9.5068 9.5068 9.5353 9.5353 10.2535 10.2535 10.3227 10.3227 k = 0.0682 0.0394 0.2929 ( 8674 PWs) bands (ev): -69.7790 -69.7790 -69.7545 -69.7545 -39.5496 -39.5496 -39.5022 -39.5022 -38.3831 -38.3831 -38.3252 -38.3252 -38.2998 -38.2998 -38.2585 -38.2585 -25.7927 -25.7927 -8.6619 -8.6619 -7.5977 -7.5977 -7.4640 -7.4640 -1.3853 -1.3853 -1.3306 -1.3306 5.0791 5.0791 5.4977 5.4977 6.1270 6.1270 6.2006 6.2006 6.6714 6.6714 6.7314 6.7314 7.9331 7.9331 7.9741 7.9741 8.6448 8.6448 8.8229 8.8229 8.8480 8.8480 9.3361 9.3361 9.5063 9.5063 9.5438 9.5438 10.2197 10.2197 10.3093 10.3093 k = 0.0795 0.0459 0.2929 ( 8662 PWs) bands (ev): -69.7778 -69.7778 -69.7543 -69.7543 -39.5495 -39.5495 -39.5024 -39.5024 -38.3829 -38.3829 -38.3257 -38.3257 -38.2994 -38.2994 -38.2586 -38.2586 -25.7924 -25.7924 -8.6630 -8.6630 -7.5981 -7.5981 -7.4674 -7.4674 -1.3736 -1.3736 -1.3257 -1.3257 5.0866 5.0866 5.4657 5.4657 6.1325 6.1325 6.2244 6.2244 6.6534 6.6534 6.7352 6.7352 7.9258 7.9258 7.9659 7.9659 8.6253 8.6253 8.8194 8.8194 8.8447 8.8447 9.3395 9.3395 9.5070 9.5070 9.5571 9.5571 10.1828 10.1828 10.2970 10.2970 k = 0.0909 0.0525 0.2929 ( 8656 PWs) bands (ev): -69.7775 -69.7775 -69.7539 -69.7539 -39.5493 -39.5493 -39.5026 -39.5026 -38.3827 -38.3827 -38.3263 -38.3263 -38.2988 -38.2988 -38.2587 -38.2587 -25.7921 -25.7921 -8.6642 -8.6642 -7.5985 -7.5985 -7.4713 -7.4713 -1.3603 -1.3603 -1.3200 -1.3200 5.0948 5.0948 5.4323 5.4323 6.1383 6.1383 6.2488 6.2488 6.6318 6.6318 6.7371 6.7371 7.9152 7.9152 7.9554 7.9554 8.6033 8.6033 8.8142 8.8142 8.8400 8.8400 9.3433 9.3433 9.5087 9.5087 9.5704 9.5704 10.1433 10.1433 10.2797 10.2797 k = 0.1023 0.0590 0.2929 ( 8678 PWs) bands (ev): -69.7785 -69.7785 -69.7555 -69.7555 -39.5491 -39.5491 -39.5029 -39.5029 -38.3826 -38.3826 -38.3270 -38.3270 -38.2983 -38.2983 -38.2588 -38.2588 -25.7917 -25.7917 -8.6656 -8.6656 -7.5991 -7.5991 -7.4755 -7.4755 -1.3459 -1.3459 -1.3133 -1.3133 5.1032 5.1032 5.3972 5.3972 6.1432 6.1432 6.2707 6.2707 6.6068 6.6068 6.7376 6.7376 7.8994 7.8994 7.9378 7.9378 8.5783 8.5783 8.8036 8.8036 8.8268 8.8268 9.3460 9.3460 9.5041 9.5041 9.5825 9.5825 10.0987 10.0987 10.2583 10.2583 k = 0.1136 0.0656 0.2929 ( 8664 PWs) bands (ev): -69.7772 -69.7772 -69.7551 -69.7551 -39.5489 -39.5489 -39.5031 -39.5031 -38.3824 -38.3824 -38.3277 -38.3277 -38.2977 -38.2977 -38.2589 -38.2589 -25.7913 -25.7913 -8.6672 -8.6672 -7.5998 -7.5998 -7.4800 -7.4800 -1.3307 -1.3307 -1.3051 -1.3051 5.1121 5.1121 5.3625 5.3625 6.1507 6.1507 6.2940 6.2940 6.5826 6.5826 6.7415 6.7415 7.8877 7.8877 7.9268 7.9268 8.5552 8.5552 8.7977 8.7977 8.8202 8.8202 9.3507 9.3507 9.5037 9.5037 9.5972 9.5972 10.0627 10.0627 10.2414 10.2414 k = 0.1250 0.0722 0.2929 ( 8660 PWs) bands (ev): -69.7769 -69.7769 -69.7550 -69.7550 -39.5486 -39.5486 -39.5034 -39.5034 -38.3822 -38.3822 -38.3284 -38.3284 -38.2970 -38.2970 -38.2590 -38.2590 -25.7909 -25.7909 -8.6689 -8.6689 -7.6007 -7.6007 -7.4848 -7.4848 -1.3161 -1.3161 -1.2943 -1.2943 5.1207 5.1207 5.3279 5.3279 6.1585 6.1585 6.3158 6.3158 6.5553 6.5553 6.7439 6.7439 7.8739 7.8739 7.9131 7.9131 8.5303 8.5303 8.7894 8.7894 8.8114 8.8114 9.3547 9.3547 9.4999 9.4999 9.6120 9.6120 10.0257 10.0257 10.2219 10.2219 k = 0.1364 0.0787 0.2929 ( 8656 PWs) bands (ev): -69.7765 -69.7765 -69.7550 -69.7550 -39.5484 -39.5484 -39.5038 -39.5038 -38.3819 -38.3819 -38.3291 -38.3291 -38.2964 -38.2964 -38.2592 -38.2592 -25.7904 -25.7904 -8.6708 -8.6708 -7.6017 -7.6017 -7.4897 -7.4897 -1.3036 -1.3036 -1.2794 -1.2794 5.1285 5.1285 5.2938 5.2938 6.1679 6.1679 6.3349 6.3349 6.5258 6.5258 6.7477 6.7477 7.8604 7.8604 7.8984 7.8984 8.5041 8.5041 8.7795 8.7795 8.8008 8.8008 9.3586 9.3586 9.4929 9.4929 9.6277 9.6277 9.9918 9.9918 10.2047 10.2047 k = 0.1477 0.0853 0.2929 ( 8656 PWs) bands (ev): -69.7762 -69.7762 -69.7553 -69.7553 -39.5481 -39.5481 -39.5041 -39.5041 -38.3817 -38.3817 -38.3299 -38.3299 -38.2957 -38.2957 -38.2593 -38.2593 -25.7900 -25.7900 -8.6728 -8.6728 -7.6029 -7.6029 -7.4948 -7.4948 -1.2931 -1.2931 -1.2607 -1.2607 5.1342 5.1342 5.2619 5.2619 6.1766 6.1766 6.3529 6.3529 6.4962 6.4962 6.7505 6.7505 7.8459 7.8459 7.8844 7.8844 8.4786 8.4786 8.7652 8.7652 8.7889 8.7889 9.3634 9.3634 9.4830 9.4830 9.6408 9.6408 9.9591 9.9591 10.1869 10.1869 k = 0.1591 0.0919 0.2929 ( 8654 PWs) bands (ev): -69.7756 -69.7756 -69.7557 -69.7557 -39.5478 -39.5478 -39.5045 -39.5045 -38.3814 -38.3814 -38.3307 -38.3307 -38.2950 -38.2950 -38.2594 -38.2594 -25.7894 -25.7894 -8.6750 -8.6750 -7.6043 -7.6043 -7.4998 -7.4998 -1.2834 -1.2834 -1.2395 -1.2395 5.1357 5.1357 5.2341 5.2341 6.1862 6.1862 6.3682 6.3682 6.4668 6.4668 6.7533 6.7533 7.8319 7.8319 7.8730 7.8730 8.4522 8.4522 8.7500 8.7500 8.7769 8.7769 9.3672 9.3672 9.4705 9.4705 9.6535 9.6535 9.9302 9.9302 10.1695 10.1695 k = 0.1705 0.0984 0.2929 ( 8650 PWs) bands (ev): -69.7752 -69.7752 -69.7556 -69.7556 -39.5474 -39.5474 -39.5049 -39.5049 -38.3811 -38.3811 -38.3315 -38.3315 -38.2943 -38.2943 -38.2596 -38.2596 -25.7889 -25.7889 -8.6773 -8.6773 -7.6061 -7.6061 -7.5048 -7.5048 -1.2739 -1.2739 -1.2165 -1.2165 5.1287 5.1287 5.2144 5.2144 6.1969 6.1969 6.3783 6.3783 6.4394 6.4394 6.7566 6.7566 7.8174 7.8174 7.8588 7.8588 8.4268 8.4268 8.7337 8.7337 8.7683 8.7683 9.3707 9.3707 9.4549 9.4549 9.6645 9.6645 9.9046 9.9046 10.1564 10.1564 k = 0.1818 0.1050 0.2929 ( 8650 PWs) bands (ev): -69.7751 -69.7751 -69.7558 -69.7558 -39.5471 -39.5471 -39.5054 -39.5054 -38.3808 -38.3808 -38.3324 -38.3324 -38.2936 -38.2936 -38.2598 -38.2598 -25.7883 -25.7883 -8.6798 -8.6798 -7.6081 -7.6081 -7.5097 -7.5097 -1.2644 -1.2644 -1.1921 -1.1921 5.1111 5.1111 5.2050 5.2050 6.2074 6.2074 6.3756 6.3756 6.4236 6.4236 6.7582 6.7582 7.8029 7.8029 7.8471 7.8471 8.4010 8.4010 8.7143 8.7143 8.7575 8.7575 9.3738 9.3738 9.4390 9.4390 9.6699 9.6699 9.8816 9.8816 10.1441 10.1441 k = 0.1932 0.1115 0.2929 ( 8654 PWs) bands (ev): -69.7751 -69.7751 -69.7562 -69.7562 -39.5467 -39.5467 -39.5058 -39.5058 -38.3804 -38.3804 -38.3332 -38.3332 -38.2929 -38.2929 -38.2600 -38.2600 -25.7878 -25.7878 -8.6824 -8.6824 -7.6105 -7.6105 -7.5143 -7.5143 -1.2547 -1.2547 -1.1667 -1.1667 5.0853 5.0853 5.2027 5.2027 6.2181 6.2181 6.3556 6.3556 6.4237 6.4237 6.7596 6.7596 7.7881 7.7881 7.8350 7.8350 8.3750 8.3750 8.6944 8.6944 8.7463 8.7463 9.3757 9.3757 9.4202 9.4202 9.6706 9.6706 9.8602 9.8602 10.1357 10.1357 k = 0.2045 0.1181 0.2929 ( 8650 PWs) bands (ev): -69.7743 -69.7743 -69.7566 -69.7566 -39.5463 -39.5463 -39.5063 -39.5063 -38.3801 -38.3801 -38.3341 -38.3341 -38.2922 -38.2922 -38.2602 -38.2602 -25.7872 -25.7872 -8.6851 -8.6851 -7.6133 -7.6133 -7.5186 -7.5186 -1.2448 -1.2448 -1.1404 -1.1404 5.0561 5.0561 5.2028 5.2028 6.2291 6.2291 6.3300 6.3300 6.4291 6.4291 6.7626 6.7626 7.7748 7.7748 7.8256 7.8256 8.3501 8.3501 8.6743 8.6743 8.7378 8.7378 9.3778 9.3778 9.4004 9.4004 9.6688 9.6688 9.8400 9.8400 10.1343 10.1343 k = 0.2159 0.1247 0.2929 ( 8638 PWs) bands (ev): -69.7730 -69.7730 -69.7565 -69.7565 -39.5459 -39.5459 -39.5068 -39.5068 -38.3797 -38.3797 -38.3349 -38.3349 -38.2915 -38.2915 -38.2604 -38.2604 -25.7866 -25.7866 -8.6879 -8.6879 -7.6164 -7.6164 -7.5226 -7.5226 -1.2348 -1.2348 -1.1132 -1.1132 5.0256 5.0256 5.2034 5.2034 6.2412 6.2412 6.3046 6.3046 6.4351 6.4351 6.7641 6.7641 7.7649 7.7649 7.8164 7.8164 8.3281 8.3281 8.6544 8.6544 8.7301 8.7301 9.3724 9.3724 9.3886 9.3886 9.6643 9.6643 9.8251 9.8251 10.1361 10.1361 k = 0.2273 0.1312 0.2929 ( 8630 PWs) bands (ev): -69.7725 -69.7725 -69.7561 -69.7561 -39.5454 -39.5454 -39.5073 -39.5073 -38.3793 -38.3793 -38.3358 -38.3358 -38.2908 -38.2908 -38.2606 -38.2606 -25.7859 -25.7859 -8.6909 -8.6909 -7.6200 -7.6200 -7.5261 -7.5261 -1.2246 -1.2246 -1.0855 -1.0855 4.9948 4.9948 5.2029 5.2029 6.2536 6.2536 6.2813 6.2813 6.4405 6.4405 6.7646 6.7646 7.7543 7.7543 7.8074 7.8074 8.3054 8.3054 8.6335 8.6335 8.7206 8.7206 9.3552 9.3552 9.3875 9.3875 9.6525 9.6525 9.8108 9.8108 10.1419 10.1419 k = 0.2386 0.1378 0.2929 ( 8634 PWs) bands (ev): -69.7722 -69.7722 -69.7569 -69.7569 -39.5450 -39.5450 -39.5078 -39.5078 -38.3789 -38.3789 -38.3367 -38.3367 -38.2901 -38.2901 -38.2608 -38.2608 -25.7853 -25.7853 -8.6939 -8.6939 -7.6240 -7.6240 -7.5292 -7.5292 -1.2144 -1.2144 -1.0572 -1.0572 4.9635 4.9635 5.2004 5.2004 6.2575 6.2575 6.2676 6.2676 6.4429 6.4429 6.7647 6.7647 7.7427 7.7427 7.7990 7.7990 8.2830 8.2830 8.6095 8.6095 8.7099 8.7099 9.3319 9.3319 9.3858 9.3858 9.6360 9.6360 9.7941 9.7941 10.1507 10.1507 k = 0.2500 0.1443 0.2929 ( 8630 PWs) bands (ev): -69.7717 -69.7717 -69.7570 -69.7570 -39.5445 -39.5445 -39.5084 -39.5084 -38.3785 -38.3785 -38.3375 -38.3375 -38.2895 -38.2895 -38.2610 -38.2610 -25.7847 -25.7847 -8.6969 -8.6969 -7.6283 -7.6283 -7.5319 -7.5319 -1.2041 -1.2041 -1.0286 -1.0286 4.9326 4.9326 5.1960 5.1960 6.2402 6.2402 6.2792 6.2792 6.4444 6.4444 6.7639 6.7639 7.7322 7.7322 7.7926 7.7926 8.2615 8.2615 8.5893 8.5893 8.6983 8.6983 9.3102 9.3102 9.3855 9.3855 9.6181 9.6181 9.7795 9.7795 10.1625 10.1625 k = 0.2614 0.1509 0.2929 ( 8638 PWs) bands (ev): -69.7722 -69.7722 -69.7574 -69.7574 -39.5441 -39.5441 -39.5090 -39.5090 -38.3781 -38.3781 -38.3384 -38.3384 -38.2888 -38.2888 -38.2613 -38.2613 -25.7841 -25.7841 -8.7001 -8.7001 -7.6329 -7.6329 -7.5341 -7.5341 -1.1939 -1.1939 -0.9998 -0.9998 4.9017 4.9017 5.1891 5.1891 6.2251 6.2251 6.2915 6.2915 6.4436 6.4436 6.7617 6.7617 7.7228 7.7228 7.7850 7.7850 8.2403 8.2403 8.5664 8.5664 8.6871 8.6871 9.2888 9.2888 9.3830 9.3830 9.5915 9.5915 9.7590 9.7590 10.1759 10.1759 k = 0.2727 0.1575 0.2929 ( 8642 PWs) bands (ev): -69.7716 -69.7716 -69.7584 -69.7584 -39.5436 -39.5436 -39.5096 -39.5096 -38.3777 -38.3777 -38.3393 -38.3393 -38.2881 -38.2881 -38.2615 -38.2615 -25.7834 -25.7834 -8.7033 -8.7033 -7.6378 -7.6378 -7.5359 -7.5359 -1.1837 -1.1837 -0.9709 -0.9709 4.8706 4.8706 5.1807 5.1807 6.2134 6.2134 6.3047 6.3047 6.4403 6.4403 6.7604 6.7604 7.7143 7.7143 7.7778 7.7778 8.2213 8.2213 8.5411 8.5411 8.6792 8.6792 9.2648 9.2648 9.3806 9.3806 9.5660 9.5660 9.7407 9.7407 10.1926 10.1926 k = 0.2841 0.1640 0.2929 ( 8658 PWs) bands (ev): -69.7727 -69.7727 -69.7592 -69.7592 -39.5431 -39.5431 -39.5102 -39.5102 -38.3773 -38.3773 -38.3402 -38.3402 -38.2875 -38.2875 -38.2618 -38.2618 -25.7828 -25.7828 -8.7065 -8.7065 -7.6429 -7.6429 -7.5373 -7.5373 -1.1736 -1.1736 -0.9421 -0.9421 4.8397 4.8397 5.1705 5.1705 6.2041 6.2041 6.3172 6.3172 6.4368 6.4368 6.7572 6.7572 7.7031 7.7031 7.7723 7.7723 8.2001 8.2001 8.5157 8.5157 8.6694 8.6694 9.2419 9.2419 9.3741 9.3741 9.5333 9.5333 9.7204 9.7204 10.2090 10.2090 k = 0.2955 0.1706 0.2929 ( 8642 PWs) bands (ev): -69.7717 -69.7717 -69.7584 -69.7584 -39.5426 -39.5426 -39.5108 -39.5108 -38.3768 -38.3768 -38.3410 -38.3410 -38.2869 -38.2869 -38.2620 -38.2620 -25.7822 -25.7822 -8.7097 -8.7097 -7.6481 -7.6481 -7.5385 -7.5385 -1.1636 -1.1636 -0.9135 -0.9135 4.8095 4.8095 5.1596 5.1596 6.1996 6.1996 6.3315 6.3315 6.4322 6.4322 6.7552 6.7552 7.6984 7.6984 7.7736 7.7736 8.1847 8.1847 8.4955 8.4955 8.6640 8.6640 9.2262 9.2262 9.3687 9.3687 9.5056 9.5056 9.7032 9.7032 10.2305 10.2305 k = 0.3068 0.1771 0.2929 ( 8648 PWs) bands (ev): -69.7722 -69.7722 -69.7586 -69.7586 -39.5420 -39.5420 -39.5114 -39.5114 -38.3764 -38.3764 -38.3418 -38.3418 -38.2862 -38.2862 -38.2623 -38.2623 -25.7816 -25.7816 -8.7129 -8.7129 -7.6533 -7.6533 -7.5393 -7.5393 -1.1539 -1.1539 -0.8852 -0.8852 4.7785 4.7785 5.1479 5.1479 6.1969 6.1969 6.3446 6.3446 6.4259 6.4259 6.7501 6.7501 7.6908 7.6908 7.7734 7.7734 8.1692 8.1692 8.4718 8.4718 8.6541 8.6541 9.2076 9.2076 9.3617 9.3617 9.4713 9.4713 9.6831 9.6831 10.2505 10.2505 k = 0.3182 0.1837 0.2929 ( 8638 PWs) bands (ev): -69.7713 -69.7713 -69.7584 -69.7584 -39.5415 -39.5415 -39.5120 -39.5120 -38.3759 -38.3759 -38.3426 -38.3426 -38.2856 -38.2856 -38.2626 -38.2626 -25.7810 -25.7810 -8.7160 -8.7160 -7.6585 -7.6585 -7.5399 -7.5399 -1.1445 -1.1445 -0.8575 -0.8575 4.7478 4.7478 5.1361 5.1361 6.1969 6.1969 6.3584 6.3584 6.4187 6.4187 6.7469 6.7469 7.6872 7.6872 7.7744 7.7744 8.1560 8.1560 8.4497 8.4497 8.6500 8.6500 9.1933 9.1933 9.3545 9.3545 9.4416 9.4416 9.6646 9.6646 10.2722 10.2722 k = 0.3295 0.1903 0.2929 ( 8648 PWs) bands (ev): -69.7715 -69.7715 -69.7595 -69.7595 -39.5410 -39.5410 -39.5126 -39.5126 -38.3754 -38.3754 -38.3434 -38.3434 -38.2850 -38.2850 -38.2628 -38.2628 -25.7805 -25.7805 -8.7191 -8.7191 -7.6637 -7.6637 -7.5402 -7.5402 -1.1353 -1.1353 -0.8305 -0.8305 4.7168 4.7168 5.1244 5.1244 6.1984 6.1984 6.3707 6.3707 6.4095 6.4095 6.7425 6.7425 7.6816 7.6816 7.7744 7.7744 8.1428 8.1428 8.4240 8.4240 8.6438 8.6438 9.1788 9.1788 9.3387 9.3387 9.4075 9.4075 9.6448 9.6448 10.2904 10.2904 k = 0.3409 0.1968 0.2929 ( 8650 PWs) bands (ev): -69.7714 -69.7714 -69.7598 -69.7598 -39.5404 -39.5404 -39.5132 -39.5132 -38.3750 -38.3750 -38.3442 -38.3442 -38.2845 -38.2845 -38.2631 -38.2631 -25.7799 -25.7799 -8.7221 -8.7221 -7.6687 -7.6687 -7.5405 -7.5405 -1.1265 -1.1265 -0.8042 -0.8042 4.6860 4.6860 5.1133 5.1133 6.2020 6.2020 6.3827 6.3827 6.4009 6.4009 6.7379 6.7379 7.6784 7.6784 7.7761 7.7761 8.1307 8.1307 8.4002 8.4002 8.6405 8.6405 9.1643 9.1643 9.3256 9.3256 9.3748 9.3748 9.6268 9.6268 10.3096 10.3096 k = 0.3523 0.2034 0.2929 ( 8662 PWs) bands (ev): -69.7718 -69.7718 -69.7608 -69.7608 -39.5399 -39.5399 -39.5139 -39.5139 -38.3745 -38.3745 -38.3450 -38.3450 -38.2840 -38.2840 -38.2634 -38.2634 -25.7794 -25.7794 -8.7251 -8.7251 -7.6735 -7.6735 -7.5405 -7.5405 -1.1182 -1.1182 -0.7790 -0.7790 4.6555 4.6555 5.1029 5.1029 6.2068 6.2068 6.3867 6.3867 6.3983 6.3983 6.7328 6.7328 7.6742 7.6742 7.7776 7.7776 8.1197 8.1197 8.3750 8.3750 8.6365 8.6365 9.1489 9.1489 9.3082 9.3082 9.3402 9.3402 9.6082 9.6082 10.3270 10.3270 k = 0.3636 0.2099 0.2929 ( 8658 PWs) bands (ev): -69.7713 -69.7713 -69.7609 -69.7609 -39.5394 -39.5394 -39.5145 -39.5145 -38.3741 -38.3741 -38.3457 -38.3457 -38.2834 -38.2834 -38.2636 -38.2636 -25.7789 -25.7789 -8.7279 -8.7279 -7.6781 -7.6781 -7.5405 -7.5405 -1.1101 -1.1101 -0.7548 -0.7548 4.6260 4.6260 5.0939 5.0939 6.2121 6.2121 6.3788 6.3788 6.4095 6.4095 6.7274 6.7274 7.6722 7.6722 7.7837 7.7837 8.1101 8.1101 8.3529 8.3529 8.6370 8.6370 9.1375 9.1375 9.2925 9.2925 9.3080 9.3080 9.5932 9.5932 10.3469 10.3469 k = 0.3750 0.2165 0.2929 ( 8654 PWs) bands (ev): -69.7704 -69.7704 -69.7614 -69.7614 -39.5389 -39.5389 -39.5151 -39.5151 -38.3736 -38.3736 -38.3464 -38.3464 -38.2829 -38.2829 -38.2638 -38.2638 -25.7785 -25.7785 -8.7305 -8.7305 -7.6825 -7.6825 -7.5404 -7.5404 -1.1027 -1.1027 -0.7319 -0.7319 4.5973 4.5973 5.0859 5.0859 6.2185 6.2185 6.3686 6.3686 6.4202 6.4202 6.7227 6.7227 7.6730 7.6730 7.7895 7.7895 8.1032 8.1032 8.3309 8.3309 8.6379 8.6379 9.1291 9.1291 9.2671 9.2671 9.2870 9.2870 9.5794 9.5794 10.3617 10.3617 k = 0.3864 0.2231 0.2929 ( 8656 PWs) bands (ev): -69.7703 -69.7703 -69.7617 -69.7617 -39.5383 -39.5383 -39.5156 -39.5156 -38.3732 -38.3732 -38.3471 -38.3471 -38.2825 -38.2825 -38.2641 -38.2641 -25.7780 -25.7780 -8.7330 -8.7330 -7.6866 -7.6866 -7.5402 -7.5402 -1.0957 -1.0957 -0.7105 -0.7105 4.5697 4.5697 5.0792 5.0792 6.2250 6.2250 6.3583 6.3583 6.4310 6.4310 6.7174 6.7174 7.6715 7.6715 7.7950 7.7950 8.0966 8.0966 8.3091 8.3091 8.6400 8.6400 9.1187 9.1187 9.2366 9.2366 9.2688 9.2688 9.5661 9.5661 10.3769 10.3769 k = 0.3977 0.2296 0.2929 ( 8656 PWs) bands (ev): -69.7701 -69.7701 -69.7619 -69.7619 -39.5378 -39.5378 -39.5162 -39.5162 -38.3728 -38.3728 -38.3477 -38.3477 -38.2821 -38.2821 -38.2643 -38.2643 -25.7776 -25.7776 -8.7354 -8.7354 -7.6903 -7.6903 -7.5400 -7.5400 -1.0893 -1.0893 -0.6906 -0.6906 4.5436 4.5436 5.0736 5.0736 6.2314 6.2314 6.3481 6.3481 6.4415 6.4415 6.7122 6.7122 7.6708 7.6708 7.8031 7.8031 8.0905 8.0905 8.2872 8.2872 8.6434 8.6434 9.1095 9.1095 9.2066 9.2066 9.2533 9.2533 9.5543 9.5543 10.3914 10.3914 k = 0.4091 0.2362 0.2929 ( 8660 PWs) bands (ev): -69.7699 -69.7699 -69.7626 -69.7626 -39.5374 -39.5374 -39.5167 -39.5167 -38.3724 -38.3724 -38.3483 -38.3483 -38.2817 -38.2817 -38.2645 -38.2645 -25.7773 -25.7773 -8.7375 -8.7375 -7.6937 -7.6937 -7.5397 -7.5397 -1.0835 -1.0835 -0.6723 -0.6723 4.5194 4.5194 5.0691 5.0691 6.2376 6.2376 6.3386 6.3386 6.4501 6.4501 6.7067 6.7067 7.6697 7.6697 7.8117 7.8117 8.0857 8.0857 8.2668 8.2668 8.6451 8.6451 9.0997 9.0997 9.1753 9.1753 9.2397 9.2397 9.5439 9.5439 10.4024 10.4024 k = 0.4205 0.2427 0.2929 ( 8654 PWs) bands (ev): -69.7693 -69.7693 -69.7625 -69.7625 -39.5369 -39.5369 -39.5172 -39.5172 -38.3720 -38.3720 -38.3488 -38.3488 -38.2813 -38.2813 -38.2647 -38.2647 -25.7769 -25.7769 -8.7394 -8.7394 -7.6968 -7.6968 -7.5395 -7.5395 -1.0783 -1.0783 -0.6559 -0.6559 4.4972 4.4972 5.0656 5.0656 6.2435 6.2435 6.3292 6.3292 6.4595 6.4595 6.7019 6.7019 7.6700 7.6700 7.8236 7.8236 8.0810 8.0810 8.2484 8.2484 8.6509 8.6509 9.0921 9.0921 9.1487 9.1487 9.2294 9.2294 9.5348 9.5348 10.4145 10.4145 k = 0.4318 0.2493 0.2929 ( 8646 PWs) bands (ev): -69.7689 -69.7689 -69.7621 -69.7621 -39.5365 -39.5365 -39.5177 -39.5177 -38.3717 -38.3717 -38.3493 -38.3493 -38.2810 -38.2810 -38.2649 -38.2649 -25.7767 -25.7767 -8.7411 -8.7411 -7.6995 -7.6995 -7.5393 -7.5393 -1.0737 -1.0737 -0.6414 -0.6414 4.4775 4.4775 5.0630 5.0630 6.2494 6.2494 6.3205 6.3205 6.4683 6.4683 6.6977 6.6977 7.6704 7.6704 7.8359 7.8359 8.0778 8.0778 8.2301 8.2301 8.6594 8.6594 9.0839 9.0839 9.1245 9.1245 9.2193 9.2193 9.5278 9.5278 10.4277 10.4277 k = 0.4432 0.2559 0.2929 ( 8650 PWs) bands (ev): -69.7692 -69.7692 -69.7622 -69.7622 -39.5361 -39.5361 -39.5181 -39.5181 -38.3714 -38.3714 -38.3498 -38.3498 -38.2807 -38.2807 -38.2651 -38.2651 -25.7764 -25.7764 -8.7426 -8.7426 -7.7018 -7.7018 -7.5390 -7.5390 -1.0698 -1.0698 -0.6290 -0.6290 4.4600 4.4600 5.0610 5.0610 6.2541 6.2541 6.3126 6.3126 6.4752 6.4752 6.6934 6.6934 7.6682 7.6682 7.8472 7.8472 8.0734 8.0734 8.2139 8.2139 8.6657 8.6657 9.0736 9.0736 9.1015 9.1015 9.2088 9.2088 9.5214 9.5214 10.4357 10.4357 k = 0.4545 0.2624 0.2929 ( 8650 PWs) bands (ev): -69.7693 -69.7693 -69.7620 -69.7620 -39.5358 -39.5358 -39.5184 -39.5184 -38.3711 -38.3711 -38.3501 -38.3501 -38.2804 -38.2804 -38.2652 -38.2652 -25.7762 -25.7762 -8.7438 -8.7438 -7.7037 -7.7037 -7.5389 -7.5389 -1.0666 -1.0666 -0.6187 -0.6187 4.4456 4.4456 5.0597 5.0597 6.2582 6.2582 6.3056 6.3056 6.4816 6.4816 6.6899 6.6899 7.6681 7.6681 7.8585 7.8585 8.0685 8.0685 8.1995 8.1995 8.6726 8.6726 9.0660 9.0660 9.0825 9.0825 9.2008 9.2008 9.5154 9.5154 10.4436 10.4436 k = 0.4659 0.2690 0.2929 ( 8646 PWs) bands (ev): -69.7691 -69.7691 -69.7618 -69.7618 -39.5355 -39.5355 -39.5187 -39.5187 -38.3709 -38.3709 -38.3504 -38.3504 -38.2802 -38.2802 -38.2653 -38.2653 -25.7761 -25.7761 -8.7448 -8.7448 -7.7051 -7.7051 -7.5387 -7.5387 -1.0641 -1.0641 -0.6105 -0.6105 4.4340 4.4340 5.0587 5.0587 6.2626 6.2626 6.2997 6.2997 6.4873 6.4873 6.6871 6.6871 7.6696 7.6696 7.8697 7.8697 8.0642 8.0642 8.1853 8.1853 8.6796 8.6796 9.0581 9.0581 9.0675 9.0675 9.1954 9.1954 9.5137 9.5137 10.4519 10.4519 k = 0.4773 0.2756 0.2929 ( 8654 PWs) bands (ev): -69.7695 -69.7695 -69.7623 -69.7623 -39.5354 -39.5354 -39.5189 -39.5189 -38.3708 -38.3708 -38.3506 -38.3506 -38.2801 -38.2801 -38.2654 -38.2654 -25.7760 -25.7760 -8.7455 -8.7455 -7.7062 -7.7062 -7.5386 -7.5386 -1.0624 -1.0624 -0.6047 -0.6047 4.4255 4.4255 5.0580 5.0580 6.2652 6.2652 6.2947 6.2947 6.4906 6.4906 6.6849 6.6849 7.6690 7.6690 7.8771 7.8771 8.0594 8.0594 8.1748 8.1748 8.6848 8.6848 9.0476 9.0476 9.0563 9.0563 9.1894 9.1894 9.5101 9.5101 10.4558 10.4558 k = 0.4886 0.2821 0.2929 ( 8664 PWs) bands (ev): -69.7701 -69.7701 -69.7628 -69.7628 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7459 -8.7459 -7.7068 -7.7068 -7.5385 -7.5385 -1.0613 -1.0613 -0.6012 -0.6012 4.4204 4.4204 5.0577 5.0577 6.2671 6.2671 6.2912 6.2912 6.4926 6.4926 6.6830 6.6830 7.6668 7.6668 7.8816 7.8816 8.0545 8.0545 8.1688 8.1688 8.6842 8.6842 9.0383 9.0383 9.0514 9.0514 9.1865 9.1865 9.5077 9.5077 10.4577 10.4577 k = 0.5000 0.2887 0.2929 ( 8660 PWs) bands (ev): -69.7699 -69.7699 -69.7625 -69.7625 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0609 -1.0609 -0.6000 -0.6000 4.4189 4.4189 5.0576 5.0576 6.2681 6.2681 6.2902 6.2902 6.4933 6.4933 6.6824 6.6824 7.6667 7.6667 7.8843 7.8843 8.0540 8.0540 8.1705 8.1705 8.6846 8.6846 9.0346 9.0346 9.0527 9.0527 9.1861 9.1861 9.5075 9.5075 10.4584 10.4584 k = 0.5000 0.2887 0.2929 ( 8660 PWs) bands (ev): -69.7699 -69.7699 -69.7625 -69.7625 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0609 -1.0609 -0.6000 -0.6000 4.4189 4.4189 5.0576 5.0576 6.2681 6.2681 6.2902 6.2902 6.4933 6.4933 6.6824 6.6824 7.6667 7.6667 7.8843 7.8843 8.0540 8.0540 8.1705 8.1705 8.6846 8.6846 9.0346 9.0346 9.0527 9.0527 9.1861 9.1861 9.5075 9.5075 10.4584 10.4584 k = 0.4936 0.2998 0.2929 ( 8666 PWs) bands (ev): -69.7703 -69.7703 -69.7629 -69.7629 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7070 -7.7070 -7.5387 -7.5387 -1.0603 -1.0603 -0.6003 -0.6003 4.4204 4.4204 5.0580 5.0580 6.2671 6.2671 6.2894 6.2894 6.4915 6.4915 6.6812 6.6812 7.6657 7.6657 7.8844 7.8844 8.0532 8.0532 8.1662 8.1662 8.6847 8.6847 9.0248 9.0248 9.0609 9.0609 9.1844 9.1844 9.5091 9.5091 10.4536 10.4536 k = 0.4872 0.3109 0.2929 ( 8650 PWs) bands (ev): -69.7693 -69.7693 -69.7620 -69.7620 -39.5351 -39.5351 -39.5192 -39.5192 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7460 -8.7460 -7.7068 -7.7068 -7.5393 -7.5393 -1.0584 -1.0584 -0.6011 -0.6011 4.4249 4.4249 5.0593 5.0593 6.2641 6.2641 6.2911 6.2911 6.4884 6.4884 6.6786 6.6786 7.6683 7.6683 7.8864 7.8864 8.0553 8.0553 8.1593 8.1593 8.6913 8.6913 9.0140 9.0140 9.0755 9.0755 9.1878 9.1878 9.5168 9.5168 10.4453 10.4453 k = 0.4808 0.3220 0.2929 ( 8654 PWs) bands (ev): -69.7695 -69.7695 -69.7623 -69.7623 -39.5351 -39.5351 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7460 -8.7460 -7.7065 -7.7065 -7.5402 -7.5402 -1.0553 -1.0553 -0.6024 -0.6024 4.4318 4.4318 5.0611 5.0611 6.2587 6.2587 6.2913 6.2913 6.4832 6.4832 6.6731 6.6731 7.6697 7.6697 7.8871 7.8871 8.0561 8.0561 8.1405 8.1405 8.6938 8.6938 8.9972 8.9972 9.0860 9.0860 9.1892 9.1892 9.5254 9.5254 10.4309 10.4309 k = 0.4744 0.3331 0.2929 ( 8658 PWs) bands (ev): -69.7696 -69.7696 -69.7626 -69.7626 -39.5350 -39.5350 -39.5193 -39.5193 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7758 -25.7758 -8.7461 -8.7461 -7.7061 -7.7061 -7.5415 -7.5415 -1.0510 -1.0510 -0.6042 -0.6042 4.4418 4.4418 5.0637 5.0637 6.2506 6.2506 6.2915 6.2915 6.4759 6.4759 6.6650 6.6650 7.6702 7.6702 7.8886 7.8886 8.0581 8.0581 8.1215 8.1215 8.6949 8.6949 8.9785 8.9785 9.0943 9.0943 9.1907 9.1907 9.5368 9.5368 10.4119 10.4119 k = 0.4679 0.3442 0.2929 ( 8662 PWs) bands (ev): -69.7697 -69.7697 -69.7630 -69.7630 -39.5349 -39.5349 -39.5194 -39.5194 -38.3705 -38.3705 -38.3510 -38.3510 -38.2800 -38.2800 -38.2655 -38.2655 -25.7757 -25.7757 -8.7461 -8.7461 -7.7056 -7.7056 -7.5432 -7.5432 -1.0454 -1.0454 -0.6066 -0.6066 4.4547 4.4547 5.0670 5.0670 6.2397 6.2397 6.2914 6.2914 6.4673 6.4673 6.6551 6.6551 7.6696 7.6696 7.8899 7.8899 8.0586 8.0586 8.0988 8.0988 8.6982 8.6982 8.9615 8.9615 9.1017 9.1017 9.1944 9.1944 9.5491 9.5491 10.3887 10.3887 k = 0.4615 0.3553 0.2929 ( 8668 PWs) bands (ev): -69.7702 -69.7702 -69.7631 -69.7631 -39.5348 -39.5348 -39.5196 -39.5196 -38.3705 -38.3705 -38.3511 -38.3511 -38.2800 -38.2800 -38.2655 -38.2655 -25.7756 -25.7756 -8.7461 -8.7461 -7.7050 -7.7050 -7.5451 -7.5451 -1.0387 -1.0387 -0.6096 -0.6096 4.4704 4.4704 5.0710 5.0710 6.2254 6.2254 6.2898 6.2898 6.4592 6.4592 6.6432 6.6432 7.6693 7.6693 7.8938 7.8938 8.0533 8.0533 8.0759 8.0759 8.7028 8.7028 8.9445 8.9445 9.1064 9.1064 9.1958 9.1958 9.5620 9.5620 10.3656 10.3656 k = 0.4551 0.3664 0.2929 ( 8658 PWs) bands (ev): -69.7696 -69.7696 -69.7626 -69.7626 -39.5346 -39.5346 -39.5198 -39.5198 -38.3704 -38.3704 -38.3511 -38.3511 -38.2799 -38.2799 -38.2655 -38.2655 -25.7755 -25.7755 -8.7462 -8.7462 -7.7044 -7.7044 -7.5474 -7.5474 -1.0308 -1.0308 -0.6129 -0.6129 4.4888 4.4888 5.0757 5.0757 6.2071 6.2071 6.2908 6.2908 6.4516 6.4516 6.6295 6.6295 7.6707 7.6707 7.8981 7.8981 8.0352 8.0352 8.0705 8.0705 8.7084 8.7084 8.9308 8.9308 9.1101 9.1101 9.2049 9.2049 9.5776 9.5776 10.3415 10.3415 k = 0.4487 0.3775 0.2929 ( 8670 PWs) bands (ev): -69.7700 -69.7700 -69.7635 -69.7635 -39.5344 -39.5344 -39.5200 -39.5200 -38.3703 -38.3703 -38.3512 -38.3512 -38.2799 -38.2799 -38.2655 -38.2655 -25.7754 -25.7754 -8.7462 -8.7462 -7.7036 -7.7036 -7.5499 -7.5499 -1.0219 -1.0219 -0.6170 -0.6170 4.5098 4.5098 5.0808 5.0808 6.1839 6.1839 6.2883 6.2883 6.4441 6.4441 6.6140 6.6140 7.6713 7.6713 7.8988 7.8988 8.0068 8.0068 8.0692 8.0692 8.7119 8.7119 8.9131 8.9131 9.1085 9.1085 9.2118 9.2118 9.5869 9.5869 10.3139 10.3139 k = 0.4423 0.3886 0.2929 ( 8670 PWs) bands (ev): -69.7698 -69.7698 -69.7637 -69.7637 -39.5342 -39.5342 -39.5202 -39.5202 -38.3702 -38.3702 -38.3513 -38.3513 -38.2799 -38.2799 -38.2655 -38.2655 -25.7753 -25.7753 -8.7463 -8.7463 -7.7028 -7.7028 -7.5526 -7.5526 -1.0120 -1.0120 -0.6214 -0.6214 4.5335 4.5335 5.0864 5.0864 6.1568 6.1568 6.2869 6.2869 6.4382 6.4382 6.5973 6.5973 7.6722 7.6722 7.9025 7.9025 7.9790 7.9790 8.0716 8.0716 8.7177 8.7177 8.8960 8.8960 9.1055 9.1055 9.2203 9.2203 9.5964 9.5964 10.2902 10.2902 k = 0.4359 0.3997 0.2929 ( 8670 PWs) bands (ev): -69.7693 -69.7693 -69.7643 -69.7643 -39.5340 -39.5340 -39.5204 -39.5204 -38.3702 -38.3702 -38.3514 -38.3514 -38.2799 -38.2799 -38.2655 -38.2655 -25.7752 -25.7752 -8.7464 -8.7464 -7.7019 -7.7019 -7.5555 -7.5555 -1.0011 -1.0011 -0.6264 -0.6264 4.5596 4.5596 5.0922 5.0922 6.1248 6.1248 6.2859 6.2859 6.4334 6.4334 6.5796 6.5796 7.6739 7.6739 7.9008 7.9008 7.9527 7.9527 8.0774 8.0774 8.7232 8.7232 8.8801 8.8801 9.1034 9.1034 9.2304 9.2304 9.6045 9.6045 10.2624 10.2624 k = 0.4295 0.4108 0.2929 ( 8676 PWs) bands (ev): -69.7691 -69.7691 -69.7651 -69.7651 -39.5337 -39.5337 -39.5207 -39.5207 -38.3701 -38.3701 -38.3516 -38.3516 -38.2798 -38.2798 -38.2655 -38.2655 -25.7751 -25.7751 -8.7465 -8.7465 -7.7010 -7.7010 -7.5585 -7.5585 -0.9893 -0.9893 -0.6320 -0.6320 4.5883 4.5883 5.0984 5.0984 6.0888 6.0888 6.2822 6.2822 6.4298 6.4298 6.5610 6.5610 7.6749 7.6749 7.8912 7.8912 7.9371 7.9371 8.0789 8.0789 8.7295 8.7295 8.8650 8.8650 9.0974 9.0974 9.2391 9.2391 9.6072 9.6072 10.2382 10.2382 k = 0.4231 0.4219 0.2929 ( 8670 PWs) bands (ev): -69.7685 -69.7685 -69.7651 -69.7651 -39.5335 -39.5335 -39.5210 -39.5210 -38.3700 -38.3700 -38.3517 -38.3517 -38.2798 -38.2798 -38.2655 -38.2655 -25.7750 -25.7750 -8.7466 -8.7466 -7.7001 -7.7001 -7.5617 -7.5617 -0.9767 -0.9767 -0.6380 -0.6380 4.6196 4.6196 5.1048 5.1048 6.0490 6.0490 6.2801 6.2801 6.4280 6.4280 6.5423 6.5423 7.6734 7.6734 7.8710 7.8710 7.9360 7.9360 8.0843 8.0843 8.7353 8.7353 8.8510 8.8510 9.0948 9.0948 9.2525 9.2525 9.6103 9.6103 10.2155 10.2155 k = 0.4167 0.4330 0.2929 ( 8674 PWs) bands (ev): -69.7689 -69.7689 -69.7652 -69.7652 -39.5332 -39.5332 -39.5213 -39.5213 -38.3699 -38.3699 -38.3518 -38.3518 -38.2797 -38.2797 -38.2656 -38.2656 -25.7748 -25.7748 -8.7467 -8.7467 -7.6991 -7.6991 -7.5648 -7.5648 -0.9634 -0.9634 -0.6446 -0.6446 4.6525 4.6525 5.1111 5.1111 6.0067 6.0067 6.2754 6.2754 6.4268 6.4268 6.5239 6.5239 7.6743 7.6743 7.8454 7.8454 7.9389 7.9389 8.0851 8.0851 8.7433 8.7433 8.8400 8.8400 9.0841 9.0841 9.2637 9.2637 9.6063 9.6063 10.1954 10.1954 k = 0.4103 0.4441 0.2929 ( 8664 PWs) bands (ev): -69.7684 -69.7684 -69.7646 -69.7646 -39.5328 -39.5328 -39.5217 -39.5217 -38.3697 -38.3697 -38.3520 -38.3520 -38.2797 -38.2797 -38.2656 -38.2656 -25.7747 -25.7747 -8.7469 -8.7469 -7.6982 -7.6982 -7.5679 -7.5679 -0.9494 -0.9494 -0.6516 -0.6516 4.6876 4.6876 5.1174 5.1174 5.9622 5.9622 6.2713 6.2713 6.4265 6.4265 6.5063 6.5063 7.6780 7.6780 7.8231 7.8231 7.9454 7.9454 8.0868 8.0868 8.7549 8.7549 8.8297 8.8297 9.0749 9.0749 9.2760 9.2760 9.6023 9.6023 10.1788 10.1788 k = 0.4038 0.4552 0.2929 ( 8660 PWs) bands (ev): -69.7686 -69.7686 -69.7640 -69.7640 -39.5325 -39.5325 -39.5221 -39.5221 -38.3696 -38.3696 -38.3521 -38.3521 -38.2796 -38.2796 -38.2656 -38.2656 -25.7746 -25.7746 -8.7470 -8.7470 -7.6973 -7.6973 -7.5710 -7.5710 -0.9349 -0.9349 -0.6591 -0.6591 4.7244 4.7244 5.1236 5.1236 5.9161 5.9161 6.2657 6.2657 6.4266 6.4266 6.4899 6.4899 7.6790 7.6790 7.8004 7.8004 7.9521 7.9521 8.0861 8.0861 8.7645 8.7645 8.8224 8.8224 9.0623 9.0623 9.2868 9.2868 9.5954 9.5954 10.1666 10.1666 k = 0.3974 0.4663 0.2929 ( 8660 PWs) bands (ev): -69.7684 -69.7684 -69.7641 -69.7641 -39.5321 -39.5321 -39.5224 -39.5224 -38.3695 -38.3695 -38.3523 -38.3523 -38.2796 -38.2796 -38.2656 -38.2656 -25.7745 -25.7745 -8.7472 -8.7472 -7.6965 -7.6965 -7.5740 -7.5740 -0.9200 -0.9200 -0.6671 -0.6671 4.7629 4.7629 5.1291 5.1291 5.8681 5.8681 6.2584 6.2584 6.4273 6.4273 6.4751 6.4751 7.6812 7.6812 7.7789 7.7789 7.9583 7.9583 8.0858 8.0858 8.7734 8.7734 8.8132 8.8132 9.0506 9.0506 9.2964 9.2964 9.5859 9.5859 10.1525 10.1525 k = 0.3910 0.4774 0.2929 ( 8672 PWs) bands (ev): -69.7690 -69.7690 -69.7650 -69.7650 -39.5317 -39.5317 -39.5229 -39.5229 -38.3694 -38.3694 -38.3525 -38.3525 -38.2795 -38.2795 -38.2657 -38.2657 -25.7743 -25.7743 -8.7474 -8.7474 -7.6958 -7.6958 -7.5768 -7.5768 -0.9048 -0.9048 -0.6756 -0.6756 4.8028 4.8028 5.1338 5.1338 5.8190 5.8190 6.2494 6.2494 6.4278 6.4278 6.4622 6.4622 7.6787 7.6787 7.7599 7.7599 7.9639 7.9639 8.0835 8.0835 8.7787 8.7787 8.8033 8.8033 9.0356 9.0356 9.3052 9.3052 9.5713 9.5713 10.1390 10.1390 k = 0.3846 0.4885 0.2929 ( 8668 PWs) bands (ev): -69.7684 -69.7684 -69.7651 -69.7651 -39.5313 -39.5313 -39.5233 -39.5233 -38.3692 -38.3692 -38.3526 -38.3526 -38.2795 -38.2795 -38.2657 -38.2657 -25.7742 -25.7742 -8.7476 -8.7476 -7.6951 -7.6951 -7.5794 -7.5794 -0.8893 -0.8893 -0.6845 -0.6845 4.8439 4.8439 5.1379 5.1379 5.7703 5.7703 6.2398 6.2398 6.4285 6.4285 6.4517 6.4517 7.6791 7.6791 7.7466 7.7466 7.9713 7.9713 8.0829 8.0829 8.7817 8.7817 8.8030 8.8030 9.0236 9.0236 9.3156 9.3156 9.5567 9.5567 10.1304 10.1304 k = 0.3782 0.4996 0.2929 ( 8672 PWs) bands (ev): -69.7683 -69.7683 -69.7657 -69.7657 -39.5309 -39.5309 -39.5237 -39.5237 -38.3691 -38.3691 -38.3528 -38.3528 -38.2794 -38.2794 -38.2657 -38.2657 -25.7741 -25.7741 -8.7478 -8.7478 -7.6946 -7.6946 -7.5817 -7.5817 -0.8737 -0.8737 -0.6939 -0.6939 4.8857 4.8857 5.1408 5.1408 5.7214 5.7214 6.2293 6.2293 6.4291 6.4291 6.4434 6.4434 7.6757 7.6757 7.7353 7.7353 7.9765 7.9765 8.0803 8.0803 8.7782 8.7782 8.8110 8.8110 9.0091 9.0091 9.3265 9.3265 9.5404 9.5404 10.1209 10.1209 k = 0.3718 0.5107 0.2929 ( 8678 PWs) bands (ev): -69.7684 -69.7684 -69.7662 -69.7662 -39.5304 -39.5304 -39.5242 -39.5242 -38.3690 -38.3690 -38.3529 -38.3529 -38.2794 -38.2794 -38.2658 -38.2658 -25.7740 -25.7740 -8.7480 -8.7480 -7.6941 -7.6941 -7.5838 -7.5838 -0.8582 -0.8582 -0.7037 -0.7037 4.9277 4.9277 5.1425 5.1425 5.6742 5.6742 6.2184 6.2184 6.4296 6.4296 6.4366 6.4366 7.6697 7.6697 7.7284 7.7284 7.9837 7.9837 8.0763 8.0763 8.7728 8.7728 8.8211 8.8211 8.9923 8.9923 9.3370 9.3370 9.5209 9.5209 10.1143 10.1143 k = 0.3654 0.5218 0.2929 ( 8670 PWs) bands (ev): -69.7678 -69.7678 -69.7659 -69.7659 -39.5299 -39.5299 -39.5247 -39.5247 -38.3689 -38.3689 -38.3530 -38.3530 -38.2793 -38.2793 -38.2658 -38.2658 -25.7739 -25.7739 -8.7482 -8.7482 -7.6938 -7.6938 -7.5855 -7.5855 -0.8428 -0.8428 -0.7139 -0.7139 4.9693 4.9693 5.1429 5.1429 5.6297 5.6297 6.2083 6.2083 6.4298 6.4298 6.4328 6.4328 7.6646 7.6646 7.7275 7.7275 7.9930 7.9930 8.0729 8.0729 8.7698 8.7698 8.8341 8.8341 8.9787 8.9787 9.3486 9.3486 9.5035 9.5035 10.1120 10.1120 k = 0.3590 0.5329 0.2929 ( 8660 PWs) bands (ev): -69.7667 -69.7667 -69.7659 -69.7659 -39.5295 -39.5295 -39.5252 -39.5252 -38.3688 -38.3688 -38.3531 -38.3531 -38.2793 -38.2793 -38.2658 -38.2658 -25.7738 -25.7738 -8.7484 -8.7484 -7.6935 -7.6935 -7.5870 -7.5870 -0.8277 -0.8277 -0.7245 -0.7245 5.0094 5.0094 5.1421 5.1421 5.5883 5.5883 6.1991 6.1991 6.4287 6.4287 6.4319 6.4319 7.6598 7.6598 7.7281 7.7281 8.0025 8.0025 8.0682 8.0682 8.7682 8.7682 8.8490 8.8490 8.9645 8.9645 9.3623 9.3623 9.4876 9.4876 10.1102 10.1102 k = 0.3526 0.5440 0.2929 ( 8662 PWs) bands (ev): -69.7668 -69.7668 -69.7661 -69.7661 -39.5290 -39.5290 -39.5257 -39.5257 -38.3687 -38.3687 -38.3532 -38.3532 -38.2792 -38.2792 -38.2658 -38.2658 -25.7738 -25.7738 -8.7486 -8.7486 -7.6934 -7.6934 -7.5881 -7.5881 -0.8132 -0.8132 -0.7354 -0.7354 5.0464 5.0464 5.1394 5.1394 5.5517 5.5517 6.1912 6.1912 6.4272 6.4272 6.4316 6.4316 7.6534 7.6534 7.7264 7.7264 8.0107 8.0107 8.0621 8.0621 8.7657 8.7657 8.8618 8.8618 8.9493 8.9493 9.3737 9.3737 9.4696 9.4696 10.1084 10.1084 k = 0.3462 0.5551 0.2929 ( 8662 PWs) bands (ev): -69.7667 -69.7667 -69.7661 -69.7661 -39.5284 -39.5284 -39.5262 -39.5262 -38.3686 -38.3686 -38.3533 -38.3533 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7487 -8.7487 -7.6933 -7.6933 -7.5889 -7.5889 -0.7993 -0.7993 -0.7466 -0.7466 5.0783 5.0783 5.1354 5.1354 5.5220 5.5220 6.1853 6.1853 6.4267 6.4267 6.4312 6.4312 7.6488 7.6488 7.7265 7.7265 8.0197 8.0197 8.0549 8.0549 8.7652 8.7652 8.8751 8.8751 8.9341 8.9341 9.3858 9.3858 9.4528 9.4528 10.1063 10.1063 k = 0.3397 0.5662 0.2929 ( 8666 PWs) bands (ev): -69.7668 -69.7668 -69.7665 -69.7665 -39.5279 -39.5279 -39.5268 -39.5268 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5893 -7.5893 -0.7867 -0.7867 -0.7574 -0.7574 5.1013 5.1013 5.1308 5.1308 5.5022 5.5022 6.1816 6.1816 6.4270 6.4270 6.4302 6.4302 7.6460 7.6460 7.7256 7.7256 8.0278 8.0278 8.0465 8.0465 8.7631 8.7631 8.8871 8.8871 8.9201 8.9201 9.3956 9.3956 9.4390 9.4390 10.1050 10.1050 k = 0.3333 0.5774 0.2929 ( 8670 PWs) bands (ev): -69.7669 -69.7669 -69.7669 -69.7669 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7794 -0.7794 -0.7641 -0.7641 5.1098 5.1098 5.1287 5.1287 5.4946 5.4946 6.1804 6.1804 6.4281 6.4281 6.4290 6.4290 7.6456 7.6456 7.7251 7.7251 8.0331 8.0331 8.0400 8.0400 8.7621 8.7621 8.8948 8.8948 8.9110 8.9110 9.4004 9.4004 9.4331 9.4331 10.1013 10.1013 k = 0.3333 0.5774 0.2929 ( 8670 PWs) bands (ev): -69.7669 -69.7669 -69.7669 -69.7669 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7794 -0.7794 -0.7641 -0.7641 5.1098 5.1098 5.1287 5.1287 5.4946 5.4946 6.1804 6.1804 6.4281 6.4281 6.4290 6.4290 7.6456 7.6456 7.7251 7.7251 8.0331 8.0331 8.0400 8.0400 8.7621 8.7621 8.8948 8.8948 8.9110 8.9110 9.4004 9.4004 9.4331 9.4331 10.1013 10.1013 k = 0.3268 0.5660 0.2929 ( 8664 PWs) bands (ev): -69.7668 -69.7668 -69.7663 -69.7663 -39.5279 -39.5279 -39.5267 -39.5267 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5893 -7.5893 -0.7867 -0.7867 -0.7575 -0.7575 5.1046 5.1046 5.1274 5.1274 5.5023 5.5023 6.1817 6.1817 6.4265 6.4265 6.4309 6.4309 7.6476 7.6476 7.7255 7.7255 8.0266 8.0266 8.0479 8.0479 8.7629 8.7629 8.8872 8.8872 8.9213 8.9213 9.3966 9.3966 9.4393 9.4393 10.1042 10.1042 k = 0.3203 0.5547 0.2929 ( 8660 PWs) bands (ev): -69.7666 -69.7666 -69.7660 -69.7660 -39.5285 -39.5285 -39.5261 -39.5261 -38.3687 -38.3687 -38.3533 -38.3533 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7487 -8.7487 -7.6932 -7.6932 -7.5889 -7.5889 -0.7988 -0.7988 -0.7475 -0.7475 5.0940 5.0940 5.1189 5.1189 5.5235 5.5235 6.1857 6.1857 6.4239 6.4239 6.4335 6.4335 7.6503 7.6503 7.7265 7.7265 8.0173 8.0173 8.0581 8.0581 8.7624 8.7624 8.8765 8.8765 8.9359 8.9359 9.3874 9.3874 9.4522 9.4522 10.1070 10.1070 k = 0.3137 0.5434 0.2929 ( 8656 PWs) bands (ev): -69.7664 -69.7664 -69.7658 -69.7658 -39.5291 -39.5291 -39.5255 -39.5255 -38.3687 -38.3687 -38.3532 -38.3532 -38.2792 -38.2792 -38.2658 -38.2658 -25.7738 -25.7738 -8.7485 -8.7485 -7.6931 -7.6931 -7.5882 -7.5882 -0.8118 -0.8118 -0.7380 -0.7380 5.0811 5.0811 5.1039 5.1039 5.5545 5.5545 6.1922 6.1922 6.4207 6.4207 6.4370 6.4370 7.6544 7.6544 7.7280 7.7280 8.0063 8.0063 8.0695 8.0695 8.7629 8.7629 8.8677 8.8677 8.9503 8.9503 9.3798 9.3798 9.4665 9.4665 10.1082 10.1082 k = 0.3072 0.5321 0.2929 ( 8664 PWs) bands (ev): -69.7671 -69.7671 -69.7659 -69.7659 -39.5297 -39.5297 -39.5249 -39.5249 -38.3689 -38.3689 -38.3531 -38.3531 -38.2793 -38.2793 -38.2658 -38.2658 -25.7739 -25.7739 -8.7482 -8.7482 -7.6928 -7.6928 -7.5874 -7.5874 -0.8253 -0.8253 -0.7297 -0.7297 5.0661 5.0661 5.0855 5.0855 5.5921 5.5921 6.2011 6.2011 6.4166 6.4166 6.4405 6.4405 7.6572 7.6572 7.7273 7.7273 7.9925 7.9925 8.0807 8.0807 8.7563 8.7563 8.8612 8.8612 8.9631 8.9631 9.3718 9.3718 9.4811 9.4811 10.1082 10.1082 k = 0.3007 0.5207 0.2929 ( 8660 PWs) bands (ev): -69.7671 -69.7671 -69.7655 -69.7655 -39.5303 -39.5303 -39.5243 -39.5243 -38.3690 -38.3690 -38.3528 -38.3528 -38.2794 -38.2794 -38.2657 -38.2657 -25.7740 -25.7740 -8.7477 -8.7477 -7.6924 -7.6924 -7.5863 -7.5863 -0.8391 -0.8391 -0.7228 -0.7228 5.0495 5.0495 5.0666 5.0666 5.6337 5.6337 6.2122 6.2122 6.4118 6.4118 6.4453 6.4453 7.6654 7.6654 7.7288 7.7288 7.9804 7.9804 8.0923 8.0923 8.7522 8.7522 8.8608 8.8608 8.9759 8.9759 9.3703 9.3703 9.4965 9.4965 10.1083 10.1083 k = 0.2941 0.5094 0.2929 ( 8668 PWs) bands (ev): -69.7678 -69.7678 -69.7657 -69.7657 -39.5310 -39.5310 -39.5236 -39.5236 -38.3692 -38.3692 -38.3526 -38.3526 -38.2795 -38.2795 -38.2656 -38.2656 -25.7741 -25.7741 -8.7472 -8.7472 -7.6919 -7.6919 -7.5852 -7.5852 -0.8531 -0.8531 -0.7175 -0.7175 5.0313 5.0313 5.0485 5.0485 5.6780 5.6780 6.2253 6.2253 6.4058 6.4058 6.4502 6.4502 7.6684 7.6684 7.7320 7.7320 7.9670 7.9670 8.1031 8.1031 8.7404 8.7404 8.8629 8.8629 8.9869 8.9869 9.3682 9.3682 9.5108 9.5108 10.1083 10.1083 k = 0.2876 0.4981 0.2929 ( 8656 PWs) bands (ev): -69.7678 -69.7678 -69.7644 -69.7644 -39.5316 -39.5316 -39.5230 -39.5230 -38.3694 -38.3694 -38.3523 -38.3523 -38.2797 -38.2797 -38.2656 -38.2656 -25.7743 -25.7743 -8.7465 -8.7465 -7.6911 -7.6911 -7.5838 -7.5838 -0.8674 -0.8674 -0.7137 -0.7137 5.0135 5.0135 5.0317 5.0317 5.7236 5.7236 6.2403 6.2403 6.3998 6.3998 6.4566 6.4566 7.6744 7.6744 7.7380 7.7380 7.9542 7.9542 8.1172 8.1172 8.7333 8.7333 8.8702 8.8702 9.0026 9.0026 9.3739 9.3739 9.5287 9.5287 10.1111 10.1111 k = 0.2810 0.4868 0.2929 ( 8656 PWs) bands (ev): -69.7681 -69.7681 -69.7641 -69.7641 -39.5322 -39.5322 -39.5223 -39.5223 -38.3697 -38.3697 -38.3520 -38.3520 -38.2798 -38.2798 -38.2655 -38.2655 -25.7745 -25.7745 -8.7457 -8.7457 -7.6901 -7.6901 -7.5824 -7.5824 -0.8819 -0.8819 -0.7117 -0.7117 4.9967 4.9967 5.0158 5.0158 5.7691 5.7691 6.2565 6.2565 6.3928 6.3928 6.4631 6.4631 7.6762 7.6762 7.7448 7.7448 7.9419 7.9419 8.1309 8.1309 8.7212 8.7212 8.8790 8.8790 9.0156 9.0156 9.3785 9.3785 9.5451 9.5451 10.1123 10.1123 k = 0.2745 0.4755 0.2929 ( 8648 PWs) bands (ev): -69.7677 -69.7677 -69.7636 -69.7636 -39.5328 -39.5328 -39.5216 -39.5216 -38.3700 -38.3700 -38.3516 -38.3516 -38.2800 -38.2800 -38.2653 -38.2653 -25.7747 -25.7747 -8.7447 -8.7447 -7.6889 -7.6889 -7.5809 -7.5809 -0.8965 -0.8965 -0.7114 -0.7114 4.9821 4.9821 5.0008 5.0008 5.8139 5.8139 6.2738 6.2738 6.3853 6.3853 6.4704 6.4704 7.6774 7.6774 7.7573 7.7573 7.9288 7.9288 8.1458 8.1458 8.7098 8.7098 8.8951 8.8951 9.0284 9.0284 9.3887 9.3887 9.5624 9.5624 10.1131 10.1131 k = 0.2680 0.4641 0.2929 ( 8660 PWs) bands (ev): -69.7685 -69.7685 -69.7641 -69.7641 -39.5335 -39.5335 -39.5210 -39.5210 -38.3703 -38.3703 -38.3511 -38.3511 -38.2803 -38.2803 -38.2652 -38.2652 -25.7750 -25.7750 -8.7435 -8.7435 -7.6874 -7.6874 -7.5794 -7.5794 -0.9113 -0.9113 -0.7131 -0.7131 4.9693 4.9693 4.9865 4.9865 5.8565 5.8565 6.2912 6.2912 6.3765 6.3765 6.4780 6.4780 7.6744 7.6744 7.7721 7.7721 7.9138 7.9138 8.1586 8.1586 8.6971 8.6971 8.9075 8.9075 9.0388 9.0388 9.3959 9.3959 9.5773 9.5773 10.1069 10.1069 k = 0.2614 0.4528 0.2929 ( 8670 PWs) bands (ev): -69.7691 -69.7691 -69.7646 -69.7646 -39.5341 -39.5341 -39.5203 -39.5203 -38.3707 -38.3707 -38.3507 -38.3507 -38.2805 -38.2805 -38.2651 -38.2651 -25.7753 -25.7753 -8.7422 -8.7422 -7.6857 -7.6857 -7.5778 -7.5778 -0.9263 -0.9263 -0.7166 -0.7166 4.9587 4.9587 4.9740 4.9740 5.8981 5.8981 6.3086 6.3086 6.3673 6.3673 6.4863 6.4863 7.6723 7.6723 7.7892 7.7892 7.9004 7.9004 8.1715 8.1715 8.6826 8.6826 8.9215 8.9215 9.0487 9.0487 9.4056 9.4056 9.5921 9.5921 10.1032 10.1032 k = 0.2549 0.4415 0.2929 ( 8672 PWs) bands (ev): -69.7695 -69.7695 -69.7645 -69.7645 -39.5348 -39.5348 -39.5196 -39.5196 -38.3711 -38.3711 -38.3502 -38.3502 -38.2808 -38.2808 -38.2649 -38.2649 -25.7756 -25.7756 -8.7408 -8.7408 -7.6837 -7.6837 -7.5761 -7.5761 -0.9413 -0.9413 -0.7220 -0.7220 4.9493 4.9493 4.9645 4.9645 5.9383 5.9383 6.3257 6.3257 6.3581 6.3581 6.4961 6.4961 7.6702 7.6702 7.8078 7.8078 7.8895 7.8895 8.1862 8.1862 8.6699 8.6699 8.9385 8.9385 9.0598 9.0598 9.4205 9.4205 9.6068 9.6068 10.1008 10.1008 k = 0.2484 0.4302 0.2929 ( 8668 PWs) bands (ev): -69.7696 -69.7696 -69.7640 -69.7640 -39.5354 -39.5354 -39.5189 -39.5189 -38.3715 -38.3715 -38.3496 -38.3496 -38.2811 -38.2811 -38.2647 -38.2647 -25.7760 -25.7760 -8.7391 -8.7391 -7.6815 -7.6815 -7.5744 -7.5744 -0.9563 -0.9563 -0.7293 -0.7293 4.9403 4.9403 4.9594 4.9594 5.9757 5.9757 6.3382 6.3382 6.3530 6.3530 6.5073 6.5073 7.6677 7.6677 7.8288 7.8288 7.8811 7.8811 8.2028 8.2028 8.6608 8.6608 8.9566 8.9566 9.0733 9.0733 9.4382 9.4382 9.6222 9.6222 10.0964 10.0964 k = 0.2418 0.4189 0.2929 ( 8672 PWs) bands (ev): -69.7702 -69.7702 -69.7638 -69.7638 -39.5360 -39.5360 -39.5182 -39.5182 -38.3719 -38.3719 -38.3490 -38.3490 -38.2815 -38.2815 -38.2645 -38.2645 -25.7763 -25.7763 -8.7373 -8.7373 -7.6790 -7.6790 -7.5727 -7.5727 -0.9714 -0.9714 -0.7384 -0.7384 4.9313 4.9313 4.9585 4.9585 6.0109 6.0109 6.3336 6.3336 6.3635 6.3635 6.5195 6.5195 7.6630 7.6630 7.8436 7.8436 7.8780 7.8780 8.2185 8.2185 8.6509 8.6509 8.9756 8.9756 9.0841 9.0841 9.4568 9.4568 9.6363 9.6363 10.0922 10.0922 k = 0.2353 0.4075 0.2929 ( 8672 PWs) bands (ev): -69.7705 -69.7705 -69.7635 -69.7635 -39.5367 -39.5367 -39.5175 -39.5175 -38.3723 -38.3723 -38.3484 -38.3484 -38.2819 -38.2819 -38.2643 -38.2643 -25.7768 -25.7768 -8.7353 -8.7353 -7.6762 -7.6762 -7.5710 -7.5710 -0.9866 -0.9866 -0.7495 -0.7495 4.9231 4.9231 4.9615 4.9615 6.0435 6.0435 6.3236 6.3236 6.3782 6.3782 6.5329 6.5329 7.6601 7.6601 7.8463 7.8463 7.8903 7.8903 8.2354 8.2354 8.6422 8.6422 8.9969 8.9969 9.0961 9.0961 9.4773 9.4773 9.6498 9.6498 10.0881 10.0881 k = 0.2288 0.3962 0.2929 ( 8670 PWs) bands (ev): -69.7704 -69.7704 -69.7634 -69.7634 -39.5373 -39.5373 -39.5168 -39.5168 -38.3728 -38.3728 -38.3478 -38.3478 -38.2823 -38.2823 -38.2641 -38.2641 -25.7772 -25.7772 -8.7332 -8.7332 -7.6732 -7.6732 -7.5693 -7.5693 -1.0017 -1.0017 -0.7623 -0.7623 4.9163 4.9163 4.9678 4.9678 6.0733 6.0733 6.3125 6.3125 6.3925 6.3925 6.5474 6.5474 7.6563 7.6563 7.8418 7.8418 7.9125 7.9125 8.2536 8.2536 8.6360 8.6360 9.0203 9.0203 9.1100 9.1100 9.4989 9.4989 9.6619 9.6619 10.0837 10.0837 k = 0.2222 0.3849 0.2929 ( 8684 PWs) bands (ev): -69.7713 -69.7713 -69.7639 -69.7639 -39.5379 -39.5379 -39.5162 -39.5162 -38.3733 -38.3733 -38.3471 -38.3471 -38.2827 -38.2827 -38.2639 -38.2639 -25.7777 -25.7777 -8.7309 -8.7309 -7.6700 -7.6700 -7.5675 -7.5675 -1.0168 -1.0168 -0.7769 -0.7769 4.9109 4.9109 4.9766 4.9766 6.0994 6.0994 6.3016 6.3016 6.4049 6.4049 6.5625 6.5625 7.6516 7.6516 7.8333 7.8333 7.9368 7.9368 8.2702 8.2702 8.6253 8.6253 9.0405 9.0405 9.1209 9.1209 9.5187 9.5187 9.6731 9.6731 10.0770 10.0770 k = 0.2157 0.3736 0.2929 ( 8668 PWs) bands (ev): -69.7703 -69.7703 -69.7631 -69.7631 -39.5385 -39.5385 -39.5154 -39.5154 -38.3737 -38.3737 -38.3464 -38.3464 -38.2832 -38.2832 -38.2637 -38.2637 -25.7782 -25.7782 -8.7285 -8.7285 -7.6665 -7.6665 -7.5657 -7.5657 -1.0319 -1.0319 -0.7931 -0.7931 4.9076 4.9076 4.9884 4.9884 6.1233 6.1233 6.2914 6.2914 6.4169 6.4169 6.5789 6.5789 7.6527 7.6527 7.8295 7.8295 7.9655 7.9655 8.2914 8.2914 8.6227 8.6227 9.0690 9.0690 9.1381 9.1381 9.5455 9.5455 9.6854 9.6854 10.0726 10.0726 k = 0.2092 0.3623 0.2929 ( 8680 PWs) bands (ev): -69.7712 -69.7712 -69.7636 -69.7636 -39.5392 -39.5392 -39.5148 -39.5148 -38.3742 -38.3742 -38.3457 -38.3457 -38.2837 -38.2837 -38.2635 -38.2635 -25.7787 -25.7787 -8.7259 -8.7259 -7.6629 -7.6629 -7.5639 -7.5639 -1.0469 -1.0469 -0.8109 -0.8109 4.9058 4.9058 5.0022 5.0022 6.1427 6.1427 6.2812 6.2812 6.4274 6.4274 6.5952 6.5952 7.6494 7.6494 7.8207 7.8207 7.9927 7.9927 8.3087 8.3087 8.6186 8.6186 9.0910 9.0910 9.1498 9.1498 9.5700 9.5700 9.6944 9.6944 10.0621 10.0621 k = 0.2026 0.3509 0.2929 ( 8680 PWs) bands (ev): -69.7715 -69.7715 -69.7633 -69.7633 -39.5398 -39.5398 -39.5141 -39.5141 -38.3746 -38.3746 -38.3449 -38.3449 -38.2842 -38.2842 -38.2632 -38.2632 -25.7792 -25.7792 -8.7233 -8.7233 -7.6590 -7.6590 -7.5619 -7.5619 -1.0617 -1.0617 -0.8301 -0.8301 4.9061 4.9061 5.0179 5.0179 6.1600 6.1600 6.2725 6.2725 6.4365 6.4365 6.6118 6.6118 7.6487 7.6487 7.8143 7.8143 8.0204 8.0204 8.3278 8.3278 8.6184 8.6184 9.1159 9.1159 9.1651 9.1651 9.5956 9.5956 9.7048 9.7048 10.0540 10.0540 k = 0.1961 0.3396 0.2929 ( 8676 PWs) bands (ev): -69.7719 -69.7719 -69.7624 -69.7624 -39.5403 -39.5403 -39.5134 -39.5134 -38.3751 -38.3751 -38.3441 -38.3441 -38.2847 -38.2847 -38.2630 -38.2630 -25.7798 -25.7798 -8.7205 -8.7205 -7.6551 -7.6551 -7.5600 -7.5600 -1.0765 -1.0765 -0.8507 -0.8507 4.9087 4.9087 5.0347 5.0347 6.1743 6.1743 6.2655 6.2655 6.4450 6.4450 6.6285 6.6285 7.6502 7.6502 7.8096 7.8096 8.0486 8.0486 8.3508 8.3508 8.6192 8.6192 9.1386 9.1386 9.1821 9.1821 9.6229 9.6229 9.7141 9.7141 10.0453 10.0453 k = 0.1895 0.3283 0.2929 ( 8668 PWs) bands (ev): -69.7718 -69.7718 -69.7615 -69.7615 -39.5409 -39.5409 -39.5127 -39.5127 -38.3755 -38.3755 -38.3433 -38.3433 -38.2853 -38.2853 -38.2627 -38.2627 -25.7804 -25.7804 -8.7176 -8.7176 -7.6510 -7.6510 -7.5579 -7.5579 -1.0911 -1.0911 -0.8724 -0.8724 4.9135 4.9135 5.0523 5.0523 6.1852 6.1852 6.2605 6.2605 6.4519 6.4519 6.6446 6.6446 7.6541 7.6541 7.8084 7.8084 8.0768 8.0768 8.3751 8.3751 8.6220 8.6220 9.1627 9.1627 9.2013 9.2013 9.6491 9.6491 9.7230 9.7230 10.0362 10.0362 k = 0.1830 0.3170 0.2929 ( 8662 PWs) bands (ev): -69.7722 -69.7722 -69.7605 -69.7605 -39.5415 -39.5415 -39.5121 -39.5121 -38.3760 -38.3760 -38.3425 -38.3425 -38.2858 -38.2858 -38.2625 -38.2625 -25.7809 -25.7809 -8.7147 -8.7147 -7.6468 -7.6468 -7.5556 -7.5556 -1.1056 -1.1056 -0.8953 -0.8953 4.9203 4.9203 5.0700 5.0700 6.1936 6.1936 6.2576 6.2576 6.4575 6.4575 6.6598 6.6598 7.6596 7.6596 7.8062 7.8062 8.1036 8.1036 8.3995 8.3995 8.6261 8.6261 9.1858 9.1858 9.2224 9.2224 9.6753 9.6753 9.7308 9.7308 10.0264 10.0264 k = 0.1765 0.3057 0.2929 ( 8674 PWs) bands (ev): -69.7734 -69.7734 -69.7606 -69.7606 -39.5420 -39.5420 -39.5115 -39.5115 -38.3765 -38.3765 -38.3417 -38.3417 -38.2864 -38.2864 -38.2623 -38.2623 -25.7816 -25.7816 -8.7116 -8.7116 -7.6427 -7.6427 -7.5533 -7.5533 -1.1199 -1.1199 -0.9191 -0.9191 4.9290 4.9290 5.0872 5.0872 6.1990 6.1990 6.2562 6.2562 6.4605 6.4605 6.6736 6.6736 7.6623 7.6623 7.8006 7.8006 8.1292 8.1292 8.4235 8.4235 8.6294 8.6294 9.2052 9.2052 9.2396 9.2396 9.6980 9.6980 9.7373 9.7373 10.0136 10.0136 k = 0.1699 0.2943 0.2929 ( 8678 PWs) bands (ev): -69.7737 -69.7737 -69.7607 -69.7607 -39.5426 -39.5426 -39.5108 -39.5108 -38.3769 -38.3769 -38.3409 -38.3409 -38.2870 -38.2870 -38.2620 -38.2620 -25.7822 -25.7822 -8.7086 -8.7086 -7.6385 -7.6385 -7.5507 -7.5507 -1.1340 -1.1340 -0.9437 -0.9437 4.9400 4.9400 5.1037 5.1037 6.2032 6.2032 6.2562 6.2562 6.4625 6.4625 6.6867 6.6867 7.6681 7.6681 7.8000 7.8000 8.1540 8.1540 8.4490 8.4490 8.6363 8.6363 9.2264 9.2264 9.2589 9.2589 9.7192 9.7192 9.7455 9.7455 10.0004 10.0004 k = 0.1634 0.2830 0.2929 ( 8674 PWs) bands (ev): -69.7739 -69.7739 -69.7600 -69.7600 -39.5431 -39.5431 -39.5102 -39.5102 -38.3774 -38.3774 -38.3401 -38.3401 -38.2877 -38.2877 -38.2618 -38.2618 -25.7828 -25.7828 -8.7055 -8.7055 -7.6344 -7.6344 -7.5479 -7.5479 -1.1479 -1.1479 -0.9690 -0.9690 4.9533 4.9533 5.1193 5.1193 6.2068 6.2068 6.2587 6.2587 6.4639 6.4639 6.6986 6.6986 7.6761 7.6761 7.8015 7.8015 8.1797 8.1797 8.4759 8.4759 8.6434 8.6434 9.2485 9.2485 9.2794 9.2794 9.7349 9.7349 9.7633 9.7633 9.9868 9.9868 k = 0.1569 0.2717 0.2929 ( 8666 PWs) bands (ev): -69.7739 -69.7739 -69.7591 -69.7591 -39.5436 -39.5436 -39.5096 -39.5096 -38.3778 -38.3778 -38.3392 -38.3392 -38.2883 -38.2883 -38.2615 -38.2615 -25.7834 -25.7834 -8.7024 -8.7024 -7.6304 -7.6304 -7.5449 -7.5449 -1.1615 -1.1615 -0.9947 -0.9947 4.9688 4.9688 5.1339 5.1339 6.2102 6.2102 6.2630 6.2630 6.4646 6.4646 6.7097 6.7097 7.6861 7.6861 7.8033 7.8033 8.2061 8.2061 8.5025 8.5025 8.6533 8.6533 9.2689 9.2689 9.2997 9.2997 9.7451 9.7451 9.7885 9.7885 9.9733 9.9733 k = 0.1503 0.2604 0.2929 ( 8656 PWs) bands (ev): -69.7735 -69.7735 -69.7583 -69.7583 -39.5441 -39.5441 -39.5090 -39.5090 -38.3782 -38.3782 -38.3383 -38.3383 -38.2889 -38.2889 -38.2613 -38.2613 -25.7841 -25.7841 -8.6994 -8.6994 -7.6266 -7.6266 -7.5416 -7.5416 -1.1748 -1.1748 -1.0208 -1.0208 4.9865 4.9865 5.1462 5.1462 6.2134 6.2134 6.2696 6.2696 6.4630 6.4630 6.7197 6.7197 7.6965 7.6965 7.8078 7.8078 8.2322 8.2322 8.5308 8.5308 8.6654 8.6654 9.2872 9.2872 9.3217 9.3217 9.7533 9.7533 9.8160 9.8160 9.9593 9.9593 k = 0.1438 0.2491 0.2929 ( 8652 PWs) bands (ev): -69.7736 -69.7736 -69.7577 -69.7577 -39.5446 -39.5446 -39.5084 -39.5084 -38.3786 -38.3786 -38.3375 -38.3375 -38.2896 -38.2896 -38.2610 -38.2610 -25.7847 -25.7847 -8.6963 -8.6963 -7.6230 -7.6230 -7.5380 -7.5380 -1.1878 -1.1878 -1.0470 -1.0470 5.0063 5.0063 5.1559 5.1559 6.2148 6.2148 6.2791 6.2791 6.4601 6.4601 6.7278 6.7278 7.7090 7.7090 7.8126 7.8126 8.2572 8.2572 8.5573 8.5573 8.6761 8.6761 9.3002 9.3002 9.3438 9.3438 9.7587 9.7587 9.8433 9.8433 9.9472 9.9472 k = 0.1373 0.2377 0.2929 ( 8650 PWs) bands (ev): -69.7738 -69.7738 -69.7573 -69.7573 -39.5450 -39.5450 -39.5078 -39.5078 -38.3790 -38.3790 -38.3366 -38.3366 -38.2902 -38.2902 -38.2608 -38.2608 -25.7853 -25.7853 -8.6933 -8.6933 -7.6196 -7.6196 -7.5341 -7.5341 -1.2004 -1.2004 -1.0733 -1.0733 5.0279 5.0279 5.1633 5.1633 6.2140 6.2140 6.2927 6.2927 6.4564 6.4564 6.7341 6.7341 7.7211 7.7211 7.8178 7.8178 8.2827 8.2827 8.5853 8.5853 8.6862 8.6862 9.3130 9.3130 9.3633 9.3633 9.7623 9.7623 9.8701 9.8701 9.9359 9.9359 k = 0.1307 0.2264 0.2929 ( 8646 PWs) bands (ev): -69.7735 -69.7735 -69.7571 -69.7571 -39.5455 -39.5455 -39.5073 -39.5073 -38.3794 -38.3794 -38.3357 -38.3357 -38.2909 -38.2909 -38.2606 -38.2606 -25.7860 -25.7860 -8.6904 -8.6904 -7.6165 -7.6165 -7.5299 -7.5299 -1.2127 -1.2127 -1.0995 -1.0995 5.0514 5.0514 5.1678 5.1678 6.2115 6.2115 6.3103 6.3103 6.4500 6.4500 6.7405 6.7405 7.7347 7.7347 7.8247 7.8247 8.3075 8.3075 8.6125 8.6125 8.6982 8.6982 9.3237 9.3237 9.3829 9.3829 9.7634 9.7634 9.8973 9.8973 9.9299 9.9299 k = 0.1242 0.2151 0.2929 ( 8662 PWs) bands (ev): -69.7745 -69.7745 -69.7579 -69.7579 -39.5459 -39.5459 -39.5068 -39.5068 -38.3798 -38.3798 -38.3349 -38.3349 -38.2916 -38.2916 -38.2604 -38.2604 -25.7866 -25.7866 -8.6876 -8.6876 -7.6137 -7.6137 -7.5254 -7.5254 -1.2247 -1.2247 -1.1255 -1.1255 5.0760 5.0760 5.1694 5.1694 6.2066 6.2066 6.3306 6.3306 6.4410 6.4410 6.7438 6.7438 7.7462 7.7462 7.8287 7.8287 8.3316 8.3316 8.6358 8.6358 8.7084 8.7084 9.3309 9.3309 9.3972 9.3972 9.7593 9.7593 9.9070 9.9070 9.9390 9.9390 k = 0.1176 0.2038 0.2929 ( 8662 PWs) bands (ev): -69.7748 -69.7748 -69.7576 -69.7576 -39.5463 -39.5463 -39.5063 -39.5063 -38.3802 -38.3802 -38.3340 -38.3340 -38.2923 -38.2923 -38.2602 -38.2602 -25.7872 -25.7872 -8.6848 -8.6848 -7.6112 -7.6112 -7.5206 -7.5206 -1.2363 -1.2363 -1.1510 -1.1510 5.1031 5.1031 5.1687 5.1687 6.2019 6.2019 6.3543 6.3543 6.4311 6.4311 6.7467 6.7467 7.7619 7.7619 7.8374 7.8374 8.3556 8.3556 8.6606 8.6606 8.7202 8.7202 9.3375 9.3375 9.4156 9.4156 9.7524 9.7524 9.9099 9.9099 9.9658 9.9658 k = 0.1111 0.1925 0.2929 ( 8658 PWs) bands (ev): -69.7746 -69.7746 -69.7572 -69.7572 -39.5467 -39.5467 -39.5058 -39.5058 -38.3805 -38.3805 -38.3332 -38.3332 -38.2930 -38.2930 -38.2600 -38.2600 -25.7878 -25.7878 -8.6821 -8.6821 -7.6090 -7.6090 -7.5157 -7.5157 -1.2474 -1.2474 -1.1760 -1.1760 5.1315 5.1315 5.1665 5.1665 6.1962 6.1962 6.3807 6.3807 6.4203 6.4203 6.7492 6.7492 7.7773 7.7773 7.8459 7.8459 8.3817 8.3817 8.6848 8.6848 8.7329 8.7329 9.3439 9.3439 9.4311 9.4311 9.7417 9.7417 9.9181 9.9181 9.9976 9.9976 k = 0.1046 0.1811 0.2929 ( 8658 PWs) bands (ev): -69.7748 -69.7748 -69.7570 -69.7570 -39.5471 -39.5471 -39.5053 -39.5053 -38.3808 -38.3808 -38.3323 -38.3323 -38.2937 -38.2937 -38.2598 -38.2598 -25.7884 -25.7884 -8.6796 -8.6796 -7.6070 -7.6070 -7.5106 -7.5106 -1.2581 -1.2581 -1.2003 -1.2003 5.1596 5.1596 5.1639 5.1639 6.1901 6.1901 6.4016 6.4016 6.4146 6.4146 6.7497 6.7497 7.7947 7.7947 7.8548 7.8548 8.4072 8.4072 8.7064 8.7064 8.7446 8.7446 9.3476 9.3476 9.4453 9.4453 9.7268 9.7268 9.9318 9.9318 10.0283 10.0283 k = 0.0980 0.1698 0.2929 ( 8654 PWs) bands (ev): -69.7750 -69.7750 -69.7564 -69.7564 -39.5474 -39.5474 -39.5049 -39.5049 -38.3811 -38.3811 -38.3315 -38.3315 -38.2944 -38.2944 -38.2596 -38.2596 -25.7889 -25.7889 -8.6771 -8.6771 -7.6053 -7.6053 -7.5054 -7.5054 -1.2685 -1.2685 -1.2236 -1.2236 5.1554 5.1554 5.1932 5.1932 6.1839 6.1839 6.3902 6.3902 6.4407 6.4407 6.7500 6.7500 7.8089 7.8089 7.8666 7.8666 8.4321 8.4321 8.7285 8.7285 8.7601 8.7601 9.3506 9.3506 9.4588 9.4588 9.7100 9.7100 9.9493 9.9493 10.0613 10.0613 k = 0.0915 0.1585 0.2929 ( 8642 PWs) bands (ev): -69.7746 -69.7746 -69.7553 -69.7553 -39.5478 -39.5478 -39.5045 -39.5045 -38.3814 -38.3814 -38.3306 -38.3306 -38.2951 -38.2951 -38.2594 -38.2594 -25.7895 -25.7895 -8.6748 -8.6748 -7.6038 -7.6038 -7.5001 -7.5001 -1.2785 -1.2785 -1.2459 -1.2459 5.1483 5.1483 5.2260 5.2260 6.1776 6.1776 6.3750 6.3750 6.4714 6.4714 6.7499 6.7499 7.8267 7.8267 7.8794 7.8794 8.4582 8.4582 8.7498 8.7498 8.7750 8.7750 9.3526 9.3526 9.4716 9.4716 9.6921 9.6921 9.9737 9.9737 10.0955 10.0955 k = 0.0850 0.1472 0.2929 ( 8638 PWs) bands (ev): -69.7744 -69.7744 -69.7550 -69.7550 -39.5481 -39.5481 -39.5041 -39.5041 -38.3817 -38.3817 -38.3298 -38.3298 -38.2957 -38.2957 -38.2592 -38.2592 -25.7900 -25.7900 -8.6727 -8.6727 -7.6025 -7.6025 -7.4949 -7.4949 -1.2887 -1.2887 -1.2665 -1.2665 5.1400 5.1400 5.2598 5.2598 6.1705 6.1705 6.3569 6.3569 6.5020 6.5020 6.7484 6.7484 7.8453 7.8453 7.8938 7.8938 8.4857 8.4857 8.7650 8.7650 8.7876 8.7876 9.3535 9.3535 9.4829 9.4829 9.6716 9.6716 9.9982 9.9982 10.1262 10.1262 k = 0.0784 0.1358 0.2929 ( 8654 PWs) bands (ev): -69.7757 -69.7757 -69.7555 -69.7555 -39.5484 -39.5484 -39.5037 -39.5037 -38.3820 -38.3820 -38.3291 -38.3291 -38.2964 -38.2964 -38.2591 -38.2591 -25.7905 -25.7905 -8.6707 -8.6707 -7.6015 -7.6015 -7.4897 -7.4897 -1.2999 -1.2999 -1.2843 -1.2843 5.1308 5.1308 5.2940 5.2940 6.1626 6.1626 6.3371 6.3371 6.5299 6.5299 6.7463 6.7463 7.8596 7.8596 7.9046 7.9046 8.5094 8.5094 8.7744 8.7744 8.7972 8.7972 9.3512 9.3512 9.4893 9.4893 9.6490 9.6490 10.0211 10.0211 10.1559 10.1559 k = 0.0719 0.1245 0.2929 ( 8646 PWs) bands (ev): -69.7760 -69.7760 -69.7543 -69.7543 -39.5486 -39.5486 -39.5034 -39.5034 -38.3822 -38.3822 -38.3283 -38.3283 -38.2970 -38.2970 -38.2590 -38.2590 -25.7909 -25.7909 -8.6688 -8.6688 -7.6005 -7.6005 -7.4847 -7.4847 -1.3141 -1.3141 -1.2973 -1.2973 5.1221 5.1221 5.3289 5.3289 6.1574 6.1574 6.3166 6.3166 6.5577 6.5577 6.7450 6.7450 7.8754 7.8754 7.9185 7.9185 8.5349 8.5349 8.7890 8.7890 8.8114 8.8114 9.3505 9.3505 9.4952 9.4952 9.6300 9.6300 10.0526 10.0526 10.1884 10.1884 k = 0.0654 0.1132 0.2929 ( 8650 PWs) bands (ev): -69.7762 -69.7762 -69.7545 -69.7545 -39.5489 -39.5489 -39.5031 -39.5031 -38.3824 -38.3824 -38.3276 -38.3276 -38.2977 -38.2977 -38.2589 -38.2589 -25.7913 -25.7913 -8.6671 -8.6671 -7.5997 -7.5997 -7.4799 -7.4799 -1.3302 -1.3302 -1.3065 -1.3065 5.1127 5.1127 5.3638 5.3638 6.1506 6.1506 6.2940 6.2940 6.5852 6.5852 6.7427 6.7427 7.8905 7.8905 7.9316 7.9316 8.5590 8.5590 8.7973 8.7973 8.8209 8.8209 9.3483 9.3483 9.4990 9.4990 9.6110 9.6110 10.0859 10.0859 10.2163 10.2163 k = 0.0588 0.1019 0.2929 ( 8658 PWs) bands (ev): -69.7774 -69.7774 -69.7543 -69.7543 -39.5491 -39.5491 -39.5028 -39.5028 -38.3826 -38.3826 -38.3270 -38.3270 -38.2983 -38.2983 -38.2588 -38.2588 -25.7917 -25.7917 -8.6656 -8.6656 -7.5991 -7.5991 -7.4754 -7.4754 -1.3459 -1.3459 -1.3140 -1.3140 5.1032 5.1032 5.3987 5.3987 6.1443 6.1443 6.2709 6.2709 6.6092 6.6092 6.7394 6.7394 7.9024 7.9024 7.9417 7.9417 8.5809 8.5809 8.8064 8.8064 8.8317 8.8317 9.3454 9.3454 9.5022 9.5022 9.5923 9.5923 10.1182 10.1182 10.2418 10.2418 k = 0.0523 0.0906 0.2929 ( 8666 PWs) bands (ev): -69.7780 -69.7780 -69.7545 -69.7545 -39.5493 -39.5493 -39.5026 -39.5026 -38.3828 -38.3828 -38.3263 -38.3263 -38.2988 -38.2988 -38.2587 -38.2587 -25.7921 -25.7921 -8.6642 -8.6642 -7.5985 -7.5985 -7.4712 -7.4712 -1.3606 -1.3606 -1.3204 -1.3204 5.0945 5.0945 5.4330 5.4330 6.1382 6.1382 6.2468 6.2468 6.6322 6.6322 6.7365 6.7365 7.9145 7.9145 7.9538 7.9538 8.6027 8.6027 8.8124 8.8124 8.8376 8.8376 9.3425 9.3425 9.5030 9.5030 9.5748 9.5748 10.1527 10.1527 10.2648 10.2648 k = 0.0458 0.0792 0.2929 ( 8656 PWs) bands (ev): -69.7775 -69.7775 -69.7540 -69.7540 -39.5495 -39.5495 -39.5023 -39.5023 -38.3829 -38.3829 -38.3257 -38.3257 -38.2994 -38.2994 -38.2586 -38.2586 -25.7924 -25.7924 -8.6629 -8.6629 -7.5981 -7.5981 -7.4673 -7.4673 -1.3738 -1.3738 -1.3259 -1.3259 5.0864 5.0864 5.4667 5.4667 6.1331 6.1331 6.2242 6.2242 6.6551 6.6551 6.7354 6.7354 7.9273 7.9273 7.9675 7.9675 8.6254 8.6254 8.8205 8.8205 8.8456 8.8456 9.3396 9.3396 9.5057 9.5057 9.5608 9.5608 10.1911 10.1911 10.2893 10.2893 k = 0.0392 0.0679 0.2929 ( 8660 PWs) bands (ev): -69.7783 -69.7783 -69.7536 -69.7536 -39.5496 -39.5496 -39.5022 -39.5022 -38.3830 -38.3830 -38.3252 -38.3252 -38.2998 -38.2998 -38.2585 -38.2585 -25.7927 -25.7927 -8.6619 -8.6619 -7.5977 -7.5977 -7.4639 -7.4639 -1.3855 -1.3855 -1.3307 -1.3307 5.0794 5.0794 5.4985 5.4985 6.1283 6.1283 6.2014 6.2014 6.6724 6.6724 6.7336 6.7336 7.9353 7.9353 7.9761 7.9761 8.6462 8.6462 8.8251 8.8251 8.8502 8.8502 9.3374 9.3374 9.5063 9.5063 9.5475 9.5475 10.2248 10.2248 10.3081 10.3081 k = 0.0327 0.0566 0.2929 ( 8664 PWs) bands (ev): -69.7788 -69.7788 -69.7535 -69.7535 -39.5498 -39.5498 -39.5020 -39.5020 -38.3831 -38.3831 -38.3247 -38.3247 -38.3003 -38.3003 -38.2584 -38.2584 -25.7929 -25.7929 -8.6610 -8.6610 -7.5974 -7.5974 -7.4610 -7.4610 -1.3955 -1.3955 -1.3348 -1.3348 5.0729 5.0729 5.5281 5.5281 6.1243 6.1243 6.1791 6.1791 6.6879 6.6879 6.7303 6.7303 7.9441 7.9441 7.9856 7.9856 8.6647 8.6647 8.8284 8.8284 8.8527 8.8527 9.3344 9.3344 9.5067 9.5067 9.5368 9.5368 10.2577 10.2577 10.3213 10.3213 k = 0.0261 0.0453 0.2929 ( 8668 PWs) bands (ev): -69.7795 -69.7795 -69.7533 -69.7533 -39.5499 -39.5499 -39.5019 -39.5019 -38.3832 -38.3832 -38.3243 -38.3243 -38.3006 -38.3006 -38.2584 -38.2584 -25.7931 -25.7931 -8.6602 -8.6602 -7.5971 -7.5971 -7.4585 -7.4585 -1.4038 -1.4038 -1.3381 -1.3381 5.0676 5.0676 5.5546 5.5546 6.1210 6.1210 6.1590 6.1590 6.6999 6.6999 6.7291 6.7291 7.9496 7.9496 7.9916 7.9916 8.6806 8.6806 8.8316 8.8316 8.8549 8.8549 9.3322 9.3322 9.5065 9.5065 9.5281 9.5281 10.2846 10.2846 10.3346 10.3346 k = 0.0196 0.0340 0.2929 ( 8664 PWs) bands (ev): -69.7797 -69.7797 -69.7526 -69.7526 -39.5499 -39.5499 -39.5018 -39.5018 -38.3833 -38.3833 -38.3240 -38.3240 -38.3009 -38.3009 -38.2584 -38.2584 -25.7933 -25.7933 -8.6597 -8.6597 -7.5970 -7.5970 -7.4565 -7.4565 -1.4103 -1.4103 -1.3407 -1.3407 5.0637 5.0637 5.5770 5.5770 6.1193 6.1193 6.1417 6.1417 6.7108 6.7108 6.7269 6.7269 7.9556 7.9556 7.9981 7.9981 8.6948 8.6948 8.8349 8.8349 8.8575 8.8575 9.3317 9.3317 9.5057 9.5057 9.5228 9.5228 10.3101 10.3101 10.3437 10.3437 k = 0.0131 0.0226 0.2929 ( 8664 PWs) bands (ev): -69.7797 -69.7797 -69.7526 -69.7526 -39.5500 -39.5500 -39.5017 -39.5017 -38.3833 -38.3833 -38.3238 -38.3238 -38.3011 -38.3011 -38.2583 -38.2583 -25.7934 -25.7934 -8.6593 -8.6593 -7.5968 -7.5968 -7.4551 -7.4551 -1.4149 -1.4149 -1.3425 -1.3425 5.0606 5.0606 5.5941 5.5941 6.1171 6.1171 6.1286 6.1286 6.7182 6.7182 6.7272 6.7272 7.9594 7.9594 8.0024 8.0024 8.7066 8.7066 8.8345 8.8345 8.8573 8.8573 9.3302 9.3302 9.5043 9.5043 9.5193 9.5193 10.3269 10.3269 10.3532 10.3532 k = 0.0065 0.0113 0.2929 ( 8672 PWs) bands (ev): -69.7801 -69.7801 -69.7531 -69.7531 -39.5500 -39.5500 -39.5017 -39.5017 -38.3834 -38.3834 -38.3236 -38.3236 -38.3012 -38.3012 -38.2583 -38.2583 -25.7934 -25.7934 -8.6590 -8.6590 -7.5968 -7.5968 -7.4543 -7.4543 -1.4177 -1.4177 -1.3437 -1.3437 5.0585 5.0585 5.6049 5.6049 6.1150 6.1150 6.1194 6.1194 6.7205 6.7205 6.7277 6.7277 7.9607 7.9607 8.0040 8.0040 8.7135 8.7135 8.8329 8.8329 8.8559 8.8559 9.3288 9.3288 9.5019 9.5019 9.5166 9.5166 10.3349 10.3349 10.3592 10.3592 k = 0.0000 0.0000 0.2929 ( 8678 PWs) bands (ev): -69.7804 -69.7804 -69.7536 -69.7536 -39.5501 -39.5501 -39.5016 -39.5016 -38.3834 -38.3834 -38.3236 -38.3236 -38.3013 -38.3013 -38.2583 -38.2583 -25.7935 -25.7935 -8.6589 -8.6589 -7.5967 -7.5967 -7.4540 -7.4540 -1.4187 -1.4187 -1.3440 -1.3440 5.0576 5.0576 5.6087 5.6087 6.1129 6.1129 6.1169 6.1169 6.7208 6.7208 6.7276 6.7276 7.9613 7.9613 8.0046 8.0046 8.7155 8.7155 8.8313 8.8313 8.8545 8.8545 9.3276 9.3276 9.5008 9.5008 9.5156 9.5156 10.3370 10.3370 10.3608 10.3608 k = 0.5000 0.2887 0.2929 ( 8660 PWs) bands (ev): -69.7699 -69.7699 -69.7625 -69.7625 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0609 -1.0609 -0.6000 -0.6000 4.4189 4.4189 5.0576 5.0576 6.2681 6.2681 6.2902 6.2902 6.4933 6.4933 6.6824 6.6824 7.6667 7.6667 7.8843 7.8843 8.0540 8.0540 8.1705 8.1705 8.6846 8.6846 9.0346 9.0346 9.0527 9.0527 9.1861 9.1861 9.5075 9.5075 10.4584 10.4584 k = 0.5000 0.2887 0.2801 ( 8668 PWs) bands (ev): -69.7703 -69.7703 -69.7630 -69.7630 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0605 -1.0605 -0.6006 -0.6006 4.4200 4.4200 5.0575 5.0575 6.2682 6.2682 6.2885 6.2885 6.4900 6.4900 6.6854 6.6854 7.6659 7.6659 7.8830 7.8830 8.0500 8.0500 8.1703 8.1703 8.6843 8.6843 9.0339 9.0339 9.0502 9.0502 9.1850 9.1850 9.5048 9.5048 10.4551 10.4551 k = 0.5000 0.2887 0.2674 ( 8668 PWs) bands (ev): -69.7700 -69.7700 -69.7634 -69.7634 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0591 -1.0591 -0.6023 -0.6023 4.4239 4.4239 5.0575 5.0575 6.2685 6.2685 6.2845 6.2845 6.4818 6.4818 6.6941 6.6941 7.6667 7.6667 7.8798 7.8798 8.0431 8.0431 8.1784 8.1784 8.6867 8.6867 9.0349 9.0349 9.0484 9.0484 9.1850 9.1850 9.4962 9.4962 10.4488 10.4488 k = 0.5000 0.2887 0.2547 ( 8670 PWs) bands (ev): -69.7700 -69.7700 -69.7636 -69.7636 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0570 -1.0570 -0.6051 -0.6051 4.4300 4.4300 5.0575 5.0575 6.2685 6.2685 6.2795 6.2795 6.4703 6.4703 6.7067 6.7067 7.6678 7.6678 7.8745 7.8745 8.0312 8.0312 8.1900 8.1900 8.6872 8.6872 9.0328 9.0328 9.0456 9.0456 9.1840 9.1840 9.4874 9.4874 10.4397 10.4397 k = 0.5000 0.2887 0.2419 ( 8656 PWs) bands (ev): -69.7687 -69.7687 -69.7633 -69.7633 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0539 -1.0539 -0.6090 -0.6090 4.4387 4.4387 5.0576 5.0576 6.2669 6.2669 6.2747 6.2747 6.4568 6.4568 6.7231 6.7231 7.6728 7.6728 7.8721 7.8721 8.0199 8.0199 8.2032 8.2032 8.6939 8.6939 9.0339 9.0339 9.0424 9.0424 9.1849 9.1849 9.4761 9.4761 10.4287 10.4287 k = 0.5000 0.2887 0.2292 ( 8664 PWs) bands (ev): -69.7694 -69.7694 -69.7635 -69.7635 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7460 -8.7460 -7.7071 -7.7071 -7.5385 -7.5385 -1.0500 -1.0500 -0.6139 -0.6139 4.4492 4.4492 5.0577 5.0577 6.2592 6.2592 6.2737 6.2737 6.4412 6.4412 6.7404 6.7404 7.6730 7.6730 7.8659 7.8659 8.0043 8.0043 8.2150 8.2150 8.6942 8.6942 9.0278 9.0278 9.0333 9.0333 9.1825 9.1825 9.4628 9.4628 10.4128 10.4128 k = 0.5000 0.2887 0.2165 ( 8658 PWs) bands (ev): -69.7691 -69.7691 -69.7632 -69.7632 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7461 -8.7461 -7.7072 -7.7072 -7.5384 -7.5384 -1.0452 -1.0452 -0.6198 -0.6198 4.4621 4.4621 5.0582 5.0582 6.2477 6.2477 6.2748 6.2748 6.4252 6.4252 6.7595 6.7595 7.6753 7.6753 7.8599 7.8599 7.9910 7.9910 8.2304 8.2304 8.6975 8.6975 9.0168 9.0168 9.0293 9.0293 9.1833 9.1833 9.4497 9.4497 10.3976 10.3976 k = 0.5000 0.2887 0.2037 ( 8662 PWs) bands (ev): -69.7694 -69.7694 -69.7634 -69.7634 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7461 -8.7461 -7.7072 -7.7072 -7.5384 -7.5384 -1.0396 -1.0396 -0.6267 -0.6267 4.4765 4.4765 5.0590 5.0590 6.2333 6.2333 6.2763 6.2763 6.4084 6.4084 6.7790 6.7790 7.6750 7.6750 7.8521 7.8521 7.9776 7.9776 8.2439 8.2439 8.7002 8.7002 9.0003 9.0003 9.0265 9.0265 9.1820 9.1820 9.4345 9.4345 10.3773 10.3773 k = 0.5000 0.2887 0.1910 ( 8662 PWs) bands (ev): -69.7699 -69.7699 -69.7629 -69.7629 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7461 -8.7461 -7.7072 -7.7072 -7.5384 -7.5384 -1.0333 -1.0333 -0.6345 -0.6345 4.4925 4.4925 5.0603 5.0603 6.2167 6.2167 6.2782 6.2782 6.3935 6.3935 6.7985 6.7985 7.6762 7.6762 7.8424 7.8424 7.9660 7.9660 8.2587 8.2587 8.7047 8.7047 8.9788 8.9788 9.0252 9.0252 9.1804 9.1804 9.4175 9.4175 10.3599 10.3599 k = 0.5000 0.2887 0.1783 ( 8662 PWs) bands (ev): -69.7701 -69.7701 -69.7627 -69.7627 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7461 -8.7461 -7.7073 -7.7073 -7.5384 -7.5384 -1.0262 -1.0262 -0.6431 -0.6431 4.5096 4.5096 5.0623 5.0623 6.1980 6.1980 6.2805 6.2805 6.3777 6.3777 6.8182 6.8182 7.6775 7.6775 7.8324 7.8324 7.9557 7.9557 8.2726 8.2726 8.7082 8.7082 8.9567 8.9567 9.0244 9.0244 9.1802 9.1802 9.4033 9.4033 10.3370 10.3370 k = 0.5000 0.2887 0.1655 ( 8672 PWs) bands (ev): -69.7705 -69.7705 -69.7635 -69.7635 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7461 -8.7461 -7.7073 -7.7073 -7.5384 -7.5384 -1.0184 -1.0184 -0.6526 -0.6526 4.5278 4.5278 5.0650 5.0650 6.1767 6.1767 6.2826 6.2826 6.3615 6.3615 6.8371 6.8371 7.6785 7.6785 7.8188 7.8188 7.9456 7.9456 8.2834 8.2834 8.7127 8.7127 8.9296 8.9296 9.0206 9.0206 9.1803 9.1803 9.3914 9.3914 10.3103 10.3103 k = 0.5000 0.2887 0.1528 ( 8668 PWs) bands (ev): -69.7702 -69.7702 -69.7633 -69.7633 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7461 -8.7461 -7.7073 -7.7073 -7.5384 -7.5384 -1.0100 -1.0100 -0.6626 -0.6626 4.5466 4.5466 5.0687 5.0687 6.1546 6.1546 6.2851 6.2851 6.3472 6.3472 6.8556 6.8556 7.6816 7.6816 7.8075 7.8075 7.9383 7.9383 8.2969 8.2969 8.7184 8.7184 8.9021 8.9021 9.0168 9.0168 9.1822 9.1822 9.3845 9.3845 10.2866 10.2866 k = 0.5000 0.2887 0.1401 ( 8660 PWs) bands (ev): -69.7696 -69.7696 -69.7631 -69.7631 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7461 -8.7461 -7.7074 -7.7074 -7.5383 -7.5383 -1.0010 -1.0010 -0.6733 -0.6733 4.5654 4.5654 5.0735 5.0735 6.1309 6.1309 6.2877 6.2877 6.3342 6.3342 6.8737 6.8737 7.6886 7.6886 7.7928 7.7928 7.9324 7.9324 8.3109 8.3109 8.7268 8.7268 8.8757 8.8757 9.0133 9.0133 9.1839 9.1839 9.3782 9.3782 10.2644 10.2644 k = 0.5000 0.2887 0.1273 ( 8656 PWs) bands (ev): -69.7694 -69.7694 -69.7628 -69.7628 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7462 -8.7462 -7.7074 -7.7074 -7.5383 -7.5383 -0.9914 -0.9914 -0.6845 -0.6845 4.5841 4.5841 5.0796 5.0796 6.1061 6.1061 6.2901 6.2901 6.3221 6.3221 6.8906 6.8906 7.6919 7.6919 7.7802 7.7802 7.9274 7.9274 8.3245 8.3245 8.7340 8.7340 8.8449 8.8449 9.0116 9.0116 9.1849 9.1849 9.3728 9.3728 10.2421 10.2421 k = 0.5000 0.2887 0.1146 ( 8646 PWs) bands (ev): -69.7691 -69.7691 -69.7619 -69.7619 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7462 -8.7462 -7.7075 -7.7075 -7.5383 -7.5383 -0.9815 -0.9815 -0.6961 -0.6961 4.6020 4.6020 5.0869 5.0869 6.0821 6.0821 6.2922 6.2922 6.3115 6.3115 6.9061 6.9061 7.6954 7.6954 7.7686 7.7686 7.9251 7.9251 8.3401 8.3401 8.7409 8.7409 8.8166 8.8166 9.0070 9.0070 9.1873 9.1873 9.3695 9.3695 10.2210 10.2210 k = 0.5000 0.2887 0.1019 ( 8646 PWs) bands (ev): -69.7691 -69.7691 -69.7619 -69.7619 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7462 -8.7462 -7.7075 -7.7075 -7.5383 -7.5383 -0.9712 -0.9712 -0.7079 -0.7079 4.6188 4.6188 5.0953 5.0953 6.0561 6.0561 6.2926 6.2926 6.3032 6.3032 6.9202 6.9202 7.6984 7.6984 7.7566 7.7566 7.9216 7.9216 8.3535 8.3535 8.7475 8.7475 8.7859 8.7859 9.0019 9.0019 9.1882 9.1882 9.3665 9.3665 10.1995 10.1995 k = 0.5000 0.2887 0.0891 ( 8646 PWs) bands (ev): -69.7692 -69.7692 -69.7618 -69.7618 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7462 -8.7462 -7.7076 -7.7076 -7.5383 -7.5383 -0.9607 -0.9607 -0.7197 -0.7197 4.6341 4.6341 5.1049 5.1049 6.0305 6.0305 6.2878 6.2878 6.3010 6.3010 6.9325 6.9325 7.6998 7.6998 7.7446 7.7446 7.9202 7.9202 8.3674 8.3674 8.7497 8.7497 8.7612 8.7612 8.9961 8.9961 9.1908 9.1908 9.3646 9.3646 10.1786 10.1786 k = 0.5000 0.2887 0.0764 ( 8656 PWs) bands (ev): -69.7700 -69.7700 -69.7621 -69.7621 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7462 -8.7462 -7.7076 -7.7076 -7.5383 -7.5383 -0.9503 -0.9503 -0.7314 -0.7314 4.6476 4.6476 5.1146 5.1146 6.0057 6.0057 6.2804 6.2804 6.3021 6.3021 6.9434 6.9434 7.7004 7.7004 7.7333 7.7333 7.9171 7.9171 8.3806 8.3806 8.7257 8.7257 8.7600 8.7600 8.9904 8.9904 9.1904 9.1904 9.3577 9.3577 10.1594 10.1594 k = 0.5000 0.2887 0.0637 ( 8662 PWs) bands (ev): -69.7704 -69.7704 -69.7623 -69.7623 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7462 -8.7462 -7.7076 -7.7076 -7.5383 -7.5383 -0.9401 -0.9401 -0.7428 -0.7428 4.6592 4.6592 5.1249 5.1249 5.9824 5.9824 6.2736 6.2736 6.3036 6.3036 6.9528 6.9528 7.7022 7.7022 7.7250 7.7250 7.9153 7.9153 8.3907 8.3907 8.6987 8.6987 8.7643 8.7643 8.9837 8.9837 9.1905 9.1905 9.3559 9.3559 10.1426 10.1426 k = 0.5000 0.2887 0.0509 ( 8652 PWs) bands (ev): -69.7698 -69.7698 -69.7618 -69.7618 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2654 -38.2654 -25.7759 -25.7759 -8.7462 -8.7462 -7.7076 -7.7076 -7.5382 -7.5382 -0.9305 -0.9305 -0.7533 -0.7533 4.6689 4.6689 5.1351 5.1351 5.9624 5.9624 6.2686 6.2686 6.3053 6.3053 6.9609 6.9609 7.7054 7.7054 7.7188 7.7188 7.9150 7.9150 8.4064 8.4064 8.6778 8.6778 8.7702 8.7702 8.9805 8.9805 9.1913 9.1913 9.3578 9.3578 10.1306 10.1306 k = 0.5000 0.2887 0.0382 ( 8676 PWs) bands (ev): -69.7713 -69.7713 -69.7630 -69.7630 -39.5352 -39.5352 -39.5191 -39.5191 -38.3707 -38.3707 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9220 -0.9220 -0.7627 -0.7627 4.6762 4.6762 5.1432 5.1432 5.9448 5.9448 6.2635 6.2635 6.3061 6.3061 6.9667 6.9667 7.7036 7.7036 7.7090 7.7090 7.9103 7.9103 8.4126 8.4126 8.6521 8.6521 8.7736 8.7736 8.9751 8.9751 9.1885 9.1885 9.3506 9.3506 10.1174 10.1174 k = 0.5000 0.2887 0.0255 ( 8670 PWs) bands (ev): -69.7715 -69.7715 -69.7621 -69.7621 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3508 -38.3508 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9150 -0.9150 -0.7702 -0.7702 4.6816 4.6816 5.1501 5.1501 5.9321 5.9321 6.2615 6.2615 6.3070 6.3070 6.9710 6.9710 7.7051 7.7051 7.7067 7.7067 7.9114 7.9114 8.4201 8.4201 8.6374 8.6374 8.7765 8.7765 8.9760 8.9760 9.1883 9.1883 9.3499 9.3499 10.1133 10.1133 k = 0.5000 0.2887 0.0127 ( 8666 PWs) bands (ev): -69.7715 -69.7715 -69.7616 -69.7616 -39.5352 -39.5352 -39.5191 -39.5191 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9104 -0.9104 -0.7751 -0.7751 4.6847 4.6847 5.1545 5.1545 5.9247 5.9247 6.2604 6.2604 6.3076 6.3076 6.9732 6.9732 7.7041 7.7041 7.7068 7.7068 7.9120 7.9120 8.4272 8.4272 8.6300 8.6300 8.7773 8.7773 8.9720 8.9720 9.1880 9.1880 9.3501 9.3501 10.1113 10.1113 k = 0.5000 0.2887-0.0000 ( 8680 PWs) bands (ev): -69.7726 -69.7726 -69.7621 -69.7621 -39.5352 -39.5352 -39.5192 -39.5192 -38.3706 -38.3706 -38.3509 -38.3509 -38.2800 -38.2800 -38.2655 -38.2655 -25.7759 -25.7759 -8.7463 -8.7463 -7.7077 -7.7077 -7.5382 -7.5382 -0.9088 -0.9088 -0.7768 -0.7768 4.6858 4.6858 5.1560 5.1560 5.9216 5.9216 6.2591 6.2591 6.3076 6.3076 6.9738 6.9738 7.7012 7.7012 7.7026 7.7026 7.9110 7.9110 8.4272 8.4272 8.6242 8.6242 8.7758 8.7758 8.9710 8.9710 9.1840 9.1840 9.3489 9.3489 10.1073 10.1073 k = 0.3333 0.5774-0.0000 ( 8667 PWs) bands (ev): -69.7667 -69.7667 -69.7667 -69.7667 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7750 -0.7750 -0.7577 -0.7577 5.1584 5.1584 5.1714 5.1714 5.5265 5.5265 6.0779 6.0779 6.3268 6.3268 6.3624 6.3624 7.6145 7.6145 7.7114 7.7114 8.1376 8.1376 8.1456 8.1456 8.8399 8.8399 8.8995 8.8995 8.9084 8.9084 9.1163 9.1163 9.1687 9.1687 10.5114 10.5114 k = 0.3333 0.5774 0.0127 ( 8667 PWs) bands (ev): -69.7668 -69.7668 -69.7668 -69.7668 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7750 -0.7750 -0.7577 -0.7577 5.1582 5.1582 5.1710 5.1710 5.5263 5.5263 6.0783 6.0783 6.3274 6.3274 6.3629 6.3629 7.6135 7.6135 7.7103 7.7103 8.1383 8.1383 8.1464 8.1464 8.8396 8.8396 8.9000 8.9000 8.9082 8.9082 9.1176 9.1176 9.1697 9.1697 10.5084 10.5084 k = 0.3333 0.5774 0.0255 ( 8667 PWs) bands (ev): -69.7667 -69.7667 -69.7667 -69.7667 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7750 -0.7750 -0.7578 -0.7578 5.1578 5.1578 5.1701 5.1701 5.5258 5.5258 6.0798 6.0798 6.3289 6.3289 6.3638 6.3638 7.6139 7.6139 7.7105 7.7105 8.1368 8.1368 8.1449 8.1449 8.8388 8.8388 8.9002 8.9002 8.9078 8.9078 9.1215 9.1215 9.1730 9.1730 10.5013 10.5013 k = 0.3333 0.5774 0.0382 ( 8670 PWs) bands (ev): -69.7669 -69.7669 -69.7669 -69.7669 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7752 -0.7752 -0.7580 -0.7580 5.1570 5.1570 5.1685 5.1685 5.5250 5.5250 6.0825 6.0825 6.3309 6.3309 6.3649 6.3649 7.6139 7.6139 7.7092 7.7092 8.1337 8.1337 8.1418 8.1418 8.8369 8.8369 8.9011 8.9011 8.9076 8.9076 9.1266 9.1266 9.1773 9.1773 10.4916 10.4916 k = 0.3333 0.5774 0.0509 ( 8670 PWs) bands (ev): -69.7669 -69.7669 -69.7669 -69.7669 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6939 -7.6939 -7.5895 -7.5895 -0.7753 -0.7753 -0.7582 -0.7582 5.1561 5.1561 5.1665 5.1665 5.5239 5.5239 6.0858 6.0858 6.3342 6.3342 6.3669 6.3669 7.6148 7.6148 7.7096 7.7096 8.1303 8.1303 8.1382 8.1382 8.8350 8.8350 8.9018 8.9018 8.9069 8.9069 9.1354 9.1354 9.1850 9.1850 10.4760 10.4760 k = 0.3333 0.5774 0.0637 ( 8682 PWs) bands (ev): -69.7676 -69.7676 -69.7676 -69.7676 -39.5274 -39.5274 -39.5273 -39.5273 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2659 -38.2659 -25.7737 -25.7737 -8.7490 -8.7490 -7.6938 -7.6938 -7.5895 -7.5895 -0.7755 -0.7755 -0.7584 -0.7584 5.1548 5.1548 5.1638 5.1638 5.5225 5.5225 6.0887 6.0887 6.3381 6.3381 6.3693 6.3693 7.6151 7.6151 7.7083 7.7083 8.1237 8.1237 8.1317 8.1317 8.8319 8.8319 8.8994 8.8994 8.9034 8.9034 9.1455 9.1455 9.1940 9.1940 10.4526 10.4526 k = 0.3333 0.5774 0.0764 ( 8664 PWs) bands (ev): -69.7665 -69.7665 -69.7665 -69.7665 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6938 -7.6938 -7.5895 -7.5895 -0.7757 -0.7757 -0.7587 -0.7587 5.1536 5.1536 5.1610 5.1610 5.5212 5.5212 6.0944 6.0944 6.3435 6.3435 6.3728 6.3728 7.6184 7.6184 7.7108 7.7108 8.1214 8.1214 8.1292 8.1292 8.8317 8.8317 8.9039 8.9039 8.9058 8.9058 9.1614 9.1614 9.2082 9.2082 10.4351 10.4351 k = 0.3333 0.5774 0.0891 ( 8664 PWs) bands (ev): -69.7665 -69.7665 -69.7665 -69.7665 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6938 -7.6938 -7.5895 -7.5895 -0.7759 -0.7759 -0.7591 -0.7591 5.1521 5.1521 5.1577 5.1577 5.5195 5.5195 6.0997 6.0997 6.3486 6.3486 6.3759 6.3759 7.6219 7.6219 7.7114 7.7114 8.1142 8.1142 8.1220 8.1220 8.8296 8.8296 8.9044 8.9044 8.9051 8.9051 9.1759 9.1759 9.2218 9.2218 10.4108 10.4108 k = 0.3333 0.5774 0.1019 ( 8664 PWs) bands (ev): -69.7665 -69.7665 -69.7665 -69.7665 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6937 -7.6937 -7.5895 -7.5895 -0.7762 -0.7762 -0.7594 -0.7594 5.1503 5.1503 5.1540 5.1540 5.5176 5.5176 6.1056 6.1056 6.3546 6.3546 6.3796 6.3796 7.6236 7.6236 7.7121 7.7121 8.1079 8.1079 8.1156 8.1156 8.8257 8.8257 8.9042 8.9042 8.9053 8.9053 9.1921 9.1921 9.2364 9.2364 10.3846 10.3846 k = 0.3333 0.5774 0.1146 ( 8664 PWs) bands (ev): -69.7665 -69.7665 -69.7665 -69.7665 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6937 -7.6937 -7.5895 -7.5895 -0.7764 -0.7764 -0.7598 -0.7598 5.1485 5.1485 5.1500 5.1500 5.5156 5.5156 6.1122 6.1122 6.3612 6.3612 6.3838 6.3838 7.6252 7.6252 7.7112 7.7112 8.1025 8.1025 8.1101 8.1101 8.8215 8.8215 8.9026 8.9026 8.9055 8.9055 9.2091 9.2091 9.2521 9.2521 10.3584 10.3584 k = 0.3333 0.5774 0.1273 ( 8664 PWs) bands (ev): -69.7665 -69.7665 -69.7665 -69.7665 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7490 -8.7490 -7.6937 -7.6937 -7.5895 -7.5895 -0.7767 -0.7767 -0.7602 -0.7602 5.1460 5.1460 5.1466 5.1466 5.5136 5.5136 6.1190 6.1190 6.3678 6.3678 6.3879 6.3879 7.6271 7.6271 7.7127 7.7127 8.0948 8.0948 8.1023 8.1023 8.8175 8.8175 8.9016 8.9016 8.9061 8.9061 9.2275 9.2275 9.2691 9.2691 10.3316 10.3316 k = 0.3333 0.5774 0.1401 ( 8646 PWs) bands (ev): -69.7655 -69.7655 -69.7655 -69.7655 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7489 -8.7489 -7.6936 -7.6936 -7.5895 -7.5895 -0.7770 -0.7770 -0.7606 -0.7606 5.1421 5.1421 5.1448 5.1448 5.5118 5.5118 6.1263 6.1263 6.3752 6.3752 6.3929 6.3929 7.6331 7.6331 7.7153 7.7153 8.0911 8.0911 8.0986 8.0986 8.8137 8.8137 8.9038 8.9038 8.9100 8.9100 9.2487 9.2487 9.2891 9.2891 10.3076 10.3076 k = 0.3333 0.5774 0.1528 ( 8652 PWs) bands (ev): -69.7658 -69.7658 -69.7658 -69.7658 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7489 -8.7489 -7.6936 -7.6936 -7.5895 -7.5895 -0.7773 -0.7773 -0.7611 -0.7611 5.1378 5.1378 5.1427 5.1427 5.5095 5.5095 6.1330 6.1330 6.3821 6.3821 6.3973 6.3973 7.6350 7.6350 7.7151 7.7151 8.0830 8.0830 8.0904 8.0904 8.8064 8.8064 8.9022 8.9022 8.9101 8.9101 9.2672 9.2672 9.3063 9.3063 10.2790 10.2790 k = 0.3333 0.5774 0.1655 ( 8655 PWs) bands (ev): -69.7660 -69.7660 -69.7660 -69.7660 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7489 -8.7489 -7.6935 -7.6935 -7.5895 -7.5895 -0.7776 -0.7776 -0.7615 -0.7615 5.1336 5.1336 5.1406 5.1406 5.5073 5.5073 6.1397 6.1397 6.3889 6.3889 6.4017 6.4017 7.6355 7.6355 7.7182 7.7182 8.0757 8.0757 8.0830 8.0830 8.8004 8.8004 8.9012 8.9012 8.9108 8.9108 9.2858 9.2858 9.3237 9.3237 10.2501 10.2501 k = 0.3333 0.5774 0.1783 ( 8667 PWs) bands (ev): -69.7666 -69.7666 -69.7666 -69.7666 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2659 -38.2659 -25.7737 -25.7737 -8.7489 -8.7489 -7.6935 -7.6935 -7.5895 -7.5895 -0.7779 -0.7779 -0.7620 -0.7620 5.1295 5.1295 5.1386 5.1386 5.5049 5.5049 6.1462 6.1462 6.3953 6.3953 6.4057 6.4057 7.6370 7.6370 7.7166 7.7166 8.0665 8.0665 8.0738 8.0738 8.7946 8.7946 8.8984 8.8984 8.9089 8.9089 9.3033 9.3033 9.3403 9.3403 10.2220 10.2220 k = 0.3333 0.5774 0.1910 ( 8670 PWs) bands (ev): -69.7668 -69.7668 -69.7668 -69.7668 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2659 -38.2659 -25.7737 -25.7737 -8.7489 -8.7489 -7.6934 -7.6934 -7.5895 -7.5895 -0.7782 -0.7782 -0.7624 -0.7624 5.1256 5.1256 5.1366 5.1366 5.5027 5.5027 6.1526 6.1526 6.4018 6.4018 6.4101 6.4101 7.6371 7.6371 7.7185 7.7185 8.0615 8.0615 8.0688 8.0688 8.7881 8.7881 8.8965 8.8965 8.9083 8.9083 9.3202 9.3202 9.3564 9.3564 10.1964 10.1964 k = 0.3333 0.5774 0.2037 ( 8679 PWs) bands (ev): -69.7673 -69.7673 -69.7673 -69.7673 -39.5274 -39.5274 -39.5273 -39.5273 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2659 -38.2659 -25.7737 -25.7737 -8.7489 -8.7489 -7.6934 -7.6934 -7.5895 -7.5895 -0.7785 -0.7785 -0.7628 -0.7628 5.1220 5.1220 5.1348 5.1348 5.5005 5.5005 6.1584 6.1584 6.4077 6.4077 6.4139 6.4139 7.6376 7.6376 7.7195 7.7195 8.0537 8.0537 8.0609 8.0609 8.7786 8.7786 8.8947 8.8947 8.9080 8.9080 9.3371 9.3371 9.3721 9.3721 10.1723 10.1723 k = 0.3333 0.5774 0.2165 ( 8685 PWs) bands (ev): -69.7677 -69.7677 -69.7677 -69.7677 -39.5274 -39.5274 -39.5273 -39.5273 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2659 -38.2659 -25.7737 -25.7737 -8.7489 -8.7489 -7.6934 -7.6934 -7.5895 -7.5895 -0.7787 -0.7787 -0.7631 -0.7631 5.1189 5.1189 5.1332 5.1332 5.4988 5.4988 6.1639 6.1639 6.4125 6.4125 6.4170 6.4170 7.6405 7.6405 7.7198 7.7198 8.0468 8.0468 8.0539 8.0539 8.7724 8.7724 8.8931 8.8931 8.9069 8.9069 9.3511 9.3511 9.3857 9.3857 10.1532 10.1532 k = 0.3333 0.5774 0.2292 ( 8667 PWs) bands (ev): -69.7667 -69.7667 -69.7667 -69.7667 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5895 -7.5895 -0.7789 -0.7789 -0.7634 -0.7634 5.1163 5.1163 5.1320 5.1320 5.4976 5.4976 6.1688 6.1688 6.4175 6.4175 6.4204 6.4204 7.6443 7.6443 7.7253 7.7253 8.0441 8.0441 8.0512 8.0512 8.7734 8.7734 8.8968 8.8968 8.9111 8.9111 9.3669 9.3669 9.4011 9.4011 10.1379 10.1379 k = 0.3333 0.5774 0.2419 ( 8658 PWs) bands (ev): -69.7662 -69.7662 -69.7662 -69.7662 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7791 -0.7791 -0.7636 -0.7636 5.1142 5.1142 5.1310 5.1310 5.4971 5.4971 6.1729 6.1729 6.4216 6.4216 6.4232 6.4232 7.6462 7.6462 7.7273 7.7273 8.0415 8.0415 8.0485 8.0485 8.7712 8.7712 8.8981 8.8981 8.9130 8.9130 9.3795 9.3795 9.4131 9.4131 10.1284 10.1284 k = 0.3333 0.5774 0.2547 ( 8658 PWs) bands (ev): -69.7662 -69.7662 -69.7662 -69.7662 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7792 -0.7792 -0.7638 -0.7638 5.1124 5.1124 5.1301 5.1301 5.4961 5.4961 6.1761 6.1761 6.4252 6.4252 6.4257 6.4257 7.6469 7.6469 7.7265 7.7265 8.0393 8.0393 8.0463 8.0463 8.7678 8.7678 8.8971 8.8971 8.9126 8.9126 9.3894 9.3894 9.4226 9.4226 10.1176 10.1176 k = 0.3333 0.5774 0.2674 ( 8652 PWs) bands (ev): -69.7659 -69.7659 -69.7659 -69.7659 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2791 -38.2791 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7793 -0.7793 -0.7640 -0.7640 5.1111 5.1111 5.1295 5.1295 5.4959 5.4959 6.1785 6.1785 6.4273 6.4273 6.4276 6.4276 7.6476 7.6476 7.7275 7.7275 8.0374 8.0374 8.0443 8.0443 8.7662 8.7662 8.8989 8.8989 8.9148 8.9148 9.3972 9.3972 9.4299 9.4299 10.1126 10.1126 k = 0.3333 0.5774 0.2801 ( 8661 PWs) bands (ev): -69.7664 -69.7664 -69.7664 -69.7664 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7794 -0.7794 -0.7641 -0.7641 5.1102 5.1102 5.1290 5.1290 5.4953 5.4953 6.1799 6.1799 6.4279 6.4279 6.4287 6.4287 7.6471 7.6471 7.7258 7.7258 8.0348 8.0348 8.0417 8.0417 8.7636 8.7636 8.8965 8.8965 8.9125 8.9125 9.3999 9.3999 9.4326 9.4326 10.1069 10.1069 k = 0.3333 0.5774 0.2929 ( 8670 PWs) bands (ev): -69.7669 -69.7669 -69.7669 -69.7669 -39.5274 -39.5274 -39.5272 -39.5272 -38.3686 -38.3686 -38.3534 -38.3534 -38.2792 -38.2792 -38.2658 -38.2658 -25.7737 -25.7737 -8.7488 -8.7488 -7.6933 -7.6933 -7.5894 -7.5894 -0.7794 -0.7794 -0.7641 -0.7641 5.1098 5.1098 5.1287 5.1287 5.4946 5.4946 6.1804 6.1804 6.4281 6.4281 6.4290 6.4290 7.6456 7.6456 7.7251 7.7251 8.0331 8.0331 8.0400 8.0400 8.7621 8.7621 8.8948 8.8948 8.9110 8.9110 9.4004 9.4004 9.4331 9.4331 10.1013 10.1013 Writing output data file SrxMnPx2.save init_run : 0.29s CPU 0.40s WALL ( 1 calls) electrons : 225.65s CPU 228.47s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 225.64s CPU 228.46s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.08s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.14s WALL ( 320 calls) cegterg : 201.44s CPU 203.29s WALL ( 320 calls) Called by sum_band: Called by *egterg: h_psi : 142.10s CPU 143.61s WALL ( 4644 calls) s_psi : 6.92s CPU 6.98s WALL ( 4644 calls) g_psi : 0.39s CPU 0.47s WALL ( 4004 calls) cdiaghg : 41.20s CPU 41.71s WALL ( 4324 calls) cegterg:over : 11.00s CPU 11.01s WALL ( 4004 calls) cegterg:upda : 9.59s CPU 9.54s WALL ( 4004 calls) cegterg:last : 5.64s CPU 5.61s WALL ( 960 calls) cdiaghg:chol : 2.25s CPU 2.44s WALL ( 4324 calls) cdiaghg:inve : 1.66s CPU 1.63s WALL ( 4324 calls) cdiaghg:para : 2.72s CPU 2.80s WALL ( 8648 calls) Called by h_psi: h_psi:vloc : 124.14s CPU 125.57s WALL ( 4644 calls) h_psi:vnl : 17.54s CPU 17.60s WALL ( 4644 calls) add_vuspsi : 9.42s CPU 9.33s WALL ( 4644 calls) General routines calbec : 8.09s CPU 8.26s WALL ( 4644 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 117.80s CPU 119.38s WALL ( 780380 calls) davcio : 0.30s CPU 0.53s WALL ( 640 calls) Parallel routines fft_scatter : 37.45s CPU 38.45s WALL ( 780395 calls) PWSCF : 4m14.01s CPU 4m31.11s WALL This run was terminated on: 20:27:54 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=