Program PWSCF v.5.1.1 starts on 19Oct2015 at 8:32:32 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./ScSiAu.save/ file Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized file Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 38 18 5 2162 711 111 Max 40 19 6 2167 731 122 Sum 1843 889 253 103879 34607 5503 bravais-lattice index = 14 lattice parameter (alat) = 7.9595 a.u. unit-cell volume = 705.3495 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 51.0000 Ry charge density cutoff = 424.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.959526 celldm(2)= 1.000000 celldm(3)= 1.615147 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 1.615147 ) 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 0.619139 ) PseudoPot. # 1 for Sc read from file: /home/autes/Pseudo/Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: e27f768e72ba10e20459589e24f2b6a7 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1173 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 Au read from file: /home/autes/Pseudo/Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d39daeb1f194fdf5670f47ad6d8ea3dd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1279 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 Sc 11.00 44.95590 Sc( 1.00) Si 4.00 28.08550 Si( 1.00) Au 11.00 196.96660 Au( 1.00) 12 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,1,0] 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 [1,-1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [2,1,0] cryst. s( 6) = ( 1 1 0 ) ( 0 -1 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 inv. 180 deg rotation - cart. axis [0,0,1] 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. 60 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( -1 -1 0 ) ( 1 0 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. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 -1 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_3h (-62m) there are 9 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3C2' s_h 2S3 -2S3 3s_v -3C2' -s_h' -3s_v G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 1.73 -1.73 0.00 G_8 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.73 1.73 0.00 G_9 2.00 -2.00 -2.00 2.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2'-3C2' 2 -6 -5 -2 5 6 2C3 3 4 3s_v-3s_v 7 -7 3s_v-3s_v 8 -8 11 -12 -11 12 2S3 9 10 -E -1 -2C3 -3 -4 -2S3 -9 -10 Cartesian axes number of k points= 319 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 2) = ( 0.0113636 0.0065608 -0.0000000), wk = 0.0031348 k( 3) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0031348 k( 4) = ( 0.0340909 0.0196824 -0.0000000), wk = 0.0031348 k( 5) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0031348 k( 6) = ( 0.0568182 0.0328040 -0.0000000), wk = 0.0031348 k( 7) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0031348 k( 8) = ( 0.0795455 0.0459256 -0.0000000), wk = 0.0031348 k( 9) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0031348 k( 10) = ( 0.1022727 0.0590472 -0.0000000), wk = 0.0031348 k( 11) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0031348 k( 12) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0031348 k( 13) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0031348 k( 14) = ( 0.1477273 0.0852904 -0.0000000), wk = 0.0031348 k( 15) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0031348 k( 16) = ( 0.1704546 0.0984120 -0.0000000), wk = 0.0031348 k( 17) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0031348 k( 18) = ( 0.1931818 0.1115336 -0.0000000), wk = 0.0031348 k( 19) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0031348 k( 20) = ( 0.2159091 0.1246552 -0.0000000), wk = 0.0031348 k( 21) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0031348 k( 22) = ( 0.2386364 0.1377768 -0.0000000), wk = 0.0031348 k( 23) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0031348 k( 24) = ( 0.2613636 0.1508984 -0.0000000), wk = 0.0031348 k( 25) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0031348 k( 26) = ( 0.2840909 0.1640200 -0.0000000), wk = 0.0031348 k( 27) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0031348 k( 28) = ( 0.3068182 0.1771416 -0.0000000), wk = 0.0031348 k( 29) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0031348 k( 30) = ( 0.3295455 0.1902632 -0.0000000), wk = 0.0031348 k( 31) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0031348 k( 32) = ( 0.3522727 0.2033848 -0.0000000), wk = 0.0031348 k( 33) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0031348 k( 34) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0031348 k( 35) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0031348 k( 36) = ( 0.3977273 0.2296279 -0.0000000), wk = 0.0031348 k( 37) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0031348 k( 38) = ( 0.4204545 0.2427495 -0.0000000), wk = 0.0031348 k( 39) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0031348 k( 40) = ( 0.4431818 0.2558711 -0.0000000), wk = 0.0031348 k( 41) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0031348 k( 42) = ( 0.4659091 0.2689927 -0.0000000), wk = 0.0031348 k( 43) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0031348 k( 44) = ( 0.4886364 0.2821143 -0.0000000), wk = 0.0031348 k( 45) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031348 k( 46) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031348 k( 47) = ( 0.4933333 0.3002221 -0.0000000), wk = 0.0031348 k( 48) = ( 0.4866667 0.3117692 -0.0000000), wk = 0.0031348 k( 49) = ( 0.4800000 0.3233162 -0.0000000), wk = 0.0031348 k( 50) = ( 0.4733333 0.3348632 -0.0000000), wk = 0.0031348 k( 51) = ( 0.4666667 0.3464102 -0.0000000), wk = 0.0031348 k( 52) = ( 0.4600000 0.3579572 -0.0000000), wk = 0.0031348 k( 53) = ( 0.4533333 0.3695042 -0.0000000), wk = 0.0031348 k( 54) = ( 0.4466667 0.3810512 -0.0000000), wk = 0.0031348 k( 55) = ( 0.4400000 0.3925982 -0.0000000), wk = 0.0031348 k( 56) = ( 0.4333333 0.4041452 -0.0000000), wk = 0.0031348 k( 57) = ( 0.4266667 0.4156922 -0.0000000), wk = 0.0031348 k( 58) = ( 0.4200000 0.4272392 -0.0000000), wk = 0.0031348 k( 59) = ( 0.4133333 0.4387862 -0.0000000), wk = 0.0031348 k( 60) = ( 0.4066667 0.4503332 -0.0000000), wk = 0.0031348 k( 61) = ( 0.4000000 0.4618802 -0.0000000), wk = 0.0031348 k( 62) = ( 0.3933333 0.4734272 -0.0000000), wk = 0.0031348 k( 63) = ( 0.3866667 0.4849742 -0.0000000), wk = 0.0031348 k( 64) = ( 0.3800000 0.4965212 -0.0000000), wk = 0.0031348 k( 65) = ( 0.3733333 0.5080682 -0.0000000), wk = 0.0031348 k( 66) = ( 0.3666667 0.5196152 -0.0000000), wk = 0.0031348 k( 67) = ( 0.3600000 0.5311622 -0.0000000), wk = 0.0031348 k( 68) = ( 0.3533333 0.5427092 -0.0000000), wk = 0.0031348 k( 69) = ( 0.3466667 0.5542563 -0.0000000), wk = 0.0031348 k( 70) = ( 0.3400000 0.5658033 -0.0000000), wk = 0.0031348 k( 71) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031348 k( 72) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031348 k( 73) = ( 0.3266667 0.5658033 -0.0000000), wk = 0.0031348 k( 74) = ( 0.3200000 0.5542563 -0.0000000), wk = 0.0031348 k( 75) = ( 0.3133333 0.5427092 -0.0000000), wk = 0.0031348 k( 76) = ( 0.3066667 0.5311623 -0.0000000), wk = 0.0031348 k( 77) = ( 0.3000000 0.5196152 -0.0000000), wk = 0.0031348 k( 78) = ( 0.2933333 0.5080682 -0.0000000), wk = 0.0031348 k( 79) = ( 0.2866667 0.4965212 -0.0000000), wk = 0.0031348 k( 80) = ( 0.2800000 0.4849742 -0.0000000), wk = 0.0031348 k( 81) = ( 0.2733333 0.4734272 -0.0000000), wk = 0.0031348 k( 82) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0031348 k( 83) = ( 0.2600000 0.4503332 -0.0000000), wk = 0.0031348 k( 84) = ( 0.2533333 0.4387862 -0.0000000), wk = 0.0031348 k( 85) = ( 0.2466667 0.4272392 -0.0000000), wk = 0.0031348 k( 86) = ( 0.2400000 0.4156922 -0.0000000), wk = 0.0031348 k( 87) = ( 0.2333333 0.4041452 -0.0000000), wk = 0.0031348 k( 88) = ( 0.2266667 0.3925982 -0.0000000), wk = 0.0031348 k( 89) = ( 0.2200000 0.3810512 -0.0000000), wk = 0.0031348 k( 90) = ( 0.2133333 0.3695042 -0.0000000), wk = 0.0031348 k( 91) = ( 0.2066667 0.3579572 -0.0000000), wk = 0.0031348 k( 92) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0031348 k( 93) = ( 0.1933333 0.3348632 -0.0000000), wk = 0.0031348 k( 94) = ( 0.1866667 0.3233162 -0.0000000), wk = 0.0031348 k( 95) = ( 0.1800000 0.3117691 -0.0000000), wk = 0.0031348 k( 96) = ( 0.1733333 0.3002221 -0.0000000), wk = 0.0031348 k( 97) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0031348 k( 98) = ( 0.1600000 0.2771281 -0.0000000), wk = 0.0031348 k( 99) = ( 0.1533333 0.2655811 -0.0000000), wk = 0.0031348 k( 100) = ( 0.1466667 0.2540341 -0.0000000), wk = 0.0031348 k( 101) = ( 0.1400000 0.2424871 -0.0000000), wk = 0.0031348 k( 102) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0031348 k( 103) = ( 0.1266667 0.2193931 -0.0000000), wk = 0.0031348 k( 104) = ( 0.1200000 0.2078461 -0.0000000), wk = 0.0031348 k( 105) = ( 0.1133333 0.1962991 -0.0000000), wk = 0.0031348 k( 106) = ( 0.1066667 0.1847521 -0.0000000), wk = 0.0031348 k( 107) = ( 0.1000000 0.1732051 -0.0000000), wk = 0.0031348 k( 108) = ( 0.0933333 0.1616581 -0.0000000), wk = 0.0031348 k( 109) = ( 0.0866667 0.1501111 -0.0000000), wk = 0.0031348 k( 110) = ( 0.0800000 0.1385641 -0.0000000), wk = 0.0031348 k( 111) = ( 0.0733333 0.1270171 -0.0000000), wk = 0.0031348 k( 112) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0031348 k( 113) = ( 0.0600000 0.1039230 -0.0000000), wk = 0.0031348 k( 114) = ( 0.0533333 0.0923760 -0.0000000), wk = 0.0031348 k( 115) = ( 0.0466667 0.0808290 -0.0000000), wk = 0.0031348 k( 116) = ( 0.0400000 0.0692820 -0.0000000), wk = 0.0031348 k( 117) = ( 0.0333333 0.0577350 -0.0000000), wk = 0.0031348 k( 118) = ( 0.0266667 0.0461880 -0.0000000), wk = 0.0031348 k( 119) = ( 0.0200000 0.0346410 -0.0000000), wk = 0.0031348 k( 120) = ( 0.0133333 0.0230940 -0.0000000), wk = 0.0031348 k( 121) = ( 0.0066667 0.0115470 -0.0000000), wk = 0.0031348 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 124) = ( 0.0000000 0.0000000 0.0128987), wk = 0.0031348 k( 125) = ( 0.0000000 0.0000000 0.0257974), wk = 0.0031348 k( 126) = ( 0.0000000 0.0000000 0.0386962), wk = 0.0031348 k( 127) = ( 0.0000000 0.0000000 0.0515949), wk = 0.0031348 k( 128) = ( 0.0000000 0.0000000 0.0644936), wk = 0.0031348 k( 129) = ( 0.0000000 0.0000000 0.0773923), wk = 0.0031348 k( 130) = ( 0.0000000 0.0000000 0.0902910), wk = 0.0031348 k( 131) = ( 0.0000000 0.0000000 0.1031898), wk = 0.0031348 k( 132) = ( 0.0000000 0.0000000 0.1160885), wk = 0.0031348 k( 133) = ( 0.0000000 0.0000000 0.1289872), wk = 0.0031348 k( 134) = ( 0.0000000 0.0000000 0.1418859), wk = 0.0031348 k( 135) = ( 0.0000000 0.0000000 0.1547847), wk = 0.0031348 k( 136) = ( 0.0000000 0.0000000 0.1676834), wk = 0.0031348 k( 137) = ( 0.0000000 0.0000000 0.1805821), wk = 0.0031348 k( 138) = ( 0.0000000 0.0000000 0.1934808), wk = 0.0031348 k( 139) = ( 0.0000000 0.0000000 0.2063795), wk = 0.0031348 k( 140) = ( 0.0000000 0.0000000 0.2192783), wk = 0.0031348 k( 141) = ( 0.0000000 0.0000000 0.2321770), wk = 0.0031348 k( 142) = ( 0.0000000 0.0000000 0.2450757), wk = 0.0031348 k( 143) = ( 0.0000000 0.0000000 0.2579744), wk = 0.0031348 k( 144) = ( 0.0000000 0.0000000 0.2708731), wk = 0.0031348 k( 145) = ( 0.0000000 0.0000000 0.2837719), wk = 0.0031348 k( 146) = ( 0.0000000 0.0000000 0.2966706), wk = 0.0031348 k( 147) = ( 0.0000000 0.0000000 0.3095693), wk = 0.0031348 k( 148) = ( 0.0000000 0.0000000 0.3095693), wk = 0.0031348 k( 149) = ( 0.0113636 0.0065608 0.3095693), wk = 0.0031348 k( 150) = ( 0.0227273 0.0131216 0.3095693), wk = 0.0031348 k( 151) = ( 0.0340909 0.0196824 0.3095693), wk = 0.0031348 k( 152) = ( 0.0454546 0.0262432 0.3095693), wk = 0.0031348 k( 153) = ( 0.0568182 0.0328040 0.3095693), wk = 0.0031348 k( 154) = ( 0.0681818 0.0393648 0.3095693), wk = 0.0031348 k( 155) = ( 0.0795455 0.0459256 0.3095693), wk = 0.0031348 k( 156) = ( 0.0909091 0.0524864 0.3095693), wk = 0.0031348 k( 157) = ( 0.1022727 0.0590472 0.3095693), wk = 0.0031348 k( 158) = ( 0.1136364 0.0656080 0.3095693), wk = 0.0031348 k( 159) = ( 0.1250000 0.0721688 0.3095693), wk = 0.0031348 k( 160) = ( 0.1363636 0.0787296 0.3095693), wk = 0.0031348 k( 161) = ( 0.1477273 0.0852904 0.3095693), wk = 0.0031348 k( 162) = ( 0.1590909 0.0918512 0.3095693), wk = 0.0031348 k( 163) = ( 0.1704546 0.0984120 0.3095693), wk = 0.0031348 k( 164) = ( 0.1818182 0.1049728 0.3095693), wk = 0.0031348 k( 165) = ( 0.1931818 0.1115336 0.3095693), wk = 0.0031348 k( 166) = ( 0.2045454 0.1180944 0.3095693), wk = 0.0031348 k( 167) = ( 0.2159091 0.1246552 0.3095693), wk = 0.0031348 k( 168) = ( 0.2272727 0.1312160 0.3095693), wk = 0.0031348 k( 169) = ( 0.2386364 0.1377768 0.3095693), wk = 0.0031348 k( 170) = ( 0.2500000 0.1443376 0.3095693), wk = 0.0031348 k( 171) = ( 0.2613636 0.1508984 0.3095693), wk = 0.0031348 k( 172) = ( 0.2727273 0.1574592 0.3095693), wk = 0.0031348 k( 173) = ( 0.2840909 0.1640200 0.3095693), wk = 0.0031348 k( 174) = ( 0.2954545 0.1705808 0.3095693), wk = 0.0031348 k( 175) = ( 0.3068182 0.1771416 0.3095693), wk = 0.0031348 k( 176) = ( 0.3181818 0.1837024 0.3095693), wk = 0.0031348 k( 177) = ( 0.3295455 0.1902632 0.3095693), wk = 0.0031348 k( 178) = ( 0.3409091 0.1968240 0.3095693), wk = 0.0031348 k( 179) = ( 0.3522727 0.2033848 0.3095693), wk = 0.0031348 k( 180) = ( 0.3636364 0.2099456 0.3095693), wk = 0.0031348 k( 181) = ( 0.3750000 0.2165064 0.3095693), wk = 0.0031348 k( 182) = ( 0.3863636 0.2230672 0.3095693), wk = 0.0031348 k( 183) = ( 0.3977273 0.2296279 0.3095693), wk = 0.0031348 k( 184) = ( 0.4090909 0.2361887 0.3095693), wk = 0.0031348 k( 185) = ( 0.4204545 0.2427495 0.3095693), wk = 0.0031348 k( 186) = ( 0.4318182 0.2493103 0.3095693), wk = 0.0031348 k( 187) = ( 0.4431818 0.2558711 0.3095693), wk = 0.0031348 k( 188) = ( 0.4545455 0.2624319 0.3095693), wk = 0.0031348 k( 189) = ( 0.4659091 0.2689927 0.3095693), wk = 0.0031348 k( 190) = ( 0.4772727 0.2755535 0.3095693), wk = 0.0031348 k( 191) = ( 0.4886364 0.2821143 0.3095693), wk = 0.0031348 k( 192) = ( 0.5000000 0.2886751 0.3095693), wk = 0.0031348 k( 193) = ( 0.5000000 0.2886751 0.3095693), wk = 0.0031348 k( 194) = ( 0.4933333 0.3002221 0.3095693), wk = 0.0031348 k( 195) = ( 0.4866667 0.3117692 0.3095693), wk = 0.0031348 k( 196) = ( 0.4800000 0.3233162 0.3095693), wk = 0.0031348 k( 197) = ( 0.4733333 0.3348632 0.3095693), wk = 0.0031348 k( 198) = ( 0.4666667 0.3464102 0.3095693), wk = 0.0031348 k( 199) = ( 0.4600000 0.3579572 0.3095693), wk = 0.0031348 k( 200) = ( 0.4533333 0.3695042 0.3095693), wk = 0.0031348 k( 201) = ( 0.4466667 0.3810512 0.3095693), wk = 0.0031348 k( 202) = ( 0.4400000 0.3925982 0.3095693), wk = 0.0031348 k( 203) = ( 0.4333333 0.4041452 0.3095693), wk = 0.0031348 k( 204) = ( 0.4266667 0.4156922 0.3095693), wk = 0.0031348 k( 205) = ( 0.4200000 0.4272392 0.3095693), wk = 0.0031348 k( 206) = ( 0.4133333 0.4387862 0.3095693), wk = 0.0031348 k( 207) = ( 0.4066667 0.4503332 0.3095693), wk = 0.0031348 k( 208) = ( 0.4000000 0.4618802 0.3095693), wk = 0.0031348 k( 209) = ( 0.3933333 0.4734272 0.3095693), wk = 0.0031348 k( 210) = ( 0.3866667 0.4849742 0.3095693), wk = 0.0031348 k( 211) = ( 0.3800000 0.4965212 0.3095693), wk = 0.0031348 k( 212) = ( 0.3733333 0.5080682 0.3095693), wk = 0.0031348 k( 213) = ( 0.3666667 0.5196152 0.3095693), wk = 0.0031348 k( 214) = ( 0.3600000 0.5311622 0.3095693), wk = 0.0031348 k( 215) = ( 0.3533333 0.5427092 0.3095693), wk = 0.0031348 k( 216) = ( 0.3466667 0.5542563 0.3095693), wk = 0.0031348 k( 217) = ( 0.3400000 0.5658033 0.3095693), wk = 0.0031348 k( 218) = ( 0.3333333 0.5773503 0.3095693), wk = 0.0031348 k( 219) = ( 0.3333333 0.5773503 0.3095693), wk = 0.0031348 k( 220) = ( 0.3266667 0.5658033 0.3095693), wk = 0.0031348 k( 221) = ( 0.3200000 0.5542563 0.3095693), wk = 0.0031348 k( 222) = ( 0.3133333 0.5427092 0.3095693), wk = 0.0031348 k( 223) = ( 0.3066667 0.5311623 0.3095693), wk = 0.0031348 k( 224) = ( 0.3000000 0.5196152 0.3095693), wk = 0.0031348 k( 225) = ( 0.2933333 0.5080682 0.3095693), wk = 0.0031348 k( 226) = ( 0.2866667 0.4965212 0.3095693), wk = 0.0031348 k( 227) = ( 0.2800000 0.4849742 0.3095693), wk = 0.0031348 k( 228) = ( 0.2733333 0.4734272 0.3095693), wk = 0.0031348 k( 229) = ( 0.2666667 0.4618802 0.3095693), wk = 0.0031348 k( 230) = ( 0.2600000 0.4503332 0.3095693), wk = 0.0031348 k( 231) = ( 0.2533333 0.4387862 0.3095693), wk = 0.0031348 k( 232) = ( 0.2466667 0.4272392 0.3095693), wk = 0.0031348 k( 233) = ( 0.2400000 0.4156922 0.3095693), wk = 0.0031348 k( 234) = ( 0.2333333 0.4041452 0.3095693), wk = 0.0031348 k( 235) = ( 0.2266667 0.3925982 0.3095693), wk = 0.0031348 k( 236) = ( 0.2200000 0.3810512 0.3095693), wk = 0.0031348 k( 237) = ( 0.2133333 0.3695042 0.3095693), wk = 0.0031348 k( 238) = ( 0.2066667 0.3579572 0.3095693), wk = 0.0031348 k( 239) = ( 0.2000000 0.3464102 0.3095693), wk = 0.0031348 k( 240) = ( 0.1933333 0.3348632 0.3095693), wk = 0.0031348 k( 241) = ( 0.1866667 0.3233162 0.3095693), wk = 0.0031348 k( 242) = ( 0.1800000 0.3117691 0.3095693), wk = 0.0031348 k( 243) = ( 0.1733333 0.3002221 0.3095693), wk = 0.0031348 k( 244) = ( 0.1666667 0.2886751 0.3095693), wk = 0.0031348 k( 245) = ( 0.1600000 0.2771281 0.3095693), wk = 0.0031348 k( 246) = ( 0.1533333 0.2655811 0.3095693), wk = 0.0031348 k( 247) = ( 0.1466667 0.2540341 0.3095693), wk = 0.0031348 k( 248) = ( 0.1400000 0.2424871 0.3095693), wk = 0.0031348 k( 249) = ( 0.1333333 0.2309401 0.3095693), wk = 0.0031348 k( 250) = ( 0.1266667 0.2193931 0.3095693), wk = 0.0031348 k( 251) = ( 0.1200000 0.2078461 0.3095693), wk = 0.0031348 k( 252) = ( 0.1133333 0.1962991 0.3095693), wk = 0.0031348 k( 253) = ( 0.1066667 0.1847521 0.3095693), wk = 0.0031348 k( 254) = ( 0.1000000 0.1732051 0.3095693), wk = 0.0031348 k( 255) = ( 0.0933333 0.1616581 0.3095693), wk = 0.0031348 k( 256) = ( 0.0866667 0.1501111 0.3095693), wk = 0.0031348 k( 257) = ( 0.0800000 0.1385641 0.3095693), wk = 0.0031348 k( 258) = ( 0.0733333 0.1270171 0.3095693), wk = 0.0031348 k( 259) = ( 0.0666667 0.1154701 0.3095693), wk = 0.0031348 k( 260) = ( 0.0600000 0.1039230 0.3095693), wk = 0.0031348 k( 261) = ( 0.0533333 0.0923760 0.3095693), wk = 0.0031348 k( 262) = ( 0.0466667 0.0808290 0.3095693), wk = 0.0031348 k( 263) = ( 0.0400000 0.0692820 0.3095693), wk = 0.0031348 k( 264) = ( 0.0333333 0.0577350 0.3095693), wk = 0.0031348 k( 265) = ( 0.0266667 0.0461880 0.3095693), wk = 0.0031348 k( 266) = ( 0.0200000 0.0346410 0.3095693), wk = 0.0031348 k( 267) = ( 0.0133333 0.0230940 0.3095693), wk = 0.0031348 k( 268) = ( 0.0066667 0.0115470 0.3095693), wk = 0.0031348 k( 269) = ( 0.0000000 0.0000000 0.3095693), wk = 0.0031348 k( 270) = ( 0.5000000 0.2886751 0.3095693), wk = 0.0031348 k( 271) = ( 0.5000000 0.2886751 0.2966706), wk = 0.0031348 k( 272) = ( 0.5000000 0.2886751 0.2837719), wk = 0.0031348 k( 273) = ( 0.5000000 0.2886751 0.2708731), wk = 0.0031348 k( 274) = ( 0.5000000 0.2886751 0.2579744), wk = 0.0031348 k( 275) = ( 0.5000000 0.2886751 0.2450757), wk = 0.0031348 k( 276) = ( 0.5000000 0.2886751 0.2321770), wk = 0.0031348 k( 277) = ( 0.5000000 0.2886751 0.2192783), wk = 0.0031348 k( 278) = ( 0.5000000 0.2886751 0.2063795), wk = 0.0031348 k( 279) = ( 0.5000000 0.2886751 0.1934808), wk = 0.0031348 k( 280) = ( 0.5000000 0.2886751 0.1805821), wk = 0.0031348 k( 281) = ( 0.5000000 0.2886751 0.1676834), wk = 0.0031348 k( 282) = ( 0.5000000 0.2886751 0.1547847), wk = 0.0031348 k( 283) = ( 0.5000000 0.2886751 0.1418859), wk = 0.0031348 k( 284) = ( 0.5000000 0.2886751 0.1289872), wk = 0.0031348 k( 285) = ( 0.5000000 0.2886751 0.1160885), wk = 0.0031348 k( 286) = ( 0.5000000 0.2886751 0.1031898), wk = 0.0031348 k( 287) = ( 0.5000000 0.2886751 0.0902910), wk = 0.0031348 k( 288) = ( 0.5000000 0.2886751 0.0773923), wk = 0.0031348 k( 289) = ( 0.5000000 0.2886751 0.0644936), wk = 0.0031348 k( 290) = ( 0.5000000 0.2886751 0.0515949), wk = 0.0031348 k( 291) = ( 0.5000000 0.2886751 0.0386962), wk = 0.0031348 k( 292) = ( 0.5000000 0.2886751 0.0257974), wk = 0.0031348 k( 293) = ( 0.5000000 0.2886751 0.0128987), wk = 0.0031348 k( 294) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0031348 k( 295) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0031348 k( 296) = ( 0.3333333 0.5773503 0.0128987), wk = 0.0031348 k( 297) = ( 0.3333333 0.5773503 0.0257974), wk = 0.0031348 k( 298) = ( 0.3333333 0.5773503 0.0386962), wk = 0.0031348 k( 299) = ( 0.3333333 0.5773503 0.0515949), wk = 0.0031348 k( 300) = ( 0.3333333 0.5773503 0.0644936), wk = 0.0031348 k( 301) = ( 0.3333333 0.5773503 0.0773923), wk = 0.0031348 k( 302) = ( 0.3333333 0.5773503 0.0902910), wk = 0.0031348 k( 303) = ( 0.3333333 0.5773503 0.1031898), wk = 0.0031348 k( 304) = ( 0.3333333 0.5773503 0.1160885), wk = 0.0031348 k( 305) = ( 0.3333333 0.5773503 0.1289872), wk = 0.0031348 k( 306) = ( 0.3333333 0.5773503 0.1418859), wk = 0.0031348 k( 307) = ( 0.3333333 0.5773503 0.1547847), wk = 0.0031348 k( 308) = ( 0.3333333 0.5773503 0.1676834), wk = 0.0031348 k( 309) = ( 0.3333333 0.5773503 0.1805821), wk = 0.0031348 k( 310) = ( 0.3333333 0.5773503 0.1934808), wk = 0.0031348 k( 311) = ( 0.3333333 0.5773503 0.2063795), wk = 0.0031348 k( 312) = ( 0.3333333 0.5773503 0.2192783), wk = 0.0031348 k( 313) = ( 0.3333333 0.5773503 0.2321770), wk = 0.0031348 k( 314) = ( 0.3333333 0.5773503 0.2450757), wk = 0.0031348 k( 315) = ( 0.3333333 0.5773503 0.2579744), wk = 0.0031348 k( 316) = ( 0.3333333 0.5773503 0.2708731), wk = 0.0031348 k( 317) = ( 0.3333333 0.5773503 0.2837719), wk = 0.0031348 k( 318) = ( 0.3333333 0.5773503 0.2966706), wk = 0.0031348 k( 319) = ( 0.3333333 0.5773503 0.3095693), wk = 0.0031348 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 2) = ( 0.0113636 0.0000000 0.0000000), wk = 0.0031348 k( 3) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0031348 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0031348 k( 5) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0031348 k( 6) = ( 0.0568182 0.0000000 0.0000000), wk = 0.0031348 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0031348 k( 8) = ( 0.0795455 0.0000000 0.0000000), wk = 0.0031348 k( 9) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0031348 k( 10) = ( 0.1022727 -0.0000000 0.0000000), wk = 0.0031348 k( 11) = ( 0.1136364 0.0000000 0.0000000), wk = 0.0031348 k( 12) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0031348 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0031348 k( 14) = ( 0.1477273 0.0000000 0.0000000), wk = 0.0031348 k( 15) = ( 0.1590909 0.0000000 0.0000000), wk = 0.0031348 k( 16) = ( 0.1704546 0.0000000 0.0000000), wk = 0.0031348 k( 17) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0031348 k( 18) = ( 0.1931818 0.0000000 0.0000000), wk = 0.0031348 k( 19) = ( 0.2045454 0.0000000 0.0000000), wk = 0.0031348 k( 20) = ( 0.2159091 0.0000000 0.0000000), wk = 0.0031348 k( 21) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0031348 k( 22) = ( 0.2386364 0.0000000 0.0000000), wk = 0.0031348 k( 23) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0031348 k( 24) = ( 0.2613636 0.0000000 0.0000000), wk = 0.0031348 k( 25) = ( 0.2727273 0.0000000 0.0000000), wk = 0.0031348 k( 26) = ( 0.2840909 0.0000000 0.0000000), wk = 0.0031348 k( 27) = ( 0.2954545 0.0000000 0.0000000), wk = 0.0031348 k( 28) = ( 0.3068182 0.0000000 0.0000000), wk = 0.0031348 k( 29) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0031348 k( 30) = ( 0.3295455 0.0000000 0.0000000), wk = 0.0031348 k( 31) = ( 0.3409091 0.0000000 0.0000000), wk = 0.0031348 k( 32) = ( 0.3522727 0.0000000 0.0000000), wk = 0.0031348 k( 33) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0031348 k( 34) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0031348 k( 35) = ( 0.3863636 0.0000000 0.0000000), wk = 0.0031348 k( 36) = ( 0.3977273 0.0000000 0.0000000), wk = 0.0031348 k( 37) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0031348 k( 38) = ( 0.4204545 0.0000000 0.0000000), wk = 0.0031348 k( 39) = ( 0.4318182 0.0000000 0.0000000), wk = 0.0031348 k( 40) = ( 0.4431818 0.0000000 0.0000000), wk = 0.0031348 k( 41) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0031348 k( 42) = ( 0.4659091 0.0000000 0.0000000), wk = 0.0031348 k( 43) = ( 0.4772727 0.0000000 0.0000000), wk = 0.0031348 k( 44) = ( 0.4886364 0.0000000 0.0000000), wk = 0.0031348 k( 45) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0031348 k( 46) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0031348 k( 47) = ( 0.4933333 0.0133333 0.0000000), wk = 0.0031348 k( 48) = ( 0.4866667 0.0266667 0.0000000), wk = 0.0031348 k( 49) = ( 0.4800000 0.0400000 0.0000000), wk = 0.0031348 k( 50) = ( 0.4733333 0.0533333 0.0000000), wk = 0.0031348 k( 51) = ( 0.4666667 0.0666667 0.0000000), wk = 0.0031348 k( 52) = ( 0.4600000 0.0800000 0.0000000), wk = 0.0031348 k( 53) = ( 0.4533333 0.0933333 0.0000000), wk = 0.0031348 k( 54) = ( 0.4466667 0.1066667 0.0000000), wk = 0.0031348 k( 55) = ( 0.4400000 0.1200000 0.0000000), wk = 0.0031348 k( 56) = ( 0.4333333 0.1333333 0.0000000), wk = 0.0031348 k( 57) = ( 0.4266667 0.1466667 0.0000000), wk = 0.0031348 k( 58) = ( 0.4200000 0.1600000 0.0000000), wk = 0.0031348 k( 59) = ( 0.4133333 0.1733333 -0.0000000), wk = 0.0031348 k( 60) = ( 0.4066667 0.1866667 -0.0000000), wk = 0.0031348 k( 61) = ( 0.4000000 0.2000000 0.0000000), wk = 0.0031348 k( 62) = ( 0.3933333 0.2133333 0.0000000), wk = 0.0031348 k( 63) = ( 0.3866667 0.2266667 0.0000000), wk = 0.0031348 k( 64) = ( 0.3800000 0.2400000 0.0000000), wk = 0.0031348 k( 65) = ( 0.3733333 0.2533333 0.0000000), wk = 0.0031348 k( 66) = ( 0.3666667 0.2666667 0.0000000), wk = 0.0031348 k( 67) = ( 0.3600000 0.2800000 0.0000000), wk = 0.0031348 k( 68) = ( 0.3533333 0.2933333 0.0000000), wk = 0.0031348 k( 69) = ( 0.3466667 0.3066667 0.0000000), wk = 0.0031348 k( 70) = ( 0.3400000 0.3200000 0.0000000), wk = 0.0031348 k( 71) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031348 k( 72) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031348 k( 73) = ( 0.3266667 0.3266667 0.0000000), wk = 0.0031348 k( 74) = ( 0.3200000 0.3200000 0.0000000), wk = 0.0031348 k( 75) = ( 0.3133333 0.3133333 -0.0000000), wk = 0.0031348 k( 76) = ( 0.3066667 0.3066667 0.0000000), wk = 0.0031348 k( 77) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0031348 k( 78) = ( 0.2933333 0.2933333 0.0000000), wk = 0.0031348 k( 79) = ( 0.2866667 0.2866667 0.0000000), wk = 0.0031348 k( 80) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0031348 k( 81) = ( 0.2733333 0.2733333 0.0000000), wk = 0.0031348 k( 82) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0031348 k( 83) = ( 0.2600000 0.2600000 0.0000000), wk = 0.0031348 k( 84) = ( 0.2533333 0.2533333 0.0000000), wk = 0.0031348 k( 85) = ( 0.2466667 0.2466667 0.0000000), wk = 0.0031348 k( 86) = ( 0.2400000 0.2400000 0.0000000), wk = 0.0031348 k( 87) = ( 0.2333333 0.2333333 0.0000000), wk = 0.0031348 k( 88) = ( 0.2266667 0.2266667 0.0000000), wk = 0.0031348 k( 89) = ( 0.2200000 0.2200000 0.0000000), wk = 0.0031348 k( 90) = ( 0.2133333 0.2133333 0.0000000), wk = 0.0031348 k( 91) = ( 0.2066667 0.2066667 0.0000000), wk = 0.0031348 k( 92) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0031348 k( 93) = ( 0.1933333 0.1933333 -0.0000000), wk = 0.0031348 k( 94) = ( 0.1866667 0.1866667 -0.0000000), wk = 0.0031348 k( 95) = ( 0.1800000 0.1800000 0.0000000), wk = 0.0031348 k( 96) = ( 0.1733333 0.1733333 0.0000000), wk = 0.0031348 k( 97) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0031348 k( 98) = ( 0.1600000 0.1600000 0.0000000), wk = 0.0031348 k( 99) = ( 0.1533333 0.1533333 0.0000000), wk = 0.0031348 k( 100) = ( 0.1466667 0.1466667 0.0000000), wk = 0.0031348 k( 101) = ( 0.1400000 0.1400000 -0.0000000), wk = 0.0031348 k( 102) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0031348 k( 103) = ( 0.1266667 0.1266667 -0.0000000), wk = 0.0031348 k( 104) = ( 0.1200000 0.1200000 0.0000000), wk = 0.0031348 k( 105) = ( 0.1133333 0.1133333 0.0000000), wk = 0.0031348 k( 106) = ( 0.1066667 0.1066667 0.0000000), wk = 0.0031348 k( 107) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0031348 k( 108) = ( 0.0933333 0.0933333 0.0000000), wk = 0.0031348 k( 109) = ( 0.0866667 0.0866667 0.0000000), wk = 0.0031348 k( 110) = ( 0.0800000 0.0800000 0.0000000), wk = 0.0031348 k( 111) = ( 0.0733333 0.0733333 -0.0000000), wk = 0.0031348 k( 112) = ( 0.0666667 0.0666667 0.0000000), wk = 0.0031348 k( 113) = ( 0.0600000 0.0600000 0.0000000), wk = 0.0031348 k( 114) = ( 0.0533333 0.0533333 0.0000000), wk = 0.0031348 k( 115) = ( 0.0466667 0.0466667 0.0000000), wk = 0.0031348 k( 116) = ( 0.0400000 0.0400000 0.0000000), wk = 0.0031348 k( 117) = ( 0.0333333 0.0333333 0.0000000), wk = 0.0031348 k( 118) = ( 0.0266667 0.0266667 0.0000000), wk = 0.0031348 k( 119) = ( 0.0200000 0.0200000 0.0000000), wk = 0.0031348 k( 120) = ( 0.0133333 0.0133333 0.0000000), wk = 0.0031348 k( 121) = ( 0.0066667 0.0066667 0.0000000), wk = 0.0031348 k( 122) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031348 k( 124) = ( 0.0000000 0.0000000 0.0208333), wk = 0.0031348 k( 125) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0031348 k( 126) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0031348 k( 127) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0031348 k( 128) = ( 0.0000000 0.0000000 0.1041667), wk = 0.0031348 k( 129) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0031348 k( 130) = ( 0.0000000 0.0000000 0.1458333), wk = 0.0031348 k( 131) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0031348 k( 132) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0031348 k( 133) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0031348 k( 134) = ( 0.0000000 0.0000000 0.2291667), wk = 0.0031348 k( 135) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0031348 k( 136) = ( 0.0000000 0.0000000 0.2708333), wk = 0.0031348 k( 137) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0031348 k( 138) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0031348 k( 139) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0031348 k( 140) = ( 0.0000000 0.0000000 0.3541667), wk = 0.0031348 k( 141) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0031348 k( 142) = ( 0.0000000 0.0000000 0.3958333), wk = 0.0031348 k( 143) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0031348 k( 144) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0031348 k( 145) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0031348 k( 146) = ( 0.0000000 0.0000000 0.4791667), wk = 0.0031348 k( 147) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031348 k( 148) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031348 k( 149) = ( 0.0113636 0.0000000 0.5000000), wk = 0.0031348 k( 150) = ( 0.0227273 0.0000000 0.5000000), wk = 0.0031348 k( 151) = ( 0.0340909 0.0000000 0.5000000), wk = 0.0031348 k( 152) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0031348 k( 153) = ( 0.0568182 0.0000000 0.5000000), wk = 0.0031348 k( 154) = ( 0.0681818 0.0000000 0.5000000), wk = 0.0031348 k( 155) = ( 0.0795455 0.0000000 0.5000000), wk = 0.0031348 k( 156) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0031348 k( 157) = ( 0.1022727 -0.0000000 0.5000000), wk = 0.0031348 k( 158) = ( 0.1136364 0.0000000 0.5000000), wk = 0.0031348 k( 159) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0031348 k( 160) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0031348 k( 161) = ( 0.1477273 0.0000000 0.5000000), wk = 0.0031348 k( 162) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0031348 k( 163) = ( 0.1704546 0.0000000 0.5000000), wk = 0.0031348 k( 164) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0031348 k( 165) = ( 0.1931818 0.0000000 0.5000000), wk = 0.0031348 k( 166) = ( 0.2045454 0.0000000 0.5000000), wk = 0.0031348 k( 167) = ( 0.2159091 0.0000000 0.5000000), wk = 0.0031348 k( 168) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0031348 k( 169) = ( 0.2386364 0.0000000 0.5000000), wk = 0.0031348 k( 170) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0031348 k( 171) = ( 0.2613636 0.0000000 0.5000000), wk = 0.0031348 k( 172) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0031348 k( 173) = ( 0.2840909 0.0000000 0.5000000), wk = 0.0031348 k( 174) = ( 0.2954545 0.0000000 0.5000000), wk = 0.0031348 k( 175) = ( 0.3068182 0.0000000 0.5000000), wk = 0.0031348 k( 176) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0031348 k( 177) = ( 0.3295455 0.0000000 0.5000000), wk = 0.0031348 k( 178) = ( 0.3409091 0.0000000 0.5000000), wk = 0.0031348 k( 179) = ( 0.3522727 0.0000000 0.5000000), wk = 0.0031348 k( 180) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0031348 k( 181) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0031348 k( 182) = ( 0.3863636 0.0000000 0.5000000), wk = 0.0031348 k( 183) = ( 0.3977273 0.0000000 0.5000000), wk = 0.0031348 k( 184) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0031348 k( 185) = ( 0.4204545 0.0000000 0.5000000), wk = 0.0031348 k( 186) = ( 0.4318182 0.0000000 0.5000000), wk = 0.0031348 k( 187) = ( 0.4431818 0.0000000 0.5000000), wk = 0.0031348 k( 188) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0031348 k( 189) = ( 0.4659091 0.0000000 0.5000000), wk = 0.0031348 k( 190) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0031348 k( 191) = ( 0.4886364 0.0000000 0.5000000), wk = 0.0031348 k( 192) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031348 k( 193) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031348 k( 194) = ( 0.4933333 0.0133333 0.5000000), wk = 0.0031348 k( 195) = ( 0.4866667 0.0266667 0.5000000), wk = 0.0031348 k( 196) = ( 0.4800000 0.0400000 0.5000000), wk = 0.0031348 k( 197) = ( 0.4733333 0.0533333 0.5000000), wk = 0.0031348 k( 198) = ( 0.4666667 0.0666667 0.5000000), wk = 0.0031348 k( 199) = ( 0.4600000 0.0800000 0.5000000), wk = 0.0031348 k( 200) = ( 0.4533333 0.0933333 0.5000000), wk = 0.0031348 k( 201) = ( 0.4466667 0.1066667 0.5000000), wk = 0.0031348 k( 202) = ( 0.4400000 0.1200000 0.5000000), wk = 0.0031348 k( 203) = ( 0.4333333 0.1333333 0.5000000), wk = 0.0031348 k( 204) = ( 0.4266667 0.1466667 0.5000000), wk = 0.0031348 k( 205) = ( 0.4200000 0.1600000 0.5000000), wk = 0.0031348 k( 206) = ( 0.4133333 0.1733333 0.5000000), wk = 0.0031348 k( 207) = ( 0.4066667 0.1866667 0.5000000), wk = 0.0031348 k( 208) = ( 0.4000000 0.2000000 0.5000000), wk = 0.0031348 k( 209) = ( 0.3933333 0.2133333 0.5000000), wk = 0.0031348 k( 210) = ( 0.3866667 0.2266667 0.5000000), wk = 0.0031348 k( 211) = ( 0.3800000 0.2400000 0.5000000), wk = 0.0031348 k( 212) = ( 0.3733333 0.2533333 0.5000000), wk = 0.0031348 k( 213) = ( 0.3666667 0.2666667 0.5000000), wk = 0.0031348 k( 214) = ( 0.3600000 0.2800000 0.5000000), wk = 0.0031348 k( 215) = ( 0.3533333 0.2933333 0.5000000), wk = 0.0031348 k( 216) = ( 0.3466667 0.3066667 0.5000000), wk = 0.0031348 k( 217) = ( 0.3400000 0.3200000 0.5000000), wk = 0.0031348 k( 218) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031348 k( 219) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031348 k( 220) = ( 0.3266667 0.3266667 0.5000000), wk = 0.0031348 k( 221) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0031348 k( 222) = ( 0.3133333 0.3133333 0.5000000), wk = 0.0031348 k( 223) = ( 0.3066667 0.3066667 0.5000000), wk = 0.0031348 k( 224) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0031348 k( 225) = ( 0.2933333 0.2933333 0.5000000), wk = 0.0031348 k( 226) = ( 0.2866667 0.2866667 0.5000000), wk = 0.0031348 k( 227) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0031348 k( 228) = ( 0.2733333 0.2733333 0.5000000), wk = 0.0031348 k( 229) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0031348 k( 230) = ( 0.2600000 0.2600000 0.5000000), wk = 0.0031348 k( 231) = ( 0.2533333 0.2533333 0.5000000), wk = 0.0031348 k( 232) = ( 0.2466667 0.2466667 0.5000000), wk = 0.0031348 k( 233) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0031348 k( 234) = ( 0.2333333 0.2333333 0.5000000), wk = 0.0031348 k( 235) = ( 0.2266667 0.2266667 0.5000000), wk = 0.0031348 k( 236) = ( 0.2200000 0.2200000 0.5000000), wk = 0.0031348 k( 237) = ( 0.2133333 0.2133333 0.5000000), wk = 0.0031348 k( 238) = ( 0.2066667 0.2066667 0.5000000), wk = 0.0031348 k( 239) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0031348 k( 240) = ( 0.1933333 0.1933333 0.5000000), wk = 0.0031348 k( 241) = ( 0.1866667 0.1866667 0.5000000), wk = 0.0031348 k( 242) = ( 0.1800000 0.1800000 0.5000000), wk = 0.0031348 k( 243) = ( 0.1733333 0.1733333 0.5000000), wk = 0.0031348 k( 244) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0031348 k( 245) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0031348 k( 246) = ( 0.1533333 0.1533333 0.5000000), wk = 0.0031348 k( 247) = ( 0.1466667 0.1466667 0.5000000), wk = 0.0031348 k( 248) = ( 0.1400000 0.1400000 0.5000000), wk = 0.0031348 k( 249) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0031348 k( 250) = ( 0.1266667 0.1266667 0.5000000), wk = 0.0031348 k( 251) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0031348 k( 252) = ( 0.1133333 0.1133333 0.5000000), wk = 0.0031348 k( 253) = ( 0.1066667 0.1066667 0.5000000), wk = 0.0031348 k( 254) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0031348 k( 255) = ( 0.0933333 0.0933333 0.5000000), wk = 0.0031348 k( 256) = ( 0.0866667 0.0866667 0.5000000), wk = 0.0031348 k( 257) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0031348 k( 258) = ( 0.0733333 0.0733333 0.5000000), wk = 0.0031348 k( 259) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0031348 k( 260) = ( 0.0600000 0.0600000 0.5000000), wk = 0.0031348 k( 261) = ( 0.0533333 0.0533333 0.5000000), wk = 0.0031348 k( 262) = ( 0.0466667 0.0466667 0.5000000), wk = 0.0031348 k( 263) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0031348 k( 264) = ( 0.0333333 0.0333333 0.5000000), wk = 0.0031348 k( 265) = ( 0.0266667 0.0266667 0.5000000), wk = 0.0031348 k( 266) = ( 0.0200000 0.0200000 0.5000000), wk = 0.0031348 k( 267) = ( 0.0133333 0.0133333 0.5000000), wk = 0.0031348 k( 268) = ( 0.0066667 0.0066667 0.5000000), wk = 0.0031348 k( 269) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031348 k( 270) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031348 k( 271) = ( 0.5000000 0.0000000 0.4791667), wk = 0.0031348 k( 272) = ( 0.5000000 0.0000000 0.4583333), wk = 0.0031348 k( 273) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0031348 k( 274) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0031348 k( 275) = ( 0.5000000 0.0000000 0.3958333), wk = 0.0031348 k( 276) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0031348 k( 277) = ( 0.5000000 0.0000000 0.3541667), wk = 0.0031348 k( 278) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0031348 k( 279) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0031348 k( 280) = ( 0.5000000 0.0000000 0.2916667), wk = 0.0031348 k( 281) = ( 0.5000000 0.0000000 0.2708333), wk = 0.0031348 k( 282) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0031348 k( 283) = ( 0.5000000 0.0000000 0.2291667), wk = 0.0031348 k( 284) = ( 0.5000000 0.0000000 0.2083333), wk = 0.0031348 k( 285) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0031348 k( 286) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0031348 k( 287) = ( 0.5000000 0.0000000 0.1458333), wk = 0.0031348 k( 288) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0031348 k( 289) = ( 0.5000000 0.0000000 0.1041667), wk = 0.0031348 k( 290) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0031348 k( 291) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0031348 k( 292) = ( 0.5000000 0.0000000 0.0416667), wk = 0.0031348 k( 293) = ( 0.5000000 0.0000000 0.0208333), wk = 0.0031348 k( 294) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0031348 k( 295) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0031348 k( 296) = ( 0.3333333 0.3333333 0.0208333), wk = 0.0031348 k( 297) = ( 0.3333333 0.3333333 0.0416667), wk = 0.0031348 k( 298) = ( 0.3333333 0.3333333 0.0625000), wk = 0.0031348 k( 299) = ( 0.3333333 0.3333333 0.0833333), wk = 0.0031348 k( 300) = ( 0.3333333 0.3333333 0.1041667), wk = 0.0031348 k( 301) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0031348 k( 302) = ( 0.3333333 0.3333333 0.1458333), wk = 0.0031348 k( 303) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0031348 k( 304) = ( 0.3333333 0.3333333 0.1875000), wk = 0.0031348 k( 305) = ( 0.3333333 0.3333333 0.2083333), wk = 0.0031348 k( 306) = ( 0.3333333 0.3333333 0.2291667), wk = 0.0031348 k( 307) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0031348 k( 308) = ( 0.3333333 0.3333333 0.2708333), wk = 0.0031348 k( 309) = ( 0.3333333 0.3333333 0.2916667), wk = 0.0031348 k( 310) = ( 0.3333333 0.3333333 0.3125000), wk = 0.0031348 k( 311) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0031348 k( 312) = ( 0.3333333 0.3333333 0.3541667), wk = 0.0031348 k( 313) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0031348 k( 314) = ( 0.3333333 0.3333333 0.3958333), wk = 0.0031348 k( 315) = ( 0.3333333 0.3333333 0.4166667), wk = 0.0031348 k( 316) = ( 0.3333333 0.3333333 0.4375000), wk = 0.0031348 k( 317) = ( 0.3333333 0.3333333 0.4583333), wk = 0.0031348 k( 318) = ( 0.3333333 0.3333333 0.4791667), wk = 0.0031348 k( 319) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031348 Dense grid: 103879 G-vectors FFT dimensions: ( 54, 54, 90) Smooth grid: 34607 G-vectors FFT dimensions: ( 40, 40, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 200, 62) NL pseudopotentials 0.31 Mb ( 100, 204) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.02 Mb ( 2166) G-vector shells 0.01 Mb ( 1048) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.76 Mb ( 200, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.39 Mb ( 204, 2, 62) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./ScSiAu.save/charge-density.dat Starting wfc are 92 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.2 secs Computing kpt #: 2 total cpu time spent up to now is 54.5 secs Computing kpt #: 3 total cpu time spent up to now is 60.0 secs Computing kpt #: 4 total cpu time spent up to now is 65.5 secs Computing kpt #: 5 total cpu time spent up to now is 71.8 secs Computing kpt #: 6 total cpu time spent up to now is 78.0 secs Computing kpt #: 7 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 85.3 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 92.2 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 99.1 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 105.8 secs Computing kpt #: 11 total cpu time spent up to now is 112.2 secs Computing kpt #: 12 total cpu time spent up to now is 117.6 secs Computing kpt #: 13 total cpu time spent up to now is 122.7 secs Computing kpt #: 14 total cpu time spent up to now is 127.2 secs Computing kpt #: 15 total cpu time spent up to now is 132.1 secs Computing kpt #: 16 total cpu time spent up to now is 137.0 secs Computing kpt #: 17 total cpu time spent up to now is 142.3 secs Computing kpt #: 18 total cpu time spent up to now is 148.6 secs Computing kpt #: 19 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.7 secs Computing kpt #: 20 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 162.7 secs Computing kpt #: 21 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 170.0 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 177.4 secs Computing kpt #: 23 total cpu time spent up to now is 184.7 secs Computing kpt #: 24 total cpu time spent up to now is 190.7 secs Computing kpt #: 25 total cpu time spent up to now is 196.8 secs Computing kpt #: 26 total cpu time spent up to now is 202.2 secs Computing kpt #: 27 total cpu time spent up to now is 208.3 secs Computing kpt #: 28 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 215.4 secs Computing kpt #: 29 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 222.5 secs Computing kpt #: 30 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 229.7 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 237.0 secs Computing kpt #: 32 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 244.1 secs Computing kpt #: 33 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 251.3 secs Computing kpt #: 34 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 258.3 secs Computing kpt #: 35 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 265.6 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 273.1 secs Computing kpt #: 37 total cpu time spent up to now is 282.1 secs Computing kpt #: 38 total cpu time spent up to now is 287.8 secs Computing kpt #: 39 total cpu time spent up to now is 294.0 secs Computing kpt #: 40 total cpu time spent up to now is 298.5 secs Computing kpt #: 41 total cpu time spent up to now is 304.1 secs Computing kpt #: 42 total cpu time spent up to now is 310.1 secs Computing kpt #: 43 total cpu time spent up to now is 314.8 secs Computing kpt #: 44 total cpu time spent up to now is 319.2 secs Computing kpt #: 45 total cpu time spent up to now is 323.5 secs Computing kpt #: 46 total cpu time spent up to now is 329.1 secs Computing kpt #: 47 total cpu time spent up to now is 334.2 secs Computing kpt #: 48 total cpu time spent up to now is 339.7 secs Computing kpt #: 49 total cpu time spent up to now is 345.5 secs Computing kpt #: 50 total cpu time spent up to now is 352.0 secs Computing kpt #: 51 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 359.2 secs Computing kpt #: 52 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 366.4 secs Computing kpt #: 53 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 373.7 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 381.0 secs Computing kpt #: 55 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 388.3 secs Computing kpt #: 56 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 395.6 secs Computing kpt #: 57 total cpu time spent up to now is 402.5 secs Computing kpt #: 58 total cpu time spent up to now is 407.8 secs Computing kpt #: 59 total cpu time spent up to now is 413.2 secs Computing kpt #: 60 total cpu time spent up to now is 418.8 secs Computing kpt #: 61 total cpu time spent up to now is 423.8 secs Computing kpt #: 62 total cpu time spent up to now is 428.4 secs Computing kpt #: 63 total cpu time spent up to now is 433.3 secs Computing kpt #: 64 total cpu time spent up to now is 437.9 secs Computing kpt #: 65 total cpu time spent up to now is 442.6 secs Computing kpt #: 66 total cpu time spent up to now is 447.8 secs Computing kpt #: 67 total cpu time spent up to now is 452.8 secs Computing kpt #: 68 total cpu time spent up to now is 457.3 secs Computing kpt #: 69 total cpu time spent up to now is 462.4 secs Computing kpt #: 70 total cpu time spent up to now is 467.7 secs Computing kpt #: 71 total cpu time spent up to now is 472.3 secs Computing kpt #: 72 total cpu time spent up to now is 477.2 secs Computing kpt #: 73 total cpu time spent up to now is 481.6 secs Computing kpt #: 74 total cpu time spent up to now is 486.2 secs Computing kpt #: 75 total cpu time spent up to now is 490.7 secs Computing kpt #: 76 total cpu time spent up to now is 495.4 secs Computing kpt #: 77 total cpu time spent up to now is 500.6 secs Computing kpt #: 78 total cpu time spent up to now is 505.4 secs Computing kpt #: 79 total cpu time spent up to now is 510.7 secs Computing kpt #: 80 total cpu time spent up to now is 515.7 secs Computing kpt #: 81 total cpu time spent up to now is 521.3 secs Computing kpt #: 82 total cpu time spent up to now is 527.0 secs Computing kpt #: 83 total cpu time spent up to now is 532.7 secs Computing kpt #: 84 total cpu time spent up to now is 537.7 secs Computing kpt #: 85 total cpu time spent up to now is 543.3 secs Computing kpt #: 86 total cpu time spent up to now is 549.8 secs Computing kpt #: 87 total cpu time spent up to now is 555.3 secs Computing kpt #: 88 total cpu time spent up to now is 560.7 secs Computing kpt #: 89 total cpu time spent up to now is 566.3 secs Computing kpt #: 90 total cpu time spent up to now is 572.2 secs Computing kpt #: 91 total cpu time spent up to now is 579.4 secs Computing kpt #: 92 total cpu time spent up to now is 584.9 secs Computing kpt #: 93 total cpu time spent up to now is 590.5 secs Computing kpt #: 94 total cpu time spent up to now is 595.7 secs Computing kpt #: 95 total cpu time spent up to now is 600.9 secs Computing kpt #: 96 total cpu time spent up to now is 606.3 secs Computing kpt #: 97 total cpu time spent up to now is 611.9 secs Computing kpt #: 98 total cpu time spent up to now is 619.1 secs Computing kpt #: 99 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 626.2 secs Computing kpt #: 100 total cpu time spent up to now is 633.2 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 640.3 secs Computing kpt #: 102 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 647.3 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 654.4 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 661.4 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 668.5 secs Computing kpt #: 106 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 675.4 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 682.1 secs Computing kpt #: 108 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 689.0 secs Computing kpt #: 109 total cpu time spent up to now is 695.2 secs Computing kpt #: 110 total cpu time spent up to now is 701.7 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 708.4 secs Computing kpt #: 112 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 715.3 secs Computing kpt #: 113 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 722.2 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 729.4 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 736.5 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 743.5 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 750.6 secs Computing kpt #: 118 total cpu time spent up to now is 757.3 secs Computing kpt #: 119 total cpu time spent up to now is 763.5 secs Computing kpt #: 120 total cpu time spent up to now is 768.8 secs Computing kpt #: 121 total cpu time spent up to now is 774.2 secs Computing kpt #: 122 total cpu time spent up to now is 779.1 secs Computing kpt #: 123 total cpu time spent up to now is 784.2 secs Computing kpt #: 124 total cpu time spent up to now is 790.6 secs Computing kpt #: 125 total cpu time spent up to now is 797.0 secs Computing kpt #: 126 total cpu time spent up to now is 803.9 secs Computing kpt #: 127 total cpu time spent up to now is 809.8 secs Computing kpt #: 128 total cpu time spent up to now is 815.0 secs Computing kpt #: 129 total cpu time spent up to now is 819.8 secs Computing kpt #: 130 total cpu time spent up to now is 824.2 secs Computing kpt #: 131 total cpu time spent up to now is 828.2 secs Computing kpt #: 132 total cpu time spent up to now is 832.4 secs Computing kpt #: 133 total cpu time spent up to now is 836.6 secs Computing kpt #: 134 total cpu time spent up to now is 840.7 secs Computing kpt #: 135 total cpu time spent up to now is 845.1 secs Computing kpt #: 136 total cpu time spent up to now is 849.2 secs Computing kpt #: 137 total cpu time spent up to now is 853.9 secs Computing kpt #: 138 total cpu time spent up to now is 858.5 secs Computing kpt #: 139 total cpu time spent up to now is 863.0 secs Computing kpt #: 140 total cpu time spent up to now is 868.1 secs Computing kpt #: 141 total cpu time spent up to now is 873.2 secs Computing kpt #: 142 total cpu time spent up to now is 880.4 secs Computing kpt #: 143 total cpu time spent up to now is 885.9 secs Computing kpt #: 144 total cpu time spent up to now is 891.7 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 898.8 secs Computing kpt #: 146 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 906.1 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 913.0 secs Computing kpt #: 148 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 920.2 secs Computing kpt #: 149 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 927.4 secs Computing kpt #: 150 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 934.4 secs Computing kpt #: 151 total cpu time spent up to now is 940.4 secs Computing kpt #: 152 total cpu time spent up to now is 945.9 secs Computing kpt #: 153 total cpu time spent up to now is 951.4 secs Computing kpt #: 154 total cpu time spent up to now is 956.5 secs Computing kpt #: 155 total cpu time spent up to now is 961.7 secs Computing kpt #: 156 total cpu time spent up to now is 966.9 secs Computing kpt #: 157 total cpu time spent up to now is 972.1 secs Computing kpt #: 158 total cpu time spent up to now is 977.6 secs Computing kpt #: 159 total cpu time spent up to now is 983.0 secs Computing kpt #: 160 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 990.1 secs Computing kpt #: 161 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 996.9 secs Computing kpt #: 162 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1003.6 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1010.4 secs Computing kpt #: 164 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1017.2 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1024.1 secs Computing kpt #: 166 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1030.9 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1037.8 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1044.5 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1051.4 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1058.2 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1065.4 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1072.3 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1079.3 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1086.1 secs Computing kpt #: 175 total cpu time spent up to now is 1092.9 secs Computing kpt #: 176 total cpu time spent up to now is 1099.1 secs Computing kpt #: 177 total cpu time spent up to now is 1105.5 secs Computing kpt #: 178 total cpu time spent up to now is 1111.9 secs Computing kpt #: 179 total cpu time spent up to now is 1118.1 secs Computing kpt #: 180 total cpu time spent up to now is 1125.1 secs Computing kpt #: 181 total cpu time spent up to now is 1130.8 secs Computing kpt #: 182 total cpu time spent up to now is 1137.7 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1144.6 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1152.1 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1159.5 secs Computing kpt #: 186 total cpu time spent up to now is 1166.7 secs Computing kpt #: 187 total cpu time spent up to now is 1172.9 secs Computing kpt #: 188 total cpu time spent up to now is 1181.2 secs Computing kpt #: 189 total cpu time spent up to now is 1187.6 secs Computing kpt #: 190 total cpu time spent up to now is 1194.7 secs Computing kpt #: 191 total cpu time spent up to now is 1200.4 secs Computing kpt #: 192 total cpu time spent up to now is 1206.3 secs Computing kpt #: 193 total cpu time spent up to now is 1212.1 secs Computing kpt #: 194 total cpu time spent up to now is 1218.0 secs Computing kpt #: 195 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1225.2 secs Computing kpt #: 196 total cpu time spent up to now is 1231.4 secs Computing kpt #: 197 total cpu time spent up to now is 1237.7 secs Computing kpt #: 198 total cpu time spent up to now is 1243.8 secs Computing kpt #: 199 total cpu time spent up to now is 1250.5 secs Computing kpt #: 200 total cpu time spent up to now is 1256.5 secs Computing kpt #: 201 total cpu time spent up to now is 1262.5 secs Computing kpt #: 202 total cpu time spent up to now is 1268.1 secs Computing kpt #: 203 total cpu time spent up to now is 1273.6 secs Computing kpt #: 204 total cpu time spent up to now is 1278.9 secs Computing kpt #: 205 total cpu time spent up to now is 1284.4 secs Computing kpt #: 206 total cpu time spent up to now is 1290.0 secs Computing kpt #: 207 total cpu time spent up to now is 1295.1 secs Computing kpt #: 208 total cpu time spent up to now is 1300.5 secs Computing kpt #: 209 total cpu time spent up to now is 1305.5 secs Computing kpt #: 210 total cpu time spent up to now is 1310.6 secs Computing kpt #: 211 total cpu time spent up to now is 1315.4 secs Computing kpt #: 212 total cpu time spent up to now is 1320.1 secs Computing kpt #: 213 total cpu time spent up to now is 1325.0 secs Computing kpt #: 214 total cpu time spent up to now is 1329.0 secs Computing kpt #: 215 total cpu time spent up to now is 1333.5 secs Computing kpt #: 216 total cpu time spent up to now is 1337.6 secs Computing kpt #: 217 total cpu time spent up to now is 1341.6 secs Computing kpt #: 218 total cpu time spent up to now is 1346.0 secs Computing kpt #: 219 total cpu time spent up to now is 1350.1 secs Computing kpt #: 220 total cpu time spent up to now is 1354.4 secs Computing kpt #: 221 total cpu time spent up to now is 1358.9 secs Computing kpt #: 222 total cpu time spent up to now is 1363.5 secs Computing kpt #: 223 total cpu time spent up to now is 1368.2 secs Computing kpt #: 224 total cpu time spent up to now is 1373.2 secs Computing kpt #: 225 total cpu time spent up to now is 1378.5 secs Computing kpt #: 226 total cpu time spent up to now is 1383.9 secs Computing kpt #: 227 total cpu time spent up to now is 1389.5 secs Computing kpt #: 228 total cpu time spent up to now is 1395.2 secs Computing kpt #: 229 total cpu time spent up to now is 1401.1 secs Computing kpt #: 230 total cpu time spent up to now is 1407.4 secs Computing kpt #: 231 total cpu time spent up to now is 1414.3 secs Computing kpt #: 232 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1421.3 secs Computing kpt #: 233 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1428.6 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1435.9 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1443.7 secs Computing kpt #: 236 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1451.2 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1458.6 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1466.1 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1473.3 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1482.6 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1489.9 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1497.0 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1504.0 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1510.9 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1518.1 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1525.1 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1532.6 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1539.5 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1546.4 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1553.4 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1560.8 secs Computing kpt #: 252 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1568.5 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1575.8 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1582.9 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1590.2 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1597.2 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1604.2 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1611.2 secs Computing kpt #: 259 total cpu time spent up to now is 1616.5 secs Computing kpt #: 260 total cpu time spent up to now is 1621.6 secs Computing kpt #: 261 total cpu time spent up to now is 1626.8 secs Computing kpt #: 262 total cpu time spent up to now is 1632.0 secs Computing kpt #: 263 total cpu time spent up to now is 1637.2 secs Computing kpt #: 264 total cpu time spent up to now is 1642.7 secs Computing kpt #: 265 total cpu time spent up to now is 1648.3 secs Computing kpt #: 266 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1655.3 secs Computing kpt #: 267 total cpu time spent up to now is 1662.7 secs Computing kpt #: 268 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1670.0 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1676.9 secs Computing kpt #: 270 total cpu time spent up to now is 1683.1 secs Computing kpt #: 271 total cpu time spent up to now is 1690.3 secs Computing kpt #: 272 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1697.5 secs Computing kpt #: 273 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1704.9 secs Computing kpt #: 274 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1712.4 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1720.1 secs Computing kpt #: 276 total cpu time spent up to now is 1726.4 secs Computing kpt #: 277 total cpu time spent up to now is 1732.4 secs Computing kpt #: 278 total cpu time spent up to now is 1739.3 secs Computing kpt #: 279 total cpu time spent up to now is 1745.3 secs Computing kpt #: 280 total cpu time spent up to now is 1750.8 secs Computing kpt #: 281 total cpu time spent up to now is 1757.7 secs Computing kpt #: 282 total cpu time spent up to now is 1763.2 secs Computing kpt #: 283 total cpu time spent up to now is 1768.5 secs Computing kpt #: 284 total cpu time spent up to now is 1774.0 secs Computing kpt #: 285 total cpu time spent up to now is 1781.0 secs Computing kpt #: 286 total cpu time spent up to now is 1785.6 secs Computing kpt #: 287 total cpu time spent up to now is 1792.2 secs Computing kpt #: 288 total cpu time spent up to now is 1796.8 secs Computing kpt #: 289 total cpu time spent up to now is 1801.8 secs Computing kpt #: 290 total cpu time spent up to now is 1807.2 secs Computing kpt #: 291 total cpu time spent up to now is 1812.4 secs Computing kpt #: 292 total cpu time spent up to now is 1817.5 secs Computing kpt #: 293 total cpu time spent up to now is 1822.8 secs Computing kpt #: 294 total cpu time spent up to now is 1827.4 secs Computing kpt #: 295 total cpu time spent up to now is 1832.7 secs Computing kpt #: 296 total cpu time spent up to now is 1837.9 secs Computing kpt #: 297 total cpu time spent up to now is 1842.7 secs Computing kpt #: 298 total cpu time spent up to now is 1847.8 secs Computing kpt #: 299 total cpu time spent up to now is 1852.4 secs Computing kpt #: 300 total cpu time spent up to now is 1858.0 secs Computing kpt #: 301 total cpu time spent up to now is 1863.4 secs Computing kpt #: 302 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1870.5 secs Computing kpt #: 303 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1877.6 secs Computing kpt #: 304 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1884.6 secs Computing kpt #: 305 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1891.9 secs Computing kpt #: 306 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1899.2 secs Computing kpt #: 307 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1906.2 secs Computing kpt #: 308 total cpu time spent up to now is 1912.1 secs Computing kpt #: 309 total cpu time spent up to now is 1917.3 secs Computing kpt #: 310 total cpu time spent up to now is 1922.3 secs Computing kpt #: 311 total cpu time spent up to now is 1927.0 secs Computing kpt #: 312 total cpu time spent up to now is 1931.7 secs Computing kpt #: 313 total cpu time spent up to now is 1936.4 secs Computing kpt #: 314 total cpu time spent up to now is 1940.9 secs Computing kpt #: 315 total cpu time spent up to now is 1945.5 secs Computing kpt #: 316 total cpu time spent up to now is 1950.0 secs Computing kpt #: 317 total cpu time spent up to now is 1954.3 secs Computing kpt #: 318 total cpu time spent up to now is 1958.7 secs Computing kpt #: 319 total cpu time spent up to now is 1963.3 secs ethr = 1.92E-11, avg # of iterations = 89.5 total cpu time spent up to now is 1963.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4283 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6972 -15.6972 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1758 -15.1758 1.9117 1.9117 3.6835 3.6835 5.8219 5.8219 5.8818 5.8818 6.2595 6.2595 6.5330 6.5330 6.8976 6.8976 7.0187 7.0187 7.3135 7.3135 7.5040 7.5040 8.0480 8.0480 8.4396 8.4396 9.4590 9.4590 11.6627 11.6627 11.7871 11.7871 12.5113 12.5113 13.7461 13.7461 13.7577 13.7577 14.2746 14.2746 14.4518 14.4518 14.4520 14.4520 14.7051 14.7051 15.1455 15.1455 k = 0.0114 0.0066-0.0000 ( 4287 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6973 -15.6973 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1759 -15.1759 1.9131 1.9131 3.6843 3.6843 5.8223 5.8223 5.8818 5.8818 6.2595 6.2595 6.5320 6.5320 6.8982 6.8982 7.0185 7.0185 7.3115 7.3115 7.5090 7.5090 8.0479 8.0479 8.4393 8.4393 9.4591 9.4591 11.6580 11.6580 11.7821 11.7821 12.5170 12.5170 13.6978 13.6978 13.7898 13.7898 14.2717 14.2717 14.4441 14.4441 14.4565 14.4565 14.7051 14.7051 15.1499 15.1499 k = 0.0227 0.0131-0.0000 ( 4291 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6973 -15.6973 -15.3973 -15.3973 -15.3702 -15.3702 -15.1892 -15.1892 -15.1759 -15.1759 1.9174 1.9174 3.6868 3.6868 5.8236 5.8236 5.8819 5.8819 6.2598 6.2598 6.5292 6.5292 6.9000 6.9000 7.0178 7.0178 7.3059 7.3059 7.5232 7.5232 8.0477 8.0477 8.4385 8.4385 9.4591 9.4591 11.6428 11.6428 11.7693 11.7693 12.5331 12.5331 13.6308 13.6308 13.8077 13.8077 14.2623 14.2623 14.4327 14.4327 14.4594 14.4594 14.7057 14.7057 15.1628 15.1628 k = 0.0341 0.0197-0.0000 ( 4295 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8923 -15.8923 -15.6974 -15.6974 -15.3973 -15.3973 -15.3703 -15.3703 -15.1893 -15.1893 -15.1759 -15.1759 1.9246 1.9246 3.6908 3.6908 5.8257 5.8257 5.8819 5.8819 6.2602 6.2602 6.5246 6.5246 6.9029 6.9029 7.0166 7.0166 7.2983 7.2983 7.5450 7.5450 8.0475 8.0475 8.4371 8.4371 9.4593 9.4593 11.6141 11.6141 11.7541 11.7541 12.5574 12.5574 13.5529 13.5529 13.8042 13.8042 14.2452 14.2452 14.4193 14.4193 14.4613 14.4613 14.7088 14.7088 15.1838 15.1838 k = 0.0455 0.0262-0.0000 ( 4307 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8924 -15.8924 -15.6975 -15.6975 -15.3973 -15.3973 -15.3704 -15.3704 -15.1895 -15.1895 -15.1760 -15.1760 1.9346 1.9346 3.6965 3.6965 5.8286 5.8286 5.8820 5.8820 6.2608 6.2608 6.5184 6.5184 6.9069 6.9069 7.0150 7.0150 7.2901 7.2901 7.5727 7.5727 8.0471 8.0471 8.4352 8.4352 9.4594 9.4594 11.5703 11.5703 11.7406 11.7406 12.5867 12.5867 13.4659 13.4659 13.7789 13.7789 14.2187 14.2187 14.4066 14.4066 14.4620 14.4620 14.7164 14.7164 15.2120 15.2120 k = 0.0568 0.0328-0.0000 ( 4311 PWs) bands (ev): -36.9135 -36.9135 -36.6995 -36.6995 -15.8924 -15.8924 -15.6976 -15.6976 -15.3974 -15.3974 -15.3706 -15.3706 -15.1898 -15.1898 -15.1760 -15.1760 1.9474 1.9474 3.7038 3.7038 5.8322 5.8322 5.8823 5.8823 6.2615 6.2615 6.5110 6.5110 6.9122 6.9122 7.0129 7.0129 7.2823 7.2823 7.6051 7.6051 8.0468 8.0468 8.4328 8.4328 9.4597 9.4597 11.5131 11.5131 11.7298 11.7298 12.6183 12.6183 13.3714 13.3714 13.7336 13.7336 14.1820 14.1820 14.3969 14.3969 14.4601 14.4601 14.7300 14.7300 15.2468 15.2468 k = 0.0682 0.0394-0.0000 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6995 -36.6995 -15.8925 -15.8925 -15.6978 -15.6978 -15.3974 -15.3974 -15.3709 -15.3709 -15.1901 -15.1901 -15.1761 -15.1761 1.9630 1.9630 3.7126 3.7126 5.8361 5.8361 5.8827 5.8827 6.2624 6.2624 6.5025 6.5025 6.9185 6.9185 7.0106 7.0106 7.2755 7.2755 7.6413 7.6413 8.0465 8.0465 8.4298 8.4298 9.4599 9.4599 11.4457 11.4457 11.7206 11.7206 12.6496 12.6496 13.2705 13.2705 13.6714 13.6714 14.1360 14.1360 14.3909 14.3909 14.4545 14.4545 14.7496 14.7496 15.2870 15.2870 k = 0.0795 0.0459-0.0000 ( 4327 PWs) bands (ev): -36.9135 -36.9135 -36.6994 -36.6994 -15.8926 -15.8926 -15.6980 -15.6980 -15.3975 -15.3975 -15.3711 -15.3711 -15.1904 -15.1904 -15.1761 -15.1761 1.9814 1.9814 3.7231 3.7231 5.8402 5.8402 5.8837 5.8837 6.2633 6.2633 6.4934 6.4934 6.9259 6.9259 7.0080 7.0080 7.2700 7.2700 7.6804 7.6804 8.0463 8.0463 8.4264 8.4264 9.4602 9.4602 11.3706 11.3706 11.7121 11.7121 12.6785 12.6785 13.1643 13.1643 13.5960 13.5960 14.0824 14.0824 14.3880 14.3880 14.4447 14.4447 14.7740 14.7740 15.3231 15.3234 k = 0.0909 0.0525-0.0000 ( 4323 PWs) bands (ev): -36.9135 -36.9135 -36.6994 -36.6994 -15.8927 -15.8927 -15.6982 -15.6982 -15.3975 -15.3975 -15.3714 -15.3714 -15.1908 -15.1908 -15.1762 -15.1762 2.0025 2.0025 3.7350 3.7350 5.8440 5.8440 5.8856 5.8856 6.2643 6.2643 6.4839 6.4839 6.9344 6.9344 7.0053 7.0053 7.2660 7.2660 7.7219 7.7219 8.0465 8.0465 8.4226 8.4226 9.4605 9.4605 11.2895 11.2895 11.7036 11.7036 12.7026 12.7026 13.0540 13.0540 13.5107 13.5107 14.0237 14.0237 14.3870 14.3870 14.4315 14.4315 14.8016 14.8016 15.3174 15.3174 k = 0.1023 0.0590-0.0000 ( 4327 PWs) bands (ev): -36.9135 -36.9135 -36.6994 -36.6994 -15.8928 -15.8928 -15.6984 -15.6984 -15.3976 -15.3976 -15.3717 -15.3717 -15.1912 -15.1912 -15.1763 -15.1763 2.0263 2.0263 3.7485 3.7485 5.8468 5.8468 5.8889 5.8889 6.2653 6.2653 6.4744 6.4744 6.9439 6.9439 7.0026 7.0026 7.2633 7.2633 7.7650 7.7650 8.0472 8.0472 8.4184 8.4184 9.4607 9.4607 11.2038 11.2038 11.6948 11.6948 12.7183 12.7183 12.9426 12.9426 13.4184 13.4184 13.9619 13.9619 14.3855 14.3855 14.4171 14.4171 14.8309 14.8309 15.3037 15.3037 k = 0.1136 0.0656-0.0000 ( 4329 PWs) bands (ev): -36.9134 -36.9134 -36.6993 -36.6993 -15.8929 -15.8929 -15.6986 -15.6986 -15.3976 -15.3976 -15.3721 -15.3721 -15.1916 -15.1916 -15.1764 -15.1764 2.0528 2.0528 3.7635 3.7635 5.8481 5.8481 5.8941 5.8941 6.2664 6.2664 6.4651 6.4651 6.9542 6.9542 7.0002 7.0002 7.2619 7.2619 7.8090 7.8090 8.0491 8.0491 8.4140 8.4140 9.4610 9.4610 11.1142 11.1142 11.6853 11.6853 12.7126 12.7126 12.8423 12.8423 13.3214 13.3214 13.8991 13.8991 14.3771 14.3771 14.4082 14.4082 14.8605 14.8605 15.2910 15.2910 k = 0.1250 0.0722-0.0000 ( 4327 PWs) bands (ev): -36.9134 -36.9134 -36.6993 -36.6993 -15.8931 -15.8931 -15.6989 -15.6989 -15.3977 -15.3977 -15.3724 -15.3724 -15.1921 -15.1921 -15.1764 -15.1764 2.0818 2.0818 3.7799 3.7799 5.8477 5.8477 5.9012 5.9012 6.2674 6.2674 6.4564 6.4564 6.9650 6.9650 6.9986 6.9986 7.2619 7.2619 7.8525 7.8525 8.0529 8.0529 8.4093 8.4093 9.4611 9.4611 11.0216 11.0216 11.6751 11.6751 12.6460 12.6460 12.7920 12.7920 13.2214 13.2214 13.8370 13.8370 14.3585 14.3585 14.4085 14.4085 14.8895 14.8895 15.2810 15.2810 k = 0.1364 0.0787-0.0000 ( 4333 PWs) bands (ev): -36.9134 -36.9134 -36.6993 -36.6993 -15.8932 -15.8932 -15.6992 -15.6992 -15.3978 -15.3978 -15.3729 -15.3729 -15.1927 -15.1927 -15.1765 -15.1765 2.1133 2.1133 3.7977 3.7977 5.8457 5.8457 5.9101 5.9101 6.2684 6.2684 6.4484 6.4484 6.9751 6.9751 6.9988 6.9988 7.2630 7.2630 7.8935 7.8935 8.0605 8.0605 8.4044 8.4044 9.4612 9.4612 10.9264 10.9264 11.6640 11.6640 12.5320 12.5320 12.7777 12.7777 13.1199 13.1199 13.7774 13.7774 14.3351 14.3351 14.4131 14.4131 14.9174 14.9174 15.2746 15.2746 k = 0.1477 0.0853-0.0000 ( 4327 PWs) bands (ev): -36.9133 -36.9133 -36.6992 -36.6992 -15.8933 -15.8933 -15.6994 -15.6994 -15.3979 -15.3979 -15.3733 -15.3733 -15.1933 -15.1933 -15.1766 -15.1766 2.1472 2.1472 3.8169 3.8169 5.8424 5.8424 5.9205 5.9205 6.2693 6.2693 6.4414 6.4414 6.9818 6.9818 7.0039 7.0039 7.2651 7.2651 7.9289 7.9289 8.0746 8.0746 8.3997 8.3997 9.4611 9.4611 10.8290 10.8290 11.6519 11.6519 12.4051 12.4051 12.7641 12.7641 13.0183 13.0183 13.7218 13.7218 14.3098 14.3098 14.4196 14.4196 14.9439 14.9439 15.2718 15.2718 k = 0.1591 0.0919-0.0000 ( 4321 PWs) bands (ev): -36.9133 -36.9133 -36.6992 -36.6992 -15.8935 -15.8935 -15.6997 -15.6997 -15.3979 -15.3979 -15.3737 -15.3737 -15.1939 -15.1939 -15.1766 -15.1766 2.1834 2.1834 3.8374 3.8374 5.8380 5.8380 5.9321 5.9321 6.2703 6.2703 6.4354 6.4354 6.9840 6.9840 7.0149 7.0149 7.2682 7.2682 7.9548 7.9548 8.0984 8.0984 8.3951 8.3951 9.4609 9.4609 10.7299 10.7299 11.6388 11.6388 12.2735 12.2735 12.7423 12.7423 12.9185 12.9185 13.6714 13.6714 14.2836 14.2836 14.4273 14.4273 14.9688 14.9688 15.2728 15.2728 k = 0.1705 0.0984-0.0000 ( 4330 PWs) bands (ev): -36.9132 -36.9132 -36.6991 -36.6991 -15.8937 -15.8937 -15.7001 -15.7001 -15.3980 -15.3980 -15.3742 -15.3742 -15.1945 -15.1945 -15.1767 -15.1767 2.2219 2.2219 3.8591 3.8591 5.8325 5.8325 5.9447 5.9447 6.2713 6.2713 6.4307 6.4307 6.9845 6.9845 7.0291 7.0291 7.2722 7.2722 7.9706 7.9706 8.1321 8.1321 8.3913 8.3913 9.4604 9.4604 10.6293 10.6293 11.6247 11.6247 12.1393 12.1393 12.7072 12.7072 12.8238 12.8238 13.6271 13.6271 14.2572 14.2572 14.4359 14.4359 14.9920 14.9920 15.2773 15.2773 k = 0.1818 0.1050-0.0000 ( 4336 PWs) bands (ev): -36.9132 -36.9132 -36.6991 -36.6991 -15.8938 -15.8938 -15.7004 -15.7004 -15.3982 -15.3982 -15.3747 -15.3747 -15.1952 -15.1952 -15.1768 -15.1768 2.2625 2.2625 3.8819 3.8819 5.8263 5.8263 5.9582 5.9582 6.2724 6.2724 6.4271 6.4271 6.9848 6.9848 7.0449 7.0449 7.2770 7.2770 7.9789 7.9789 8.1719 8.1719 8.3888 8.3888 9.4596 9.4596 10.5279 10.5279 11.6094 11.6094 12.0038 12.0038 12.6511 12.6511 12.7425 12.7425 13.5893 13.5893 14.2309 14.2309 14.4453 14.4453 15.0134 15.0134 15.2849 15.2849 k = 0.1932 0.1115-0.0000 ( 4346 PWs) bands (ev): -36.9132 -36.9132 -36.6990 -36.6990 -15.8940 -15.8940 -15.7008 -15.7008 -15.3983 -15.3983 -15.3752 -15.3752 -15.1959 -15.1959 -15.1769 -15.1769 2.3051 2.3051 3.9059 3.9059 5.8194 5.8194 5.9724 5.9724 6.2736 6.2736 6.4247 6.4247 6.9855 6.9855 7.0616 7.0616 7.2825 7.2825 7.9827 7.9827 8.2131 8.2131 8.3891 8.3891 9.4584 9.4584 10.4259 10.4259 11.5929 11.5929 11.8680 11.8680 12.5707 12.5707 12.6784 12.6784 13.5579 13.5579 14.2053 14.2053 14.4555 14.4555 15.0331 15.0331 15.2952 15.2952 k = 0.2045 0.1181-0.0000 ( 4342 PWs) bands (ev): -36.9131 -36.9131 -36.6990 -36.6990 -15.8942 -15.8942 -15.7011 -15.7011 -15.3984 -15.3984 -15.3757 -15.3757 -15.1966 -15.1966 -15.1770 -15.1770 2.3497 2.3497 3.9309 3.9309 5.8119 5.8119 5.9871 5.9871 6.2751 6.2751 6.4235 6.4235 6.9869 6.9869 7.0792 7.0792 7.2888 7.2888 7.9841 7.9841 8.2506 8.2506 8.3950 8.3950 9.4567 9.4567 10.3239 10.3239 11.5751 11.5751 11.7325 11.7325 12.4783 12.4783 12.6207 12.6207 13.5324 13.5324 14.1805 14.1805 14.4662 14.4662 15.0509 15.0509 15.3065 15.3065 k = 0.2159 0.1247-0.0000 ( 4334 PWs) bands (ev): -36.9131 -36.9131 -36.6989 -36.6989 -15.8944 -15.8944 -15.7015 -15.7015 -15.3985 -15.3985 -15.3762 -15.3762 -15.1973 -15.1973 -15.1771 -15.1771 2.3959 2.3959 3.9568 3.9568 5.8041 5.8041 6.0024 6.0024 6.2770 6.2770 6.4235 6.4235 6.9889 6.9889 7.0973 7.0973 7.2956 7.2956 7.9841 7.9841 8.2784 8.2784 8.4107 8.4107 9.4544 9.4544 10.2227 10.2227 11.5545 11.5545 11.5997 11.5997 12.3825 12.3825 12.5621 12.5621 13.5119 13.5119 14.1567 14.1567 14.4775 14.4775 15.0665 15.0665 15.3078 15.3078 k = 0.2273 0.1312-0.0000 ( 4330 PWs) bands (ev): -36.9130 -36.9130 -36.6989 -36.6989 -15.8946 -15.8946 -15.7019 -15.7019 -15.3986 -15.3986 -15.3767 -15.3767 -15.1981 -15.1981 -15.1771 -15.1771 2.4438 2.4438 3.9835 3.9835 5.7960 5.7960 6.0180 6.0180 6.2793 6.2793 6.4245 6.4245 6.9917 6.9917 7.1156 7.1156 7.3031 7.3031 7.9831 7.9831 8.2935 8.2935 8.4381 8.4381 9.4513 9.4513 10.1229 10.1229 11.4618 11.4618 11.5395 11.5395 12.2865 12.2865 12.5012 12.5012 13.4956 13.4956 14.1341 14.1341 14.4892 14.4892 15.0792 15.0792 15.2681 15.2681 k = 0.2386 0.1378-0.0000 ( 4334 PWs) bands (ev): -36.9130 -36.9130 -36.6988 -36.6988 -15.8948 -15.8948 -15.7022 -15.7022 -15.3988 -15.3988 -15.3772 -15.3772 -15.1988 -15.1988 -15.1772 -15.1772 2.4931 2.4931 4.0110 4.0110 5.7879 5.7879 6.0337 6.0337 6.2822 6.2822 6.4265 6.4265 6.9952 6.9952 7.1342 7.1342 7.3113 7.3113 7.9817 7.9817 8.2985 8.2985 8.4736 8.4736 9.4473 9.4473 10.0255 10.0255 11.3315 11.3315 11.5178 11.5178 12.1913 12.1913 12.4383 12.4383 13.4827 13.4827 14.1127 14.1127 14.5013 14.5013 15.0867 15.0867 15.2206 15.2206 k = 0.2500 0.1443-0.0000 ( 4330 PWs) bands (ev): -36.9129 -36.9129 -36.6988 -36.6988 -15.8950 -15.8950 -15.7026 -15.7026 -15.3989 -15.3989 -15.3777 -15.3777 -15.1996 -15.1996 -15.1773 -15.1773 2.5436 2.5436 4.0390 4.0390 5.7798 5.7798 6.0496 6.0496 6.2859 6.2859 6.4294 6.4294 6.9994 6.9994 7.1525 7.1525 7.3201 7.3201 7.9799 7.9799 8.2978 8.2978 8.5114 8.5114 9.4420 9.4420 9.9318 9.9318 11.2033 11.2033 11.4960 11.4960 12.0976 12.0976 12.3741 12.3741 13.4724 13.4724 14.0926 14.0926 14.5136 14.5136 15.0831 15.0831 15.1845 15.1845 k = 0.2614 0.1509-0.0000 ( 4338 PWs) bands (ev): -36.9129 -36.9129 -36.6987 -36.6987 -15.8952 -15.8952 -15.7030 -15.7030 -15.3990 -15.3990 -15.3782 -15.3782 -15.2003 -15.2003 -15.1774 -15.1774 2.5951 2.5951 4.0675 4.0675 5.7720 5.7720 6.0654 6.0654 6.2903 6.2903 6.4333 6.4333 7.0042 7.0042 7.1704 7.1704 7.3296 7.3296 7.9779 7.9779 8.2941 8.2941 8.5474 8.5474 9.4352 9.4352 9.8435 9.8435 11.0783 11.0783 11.4734 11.4734 12.0057 12.0057 12.3094 12.3094 13.4641 13.4641 14.0739 14.0739 14.5260 14.5260 15.0607 15.0607 15.1690 15.1690 k = 0.2727 0.1575-0.0000 ( 4334 PWs) bands (ev): -36.9128 -36.9128 -36.6987 -36.6987 -15.8954 -15.8954 -15.7034 -15.7034 -15.3992 -15.3992 -15.3787 -15.3787 -15.2011 -15.2011 -15.1774 -15.1774 2.6475 2.6475 4.0964 4.0964 5.7646 5.7646 6.0809 6.0809 6.2957 6.2957 6.4380 6.4380 7.0096 7.0096 7.1875 7.1875 7.3399 7.3399 7.9760 7.9760 8.2886 8.2886 8.5787 8.5787 9.4264 9.4264 9.7625 9.7625 10.9573 10.9573 11.4500 11.4500 11.9160 11.9160 12.2451 12.2451 13.4574 13.4574 14.0566 14.0566 14.5384 14.5384 15.0250 15.0250 15.1689 15.1689 k = 0.2841 0.1640-0.0000 ( 4330 PWs) bands (ev): -36.9128 -36.9128 -36.6986 -36.6986 -15.8956 -15.8956 -15.7038 -15.7038 -15.3993 -15.3993 -15.3792 -15.3792 -15.2018 -15.2018 -15.1775 -15.1775 2.7004 2.7004 4.1255 4.1255 5.7579 5.7579 6.0960 6.0960 6.3021 6.3021 6.4437 6.4437 7.0154 7.0154 7.2035 7.2035 7.3511 7.3511 7.9740 7.9740 8.2820 8.2820 8.6024 8.6024 9.4149 9.4149 9.6913 9.6913 10.8411 10.8411 11.4258 11.4258 11.8287 11.8287 12.1818 12.1818 13.4519 13.4519 14.0407 14.0407 14.5506 14.5506 14.9856 14.9856 15.1746 15.1746 k = 0.2955 0.1706-0.0000 ( 4328 PWs) bands (ev): -36.9127 -36.9127 -36.6986 -36.6986 -15.8957 -15.8957 -15.7041 -15.7041 -15.3995 -15.3995 -15.3796 -15.3796 -15.2026 -15.2026 -15.1776 -15.1776 2.7537 2.7537 4.1545 4.1545 5.7519 5.7519 6.1106 6.1106 6.3095 6.3095 6.4503 6.4503 7.0214 7.0214 7.2179 7.2179 7.3632 7.3632 7.9722 7.9722 8.2745 8.2745 8.6163 8.6163 9.4002 9.4002 9.6328 9.6328 10.7303 10.7303 11.4010 11.4010 11.7440 11.7440 12.1199 12.1199 13.4474 13.4474 14.0261 14.0261 14.5626 14.5626 14.9466 14.9466 15.1821 15.1821 k = 0.3068 0.1771-0.0000 ( 4324 PWs) bands (ev): -36.9127 -36.9127 -36.6985 -36.6985 -15.8959 -15.8959 -15.7045 -15.7045 -15.3996 -15.3996 -15.3801 -15.3801 -15.2033 -15.2033 -15.1776 -15.1776 2.8070 2.8070 4.1835 4.1835 5.7469 5.7469 6.1245 6.1245 6.3180 6.3180 6.4578 6.4578 7.0276 7.0276 7.2305 7.2305 7.3762 7.3762 7.9707 7.9707 8.2662 8.2662 8.6182 8.6182 9.3816 9.3816 9.5890 9.5890 10.6259 10.6259 11.3754 11.3754 11.6624 11.6624 12.0600 12.0600 13.4435 13.4435 14.0128 14.0128 14.5741 14.5741 14.9092 14.9092 15.1897 15.1897 k = 0.3182 0.1837-0.0000 ( 4328 PWs) bands (ev): -36.9126 -36.9126 -36.6985 -36.6985 -15.8961 -15.8961 -15.7049 -15.7049 -15.3998 -15.3998 -15.3805 -15.3805 -15.2040 -15.2040 -15.1777 -15.1777 2.8600 2.8600 4.2122 4.2122 5.7428 5.7428 6.1379 6.1379 6.3273 6.3273 6.4665 6.4665 7.0337 7.0337 7.2410 7.2410 7.3900 7.3900 7.9694 7.9694 8.2570 8.2570 8.6071 8.6071 9.3595 9.3595 9.5607 9.5607 10.5286 10.5286 11.3491 11.3491 11.5842 11.5842 12.0024 12.0024 13.4402 13.4402 14.0008 14.0008 14.5849 14.5849 14.8740 14.8740 15.1958 15.1958 k = 0.3295 0.1903-0.0000 ( 4324 PWs) bands (ev): -36.9126 -36.9126 -36.6984 -36.6984 -15.8963 -15.8963 -15.7052 -15.7052 -15.3999 -15.3999 -15.3810 -15.3810 -15.2046 -15.2046 -15.1777 -15.1777 2.9124 2.9124 4.2404 4.2404 5.7400 5.7400 6.1506 6.1506 6.3373 6.3373 6.4764 6.4764 7.0393 7.0393 7.2495 7.2495 7.4041 7.4041 7.9686 7.9686 8.2468 8.2468 8.5835 8.5835 9.3347 9.3347 9.5466 9.5466 10.4391 10.4391 11.3219 11.3219 11.5099 11.5099 11.9474 11.9474 13.4374 13.4374 13.9900 13.9900 14.5948 14.5948 14.8412 14.8412 15.1950 15.1950 k = 0.3409 0.1968-0.0000 ( 4326 PWs) bands (ev): -36.9126 -36.9126 -36.6984 -36.6984 -15.8965 -15.8965 -15.7055 -15.7055 -15.4001 -15.4001 -15.3813 -15.3813 -15.2053 -15.2053 -15.1778 -15.1778 2.9639 2.9639 4.2680 4.2680 5.7383 5.7383 6.1627 6.1627 6.3477 6.3477 6.4875 6.4875 7.0442 7.0442 7.2559 7.2559 7.4183 7.4183 7.9683 7.9683 8.2352 8.2352 8.5497 8.5497 9.3076 9.3076 9.5444 9.5444 10.3583 10.3583 11.2932 11.2932 11.4407 11.4407 11.8953 11.8953 13.4350 13.4350 13.9803 13.9803 14.6037 14.6037 14.8107 14.8107 15.1771 15.1771 k = 0.3523 0.2034-0.0000 ( 4328 PWs) bands (ev): -36.9125 -36.9125 -36.6983 -36.6983 -15.8966 -15.8966 -15.7059 -15.7059 -15.4002 -15.4002 -15.3817 -15.3817 -15.2059 -15.2059 -15.1779 -15.1779 3.0141 3.0141 4.2947 4.2947 5.7379 5.7379 6.1745 6.1745 6.3582 6.3582 6.4999 6.4999 7.0478 7.0478 7.2605 7.2605 7.4321 7.4321 7.9686 7.9686 8.2219 8.2219 8.5088 8.5088 9.2781 9.2781 9.5515 9.5515 10.2867 10.2867 11.2619 11.2619 11.3780 11.3780 11.8463 11.8463 13.4330 13.4330 13.9718 13.9718 14.6114 14.6114 14.7826 14.7826 15.1535 15.1535 k = 0.3636 0.2099-0.0000 ( 4332 PWs) bands (ev): -36.9125 -36.9125 -36.6983 -36.6983 -15.8968 -15.8968 -15.7062 -15.7062 -15.4004 -15.4004 -15.3821 -15.3821 -15.2065 -15.2065 -15.1779 -15.1779 3.0627 3.0627 4.3204 4.3204 5.7388 5.7388 6.1860 6.1860 6.3686 6.3686 6.5136 6.5136 7.0497 7.0497 7.2637 7.2637 7.4448 7.4448 7.9697 7.9697 8.2064 8.2064 8.4647 8.4647 9.2459 9.2459 9.5655 9.5655 10.2246 10.2246 11.2258 11.2258 11.3245 11.3245 11.8007 11.8007 13.4312 13.4312 13.9642 13.9642 14.6176 14.6176 14.7568 14.7568 15.1316 15.1316 k = 0.3750 0.2165-0.0000 ( 4328 PWs) bands (ev): -36.9125 -36.9125 -36.6983 -36.6983 -15.8969 -15.8969 -15.7064 -15.7064 -15.4005 -15.4005 -15.3824 -15.3824 -15.2071 -15.2071 -15.1779 -15.1779 3.1092 3.1092 4.3450 4.3450 5.7409 5.7409 6.1975 6.1975 6.3788 6.3788 6.5284 6.5284 7.0491 7.0491 7.2662 7.2662 7.4560 7.4560 7.9716 7.9716 8.1883 8.1883 8.4209 8.4209 9.2111 9.2111 9.5839 9.5839 10.1720 10.1720 11.1835 11.1835 11.2820 11.2820 11.7584 11.7584 13.4297 13.4297 13.9576 13.9576 14.6223 14.6223 14.7334 14.7334 15.1128 15.1128 k = 0.3864 0.2231-0.0000 ( 4336 PWs) bands (ev): -36.9124 -36.9124 -36.6982 -36.6982 -15.8971 -15.8971 -15.7067 -15.7067 -15.4007 -15.4007 -15.3827 -15.3827 -15.2076 -15.2076 -15.1780 -15.1780 3.1534 3.1534 4.3681 4.3681 5.7441 5.7441 6.2091 6.2091 6.3886 6.3886 6.5439 6.5439 7.0454 7.0454 7.2685 7.2685 7.4651 7.4651 7.9743 7.9743 8.1674 8.1674 8.3800 8.3800 9.1742 9.1742 9.6046 9.6046 10.1288 10.1288 11.1369 11.1369 11.2490 11.2490 11.7197 11.7197 13.4284 13.4284 13.9519 13.9519 14.6254 14.6254 14.7124 14.7124 15.0970 15.0970 k = 0.3977 0.2296-0.0000 ( 4340 PWs) bands (ev): -36.9124 -36.9124 -36.6982 -36.6982 -15.8972 -15.8972 -15.7070 -15.7070 -15.4008 -15.4008 -15.3830 -15.3830 -15.2081 -15.2081 -15.1780 -15.1780 3.1947 3.1947 4.3896 4.3896 5.7483 5.7483 6.2209 6.2209 6.3981 6.3981 6.5599 6.5599 7.0377 7.0377 7.2716 7.2716 7.4716 7.4716 7.9777 7.9777 8.1443 8.1443 8.3440 8.3440 9.1362 9.1362 9.6259 9.6259 10.0944 10.0944 11.0897 11.0897 11.2224 11.2224 11.6847 11.6847 13.4273 13.4273 13.9469 13.9469 14.6266 14.6266 14.6939 14.6939 15.0843 15.0843 k = 0.4091 0.2362-0.0000 ( 4344 PWs) bands (ev): -36.9124 -36.9124 -36.6982 -36.6982 -15.8974 -15.8974 -15.7072 -15.7072 -15.4010 -15.4010 -15.3832 -15.3832 -15.2085 -15.2085 -15.1781 -15.1781 3.2329 3.2329 4.4094 4.4094 5.7532 5.7532 6.2328 6.2328 6.4074 6.4074 6.5758 6.5758 7.0258 7.0258 7.2761 7.2761 7.4752 7.4752 7.9816 7.9816 8.1206 8.1206 8.3129 8.3129 9.0984 9.0984 9.6464 9.6464 10.0679 10.0679 11.0445 11.0445 11.2000 11.2000 11.6534 11.6534 13.4264 13.4264 13.9427 13.9427 14.6257 14.6257 14.6784 14.6784 15.0743 15.0743 k = 0.4205 0.2427-0.0000 ( 4352 PWs) bands (ev): -36.9123 -36.9123 -36.6981 -36.6981 -15.8975 -15.8975 -15.7074 -15.7074 -15.4011 -15.4011 -15.3834 -15.3834 -15.2089 -15.2089 -15.1781 -15.1781 3.2676 3.2676 4.4273 4.4273 5.7587 5.7587 6.2449 6.2449 6.4166 6.4166 6.5910 6.5910 7.0099 7.0099 7.2825 7.2825 7.4755 7.4755 7.9852 7.9852 8.0986 8.0986 8.2862 8.2862 9.0619 9.0619 9.6650 9.6650 10.0484 10.0484 11.0028 11.0028 11.1807 11.1807 11.6257 11.6257 13.4257 13.4257 13.9392 13.9392 14.6226 14.6226 14.6661 14.6661 15.0667 15.0667 k = 0.4318 0.2493-0.0000 ( 4354 PWs) bands (ev): -36.9123 -36.9123 -36.6981 -36.6981 -15.8976 -15.8976 -15.7076 -15.7076 -15.4012 -15.4012 -15.3836 -15.3836 -15.2093 -15.2093 -15.1781 -15.1781 3.2984 3.2984 4.4432 4.4432 5.7643 5.7643 6.2568 6.2568 6.4260 6.4260 6.6049 6.6049 6.9906 6.9906 7.2910 7.2910 7.4727 7.4727 7.9873 7.9873 8.0813 8.0813 8.2629 8.2629 9.0280 9.0280 9.6810 9.6810 10.0349 10.0349 10.9656 10.9656 11.1641 11.1641 11.6019 11.6019 13.4251 13.4251 13.9362 13.9362 14.6173 14.6173 14.6573 14.6573 15.0611 15.0611 k = 0.4432 0.2559-0.0000 ( 4358 PWs) bands (ev): -36.9123 -36.9123 -36.6981 -36.6981 -15.8977 -15.8977 -15.7078 -15.7078 -15.4013 -15.4013 -15.3838 -15.3838 -15.2096 -15.2096 -15.1782 -15.1782 3.3250 3.3250 4.4568 4.4568 5.7698 5.7698 6.2682 6.2682 6.4357 6.4357 6.6169 6.6169 6.9692 6.9692 7.3015 7.3015 7.4667 7.4667 7.9864 7.9864 8.0711 8.0711 8.2420 8.2420 8.9977 8.9977 9.6943 9.6943 10.0261 10.0261 10.9334 10.9334 11.1500 11.1500 11.5818 11.5818 13.4246 13.4246 13.9339 13.9339 14.6106 14.6106 14.6513 14.6513 15.0572 15.0572 k = 0.4545 0.2624-0.0000 ( 4352 PWs) bands (ev): -36.9123 -36.9123 -36.6981 -36.6981 -15.8977 -15.8977 -15.7079 -15.7079 -15.4014 -15.4014 -15.3839 -15.3839 -15.2098 -15.2098 -15.1782 -15.1782 3.3472 3.3472 4.4682 4.4682 5.7749 5.7749 6.2785 6.2785 6.4455 6.4455 6.6265 6.6265 6.9476 6.9476 7.3136 7.3136 7.4582 7.4582 7.9822 7.9822 8.0689 8.0689 8.2230 8.2230 8.9720 8.9720 9.7046 9.7046 10.0210 10.0210 10.9066 10.9066 11.1384 11.1384 11.5654 11.5654 13.4242 13.4242 13.9320 13.9320 14.6038 14.6038 14.6474 14.6474 15.0545 15.0545 k = 0.4659 0.2690-0.0000 ( 4352 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7080 -15.7080 -15.4014 -15.4014 -15.3840 -15.3840 -15.2100 -15.2100 -15.1782 -15.1782 3.3647 3.3647 4.4771 4.4771 5.7792 5.7792 6.2872 6.2872 6.4550 6.4550 6.6333 6.6333 6.9279 6.9279 7.3266 7.3266 7.4478 7.4478 7.9764 7.9764 8.0725 8.0725 8.2059 8.2059 8.9514 8.9514 9.7122 9.7122 10.0184 10.0184 10.8855 10.8855 11.1294 11.1294 11.5527 11.5527 13.4239 13.4239 13.9306 13.9306 14.5978 14.5978 14.6447 14.6447 15.0528 15.0528 k = 0.4773 0.2756-0.0000 ( 4346 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4014 -15.4014 -15.3840 -15.3840 -15.2101 -15.2101 -15.1782 -15.1782 3.3773 3.3773 4.4836 4.4836 5.7825 5.7825 6.2938 6.2938 6.4634 6.4634 6.6375 6.6375 6.9120 6.9120 7.3394 7.3394 7.4368 7.4368 7.9710 7.9710 8.0790 8.0790 8.1914 8.1914 8.9364 8.9364 9.7174 9.7174 10.0174 10.0174 10.8702 10.8702 11.1228 11.1228 11.5437 11.5437 13.4238 13.4238 13.9296 13.9296 14.5932 14.5932 14.6430 14.6430 15.0518 15.0518 k = 0.4886 0.2821-0.0000 ( 4350 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4015 -15.4015 -15.3841 -15.3841 -15.2102 -15.2102 -15.1782 -15.1782 3.3849 3.3849 4.4875 4.4875 5.7845 5.7845 6.2979 6.2979 6.4692 6.4692 6.6395 6.6395 6.9017 6.9017 7.3497 7.3497 7.4274 7.4274 7.9673 7.9673 8.0850 8.0850 8.1811 8.1811 8.9273 8.9273 9.7204 9.7204 10.0170 10.0170 10.8610 10.8610 11.1189 11.1189 11.5383 11.5383 13.4236 13.4236 13.9290 13.9290 14.5903 14.5903 14.6419 14.6419 15.0512 15.0512 k = 0.5000 0.2887-0.0000 ( 4342 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4015 -15.4015 -15.3841 -15.3841 -15.2102 -15.2102 -15.1782 -15.1782 3.3875 3.3875 4.4888 4.4888 5.7852 5.7852 6.2993 6.2993 6.4714 6.4714 6.6401 6.6401 6.8981 6.8981 7.3539 7.3539 7.4235 7.4235 7.9661 7.9661 8.0875 8.0875 8.1772 8.1772 8.9243 8.9243 9.7214 9.7214 10.0170 10.0170 10.8579 10.8579 11.1176 11.1176 11.5365 11.5365 13.4236 13.4236 13.9288 13.9288 14.5893 14.5893 14.6416 14.6416 15.0511 15.0511 k = 0.5000 0.2887-0.0000 ( 4342 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4015 -15.4015 -15.3841 -15.3841 -15.2102 -15.2102 -15.1782 -15.1782 3.3875 3.3875 4.4888 4.4888 5.7852 5.7852 6.2993 6.2993 6.4714 6.4714 6.6401 6.6401 6.8981 6.8981 7.3539 7.3539 7.4235 7.4235 7.9661 7.9661 8.0875 8.0875 8.1772 8.1772 8.9243 8.9243 9.7214 9.7214 10.0170 10.0170 10.8579 10.8579 11.1176 11.1176 11.5365 11.5365 13.4236 13.4236 13.9288 13.9288 14.5893 14.5893 14.6416 14.6416 15.0511 15.0511 k = 0.4933 0.3002-0.0000 ( 4350 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7082 -15.7081 -15.4015 -15.4014 -15.3841 -15.3841 -15.2104 -15.2100 -15.1782 -15.1782 3.3869 3.3891 4.4865 4.4930 5.7833 5.7894 6.2950 6.3038 6.4595 6.4833 6.6197 6.6591 6.8899 6.9071 7.3461 7.3593 7.4136 7.4362 7.9497 7.9813 8.0796 8.0962 8.1764 8.1768 8.9186 8.9302 9.7095 9.7313 10.0053 10.0266 10.8432 10.8710 11.1038 11.1238 11.5359 11.5393 13.4182 13.4319 13.9281 13.9319 14.5561 14.5889 14.6414 14.6767 15.0512 15.0535 k = 0.4867 0.3118-0.0000 ( 4348 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7083 -15.7080 -15.4015 -15.4014 -15.3842 -15.3841 -15.2106 -15.2099 -15.1783 -15.1782 3.3872 3.3916 4.4862 4.4991 5.7837 5.7958 6.2909 6.3084 6.4478 6.4953 6.5986 6.6759 6.8831 6.9162 7.3367 7.3608 7.4077 7.4508 7.9323 7.9949 8.0731 8.1056 8.1745 8.1753 8.9130 8.9364 9.6958 9.7391 9.9916 10.0343 10.8274 10.8811 11.0846 11.1217 11.5373 11.5443 13.4160 13.4427 13.9298 13.9374 14.5206 14.5552 14.6757 14.7151 15.0541 15.0587 k = 0.4800 0.3233-0.0000 ( 4346 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8978 -15.8978 -15.7084 -15.7079 -15.4015 -15.4013 -15.3843 -15.3842 -15.2108 -15.2097 -15.1783 -15.1782 3.3884 3.3951 4.4878 4.5072 5.7862 5.8044 6.2871 6.3131 6.4363 6.5071 6.5773 6.6892 6.8790 6.9248 7.3258 7.3576 7.4070 7.4670 7.9139 8.0061 8.0689 8.1157 8.1714 8.1726 8.9076 8.9430 9.6805 9.7444 9.9756 10.0398 10.8109 10.8862 11.0636 11.1112 11.5405 11.5514 13.4171 13.4556 13.9340 13.9451 14.4857 14.5194 14.7129 14.7536 15.0597 15.0667 k = 0.4733 0.3349-0.0000 ( 4349 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8979 -15.8978 -15.7085 -15.7079 -15.4015 -15.4013 -15.3844 -15.3843 -15.2110 -15.2095 -15.1784 -15.1782 3.3906 3.3994 4.4912 4.5172 5.7911 5.8152 6.2836 6.3178 6.4251 6.5188 6.5563 6.6981 6.8783 6.9328 7.3138 7.3504 7.4107 7.4848 7.8945 8.0135 8.0685 8.1263 8.1674 8.1688 8.9022 8.9500 9.6636 9.7468 9.9573 10.0430 10.7937 10.8826 11.0460 11.0933 11.5451 11.5599 13.4214 13.4702 13.9405 13.9551 14.4516 14.4842 14.7496 14.7909 15.0683 15.0777 k = 0.4667 0.3464-0.0000 ( 4345 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8979 -15.8979 -15.7086 -15.7078 -15.4014 -15.4012 -15.3845 -15.3844 -15.2112 -15.2094 -15.1785 -15.1783 3.3936 3.4047 4.4964 4.5291 5.7981 5.8281 6.2806 6.3225 6.4141 6.5295 6.5365 6.7018 6.8817 6.9398 7.3006 7.3411 7.4171 7.5039 7.8742 8.0157 8.0732 8.1373 8.1625 8.1641 8.8968 8.9575 9.6451 9.7457 9.9365 10.0436 10.7758 10.8675 11.0365 11.0692 11.5509 11.5697 13.4288 13.4862 13.9495 13.9674 14.4187 14.4500 14.7846 14.8260 15.0801 15.0921 k = 0.4600 0.3580-0.0000 ( 4361 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8979 -15.8979 -15.7087 -15.7078 -15.4014 -15.4012 -15.3847 -15.3845 -15.2115 -15.2093 -15.1786 -15.1784 3.3975 3.4108 4.5033 4.5427 5.8073 5.8431 6.2782 6.3270 6.4035 6.5156 6.5416 6.7005 6.8888 6.9458 7.2864 7.3304 7.4255 7.5244 7.8528 8.0134 8.0823 8.1485 8.1569 8.1587 8.8913 8.9654 9.6252 9.7396 9.9139 10.0412 10.7570 10.8421 11.0357 11.0407 11.5576 11.5804 13.4391 13.5030 13.9607 13.9816 14.3867 14.4168 14.8167 14.8579 15.0954 15.1099 k = 0.4533 0.3695-0.0000 ( 4357 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8980 -15.8979 -15.7088 -15.7078 -15.4014 -15.4011 -15.3848 -15.3847 -15.2117 -15.2091 -15.1788 -15.1784 3.4022 3.4176 4.5117 4.5581 5.8188 5.8601 6.2762 6.3314 6.3932 6.4966 6.5521 6.6951 6.8985 6.9506 7.2712 7.3188 7.4358 7.5461 7.8305 8.0086 8.0937 8.1508 8.1512 8.1620 8.8857 8.9738 9.6037 9.7268 9.8908 10.0353 10.7376 10.8108 11.0094 11.0410 11.5651 11.5918 13.4520 13.5205 13.9743 13.9980 14.3557 14.3847 14.8449 14.8859 15.1143 15.1310 k = 0.4467 0.3811-0.0000 ( 4359 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8980 -15.8980 -15.7089 -15.7078 -15.4013 -15.4010 -15.3850 -15.3849 -15.2119 -15.2090 -15.1789 -15.1785 3.4076 3.4252 4.5216 4.5750 5.8324 5.8790 6.2749 6.3355 6.3833 6.4787 6.5621 6.6869 6.9096 6.9541 7.2550 7.3063 7.4480 7.5689 7.8071 8.0025 8.1053 8.1439 8.1465 8.1743 8.8800 8.9826 9.5806 9.7044 9.8693 10.0256 10.7174 10.7782 10.9771 11.0494 11.5733 11.6037 13.4671 13.5385 13.9900 14.0162 14.3256 14.3536 14.8685 14.9095 15.1265 15.1354 k = 0.4400 0.3926-0.0000 ( 4363 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8980 -15.8980 -15.7091 -15.7078 -15.4013 -15.4009 -15.3852 -15.3851 -15.2121 -15.2089 -15.1790 -15.1786 3.4136 3.4334 4.5328 4.5934 5.8480 5.8996 6.2743 6.3392 6.3737 6.4617 6.5715 6.6769 6.9209 6.9565 7.2379 7.2929 7.4622 7.5927 7.7829 7.9958 8.1133 8.1361 8.1460 8.1874 8.8740 8.9920 9.5557 9.6701 9.8516 10.0117 10.6970 10.7472 10.9450 11.0590 11.5821 11.6160 13.4839 13.5567 14.0078 14.0364 14.2964 14.3233 14.8872 14.9287 15.0959 15.1396 k = 0.4333 0.4041-0.0000 ( 4365 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8981 -15.8980 -15.7092 -15.7078 -15.4012 -15.4008 -15.3855 -15.3853 -15.2123 -15.2088 -15.1792 -15.1787 3.4203 3.4422 4.5452 4.6130 5.8658 5.9219 6.2744 6.3425 6.3645 6.4460 6.5802 6.6661 6.9315 6.9576 7.2201 7.2784 7.4784 7.6172 7.7578 7.9887 8.1132 8.1278 8.1545 8.2011 8.8677 9.0017 9.5287 9.6236 9.8383 9.9936 10.6768 10.7198 10.9143 11.0684 11.5913 11.6286 13.5023 13.5751 14.0277 14.0582 14.2681 14.2939 14.9012 14.9438 15.0633 15.1149 k = 0.4267 0.4157-0.0000 ( 4363 PWs) bands (ev): -36.9123 -36.9121 -36.6980 -36.6980 -15.8981 -15.8980 -15.7093 -15.7078 -15.4011 -15.4007 -15.3857 -15.3855 -15.2125 -15.2087 -15.1793 -15.1788 3.4274 3.4515 4.5586 4.6337 5.8856 5.9455 6.2752 6.3451 6.3557 6.4316 6.5881 6.6550 6.9411 6.9576 7.2016 7.2629 7.4967 7.6423 7.7320 7.9814 8.1075 8.1191 8.1694 8.2153 8.8610 9.0118 9.4994 9.5666 9.8286 9.9716 10.6576 10.6968 10.8855 11.0772 11.6009 11.6415 13.5220 13.5935 14.0493 14.0816 14.2404 14.2652 14.9109 14.9551 15.0292 15.0859 k = 0.4200 0.4272-0.0000 ( 4371 PWs) bands (ev): -36.9122 -36.9121 -36.6980 -36.6979 -15.8982 -15.8981 -15.7095 -15.7078 -15.4011 -15.4006 -15.3860 -15.3857 -15.2128 -15.2086 -15.1795 -15.1789 3.4349 3.4611 4.5727 4.6553 5.9073 5.9702 6.2769 6.3469 6.3474 6.4187 6.5953 6.6444 6.9492 6.9564 7.1826 7.2462 7.5164 7.6677 7.7057 7.9742 8.0996 8.1102 8.1875 8.2302 8.8538 9.0221 9.4675 9.5011 9.8212 9.9463 10.6400 10.6784 10.8587 11.0846 11.6107 11.6543 13.5425 13.6120 14.0724 14.1065 14.2137 14.2372 14.9165 14.9627 14.9945 15.0554 k = 0.4133 0.4388-0.0000 ( 4369 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8982 -15.8981 -15.7096 -15.7078 -15.4010 -15.4005 -15.3862 -15.3860 -15.2130 -15.2086 -15.1796 -15.1790 3.4428 3.4709 4.5873 4.6775 5.9309 5.9958 6.2792 6.3397 6.3475 6.4075 6.6018 6.6345 6.9539 6.9559 7.1633 7.2286 7.5368 7.6795 7.6931 7.9671 8.0910 8.1011 8.2077 8.2459 8.8459 9.0325 9.4294 9.4329 9.8154 9.9187 10.6245 10.6645 10.8340 11.0905 11.6207 11.6672 13.5638 13.6305 14.0966 14.1327 14.1882 14.2100 14.9182 14.9531 14.9733 15.0246 k = 0.4067 0.4503-0.0000 ( 4365 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8982 -15.8982 -15.7097 -15.7078 -15.4009 -15.4003 -15.3864 -15.3862 -15.2132 -15.2085 -15.1797 -15.1790 3.4508 3.4809 4.6023 4.7000 5.9562 6.0217 6.2823 6.3327 6.3466 6.3982 6.6074 6.6260 6.9502 6.9613 7.1440 7.2100 7.5556 7.6553 7.7182 7.9602 8.0819 8.0920 8.2296 8.2624 8.8371 9.0430 9.3536 9.3954 9.8107 9.8903 10.6112 10.6546 10.8113 11.0946 11.6307 11.6799 13.5856 13.6491 14.1198 14.1594 14.1659 14.1839 14.9153 14.9176 14.9749 14.9951 k = 0.4000 0.4619-0.0000 ( 4361 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8983 -15.8982 -15.7098 -15.7078 -15.4008 -15.4002 -15.3867 -15.3864 -15.2134 -15.2085 -15.1799 -15.1791 3.4589 3.4910 4.6174 4.7225 5.9832 6.0475 6.2858 6.3268 6.3438 6.3910 6.6124 6.6191 6.9451 6.9656 7.1251 7.1906 7.5664 7.6390 7.7427 7.9537 8.0727 8.0831 8.2533 8.2798 8.8271 9.0530 9.2758 9.3554 9.8066 9.8622 10.6002 10.6481 10.7904 11.0969 11.6404 11.6922 13.6075 13.6675 14.1250 14.1561 14.1634 14.1896 14.8798 14.9056 14.9697 14.9765 k = 0.3933 0.4734-0.0000 ( 4353 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8983 -15.8982 -15.7099 -15.7078 -15.4007 -15.4001 -15.3869 -15.3866 -15.2135 -15.2084 -15.1800 -15.1792 3.4670 3.5008 4.6323 4.7447 6.0117 6.0725 6.2896 6.3223 6.3393 6.3857 6.6144 6.6167 6.9384 6.9690 7.1069 7.1705 7.5584 7.6410 7.7662 7.9478 8.0635 8.0743 8.2788 8.2985 8.8155 9.0617 9.1984 9.3135 9.8032 9.8357 10.5911 10.6444 10.7713 11.0975 11.6498 11.7039 13.6296 13.6858 14.1057 14.1311 14.1873 14.2185 14.8414 14.8864 14.9521 14.9768 k = 0.3867 0.4850-0.0000 ( 4357 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8983 -15.8983 -15.7100 -15.7079 -15.4007 -15.4000 -15.3871 -15.3869 -15.2137 -15.2084 -15.1801 -15.1793 3.4750 3.5104 4.6468 4.7661 6.0416 6.0960 6.2928 6.3200 6.3334 6.3816 6.6122 6.6203 6.9300 6.9717 7.0902 7.1498 7.5354 7.6569 7.7882 7.9428 8.0543 8.0658 8.3060 8.3185 8.8016 9.0643 9.1276 9.2709 9.8002 9.8116 10.5834 10.6429 10.7542 11.0964 11.6587 11.7149 13.6514 13.7039 14.0831 14.1066 14.2164 14.2483 14.8027 14.8589 14.9415 14.9762 k = 0.3800 0.4965-0.0000 ( 4353 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8984 -15.8983 -15.7101 -15.7079 -15.4006 -15.3999 -15.3873 -15.3871 -15.2139 -15.2084 -15.1802 -15.1793 3.4826 3.5196 4.6604 4.7865 6.0726 6.1172 6.2950 6.3207 6.3267 6.3779 6.6129 6.6234 6.9197 6.9741 7.0753 7.1288 7.5070 7.6767 7.8084 7.9390 8.0451 8.0578 8.3349 8.3400 8.7850 9.0275 9.0977 9.2291 9.7904 9.7976 10.5767 10.6432 10.7391 11.0938 11.6668 11.7249 13.6729 13.7218 14.0604 14.0829 14.2472 14.2785 14.7639 14.8274 14.9343 14.9747 k = 0.3733 0.5081-0.0000 ( 4363 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8984 -15.8983 -15.7102 -15.7079 -15.4006 -15.3999 -15.3875 -15.3873 -15.2140 -15.2084 -15.1803 -15.1794 3.4897 3.5281 4.6731 4.8052 6.1044 6.1355 6.2960 6.3197 6.3242 6.3739 6.6168 6.6259 6.9077 6.9763 7.0628 7.1077 7.4772 7.6964 7.8261 7.9369 8.0360 8.0503 8.3632 8.3653 8.7649 8.9605 9.1007 9.1899 9.7723 9.7953 10.5706 10.6447 10.7264 11.0901 11.6739 11.7338 13.6936 13.7392 14.0384 14.0602 14.2790 14.3088 14.7253 14.7946 14.9286 14.9728 k = 0.3667 0.5196-0.0000 ( 4363 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8985 -15.8984 -15.7102 -15.7080 -15.4005 -15.3998 -15.3877 -15.3874 -15.2142 -15.2084 -15.1804 -15.1795 3.4962 3.5359 4.6844 4.8221 6.1366 6.1504 6.2967 6.3126 6.3294 6.3689 6.6240 6.6279 6.8943 6.9785 7.0530 7.0867 7.4478 7.7145 7.8408 7.9371 8.0268 8.0435 8.3880 8.3971 8.7411 8.8937 9.1073 9.1549 9.7573 9.7935 10.5648 10.6470 10.7162 11.0856 11.6799 11.7413 13.7133 13.7560 14.0177 14.0390 14.3115 14.3387 14.6871 14.7620 14.9239 14.9707 k = 0.3600 0.5312-0.0000 ( 4371 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8985 -15.8984 -15.7103 -15.7080 -15.4005 -15.3997 -15.3879 -15.3876 -15.2143 -15.2084 -15.1805 -15.1795 3.5020 3.5427 4.6942 4.8366 6.1617 6.1688 6.2978 6.3056 6.3349 6.3626 6.6295 6.6341 6.8804 6.9807 7.0456 7.0661 7.4203 7.7299 7.8520 7.9399 8.0177 8.0375 8.4141 8.4299 8.7135 8.8319 9.1137 9.1256 9.7455 9.7920 10.5593 10.6498 10.7085 11.0807 11.6847 11.7474 13.7313 13.7718 13.9985 14.0197 14.3443 14.3674 14.6497 14.7308 14.9198 14.9686 k = 0.3533 0.5427-0.0000 ( 4379 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8985 -15.8984 -15.7104 -15.7080 -15.4005 -15.3997 -15.3880 -15.3877 -15.2144 -15.2084 -15.1806 -15.1796 3.5067 3.5483 4.7022 4.8484 6.1696 6.2003 6.2987 6.2992 6.3400 6.3547 6.6307 6.6460 6.8672 6.9831 7.0406 7.0467 7.3962 7.7423 7.8598 7.9452 8.0087 8.0326 8.4406 8.4631 8.6828 8.7771 9.1027 9.1190 9.7365 9.7908 10.5542 10.6526 10.7031 11.0760 11.6882 11.7520 13.7471 13.7860 13.9816 14.0031 14.3767 14.3939 14.6136 14.7022 14.9165 14.9668 k = 0.3467 0.5543-0.0000 ( 4385 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7104 -15.7081 -15.4004 -15.3997 -15.3881 -15.3878 -15.2145 -15.2085 -15.1806 -15.1796 3.5104 3.5526 4.7080 4.8570 6.1748 6.2299 6.2919 6.3008 6.3441 6.3450 6.6315 6.6581 6.8561 6.9854 7.0295 7.0375 7.3772 7.7511 7.8648 7.9519 8.0000 8.0289 8.4655 8.4957 8.6508 8.7321 9.0865 9.1231 9.7302 9.7900 10.5500 10.6550 10.6998 11.0720 11.6905 11.7551 13.7596 13.7976 13.9680 13.9900 14.4078 14.4162 14.5800 14.6783 14.9140 14.9654 k = 0.3400 0.5658-0.0000 ( 4385 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7105 -15.7081 -15.4004 -15.3997 -15.3881 -15.3879 -15.2145 -15.2085 -15.1806 -15.1796 3.5127 3.5553 4.7117 4.8624 6.1775 6.2552 6.2854 6.3020 6.3350 6.3468 6.6319 6.6676 6.8485 6.9872 7.0169 7.0359 7.3650 7.7564 7.8675 7.9585 7.9926 8.0266 8.4846 8.5248 8.6213 8.7009 9.0769 9.1256 9.7265 9.7895 10.5471 10.6568 10.6981 11.0691 11.6916 11.7568 13.7676 13.8054 13.9591 13.9816 14.4317 14.4342 14.5522 14.6618 14.9125 14.9645 k = 0.3333 0.5774-0.0000 ( 4377 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7105 -15.7081 -15.4004 -15.3997 -15.3881 -15.3879 -15.2145 -15.2084 -15.1806 -15.1796 3.5136 3.5563 4.7129 4.8642 6.1784 6.2674 6.2819 6.3025 6.3294 6.3477 6.6320 6.6715 6.8457 6.9877 7.0122 7.0354 7.3607 7.7581 7.8685 7.9615 7.9893 8.0258 8.4921 8.5395 8.6063 8.6896 9.0738 9.1264 9.7254 9.7893 10.5460 10.6575 10.6977 11.0681 11.6919 11.7573 13.7705 13.8081 13.9560 13.9787 14.4373 14.4462 14.5397 14.6559 14.9120 14.9642 k = 0.3333 0.5774-0.0000 ( 4377 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7105 -15.7081 -15.4004 -15.3997 -15.3881 -15.3879 -15.2145 -15.2084 -15.1806 -15.1796 3.5136 3.5563 4.7129 4.8642 6.1784 6.2674 6.2819 6.3025 6.3294 6.3477 6.6320 6.6715 6.8457 6.9877 7.0122 7.0354 7.3607 7.7581 7.8685 7.9615 7.9893 8.0258 8.4921 8.5395 8.6063 8.6896 9.0738 9.1264 9.7254 9.7893 10.5460 10.6575 10.6977 11.0681 11.6919 11.7573 13.7705 13.8081 13.9560 13.9787 14.4373 14.4462 14.5397 14.6559 14.9120 14.9642 k = 0.3267 0.5658-0.0000 ( 4381 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7105 -15.7081 -15.4004 -15.3997 -15.3881 -15.3879 -15.2145 -15.2085 -15.1806 -15.1796 3.5127 3.5552 4.7117 4.8624 6.1776 6.2586 6.2801 6.3019 6.3366 6.3467 6.6319 6.6670 6.8487 6.9882 7.0166 7.0358 7.3651 7.7565 7.8673 7.9588 7.9925 8.0266 8.4851 8.5259 8.6205 8.7003 9.0769 9.1256 9.7265 9.7895 10.5472 10.6567 10.6980 11.0693 11.6918 11.7570 13.7677 13.8054 13.9590 13.9815 14.4318 14.4345 14.5519 14.6617 14.9125 14.9645 k = 0.3200 0.5543-0.0000 ( 4385 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7104 -15.7081 -15.4004 -15.3997 -15.3881 -15.3878 -15.2145 -15.2085 -15.1806 -15.1796 3.5099 3.5520 4.7078 4.8568 6.1751 6.2393 6.2739 6.3001 6.3434 6.3519 6.6318 6.6537 6.8581 6.9909 7.0291 7.0365 7.3780 7.7521 7.8627 7.9545 7.9992 8.0290 8.4687 8.5013 8.6474 8.7277 9.0860 9.1232 9.7300 9.7900 10.5509 10.6539 10.6988 11.0733 11.6917 11.7562 13.7600 13.7982 13.9673 13.9893 14.4093 14.4171 14.5784 14.6773 14.9142 14.9656 k = 0.3133 0.5427-0.0000 ( 4381 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8985 -15.8984 -15.7104 -15.7080 -15.4004 -15.3997 -15.3880 -15.3877 -15.2144 -15.2084 -15.1806 -15.1796 3.5049 3.5464 4.7013 4.8476 6.1706 6.2134 6.2674 6.2970 6.3374 6.3673 6.6317 6.6333 6.8738 6.9957 7.0374 7.0492 7.3988 7.7454 7.8533 7.9524 8.0068 8.0331 8.4491 8.4769 8.6764 8.7650 9.1011 9.1194 9.7359 9.7909 10.5571 10.6488 10.7000 11.0805 11.6922 11.7556 13.7484 13.7877 13.9793 14.0009 14.3804 14.3966 14.6095 14.6993 14.9169 14.9674 k = 0.3067 0.5312-0.0000 ( 4381 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8985 -15.8984 -15.7103 -15.7080 -15.4005 -15.3997 -15.3879 -15.3876 -15.2143 -15.2084 -15.1805 -15.1796 3.4977 3.5382 4.6922 4.8349 6.1639 6.1830 6.2613 6.2926 6.3287 6.3806 6.6089 6.6316 6.8953 7.0017 7.0381 7.0758 7.4263 7.7374 7.8383 7.9545 8.0144 8.0385 8.4302 8.4554 8.7054 8.8077 9.1148 9.1218 9.7440 9.7923 10.5656 10.6409 10.7016 11.0912 11.6941 11.7558 13.7341 13.7752 13.9936 14.0151 14.3508 14.3728 14.6420 14.7249 14.9209 14.9701 k = 0.3000 0.5196-0.0000 ( 4381 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8985 -15.8984 -15.7102 -15.7079 -15.4005 -15.3998 -15.3877 -15.3875 -15.2141 -15.2083 -15.1805 -15.1795 3.4880 3.5272 4.6805 4.8188 6.1498 6.1541 6.2554 6.2869 6.3172 6.3910 6.5838 6.6315 6.9219 7.0088 7.0384 7.1070 7.4586 7.7291 7.8180 7.9608 8.0218 8.0450 8.4140 8.4374 8.7344 8.8532 9.1101 9.1476 9.7546 9.7942 10.5756 10.6300 10.7044 11.1057 11.6982 11.7576 13.7178 13.7616 14.0092 14.0308 14.3217 14.3477 14.6747 14.7523 14.9261 14.9738 k = 0.2933 0.5081-0.0000 ( 4369 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8984 -15.8983 -15.7101 -15.7079 -15.4005 -15.3998 -15.3875 -15.3872 -15.2139 -15.2082 -15.1804 -15.1795 3.4755 3.5133 4.6664 4.7996 6.1150 6.1406 6.2497 6.2802 6.3035 6.3989 6.5605 6.6312 6.9523 7.0169 7.0380 7.1410 7.4931 7.7225 7.7935 7.9704 8.0289 8.0523 8.4017 8.4231 8.7640 8.8994 9.1065 9.1778 9.7677 9.7967 10.5855 10.6157 10.7097 11.1242 11.7050 11.7617 13.7001 13.7473 14.0254 14.0472 14.2936 14.3223 14.7069 14.7803 14.9325 14.9785 k = 0.2867 0.4965-0.0000 ( 4365 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8983 -15.8982 -15.7100 -15.7078 -15.4005 -15.3998 -15.3873 -15.3870 -15.2137 -15.2081 -15.1803 -15.1794 3.4602 3.4962 4.6499 4.7775 6.0794 6.1226 6.2440 6.2723 6.2889 6.4045 6.5403 6.6305 6.9853 7.0259 7.0369 7.1762 7.5260 7.7205 7.7658 7.9828 8.0356 8.0597 8.3945 8.4124 8.7950 8.9437 9.1065 9.2114 9.7835 9.7999 10.5932 10.5982 10.7195 11.1468 11.7153 11.7688 13.6814 13.7325 14.0417 14.0639 14.2667 14.2972 14.7384 14.8080 14.9401 14.9843 k = 0.2800 0.4850-0.0000 ( 4361 PWs) bands (ev): -36.9122 -36.9121 -36.6979 -36.6979 -15.8982 -15.8982 -15.7098 -15.7077 -15.4005 -15.3998 -15.3870 -15.3868 -15.2134 -15.2080 -15.1802 -15.1793 3.4420 3.4760 4.6312 4.7528 6.0440 6.0998 6.2384 6.2635 6.2747 6.4083 6.5236 6.6293 7.0188 7.0359 7.0359 7.2111 7.5516 7.7278 7.7359 7.9970 8.0421 8.0667 8.3933 8.4049 8.8282 8.9817 9.1143 9.2475 9.8021 9.8041 10.5775 10.5967 10.7361 11.1734 11.7296 11.7796 13.6620 13.7173 14.0578 14.0804 14.2412 14.2729 14.7686 14.8351 14.9488 14.9910 k = 0.2733 0.4734-0.0000 ( 4363 PWs) bands (ev): -36.9123 -36.9121 -36.6979 -36.6979 -15.8982 -15.8981 -15.7096 -15.7076 -15.4005 -15.3999 -15.3868 -15.3865 -15.2131 -15.2078 -15.1801 -15.1793 3.4205 3.4524 4.6104 4.7258 6.0093 6.0730 6.2328 6.2536 6.2622 6.4105 6.5102 6.6274 7.0297 7.0466 7.0567 7.2445 7.5652 7.7044 7.7482 8.0121 8.0487 8.0727 8.3990 8.4006 8.8644 9.0081 9.1357 9.2849 9.8096 9.8237 10.5540 10.5955 10.7603 11.2041 11.7482 11.7945 13.6419 13.7017 14.0735 14.0965 14.2173 14.2497 14.7976 14.8611 14.9586 14.9987 k = 0.2667 0.4619-0.0000 ( 4359 PWs) bands (ev): -36.9123 -36.9121 -36.6980 -36.6980 -15.8981 -15.8980 -15.7094 -15.7074 -15.4005 -15.3999 -15.3865 -15.3862 -15.2127 -15.2076 -15.1800 -15.1792 3.3959 3.4255 4.5878 4.6967 5.9761 6.0431 6.2272 6.2423 6.2521 6.4116 6.4994 6.6246 7.0260 7.0578 7.0905 7.2750 7.5670 7.6722 7.7802 8.0268 8.0564 8.0778 8.3998 8.4123 8.9038 9.0226 9.1711 9.3229 9.8166 9.8486 10.5285 10.5906 10.7915 11.2387 11.7714 11.8138 13.6213 13.6857 14.0887 14.1120 14.1953 14.2278 14.8249 14.8858 14.9692 15.0071 k = 0.2600 0.4503-0.0000 ( 4359 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8980 -15.8979 -15.7092 -15.7073 -15.4005 -15.3999 -15.3861 -15.3859 -15.2123 -15.2074 -15.1798 -15.1791 3.3681 3.3953 4.5634 4.6658 5.9447 6.0117 6.2216 6.2304 6.2436 6.4116 6.4906 6.6209 7.0207 7.0694 7.1230 7.3014 7.5613 7.6398 7.8178 8.0386 8.0668 8.0828 8.4025 8.4331 8.9464 9.0312 9.2147 9.3605 9.8257 9.8769 10.5018 10.5839 10.8288 11.2772 11.7992 11.8376 13.6003 13.6693 14.1030 14.1269 14.1754 14.2076 14.8504 14.9089 14.9802 15.0159 k = 0.2533 0.4388-0.0000 ( 4343 PWs) bands (ev): -36.9123 -36.9122 -36.6980 -36.6980 -15.8978 -15.8978 -15.7090 -15.7071 -15.4005 -15.3999 -15.3858 -15.3855 -15.2118 -15.2071 -15.1797 -15.1790 3.3371 3.3619 4.5376 4.6335 5.9156 5.9802 6.2159 6.2182 6.2362 6.4107 6.4834 6.6161 7.0144 7.0811 7.1532 7.3226 7.5522 7.6077 7.8549 8.0462 8.0805 8.0896 8.4094 8.4609 8.9919 9.0393 9.2614 9.3969 9.8377 9.9088 10.4751 10.5776 10.8714 11.3193 11.8316 11.8661 13.5790 13.6523 14.1155 14.1406 14.1590 14.1897 14.8739 14.9303 14.9913 15.0248 k = 0.2467 0.4272-0.0000 ( 4353 PWs) bands (ev): -36.9123 -36.9122 -36.6981 -36.6980 -15.8977 -15.8977 -15.7087 -15.7069 -15.4004 -15.3999 -15.3854 -15.3852 -15.2114 -15.2069 -15.1796 -15.1789 3.3028 3.3252 4.5103 4.5998 5.8890 5.9498 6.2058 6.2103 6.2298 6.4092 6.4772 6.6101 7.0072 7.0928 7.1801 7.3376 7.5420 7.5765 7.8863 8.0505 8.0959 8.1007 8.4207 8.4946 9.0396 9.0499 9.3081 9.4316 9.8533 9.9442 10.4497 10.5737 10.9184 11.3649 11.8683 11.8989 13.5575 13.6349 14.1212 14.1507 14.1510 14.1766 14.8953 14.9500 15.0021 15.0333 k = 0.2400 0.4157-0.0000 ( 4345 PWs) bands (ev): -36.9124 -36.9122 -36.6981 -36.6981 -15.8976 -15.8975 -15.7084 -15.7067 -15.4004 -15.3999 -15.3850 -15.3848 -15.2108 -15.2065 -15.1795 -15.1788 3.2656 3.2856 4.4820 4.5651 5.8651 5.9212 6.1932 6.2046 6.2241 6.4070 6.4719 6.6029 6.9994 7.1041 7.2030 7.3460 7.5319 7.5467 7.9088 8.0527 8.1112 8.1184 8.4368 8.5329 9.0646 9.0884 9.3529 9.4641 9.8738 9.9836 10.4270 10.5743 10.9697 11.4138 11.9092 11.9358 13.5361 13.6172 14.1143 14.1477 14.1574 14.1781 14.9143 14.9676 15.0121 15.0411 k = 0.2333 0.4041-0.0000 ( 4345 PWs) bands (ev): -36.9124 -36.9123 -36.6981 -36.6981 -15.8975 -15.8974 -15.7081 -15.7065 -15.4003 -15.3999 -15.3846 -15.3844 -15.2103 -15.2062 -15.1793 -15.1787 3.2254 3.2432 4.4526 4.5296 5.8441 5.8950 6.1804 6.1988 6.2191 6.4043 6.4672 6.5943 6.9911 7.1150 7.2215 7.3477 7.5187 7.5221 7.9216 8.0534 8.1257 8.1422 8.4572 8.5740 9.0841 9.1372 9.3945 9.4939 9.9004 10.0272 10.4088 10.5813 11.0246 11.4658 11.9537 11.9763 13.5149 13.5991 14.1033 14.1365 14.1698 14.1895 14.9309 14.9828 15.0212 15.0477 k = 0.2267 0.3926-0.0000 ( 4345 PWs) bands (ev): -36.9124 -36.9123 -36.6982 -36.6982 -15.8973 -15.8973 -15.7078 -15.7063 -15.4003 -15.3998 -15.3842 -15.3840 -15.2097 -15.2058 -15.1792 -15.1786 3.1825 3.1981 4.4224 4.4934 5.8260 5.8717 6.1675 6.1929 6.2147 6.4011 6.4629 6.5846 6.9824 7.1252 7.2351 7.3435 7.4932 7.5123 7.9270 8.0527 8.1390 8.1695 8.4813 8.6163 9.1084 9.1848 9.4323 9.5207 9.9343 10.0759 10.3967 10.5965 11.0830 11.5208 12.0016 12.0200 13.4942 13.5808 14.0929 14.1253 14.1835 14.2027 14.9449 14.9949 15.0294 15.0530 k = 0.2200 0.3811-0.0000 ( 4337 PWs) bands (ev): -36.9125 -36.9124 -36.6982 -36.6982 -15.8971 -15.8971 -15.7075 -15.7060 -15.4002 -15.3998 -15.3838 -15.3835 -15.2090 -15.2054 -15.1790 -15.1785 3.1372 3.1508 4.3915 4.4568 5.8106 5.8513 6.1545 6.1868 6.2109 6.3974 6.4589 6.5736 6.9737 7.1345 7.2434 7.3348 7.4705 7.5014 7.9282 8.0511 8.1515 8.1969 8.5075 8.6577 9.1370 9.2303 9.4665 9.5442 9.9764 10.1305 10.3922 10.6208 11.1446 11.5785 12.0526 12.0663 13.4742 13.5625 14.0841 14.1155 14.1976 14.2163 14.9563 15.0033 15.0371 15.0573 k = 0.2133 0.3695-0.0000 ( 4331 PWs) bands (ev): -36.9125 -36.9124 -36.6982 -36.6982 -15.8970 -15.8969 -15.7071 -15.7057 -15.4001 -15.3997 -15.3833 -15.3831 -15.2084 -15.2049 -15.1789 -15.1784 3.0897 3.1014 4.3601 4.4199 5.7981 5.8341 6.1414 6.1805 6.2078 6.3932 6.4551 6.5616 6.9652 7.1426 7.2462 7.3230 7.4510 7.4886 7.9276 8.0485 8.1633 8.2223 8.5342 8.6959 9.1688 9.2728 9.4985 9.5648 10.0273 10.1925 10.3966 10.6545 11.2093 11.6389 12.1060 12.1146 13.4553 13.5444 14.0773 14.1075 14.2118 14.2301 14.9650 15.0076 15.0445 15.0611 k = 0.2067 0.3580-0.0000 ( 4337 PWs) bands (ev): -36.9125 -36.9124 -36.6983 -36.6983 -15.8968 -15.8968 -15.7068 -15.7055 -15.4000 -15.3997 -15.3828 -15.3826 -15.2077 -15.2044 -15.1788 -15.1783 3.0403 3.0503 4.3284 4.3829 5.7882 5.8198 6.1283 6.1737 6.2052 6.3885 6.4515 6.5489 6.9569 7.1492 7.2438 7.3094 7.4348 7.4732 7.9266 8.0453 8.1747 8.2444 8.5592 8.7281 9.2025 9.3119 9.5306 9.5833 10.0871 10.2629 10.4109 10.6972 11.2768 11.7016 12.1615 12.1643 13.4379 13.5267 14.0725 14.1015 14.2258 14.2441 14.9709 15.0082 15.0516 15.0649 k = 0.2000 0.3464-0.0000 ( 4331 PWs) bands (ev): -36.9126 -36.9125 -36.6983 -36.6983 -15.8966 -15.8966 -15.7064 -15.7052 -15.3999 -15.3996 -15.3823 -15.3822 -15.2069 -15.2039 -15.1786 -15.1781 2.9893 2.9978 4.2964 4.3460 5.7808 5.8085 6.1152 6.1665 6.2034 6.3834 6.4480 6.5357 6.9491 7.1540 7.2367 7.2953 7.4215 7.4551 7.9262 8.0416 8.1859 8.2629 8.5806 8.7517 9.2365 9.3470 9.5658 9.6016 10.1557 10.3425 10.4355 10.7481 11.3470 11.7666 12.2146 12.2186 13.4223 13.5098 14.0699 14.0975 14.2396 14.2581 14.9742 15.0054 15.0586 15.0695 k = 0.1933 0.3349-0.0000 ( 4339 PWs) bands (ev): -36.9126 -36.9125 -36.6984 -36.6984 -15.8964 -15.8964 -15.7060 -15.7049 -15.3998 -15.3995 -15.3819 -15.3817 -15.2062 -15.2034 -15.1785 -15.1781 2.9370 2.9441 4.2643 4.3092 5.7757 5.7999 6.1021 6.1586 6.2022 6.3777 6.4445 6.5223 6.9419 7.1565 7.2259 7.2818 7.4104 7.4343 7.9267 8.0377 8.1972 8.2780 8.5963 8.7646 9.2695 9.3777 9.6066 9.6223 10.2326 10.4311 10.4701 10.8058 11.4198 11.8338 12.2650 12.2766 13.4090 13.4939 14.0695 14.0957 14.2528 14.2720 14.9747 14.9997 15.0660 15.0757 k = 0.1867 0.3233-0.0000 ( 4333 PWs) bands (ev): -36.9127 -36.9126 -36.6984 -36.6984 -15.8963 -15.8962 -15.7056 -15.7046 -15.3997 -15.3994 -15.3813 -15.3812 -15.2054 -15.2028 -15.1783 -15.1779 2.8838 2.8897 4.2322 4.2727 5.7727 5.7939 6.0890 6.1500 6.2017 6.3716 6.4412 6.5091 6.9355 7.1561 7.2124 7.2699 7.4007 7.4111 7.9283 8.0338 8.2086 8.2899 8.6048 8.7657 9.3003 9.4033 9.6485 9.6549 10.3178 10.5141 10.5284 10.8690 11.4950 11.9029 12.3146 12.3352 13.3984 13.4794 14.0714 14.0961 14.2654 14.2858 14.9727 14.9914 15.0749 15.0840 k = 0.1800 0.3118-0.0000 ( 4337 PWs) bands (ev): -36.9127 -36.9126 -36.6985 -36.6985 -15.8961 -15.8960 -15.7052 -15.7042 -15.3996 -15.3993 -15.3808 -15.3807 -15.2046 -15.2023 -15.1782 -15.1778 2.8300 2.8349 4.2002 4.2366 5.7716 5.7903 6.0759 6.1405 6.2019 6.3649 6.4379 6.4965 6.9300 7.1523 7.1972 7.2604 7.3859 7.3919 7.9309 8.0299 8.2200 8.2992 8.6050 8.7550 9.3280 9.4233 9.6829 9.7115 10.4107 10.5666 10.6337 10.9364 11.5727 11.9739 12.3630 12.3937 13.3909 13.4667 14.0755 14.0986 14.2774 14.2993 14.9683 14.9809 15.0861 15.0952 k = 0.1733 0.3002-0.0000 ( 4335 PWs) bands (ev): -36.9127 -36.9127 -36.6985 -36.6985 -15.8959 -15.8958 -15.7048 -15.7039 -15.3994 -15.3992 -15.3803 -15.3801 -15.2038 -15.2016 -15.1781 -15.1777 2.7758 2.7798 4.1685 4.2010 5.7723 5.7887 6.0628 6.1299 6.2028 6.3579 6.4346 6.4848 6.9254 7.1451 7.1809 7.2537 7.3592 7.3833 7.9343 8.0261 8.2317 8.3062 8.5965 8.7339 9.3523 9.4379 9.7267 9.7760 10.5107 10.6268 10.7461 11.0067 11.6526 12.0467 12.4095 12.4514 13.3869 13.4562 14.0820 14.1034 14.2885 14.3125 14.9618 14.9686 15.1006 15.1095 k = 0.1667 0.2887-0.0000 ( 4339 PWs) bands (ev): -36.9128 -36.9127 -36.6986 -36.6986 -15.8957 -15.8957 -15.7043 -15.7036 -15.3993 -15.3991 -15.3798 -15.3796 -15.2030 -15.2010 -15.1779 -15.1776 2.7216 2.7248 4.1372 4.1661 5.7744 5.7889 6.0499 6.1183 6.2045 6.3505 6.4314 6.4743 6.9218 7.1351 7.1641 7.2494 7.3317 7.3747 7.9384 8.0226 8.2433 8.3113 8.5796 8.7040 9.3731 9.4479 9.7798 9.8475 10.6161 10.6943 10.8645 11.0788 11.7347 12.1211 12.4536 12.5078 13.3867 13.4484 14.0907 14.1104 14.2988 14.3251 14.9533 14.9549 15.1191 15.1274 k = 0.1600 0.2771-0.0000 ( 4331 PWs) bands (ev): -36.9128 -36.9128 -36.6986 -36.6986 -15.8955 -15.8954 -15.7039 -15.7032 -15.3992 -15.3990 -15.3792 -15.3791 -15.2022 -15.2004 -15.1778 -15.1775 2.6676 2.6702 4.1063 4.1319 5.7778 5.7907 6.0370 6.1055 6.2069 6.3429 6.4284 6.4651 6.9194 7.1231 7.1472 7.2468 7.3037 7.3659 7.9430 8.0193 8.2550 8.3146 8.5550 8.6674 9.3906 9.4547 9.8413 9.9246 10.7209 10.7733 10.9879 11.1516 11.8189 12.1970 12.4951 12.5621 13.3906 13.4438 14.1017 14.1196 14.3082 14.3370 14.9404 14.9432 15.1423 15.1492 k = 0.1533 0.2656-0.0000 ( 4323 PWs) bands (ev): -36.9129 -36.9128 -36.6987 -36.6987 -15.8952 -15.8952 -15.7034 -15.7028 -15.3990 -15.3989 -15.3786 -15.3785 -15.2013 -15.1997 -15.1777 -15.1774 2.6142 2.6163 4.0759 4.0984 5.7822 5.7938 6.0242 6.0916 6.2099 6.3353 6.4255 6.4573 6.9180 7.1101 7.1303 7.2443 7.2765 7.3570 7.9478 8.0162 8.2665 8.3158 8.5237 8.6262 9.4050 9.4593 9.9099 10.0061 10.8110 10.8760 11.1150 11.2245 11.9053 12.2743 12.5337 12.6137 13.3987 13.4429 14.1151 14.1310 14.3169 14.3481 14.9254 14.9318 15.1707 15.1753 k = 0.1467 0.2540-0.0000 ( 4327 PWs) bands (ev): -36.9129 -36.9129 -36.6988 -36.6988 -15.8950 -15.8950 -15.7030 -15.7025 -15.3989 -15.3988 -15.3781 -15.3780 -15.2005 -15.1990 -15.1776 -15.1774 2.5615 2.5632 4.0462 4.0659 5.7875 5.7980 6.0116 6.0768 6.2136 6.3279 6.4229 6.4510 6.9177 7.0968 7.1137 7.2364 7.2556 7.3479 7.9528 8.0132 8.2777 8.3147 8.4871 8.5825 9.4168 9.4623 9.9845 10.0909 10.8893 10.9975 11.2424 11.2989 11.9939 12.3529 12.5695 12.6617 13.4110 13.4464 14.1306 14.1445 14.3248 14.3583 14.9104 14.9193 15.2044 15.2057 k = 0.1400 0.2425-0.0000 ( 4327 PWs) bands (ev): -36.9130 -36.9129 -36.6988 -36.6988 -15.8948 -15.8948 -15.7026 -15.7021 -15.3988 -15.3987 -15.3775 -15.3774 -15.1996 -15.1983 -15.1775 -15.1773 2.5098 2.5111 4.0171 4.0342 5.7935 5.8029 5.9991 6.0610 6.2179 6.3207 6.4206 6.4460 6.9185 7.0835 7.0974 7.2140 7.2499 7.3387 7.9578 8.0104 8.2880 8.3100 8.4467 8.5389 9.4264 9.4643 10.0639 10.1783 10.9641 11.1277 11.3468 11.3963 12.0846 12.4326 12.6026 12.7054 13.4276 13.4548 14.1483 14.1600 14.3320 14.3674 14.8958 14.9059 15.2408 15.2430 k = 0.1333 0.2309-0.0000 ( 4323 PWs) bands (ev): -36.9130 -36.9130 -36.6989 -36.6989 -15.8946 -15.8946 -15.7022 -15.7018 -15.3986 -15.3985 -15.3770 -15.3769 -15.1988 -15.1977 -15.1774 -15.1772 2.4593 2.4603 3.9889 4.0037 5.7999 5.8083 5.9868 6.0447 6.2226 6.3140 6.4188 6.4423 6.9204 7.0708 7.0814 7.1878 7.2488 7.3296 7.9625 8.0076 8.2962 8.2999 8.4048 8.4983 9.4342 9.4655 10.1474 10.2675 11.0371 11.2632 11.4165 11.5267 12.1775 12.5134 12.6335 12.7443 13.4482 13.4687 14.1681 14.1773 14.3387 14.3755 14.8820 14.8919 15.2806 15.2835 k = 0.1267 0.2194-0.0000 ( 4331 PWs) bands (ev): -36.9131 -36.9130 -36.6989 -36.6989 -15.8944 -15.8944 -15.7018 -15.7014 -15.3985 -15.3984 -15.3765 -15.3764 -15.1980 -15.1970 -15.1773 -15.1771 2.4103 2.4110 3.9615 3.9742 5.8065 5.8141 5.9748 6.0280 6.2277 6.3077 6.4176 6.4399 6.9234 7.0588 7.0660 7.1618 7.2485 7.3206 7.9668 8.0045 8.2817 8.2976 8.3673 8.4645 9.4404 9.4662 10.2340 10.3579 11.1078 11.4029 11.4765 11.6632 12.2725 12.5949 12.6623 12.7778 13.4728 13.4885 14.1899 14.1962 14.3450 14.3825 14.8693 14.8774 15.3135 15.3252 k = 0.1200 0.2078-0.0000 ( 4329 PWs) bands (ev): -36.9131 -36.9131 -36.6990 -36.6990 -15.8942 -15.8942 -15.7014 -15.7011 -15.3984 -15.3983 -15.3759 -15.3758 -15.1972 -15.1963 -15.1772 -15.1770 2.3628 2.3634 3.9351 3.9458 5.8133 5.8200 5.9630 6.0111 6.2330 6.3019 6.4171 6.4387 6.9273 7.0476 7.0510 7.1367 7.2484 7.3119 7.9703 8.0009 8.2536 8.2780 8.3492 8.4403 9.4453 9.4664 10.3232 10.4492 11.1756 11.5301 11.5456 11.8011 12.3695 12.6767 12.6894 12.8060 13.5015 13.5145 14.2135 14.2164 14.3509 14.3885 14.8581 14.8624 15.3208 15.3739 k = 0.1133 0.1963-0.0000 ( 4333 PWs) bands (ev): -36.9132 -36.9131 -36.6990 -36.6990 -15.8941 -15.8941 -15.7010 -15.7007 -15.3983 -15.3982 -15.3754 -15.3753 -15.1964 -15.1957 -15.1770 -15.1769 2.3171 2.3175 3.9097 3.9187 5.8199 5.8257 5.9516 5.9943 6.2382 6.2965 6.4176 6.4388 6.9322 7.0364 7.0372 7.1130 7.2483 7.3035 7.9726 7.9961 8.2167 8.2386 8.3506 8.4254 9.4492 9.4664 10.4143 10.5409 11.2400 11.5774 11.6908 11.9389 12.4681 12.7154 12.7569 12.8304 13.5343 13.5466 14.2374 14.2387 14.3566 14.3935 14.8472 14.8487 15.3167 15.4249 k = 0.1067 0.1848-0.0000 ( 4327 PWs) bands (ev): -36.9132 -36.9132 -36.6991 -36.6991 -15.8939 -15.8939 -15.7006 -15.7004 -15.3982 -15.3981 -15.3749 -15.3748 -15.1956 -15.1950 -15.1769 -15.1768 2.2732 2.2736 3.8853 3.8928 5.8262 5.8312 5.9406 5.9778 6.2433 6.2917 6.4192 6.4400 6.9378 7.0225 7.0274 7.0910 7.2484 7.2957 7.9727 7.9893 8.1750 8.1944 8.3578 8.4175 9.4522 9.4661 10.5070 10.6328 11.3004 11.6183 11.8376 12.0754 12.5666 12.7419 12.8193 12.8669 13.5714 13.5849 14.2588 14.2650 14.3624 14.3978 14.8316 14.8416 15.3085 15.4700 k = 0.1000 0.1732-0.0000 ( 4335 PWs) bands (ev): -36.9132 -36.9132 -36.6991 -36.6991 -15.8937 -15.8937 -15.7003 -15.7001 -15.3981 -15.3981 -15.3744 -15.3743 -15.1949 -15.1944 -15.1769 -15.1768 2.2315 2.2317 3.8621 3.8683 5.8321 5.8363 5.9301 5.9619 6.2480 6.2872 6.4221 6.4424 6.9441 7.0090 7.0181 7.0710 7.2486 7.2886 7.9690 7.9786 8.1329 8.1521 8.3663 8.4139 9.4545 9.4657 10.6007 10.7246 11.3563 11.6528 11.9854 12.2095 12.6579 12.7752 12.8393 12.9403 13.6130 13.6288 14.2797 14.2918 14.3688 14.4013 14.8157 14.8369 15.2981 15.4912 k = 0.0933 0.1617-0.0000 ( 4339 PWs) bands (ev): -36.9133 -36.9133 -36.6992 -36.6992 -15.8936 -15.8936 -15.6999 -15.6998 -15.3980 -15.3980 -15.3739 -15.3738 -15.1942 -15.1938 -15.1768 -15.1767 2.1919 2.1920 3.8401 3.8451 5.8374 5.8407 5.9202 5.9468 6.2521 6.2832 6.4265 6.4460 6.9510 6.9962 7.0085 7.0539 7.2490 7.2822 7.9581 7.9615 8.0958 8.1158 8.3751 8.4129 9.4562 9.4652 10.6949 10.8159 11.4074 11.6812 12.1332 12.3401 12.7206 12.8369 12.8440 13.0235 13.6592 13.6780 14.2995 14.3177 14.3768 14.4046 14.7993 14.8349 15.2864 15.4934 k = 0.0867 0.1501-0.0000 ( 4349 PWs) bands (ev): -36.9133 -36.9133 -36.6992 -36.6992 -15.8934 -15.8934 -15.6996 -15.6995 -15.3979 -15.3979 -15.3734 -15.3734 -15.1936 -15.1932 -15.1767 -15.1766 2.1545 2.1547 3.8194 3.8234 5.8419 5.8442 5.9111 5.9327 6.2555 6.2796 6.4323 6.4506 6.9581 6.9841 6.9980 7.0402 7.2498 7.2767 7.9355 7.9360 8.0691 8.0886 8.3837 8.4135 9.4575 9.4645 10.7894 10.9065 11.4537 11.7039 12.2802 12.4654 12.7492 12.8416 12.9321 13.1083 13.7100 13.7316 14.3172 14.3394 14.3894 14.4077 14.7822 14.8356 15.2742 15.4893 k = 0.0800 0.1386-0.0000 ( 4345 PWs) bands (ev): -36.9134 -36.9133 -36.6993 -36.6993 -15.8933 -15.8933 -15.6993 -15.6992 -15.3978 -15.3978 -15.3730 -15.3730 -15.1930 -15.1927 -15.1766 -15.1765 2.1196 2.1197 3.7999 3.8031 5.8455 5.8468 5.9030 5.9199 6.2582 6.2763 6.4396 6.4563 6.9645 6.9735 6.9863 7.0302 7.2509 7.2723 7.9006 7.9022 8.0541 8.0711 8.3918 8.4151 9.4584 9.4639 10.8836 10.9961 11.4951 11.7215 12.4250 12.5816 12.7668 12.8339 13.0403 13.1937 13.7649 13.7888 14.3320 14.3539 14.4093 14.4111 14.7642 14.8383 15.2626 15.4826 k = 0.0733 0.1270-0.0000 ( 4337 PWs) bands (ev): -36.9134 -36.9134 -36.6993 -36.6993 -15.8931 -15.8931 -15.6990 -15.6989 -15.3977 -15.3977 -15.3726 -15.3725 -15.1924 -15.1921 -15.1765 -15.1764 2.0872 2.0872 3.7819 3.7843 5.8479 5.8481 5.8960 5.9087 6.2601 6.2734 6.4481 6.4629 6.9603 6.9738 6.9744 7.0236 7.2526 7.2692 7.8598 7.8609 8.0472 8.0607 8.3995 8.4173 9.4590 9.4632 10.9771 11.0843 11.5320 11.7348 12.5653 12.6725 12.7964 12.8231 13.1527 13.2788 13.8233 13.8487 14.3434 14.3622 14.4149 14.4348 14.7449 14.8418 15.2531 15.4741 k = 0.0667 0.1155-0.0000 ( 4325 PWs) bands (ev): -36.9134 -36.9134 -36.6993 -36.6993 -15.8929 -15.8929 -15.6987 -15.6986 -15.3976 -15.3976 -15.3721 -15.3721 -15.1918 -15.1916 -15.1764 -15.1763 2.0573 2.0573 3.7652 3.7670 5.8480 5.8489 5.8906 5.8993 6.2613 6.2708 6.4578 6.4703 6.9505 6.9613 6.9813 7.0193 7.2550 7.2673 7.8161 7.8164 8.0445 8.0546 8.4065 8.4199 9.4594 9.4625 11.0694 11.1706 11.5647 11.7442 12.6903 12.7071 12.8194 12.8711 13.2655 13.3631 13.8843 13.9102 14.3516 14.3676 14.4191 14.4622 14.7243 14.8440 15.2478 15.4634 k = 0.0600 0.1039-0.0000 ( 4321 PWs) bands (ev): -36.9134 -36.9134 -36.6994 -36.6994 -15.8928 -15.8928 -15.6984 -15.6984 -15.3976 -15.3976 -15.3718 -15.3718 -15.1913 -15.1912 -15.1763 -15.1763 2.0300 2.0300 3.7500 3.7513 5.8464 5.8481 5.8868 5.8922 6.2619 6.2685 6.4681 6.4783 6.9412 6.9495 6.9883 7.0168 7.2582 7.2670 7.7714 7.7716 8.0437 8.0511 8.4129 8.4227 9.4596 9.4619 11.1600 11.2544 11.5936 11.7507 12.7056 12.7410 12.8812 12.9717 13.3761 13.4456 13.9466 13.9719 14.3572 14.3720 14.4233 14.4887 14.7026 14.8422 15.2488 15.4430 k = 0.0533 0.0924-0.0000 ( 4313 PWs) bands (ev): -36.9135 -36.9135 -36.6994 -36.6994 -15.8927 -15.8927 -15.6982 -15.6982 -15.3975 -15.3975 -15.3714 -15.3714 -15.1908 -15.1907 -15.1762 -15.1762 2.0055 2.0055 3.7363 3.7372 5.8435 5.8455 5.8844 5.8875 6.2621 6.2665 6.4788 6.4868 6.9326 6.9386 6.9948 7.0154 7.2624 7.2683 7.7271 7.7278 8.0440 8.0491 8.4187 8.4255 9.4597 9.4613 11.2480 11.3348 11.6194 11.7547 12.6910 12.7255 13.0001 13.0760 13.4815 13.5254 14.0087 14.0322 14.3614 14.3762 14.4273 14.5116 14.6813 14.8343 15.2574 15.3931 k = 0.0467 0.0808-0.0000 ( 4313 PWs) bands (ev): -36.9135 -36.9135 -36.6994 -36.6994 -15.8926 -15.8926 -15.6980 -15.6980 -15.3975 -15.3975 -15.3711 -15.3711 -15.1904 -15.1904 -15.1761 -15.1761 1.9837 1.9837 3.7240 3.7247 5.8398 5.8417 5.8831 5.8847 6.2620 6.2648 6.4895 6.4953 6.9248 6.9289 7.0007 7.0149 7.2676 7.2713 7.6846 7.6854 8.0446 8.0480 8.4237 8.4283 9.4597 9.4607 11.3326 11.4107 11.6428 11.7570 12.6695 12.6966 13.1229 13.1787 13.5784 13.6006 14.0686 14.0894 14.3658 14.3812 14.4313 14.5266 14.6641 14.8191 15.2722 15.3404 k = 0.0400 0.0693-0.0000 ( 4301 PWs) bands (ev): -36.9135 -36.9135 -36.6995 -36.6995 -15.8925 -15.8925 -15.6978 -15.6978 -15.3974 -15.3974 -15.3708 -15.3708 -15.1901 -15.1900 -15.1761 -15.1761 1.9647 1.9647 3.7134 3.7138 5.8358 5.8373 5.8825 5.8832 6.2616 6.2633 6.4998 6.5037 6.9179 6.9205 7.0058 7.0150 7.2739 7.2760 7.6446 7.6453 8.0454 8.0475 8.4281 8.4310 9.4596 9.4603 11.4125 11.4803 11.6650 11.7582 12.6434 12.6631 13.2409 13.2785 13.6633 13.6693 14.1243 14.1413 14.3717 14.3879 14.4357 14.5281 14.6573 14.7978 15.2820 15.2924 k = 0.0333 0.0577-0.0000 ( 4301 PWs) bands (ev): -36.9135 -36.9135 -36.6995 -36.6995 -15.8924 -15.8924 -15.6976 -15.6976 -15.3974 -15.3974 -15.3706 -15.3706 -15.1898 -15.1897 -15.1760 -15.1760 1.9486 1.9486 3.7043 3.7045 5.8320 5.8330 5.8821 5.8825 6.2611 6.2621 6.5091 6.5116 6.9119 6.9134 7.0101 7.0155 7.2812 7.2823 7.6076 7.6082 8.0461 8.0474 8.4317 8.4334 9.4595 9.4599 11.4860 11.5410 11.6876 11.7592 12.6145 12.6277 13.3517 13.3744 13.7282 13.7320 14.1733 14.1856 14.3809 14.3970 14.4409 14.5149 14.6630 14.7728 15.2495 15.2501 k = 0.0267 0.0462-0.0000 ( 4297 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8923 -15.8923 -15.6975 -15.6975 -15.3973 -15.3973 -15.3704 -15.3704 -15.1895 -15.1895 -15.1760 -15.1760 1.9353 1.9353 3.6969 3.6970 5.8286 5.8291 5.8820 5.8821 6.2606 6.2611 6.5174 6.5187 6.9069 6.9077 7.0134 7.0163 7.2894 7.2898 7.5745 7.5749 8.0468 8.0474 8.4346 8.4355 9.4594 9.4596 11.5505 11.5896 11.7124 11.7611 12.5849 12.5927 13.4539 13.4657 13.7735 13.7806 14.2132 14.2207 14.3943 14.4089 14.4472 14.4946 14.6757 14.7476 15.2141 15.2141 k = 0.0200 0.0346-0.0000 ( 4293 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8923 -15.8923 -15.6974 -15.6974 -15.3973 -15.3973 -15.3703 -15.3703 -15.1893 -15.1893 -15.1759 -15.1759 1.9250 1.9250 3.6910 3.6911 5.8258 5.8260 5.8819 5.8819 6.2602 6.2604 6.5241 6.5246 6.9029 6.9032 7.0159 7.0171 7.2978 7.2980 7.5461 7.5463 8.0473 8.0476 8.4368 8.4372 9.4592 9.4593 11.6025 11.6241 11.7393 11.7653 12.5568 12.5606 13.5464 13.5511 13.8008 13.8065 14.2425 14.2460 14.4111 14.4225 14.4535 14.4755 14.6890 14.7262 15.1849 15.1850 k = 0.0133 0.0231-0.0000 ( 4291 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6973 -15.6973 -15.3972 -15.3972 -15.3702 -15.3702 -15.1892 -15.1892 -15.1759 -15.1759 1.9176 1.9176 3.6869 3.6869 5.8236 5.8237 5.8819 5.8819 6.2598 6.2598 6.5290 6.5292 6.9000 6.9001 7.0176 7.0179 7.3057 7.3057 7.5237 7.5238 8.0477 8.0478 8.4384 8.4385 9.4591 9.4592 11.6385 11.6459 11.7642 11.7731 12.5332 12.5344 13.6279 13.6290 13.8066 13.8093 14.2614 14.2624 14.4287 14.4352 14.4573 14.4627 14.6991 14.7120 15.1634 15.1634 k = 0.0067 0.0115-0.0000 ( 4287 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6973 -15.6973 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1759 -15.1759 1.9131 1.9131 3.6843 3.6844 5.8223 5.8223 5.8818 5.8818 6.2595 6.2595 6.5320 6.5320 6.8982 6.8982 7.0185 7.0185 7.3114 7.3114 7.5092 7.5092 8.0479 8.0479 8.4393 8.4393 9.4591 9.4591 11.6573 11.6583 11.7813 11.7825 12.5171 12.5172 13.6968 13.6968 13.7900 13.7905 14.2715 14.2717 14.4430 14.4449 14.4565 14.4567 14.7042 14.7059 15.1501 15.1501 k = 0.0000 0.0000 0.0000 ( 4283 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6972 -15.6972 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1758 -15.1758 1.9117 1.9117 3.6835 3.6835 5.8219 5.8219 5.8818 5.8818 6.2595 6.2595 6.5330 6.5330 6.8976 6.8976 7.0187 7.0187 7.3135 7.3135 7.5040 7.5040 8.0480 8.0480 8.4396 8.4396 9.4590 9.4590 11.6627 11.6627 11.7871 11.7871 12.5113 12.5113 13.7461 13.7461 13.7577 13.7577 14.2746 14.2746 14.4518 14.4518 14.4520 14.4520 14.7051 14.7051 15.1455 15.1455 k = 0.0000 0.0000 0.0000 ( 4283 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6972 -15.6972 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1758 -15.1758 1.9117 1.9117 3.6835 3.6835 5.8219 5.8219 5.8818 5.8818 6.2595 6.2595 6.5330 6.5330 6.8976 6.8976 7.0187 7.0187 7.3135 7.3135 7.5040 7.5040 8.0480 8.0480 8.4396 8.4396 9.4590 9.4590 11.6627 11.6627 11.7871 11.7871 12.5113 12.5113 13.7461 13.7461 13.7577 13.7577 14.2746 14.2746 14.4518 14.4518 14.4520 14.4520 14.7051 14.7051 15.1455 15.1455 k = 0.0000 0.0000 0.0129 ( 4295 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6973 -15.6973 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1759 -15.1759 1.9128 1.9128 3.6808 3.6808 5.8176 5.8262 5.8782 5.8854 6.2603 6.2603 6.5326 6.5326 6.8979 6.8979 7.0182 7.0182 7.3156 7.3156 7.4975 7.5116 8.0477 8.0477 8.4294 8.4480 9.4612 9.4612 11.6640 11.6640 11.7810 11.7964 12.5106 12.5106 13.7440 13.7488 13.7540 13.7540 14.2685 14.2685 14.4184 14.4587 14.4587 14.4646 14.7018 14.7194 15.1404 15.1404 k = 0.0000 0.0000 0.0258 ( 4307 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8922 -15.8922 -15.6972 -15.6972 -15.3972 -15.3972 -15.3701 -15.3701 -15.1891 -15.1891 -15.1761 -15.1761 1.9163 1.9163 3.6729 3.6729 5.8135 5.8306 5.8746 5.8889 6.2627 6.2627 6.5316 6.5316 6.8987 6.8987 7.0168 7.0168 7.3216 7.3216 7.4920 7.5200 8.0468 8.0468 8.4176 8.4545 9.4677 9.4677 11.6684 11.6684 11.7785 11.8090 12.5085 12.5085 13.7422 13.7427 13.7427 13.7520 14.2531 14.2531 14.3708 14.4541 14.4760 14.4760 14.7119 14.7385 15.1201 15.1201 k = 0.0000 0.0000 0.0387 ( 4307 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8921 -15.8921 -15.6972 -15.6972 -15.3971 -15.3971 -15.3701 -15.3701 -15.1891 -15.1891 -15.1764 -15.1764 1.9221 1.9221 3.6598 3.6598 5.8095 5.8349 5.8711 5.8922 6.2667 6.2667 6.5300 6.5300 6.9000 6.9000 7.0144 7.0144 7.3313 7.3313 7.4877 7.5294 8.0453 8.0453 8.4042 8.4590 9.4786 9.4786 11.6756 11.6756 11.7794 11.8249 12.5046 12.5046 13.7241 13.7241 13.7409 13.7559 14.2336 14.2336 14.3143 14.4253 14.4984 14.4984 14.7303 14.7575 15.0717 15.0717 k = 0.0000 0.0000 0.0516 ( 4313 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8920 -15.8920 -15.6971 -15.6971 -15.3969 -15.3969 -15.3701 -15.3701 -15.1892 -15.1892 -15.1768 -15.1768 1.9302 1.9302 3.6417 3.6417 5.8057 5.8391 5.8678 5.8955 6.2721 6.2721 6.5278 6.5278 6.9017 6.9017 7.0114 7.0114 7.3442 7.3442 7.4845 7.5396 8.0434 8.0434 8.3894 8.4615 9.4942 9.4942 11.6856 11.6856 11.7838 11.8437 12.4987 12.4987 13.6982 13.6982 13.7397 13.7605 14.2139 14.2139 14.2521 14.3851 14.5215 14.5215 14.7503 14.7738 14.9930 14.9930 k = 0.0000 0.0000 0.0645 ( 4325 PWs) bands (ev): -36.9136 -36.9136 -36.6995 -36.6995 -15.8918 -15.8918 -15.6971 -15.6971 -15.3967 -15.3967 -15.3701 -15.3701 -15.1892 -15.1892 -15.1774 -15.1774 1.9406 1.9406 3.6190 3.6190 5.8022 5.8427 5.8650 5.8986 6.2790 6.2790 6.5253 6.5253 6.9037 6.9037 7.0078 7.0078 7.3598 7.3598 7.4826 7.5504 8.0409 8.0409 8.3735 8.4620 9.5145 9.5145 11.6983 11.6983 11.7916 11.8653 12.4900 12.4900 13.6656 13.6656 13.7385 13.7658 14.1861 14.1959 14.1959 14.3381 14.5415 14.5415 14.7674 14.7859 14.8977 14.8977 k = 0.0000 0.0000 0.0774 ( 4319 PWs) bands (ev): -36.9136 -36.9136 -36.6996 -36.6996 -15.8916 -15.8916 -15.6969 -15.6969 -15.3965 -15.3965 -15.3701 -15.3701 -15.1892 -15.1892 -15.1780 -15.1780 1.9532 1.9532 3.5919 3.5919 5.7989 5.8451 5.8634 5.9016 6.2871 6.2871 6.5226 6.5226 6.9061 6.9061 7.0038 7.0038 7.3773 7.3773 7.4818 7.5619 8.0380 8.0380 8.3565 8.4605 9.5400 9.5400 11.7138 11.7138 11.8030 11.8898 12.4778 12.4778 13.6268 13.6268 13.7368 13.7718 14.1175 14.1806 14.1806 14.2874 14.5537 14.5537 14.7796 14.7933 14.7999 14.7999 k = 0.0000 0.0000 0.0903 ( 4301 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8913 -15.8913 -15.6967 -15.6967 -15.3961 -15.3961 -15.3701 -15.3700 -15.1892 -15.1892 -15.1786 -15.1786 1.9679 1.9679 3.5609 3.5609 5.7959 5.8455 5.8638 5.9044 6.2965 6.2965 6.5198 6.5198 6.9086 6.9086 6.9995 6.9995 7.3961 7.3961 7.4822 7.5738 8.0348 8.0348 8.3388 8.4569 9.5708 9.5708 11.7320 11.7320 11.8178 11.9167 12.4612 12.4612 13.5828 13.5828 13.7344 13.7784 14.0472 14.1681 14.1681 14.2349 14.5460 14.5460 14.7175 14.7175 14.7860 14.7959 k = 0.0000 0.0000 0.1032 ( 4301 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8911 -15.8911 -15.6966 -15.6966 -15.3958 -15.3958 -15.3700 -15.3700 -15.1892 -15.1892 -15.1795 -15.1795 1.9848 1.9848 3.5263 3.5263 5.7932 5.8438 5.8663 5.9071 6.3068 6.3068 6.5170 6.5170 6.9112 6.9112 6.9951 6.9951 7.4156 7.4156 7.4839 7.5861 8.0312 8.0312 8.3206 8.4515 9.6072 9.6072 11.7527 11.7527 11.8358 11.9460 12.4388 12.4388 13.5345 13.5345 13.7303 13.7856 13.9761 14.1584 14.1584 14.1823 14.4973 14.4973 14.6755 14.6755 14.7865 14.7939 k = 0.0000 0.0000 0.1161 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8908 -15.8908 -15.6965 -15.6965 -15.3955 -15.3955 -15.3700 -15.3700 -15.1893 -15.1893 -15.1804 -15.1804 2.0036 2.0036 3.4886 3.4886 5.7907 5.8409 5.8698 5.9095 6.3180 6.3180 6.5142 6.5142 6.9138 6.9138 6.9906 6.9906 7.4351 7.4351 7.4868 7.5985 8.0274 8.0274 8.3022 8.4441 9.6495 9.6495 11.7758 11.7758 11.8571 11.9773 12.4095 12.4095 13.4826 13.4826 13.7238 13.7931 13.9047 14.1311 14.1509 14.1509 14.4183 14.4183 14.6666 14.6666 14.7817 14.7877 k = 0.0000 0.0000 0.1290 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8905 -15.8905 -15.6963 -15.6963 -15.3952 -15.3952 -15.3700 -15.3700 -15.1893 -15.1893 -15.1813 -15.1813 2.0245 2.0245 3.4483 3.4483 5.7886 5.8375 5.8738 5.9118 6.3299 6.3299 6.5116 6.5116 6.9163 6.9163 6.9862 6.9862 7.4541 7.4541 7.4909 7.6108 8.0235 8.0235 8.2838 8.4351 9.6979 9.6979 11.8011 11.8011 11.8814 12.0104 12.3720 12.3720 13.4281 13.4281 13.7135 13.7997 13.8351 14.0833 14.1454 14.1454 14.3350 14.3350 14.6677 14.6677 14.7723 14.7778 k = 0.0000 0.0000 0.1419 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8902 -15.8902 -15.6961 -15.6961 -15.3948 -15.3948 -15.3700 -15.3700 -15.1893 -15.1893 -15.1822 -15.1822 2.0471 2.0471 3.4059 3.4059 5.7867 5.8338 5.8780 5.9139 6.3422 6.3422 6.5092 6.5092 6.9188 6.9188 6.9818 6.9818 7.4720 7.4720 7.4962 7.6228 8.0194 8.0194 8.2659 8.4244 9.7526 9.7526 11.8285 11.8285 11.9085 12.0450 12.3254 12.3254 13.3716 13.3716 13.6980 13.7594 13.8134 14.0408 14.1414 14.1414 14.2586 14.2586 14.6704 14.6704 14.7593 14.7649 k = 0.0000 0.0000 0.1548 ( 4325 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8899 -15.8899 -15.6959 -15.6959 -15.3944 -15.3944 -15.3699 -15.3699 -15.1894 -15.1894 -15.1832 -15.1832 2.0714 2.0714 3.3618 3.3618 5.7852 5.8301 5.8822 5.9157 6.3550 6.3550 6.5070 6.5070 6.9211 6.9211 6.9775 6.9775 7.4886 7.4886 7.5026 7.6343 8.0154 8.0154 8.2487 8.4122 9.8136 9.8136 11.8576 11.8576 11.9383 12.0809 12.2687 12.2687 13.3138 13.3138 13.6756 13.6905 13.8220 14.0054 14.1382 14.1382 14.1938 14.1938 14.6721 14.6721 14.7434 14.7496 k = 0.0000 0.0000 0.1677 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8896 -15.8896 -15.6957 -15.6957 -15.3940 -15.3940 -15.3699 -15.3699 -15.1894 -15.1894 -15.1842 -15.1842 2.0971 2.0971 3.3166 3.3166 5.7841 5.8263 5.8864 5.9173 6.3679 6.3679 6.5050 6.5050 6.9232 6.9232 6.9734 6.9734 7.5036 7.5036 7.5102 7.6450 8.0115 8.0115 8.2326 8.3986 9.8811 9.8811 11.8879 11.8879 11.9705 12.1174 12.2024 12.2024 13.2551 13.2551 13.6224 13.6457 13.8317 13.9782 14.1296 14.1296 14.1483 14.1483 14.6723 14.6723 14.7256 14.7326 k = 0.0000 0.0000 0.1806 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6996 -36.6996 -15.8893 -15.8893 -15.6956 -15.6956 -15.3936 -15.3936 -15.3699 -15.3699 -15.1894 -15.1894 -15.1851 -15.1851 2.1242 2.1242 3.2708 3.2708 5.7832 5.8225 5.8903 5.9187 6.3808 6.3808 6.5033 6.5033 6.9250 6.9250 6.9696 6.9696 7.5168 7.5168 7.5189 7.6545 8.0077 8.0077 8.2181 8.3839 9.9550 9.9550 11.9179 11.9179 12.0049 12.1272 12.1272 12.1543 13.1961 13.1961 13.5563 13.6085 13.8418 13.9591 14.0984 14.0984 14.1401 14.1401 14.6711 14.6711 14.7066 14.7144 k = 0.0000 0.0000 0.1935 ( 4319 PWs) bands (ev): -36.9135 -36.9135 -36.6997 -36.6997 -15.8890 -15.8890 -15.6954 -15.6954 -15.3932 -15.3932 -15.3699 -15.3699 -15.1895 -15.1894 -15.1861 -15.1861 2.1522 2.1522 3.2249 3.2249 5.7826 5.8188 5.8942 5.9198 6.3935 6.3935 6.5016 6.5016 6.9265 6.9265 6.9662 6.9662 7.5281 7.5281 7.5285 7.6625 8.0042 8.0042 8.2056 8.3681 10.0351 10.0351 11.9407 11.9407 12.0410 12.0508 12.0508 12.1908 13.1374 13.1374 13.4928 13.5657 13.8521 13.9467 14.0740 14.0740 14.1393 14.1393 14.6687 14.6687 14.6872 14.6956 k = 0.0000 0.0000 0.2064 ( 4319 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8887 -15.8887 -15.6952 -15.6952 -15.3928 -15.3928 -15.3698 -15.3698 -15.1895 -15.1895 -15.1870 -15.1870 2.1808 2.1808 3.1797 3.1797 5.7824 5.8151 5.8978 5.9207 6.4059 6.4059 6.5001 6.5001 6.9275 6.9275 6.9632 6.9632 7.5376 7.5376 7.5390 7.6687 8.0008 8.0008 8.1954 8.3516 10.1212 10.1212 11.9105 11.9105 12.0195 12.0195 12.0786 12.2264 13.0797 13.0797 13.4328 13.5191 13.8625 13.9394 14.0615 14.0615 14.1396 14.1396 14.6653 14.6653 14.6681 14.6769 k = 0.0000 0.0000 0.2193 ( 4319 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8885 -15.8885 -15.6950 -15.6950 -15.3924 -15.3924 -15.3698 -15.3698 -15.1895 -15.1895 -15.1878 -15.1878 2.2096 2.2096 3.1357 3.1357 5.7825 5.8116 5.9013 5.9214 6.4176 6.4176 6.4986 6.4986 6.9281 6.9281 6.9607 6.9607 7.5453 7.5453 7.5503 7.6728 7.9978 7.9978 8.1879 8.3344 10.2129 10.2129 11.8189 11.8189 12.0427 12.0427 12.1170 12.2602 13.0237 13.0237 13.3771 13.4708 13.8728 13.9355 14.0603 14.0603 14.1404 14.1404 14.6499 14.6587 14.6615 14.6615 k = 0.0000 0.0000 0.2322 ( 4319 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8883 -15.8883 -15.6949 -15.6949 -15.3921 -15.3921 -15.3698 -15.3698 -15.1895 -15.1895 -15.1885 -15.1885 2.2379 2.2379 3.0938 3.0938 5.7829 5.8082 5.9045 5.9217 6.4287 6.4287 6.4970 6.4970 6.9283 6.9283 6.9588 6.9588 7.5515 7.5515 7.5623 7.6745 7.9950 7.9950 8.1833 8.3168 10.3099 10.3099 11.7119 11.7119 12.0751 12.0751 12.1559 12.2910 12.9702 12.9702 13.3270 13.4224 13.8828 13.9337 14.0687 14.0687 14.1416 14.1416 14.6330 14.6416 14.6573 14.6573 k = 0.0000 0.0000 0.2451 ( 4320 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8881 -15.8881 -15.6948 -15.6948 -15.3918 -15.3918 -15.3698 -15.3698 -15.1895 -15.1895 -15.1892 -15.1892 2.2651 2.2651 3.0548 3.0548 5.7836 5.8049 5.9074 5.9219 6.4389 6.4389 6.4954 6.4954 6.9281 6.9281 6.9574 6.9574 7.5563 7.5563 7.5749 7.6738 7.9927 7.9927 8.1819 8.2991 10.4116 10.4116 11.5984 11.5984 12.1084 12.1084 12.1943 12.3176 12.9203 12.9203 13.2835 13.3753 13.8923 13.9331 14.0847 14.0847 14.1429 14.1429 14.6180 14.6259 14.6532 14.6532 k = 0.0000 0.0000 0.2580 ( 4314 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8879 -15.8879 -15.6947 -15.6947 -15.3916 -15.3916 -15.3698 -15.3698 -15.1898 -15.1898 -15.1895 -15.1895 2.2900 2.2900 3.0201 3.0201 5.7846 5.8018 5.9101 5.9217 6.4481 6.4481 6.4935 6.4935 6.9277 6.9277 6.9565 6.9565 7.5598 7.5598 7.5877 7.6707 7.9907 7.9907 8.1836 8.2815 10.5175 10.5175 11.4814 11.4814 12.1401 12.1401 12.2316 12.3387 12.8753 12.8753 13.2482 13.3311 13.9011 13.9329 14.1059 14.1059 14.1447 14.1447 14.6054 14.6122 14.6494 14.6494 k = 0.0000 0.0000 0.2709 ( 4338 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8878 -15.8878 -15.6946 -15.6946 -15.3914 -15.3914 -15.3698 -15.3698 -15.1902 -15.1902 -15.1896 -15.1896 2.3116 2.3116 2.9907 2.9907 5.7858 5.7988 5.9125 5.9212 6.4561 6.4561 6.4914 6.4914 6.9272 6.9272 6.9558 6.9558 7.5624 7.5624 7.6006 7.6652 7.9891 7.9891 8.1884 8.2643 10.6265 10.6265 11.3627 11.3627 12.1684 12.1684 12.2665 12.3527 12.8368 12.8368 13.2225 13.2910 13.9090 13.9324 14.1276 14.1276 14.1486 14.1486 14.5954 14.6008 14.6458 14.6458 k = 0.0000 0.0000 0.2838 ( 4338 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8877 -15.8877 -15.6946 -15.6946 -15.3913 -15.3913 -15.3698 -15.3698 -15.1906 -15.1906 -15.1896 -15.1896 2.3285 2.3285 2.9682 2.9682 5.7874 5.7961 5.9147 5.9205 6.4627 6.4627 6.4892 6.4892 6.9267 6.9267 6.9555 6.9555 7.5641 7.5641 7.6135 7.6577 7.9880 7.9880 8.1960 8.2479 10.7370 10.7370 11.2449 11.2449 12.1910 12.1910 12.2978 12.3585 12.8068 12.8068 13.2075 13.2566 13.9159 13.9313 14.1392 14.1392 14.1615 14.1615 14.5883 14.5921 14.6377 14.6377 k = 0.0000 0.0000 0.2967 ( 4338 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3912 -15.3912 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3393 2.3393 2.9540 2.9540 5.7892 5.7936 5.9166 5.9195 6.4674 6.4674 6.4871 6.4871 6.9263 6.9263 6.9553 6.9553 7.5650 7.5650 7.6260 7.6484 7.9873 7.9873 8.2061 8.2324 10.8432 10.8432 11.1341 11.1341 12.2059 12.2059 12.3240 12.3555 12.7876 12.7876 13.2039 13.2296 13.9216 13.9293 14.1418 14.1418 14.1772 14.1772 14.5844 14.5864 14.6104 14.6104 k = 0.0000 0.0000 0.3096 ( 4326 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3911 -15.3911 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3430 2.3430 2.9491 2.9491 5.7913 5.7913 5.9182 5.9182 6.4693 6.4693 6.4862 6.4862 6.9262 6.9262 6.9553 6.9553 7.5654 7.5654 7.6377 7.6377 7.9871 7.9871 8.2184 8.2184 10.9067 10.9067 11.0692 11.0692 12.2111 12.2111 12.3437 12.3437 12.7810 12.7810 13.2116 13.2116 13.9261 13.9261 14.1424 14.1424 14.1836 14.1836 14.5838 14.5838 14.5992 14.5992 k = 0.0000 0.0000 0.3096 ( 4326 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3911 -15.3911 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3430 2.3430 2.9491 2.9491 5.7913 5.7913 5.9182 5.9182 6.4693 6.4693 6.4862 6.4862 6.9262 6.9262 6.9553 6.9553 7.5654 7.5654 7.6377 7.6377 7.9871 7.9871 8.2184 8.2184 10.9067 10.9067 11.0692 11.0692 12.2111 12.2111 12.3437 12.3437 12.7810 12.7810 13.2116 13.2116 13.9261 13.9261 14.1424 14.1424 14.1836 14.1836 14.5838 14.5838 14.5992 14.5992 k = 0.0114 0.0066 0.3096 ( 4332 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3912 -15.3912 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3442 2.3442 2.9505 2.9505 5.7916 5.7916 5.9183 5.9183 6.4691 6.4691 6.4865 6.4865 6.9264 6.9264 6.9554 6.9554 7.5656 7.5656 7.6376 7.6376 7.9873 7.9873 8.2183 8.2183 10.9081 10.9081 11.0663 11.0663 12.2088 12.2088 12.3419 12.3419 12.7728 12.7728 13.2020 13.2020 13.9278 13.9278 14.1359 14.1359 14.2018 14.2018 14.5707 14.5707 14.6079 14.6079 k = 0.0227 0.0131 0.3096 ( 4326 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3912 -15.3912 -15.3698 -15.3698 -15.1908 -15.1908 -15.1897 -15.1897 2.3476 2.3476 2.9546 2.9546 5.7928 5.7928 5.9186 5.9186 6.4686 6.4686 6.4877 6.4877 6.9272 6.9272 6.9556 6.9556 7.5663 7.5663 7.6371 7.6371 7.9878 7.9878 8.2181 8.2181 10.9122 10.9122 11.0575 11.0575 12.2018 12.2018 12.3369 12.3369 12.7484 12.7484 13.1745 13.1745 13.9325 13.9325 14.1306 14.1306 14.2412 14.2412 14.5491 14.5491 14.6138 14.6138 k = 0.0341 0.0197 0.3096 ( 4320 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8877 -15.8877 -15.6946 -15.6946 -15.3912 -15.3912 -15.3699 -15.3699 -15.1908 -15.1908 -15.1898 -15.1898 2.3533 2.3533 2.9614 2.9614 5.7946 5.7946 5.9191 5.9191 6.4679 6.4679 6.4894 6.4894 6.9284 6.9284 6.9561 6.9561 7.5676 7.5676 7.6362 7.6362 7.9888 7.9888 8.2176 8.2176 10.9190 10.9190 11.0430 11.0430 12.1899 12.1899 12.3288 12.3288 12.7083 12.7083 13.1329 13.1329 13.9394 13.9394 14.1332 14.1332 14.2916 14.2916 14.5238 14.5238 14.6113 14.6113 k = 0.0455 0.0262 0.3096 ( 4320 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8877 -15.8877 -15.6947 -15.6947 -15.3912 -15.3912 -15.3701 -15.3701 -15.1909 -15.1909 -15.1900 -15.1900 2.3612 2.3612 2.9708 2.9708 5.7972 5.7972 5.9199 5.9199 6.4670 6.4670 6.4917 6.4917 6.9301 6.9301 6.9567 6.9567 7.5692 7.5692 7.6352 7.6352 7.9900 7.9900 8.2171 8.2171 10.9283 10.9283 11.0229 11.0229 12.1728 12.1728 12.3181 12.3181 12.6534 12.6534 13.0815 13.0815 13.9472 13.9472 14.1438 14.1438 14.3490 14.3490 14.4953 14.4953 14.6036 14.6036 k = 0.0568 0.0328 0.3096 ( 4318 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8878 -15.8878 -15.6948 -15.6948 -15.3912 -15.3912 -15.3702 -15.3702 -15.1910 -15.1910 -15.1901 -15.1901 2.3713 2.3713 2.9830 2.9830 5.8005 5.8005 5.9208 5.9208 6.4661 6.4661 6.4944 6.4944 6.9324 6.9324 6.9576 6.9576 7.5711 7.5711 7.6339 7.6339 7.9917 7.9917 8.2164 8.2164 10.9395 10.9395 10.9977 10.9977 12.1505 12.1505 12.3049 12.3049 12.5853 12.5853 13.0241 13.0241 13.9550 13.9550 14.1615 14.1615 14.4092 14.4092 14.4638 14.4638 14.5934 14.5934 k = 0.0682 0.0394 0.3096 ( 4308 PWs) bands (ev): -36.9133 -36.9133 -36.6997 -36.6997 -15.8878 -15.8878 -15.6949 -15.6949 -15.3912 -15.3912 -15.3704 -15.3704 -15.1911 -15.1911 -15.1903 -15.1903 2.3837 2.3837 2.9978 2.9978 5.8045 5.8045 5.9219 5.9219 6.4651 6.4651 6.4975 6.4975 6.9352 6.9352 6.9588 6.9588 7.5733 7.5733 7.6326 7.6326 7.9937 7.9937 8.2155 8.2155 10.9479 10.9479 10.9720 10.9720 12.1230 12.1230 12.2887 12.2887 12.5064 12.5064 12.9632 12.9632 13.9621 13.9621 14.1850 14.1850 14.4291 14.4291 14.4677 14.4677 14.5847 14.5847 k = 0.0795 0.0459 0.3096 ( 4312 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8879 -15.8879 -15.6951 -15.6951 -15.3913 -15.3913 -15.3707 -15.3707 -15.1913 -15.1913 -15.1904 -15.1904 2.3983 2.3983 3.0151 3.0151 5.8092 5.8092 5.9232 5.9232 6.4641 6.4641 6.5009 6.5009 6.9385 6.9385 6.9604 6.9604 7.5755 7.5755 7.6314 7.6314 7.9961 7.9961 8.2146 8.2146 10.9239 10.9239 10.9753 10.9753 12.0905 12.0905 12.2669 12.2669 12.4216 12.4216 12.9005 12.9005 13.9682 13.9682 14.2127 14.2127 14.3933 14.3933 14.5069 14.5069 14.5924 14.5924 k = 0.0909 0.0525 0.3096 ( 4312 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8881 -15.8881 -15.6953 -15.6953 -15.3913 -15.3913 -15.3710 -15.3710 -15.1917 -15.1917 -15.1905 -15.1905 2.4150 2.4150 3.0351 3.0351 5.8145 5.8145 5.9247 5.9247 6.4631 6.4631 6.5047 6.5047 6.9424 6.9424 6.9625 6.9625 7.5777 7.5777 7.6305 7.6305 7.9989 7.9989 8.2137 8.2137 10.8831 10.8831 10.9917 10.9917 12.0533 12.0533 12.2303 12.2303 12.3423 12.3423 12.8368 12.8368 13.9733 13.9733 14.2423 14.2423 14.3573 14.3573 14.5090 14.5090 14.6347 14.6347 k = 0.1023 0.0590 0.3096 ( 4316 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8882 -15.8882 -15.6955 -15.6955 -15.3914 -15.3914 -15.3713 -15.3713 -15.1921 -15.1921 -15.1906 -15.1906 2.4338 2.4338 3.0576 3.0576 5.8204 5.8204 5.9263 5.9263 6.4619 6.4619 6.5087 6.5087 6.9468 6.9468 6.9650 6.9650 7.5794 7.5794 7.6302 7.6302 8.0020 8.0020 8.2127 8.2127 10.8364 10.8364 11.0099 11.0099 12.0115 12.0115 12.1615 12.1615 12.2886 12.2886 12.7723 12.7723 13.9775 13.9775 14.2655 14.2655 14.3288 14.3288 14.4931 14.4931 14.6918 14.6918 k = 0.1136 0.0656 0.3096 ( 4316 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8883 -15.8883 -15.6957 -15.6957 -15.3915 -15.3915 -15.3716 -15.3716 -15.1926 -15.1926 -15.1906 -15.1906 2.4547 2.4547 3.0825 3.0825 5.8269 5.8269 5.9281 5.9281 6.4607 6.4607 6.5130 6.5130 6.9518 6.9518 6.9682 6.9682 7.5805 7.5805 7.6306 7.6306 8.0056 8.0056 8.2118 8.2118 10.7848 10.7848 11.0284 11.0284 11.9642 11.9642 12.0681 12.0681 12.2561 12.2561 12.7073 12.7073 13.9806 13.9806 14.2545 14.2545 14.3354 14.3354 14.4724 14.4724 14.7507 14.7507 k = 0.1250 0.0722 0.3096 ( 4320 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8885 -15.8885 -15.6960 -15.6960 -15.3915 -15.3915 -15.3720 -15.3720 -15.1931 -15.1931 -15.1906 -15.1906 2.4776 2.4776 3.1099 3.1099 5.8340 5.8340 5.9301 5.9301 6.4593 6.4593 6.5175 6.5175 6.9572 6.9572 6.9721 6.9721 7.5808 7.5808 7.6319 7.6319 8.0096 8.0096 8.2110 8.2110 10.7287 10.7287 11.0453 11.0453 11.9060 11.9060 11.9735 11.9735 12.2297 12.2297 12.6418 12.6418 13.9828 13.9828 14.2194 14.2194 14.3663 14.3663 14.4504 14.4504 14.8082 14.8082 k = 0.1364 0.0787 0.3096 ( 4316 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8886 -15.8886 -15.6962 -15.6962 -15.3916 -15.3916 -15.3724 -15.3724 -15.1937 -15.1937 -15.1907 -15.1907 2.5025 2.5025 3.1396 3.1396 5.8415 5.8415 5.9323 5.9323 6.4578 6.4578 6.5223 6.5223 6.9632 6.9632 6.9769 6.9769 7.5802 7.5802 7.6344 7.6344 8.0140 8.0140 8.2103 8.2103 10.6685 10.6685 11.0583 11.0583 11.8248 11.8248 11.8989 11.8989 12.2038 12.2038 12.5760 12.5760 13.9841 13.9841 14.1803 14.1803 14.3991 14.3991 14.4313 14.4313 14.8628 14.8628 k = 0.1477 0.0853 0.3096 ( 4320 PWs) bands (ev): -36.9131 -36.9131 -36.6994 -36.6994 -15.8888 -15.8888 -15.6965 -15.6965 -15.3917 -15.3917 -15.3728 -15.3728 -15.1943 -15.1943 -15.1907 -15.1907 2.5293 2.5293 3.1715 3.1715 5.8495 5.8495 5.9347 5.9347 6.4561 6.4561 6.5274 6.5274 6.9695 6.9695 6.9825 6.9825 7.5788 7.5788 7.6377 7.6377 8.0188 8.0188 8.2097 8.2097 10.6046 10.6046 11.0633 11.0633 11.7312 11.7312 11.8404 11.8404 12.1765 12.1765 12.5099 12.5099 13.9842 13.9842 14.1408 14.1408 14.3996 14.3996 14.4461 14.4461 14.9126 14.9126 k = 0.1591 0.0919 0.3096 ( 4328 PWs) bands (ev): -36.9131 -36.9131 -36.6994 -36.6994 -15.8890 -15.8890 -15.6969 -15.6969 -15.3918 -15.3918 -15.3733 -15.3733 -15.1950 -15.1950 -15.1907 -15.1907 2.5579 2.5579 3.2056 3.2056 5.8580 5.8580 5.9375 5.9375 6.4542 6.4542 6.5326 6.5326 6.9762 6.9762 6.9892 6.9892 7.5767 7.5767 7.6418 7.6418 8.0240 8.0240 8.2094 8.2094 10.5372 10.5372 11.0540 11.0540 11.6449 11.6449 11.7858 11.7858 12.1470 12.1470 12.4437 12.4437 13.9831 13.9831 14.1023 14.1023 14.3804 14.3804 14.4820 14.4820 14.9536 14.9536 k = 0.1705 0.0984 0.3096 ( 4320 PWs) bands (ev): -36.9131 -36.9131 -36.6993 -36.6993 -15.8892 -15.8892 -15.6972 -15.6972 -15.3919 -15.3919 -15.3737 -15.3737 -15.1956 -15.1956 -15.1907 -15.1907 2.5882 2.5882 3.2418 3.2418 5.8667 5.8667 5.9406 5.9406 6.4521 6.4521 6.5381 6.5381 6.9830 6.9830 6.9971 6.9971 7.5742 7.5742 7.6465 7.6465 8.0297 8.0297 8.2095 8.2095 10.4668 10.4668 11.0226 11.0226 11.5778 11.5778 11.7324 11.7324 12.1151 12.1151 12.3775 12.3775 13.9805 13.9805 14.0658 14.0658 14.3616 14.3616 14.5190 14.5190 14.9839 14.9839 k = 0.1818 0.1050 0.3096 ( 4316 PWs) bands (ev): -36.9130 -36.9130 -36.6993 -36.6993 -15.8894 -15.8894 -15.6975 -15.6975 -15.3920 -15.3920 -15.3741 -15.3741 -15.1964 -15.1964 -15.1907 -15.1907 2.6203 2.6203 3.2799 3.2799 5.8758 5.8758 5.9441 5.9441 6.4497 6.4497 6.5437 6.5437 6.9900 6.9900 7.0061 7.0061 7.5714 7.5714 7.6516 7.6516 8.0359 8.0359 8.2099 8.2099 10.3935 10.3935 10.9636 10.9636 11.5349 11.5349 11.6810 11.6810 12.0805 12.0805 12.3114 12.3114 13.9752 13.9752 14.0326 14.0326 14.3446 14.3446 14.5556 14.5556 15.0088 15.0091 k = 0.1932 0.1115 0.3096 ( 4328 PWs) bands (ev): -36.9130 -36.9130 -36.6992 -36.6992 -15.8896 -15.8896 -15.6979 -15.6979 -15.3922 -15.3922 -15.3746 -15.3746 -15.1971 -15.1971 -15.1908 -15.1908 2.6539 2.6539 3.3198 3.3198 5.8850 5.8850 5.9483 5.9483 6.4471 6.4471 6.5495 6.5495 6.9971 6.9971 7.0161 7.0161 7.5686 7.5686 7.6569 7.6569 8.0424 8.0424 8.2108 8.2108 10.3176 10.3176 10.8786 10.8786 11.5111 11.5111 11.6358 11.6358 12.0431 12.0431 12.2457 12.2457 13.9647 13.9647 14.0056 14.0056 14.3300 14.3300 14.5913 14.5913 15.0310 15.0310 k = 0.2045 0.1181 0.3096 ( 4332 PWs) bands (ev): -36.9129 -36.9129 -36.6992 -36.6992 -15.8898 -15.8898 -15.6982 -15.6982 -15.3923 -15.3923 -15.3751 -15.3751 -15.1979 -15.1979 -15.1908 -15.1908 2.6890 2.6890 3.3614 3.3614 5.8943 5.8943 5.9531 5.9531 6.4442 6.4442 6.5554 6.5554 7.0044 7.0044 7.0272 7.0272 7.5658 7.5658 7.6623 7.6623 8.0493 8.0493 8.2122 8.2122 10.2394 10.2394 10.7746 10.7746 11.4887 11.4887 11.6080 11.6080 12.0030 12.0030 12.1806 12.1806 13.9459 13.9459 13.9885 13.9885 14.3181 14.3181 14.6259 14.6259 15.0513 15.0513 k = 0.2159 0.1247 0.3096 ( 4330 PWs) bands (ev): -36.9129 -36.9129 -36.6991 -36.6991 -15.8901 -15.8901 -15.6986 -15.6986 -15.3924 -15.3924 -15.3756 -15.3756 -15.1987 -15.1987 -15.1908 -15.1908 2.7254 2.7254 3.4045 3.4045 5.9036 5.9036 5.9589 5.9589 6.4411 6.4411 6.5615 6.5615 7.0116 7.0116 7.0392 7.0392 7.5632 7.5632 7.6677 7.6677 8.0564 8.0564 8.2142 8.2142 10.1590 10.1590 10.6587 10.6587 11.4511 11.4511 11.6074 11.6074 11.9605 11.9605 12.1164 12.1164 13.9221 13.9221 13.9781 13.9781 14.3091 14.3091 14.6593 14.6593 15.0695 15.0695 k = 0.2273 0.1312 0.3096 ( 4330 PWs) bands (ev): -36.9128 -36.9128 -36.6991 -36.6991 -15.8903 -15.8903 -15.6990 -15.6990 -15.3926 -15.3926 -15.3761 -15.3761 -15.1994 -15.1994 -15.1908 -15.1908 2.7631 2.7631 3.4489 3.4489 5.9128 5.9128 5.9658 5.9658 6.4378 6.4378 6.5678 6.5678 7.0187 7.0187 7.0520 7.0520 7.5609 7.5609 7.6731 7.6731 8.0638 8.0638 8.2170 8.2170 10.0765 10.0765 10.5361 10.5361 11.4012 11.4012 11.6263 11.6263 11.9160 11.9160 12.0535 12.0535 13.8983 13.8983 13.9694 13.9694 14.3029 14.3029 14.6913 14.6913 15.0852 15.0853 k = 0.2386 0.1378 0.3096 ( 4342 PWs) bands (ev): -36.9128 -36.9128 -36.6990 -36.6990 -15.8905 -15.8905 -15.6994 -15.6994 -15.3928 -15.3928 -15.3766 -15.3766 -15.2003 -15.2003 -15.1908 -15.1908 2.8019 2.8019 3.4945 3.4945 5.9218 5.9218 5.9740 5.9740 6.4343 6.4343 6.5742 6.5742 7.0256 7.0256 7.0655 7.0655 7.5591 7.5591 7.6784 7.6784 8.0713 8.0713 8.2207 8.2207 9.9917 9.9917 10.4101 10.4101 11.3460 11.3460 11.6536 11.6536 11.8706 11.8706 11.9926 11.9926 13.8764 13.8764 13.9607 13.9607 14.2995 14.2995 14.7218 14.7218 15.0976 15.0976 k = 0.2500 0.1443 0.3096 ( 4334 PWs) bands (ev): -36.9127 -36.9127 -36.6990 -36.6990 -15.8907 -15.8907 -15.6997 -15.6997 -15.3929 -15.3929 -15.3770 -15.3770 -15.2010 -15.2010 -15.1908 -15.1908 2.8416 2.8416 3.5411 3.5411 5.9305 5.9305 5.9836 5.9836 6.4305 6.4305 6.5807 6.5807 7.0320 7.0320 7.0797 7.0797 7.5578 7.5578 7.6837 7.6837 8.0788 8.0788 8.2253 8.2253 9.9047 9.9047 10.2832 10.2832 11.2890 11.2890 11.6802 11.6802 11.8271 11.8271 11.9356 11.9356 13.8572 13.8572 13.9514 13.9514 14.2990 14.2990 14.7507 14.7507 15.1046 15.1046 k = 0.2614 0.1509 0.3096 ( 4332 PWs) bands (ev): -36.9127 -36.9127 -36.6989 -36.6989 -15.8910 -15.8910 -15.7001 -15.7001 -15.3931 -15.3931 -15.3775 -15.3775 -15.2018 -15.2018 -15.1909 -15.1909 2.8822 2.8822 3.5884 3.5884 5.9391 5.9391 5.9948 5.9948 6.4267 6.4267 6.5874 6.5874 7.0379 7.0379 7.0942 7.0942 7.5571 7.5571 7.6891 7.6891 8.0862 8.0862 8.2309 8.2309 9.8149 9.8149 10.1574 10.1574 11.2314 11.2314 11.6917 11.6917 11.7917 11.7917 11.8888 11.8888 13.8407 13.8407 13.9412 13.9412 14.3011 14.3011 14.7780 14.7780 15.1040 15.1040 k = 0.2727 0.1575 0.3096 ( 4328 PWs) bands (ev): -36.9127 -36.9127 -36.6989 -36.6989 -15.8912 -15.8912 -15.7005 -15.7005 -15.3933 -15.3933 -15.3779 -15.3779 -15.2026 -15.2026 -15.1909 -15.1909 2.9234 2.9234 3.6362 3.6362 5.9474 5.9474 6.0077 6.0077 6.4226 6.4226 6.5944 6.5944 7.0430 7.0430 7.1090 7.1090 7.5571 7.5571 7.6945 7.6945 8.0933 8.0933 8.2375 8.2375 9.7216 9.7216 10.0344 10.0344 11.1742 11.1742 11.6708 11.6708 11.7613 11.7613 11.8719 11.8719 13.8271 13.8271 13.9302 13.9302 14.3059 14.3059 14.8037 14.8037 15.0955 15.0955 k = 0.2841 0.1640 0.3096 ( 4320 PWs) bands (ev): -36.9126 -36.9126 -36.6988 -36.6988 -15.8914 -15.8914 -15.7008 -15.7008 -15.3935 -15.3935 -15.3783 -15.3783 -15.2034 -15.2034 -15.1909 -15.1909 2.9650 2.9650 3.6842 3.6842 5.9555 5.9555 6.0225 6.0225 6.4185 6.4185 6.6015 6.6015 7.0471 7.0471 7.1239 7.1239 7.5578 7.5578 7.7000 7.7000 8.1000 8.1000 8.2453 8.2453 9.6243 9.6243 9.9162 9.9162 11.1178 11.1178 11.6281 11.6281 11.7169 11.7169 11.8928 11.8928 13.8161 13.8161 13.9185 13.9185 14.3130 14.3130 14.8276 14.8276 15.0819 15.0819 k = 0.2955 0.1706 0.3096 ( 4328 PWs) bands (ev): -36.9126 -36.9126 -36.6988 -36.6988 -15.8916 -15.8916 -15.7012 -15.7012 -15.3937 -15.3937 -15.3787 -15.3787 -15.2041 -15.2041 -15.1909 -15.1909 3.0069 3.0069 3.7322 3.7322 5.9635 5.9635 6.0391 6.0391 6.4144 6.4144 6.6089 6.6089 7.0501 7.0501 7.1386 7.1386 7.5593 7.5593 7.7058 7.7058 8.1063 8.1063 8.2541 8.2541 9.5223 9.5223 9.8042 9.8042 11.0627 11.0627 11.5782 11.5782 11.6642 11.6642 11.9312 11.9312 13.8075 13.8075 13.9062 13.9062 14.3224 14.3224 14.8498 14.8498 15.0655 15.0655 k = 0.3068 0.1771 0.3096 ( 4336 PWs) bands (ev): -36.9125 -36.9125 -36.6987 -36.6987 -15.8919 -15.8919 -15.7016 -15.7016 -15.3939 -15.3939 -15.3791 -15.3791 -15.2049 -15.2049 -15.1909 -15.1909 3.0489 3.0489 3.7798 3.7798 5.9713 5.9713 6.0580 6.0580 6.4102 6.4102 6.6166 6.6166 7.0517 7.0517 7.1529 7.1529 7.5616 7.5616 7.7120 7.7120 8.1121 8.1121 8.2638 8.2638 9.4153 9.4153 9.6995 9.6995 11.0093 11.0093 11.5262 11.5262 11.6095 11.6095 11.9762 11.9762 13.8008 13.8008 13.8938 13.8938 14.3337 14.3337 14.8702 14.8702 15.0484 15.0484 k = 0.3182 0.1837 0.3096 ( 4340 PWs) bands (ev): -36.9125 -36.9125 -36.6987 -36.6987 -15.8921 -15.8921 -15.7020 -15.7020 -15.3942 -15.3942 -15.3795 -15.3795 -15.2056 -15.2056 -15.1909 -15.1909 3.0906 3.0906 3.8268 3.8268 5.9788 5.9788 6.0793 6.0793 6.4061 6.4061 6.6247 6.6247 7.0518 7.0518 7.1663 7.1663 7.5646 7.5646 7.7188 7.7188 8.1174 8.1174 8.2743 8.2743 9.3041 9.3041 9.6023 9.6023 10.9579 10.9579 11.4737 11.4737 11.5547 11.5547 12.0239 12.0239 13.7951 13.7951 13.8821 13.8821 14.3469 14.3469 14.8887 14.8887 15.0317 15.0317 k = 0.3295 0.1903 0.3096 ( 4332 PWs) bands (ev): -36.9124 -36.9124 -36.6986 -36.6986 -15.8923 -15.8923 -15.7023 -15.7023 -15.3944 -15.3944 -15.3798 -15.3798 -15.2063 -15.2063 -15.1909 -15.1909 3.1320 3.1320 3.8728 3.8728 5.9860 5.9860 6.1033 6.1033 6.4021 6.4021 6.6332 6.6332 7.0503 7.0503 7.1787 7.1787 7.5682 7.5682 7.7262 7.7262 8.1223 8.1223 8.2854 8.2854 9.1900 9.1900 9.5121 9.5121 10.9086 10.9086 11.4218 11.4218 11.5009 11.5009 12.0728 12.0728 13.7891 13.7891 13.8725 13.8725 14.3615 14.3615 14.9053 14.9053 15.0164 15.0164 k = 0.3409 0.1968 0.3096 ( 4336 PWs) bands (ev): -36.9124 -36.9124 -36.6986 -36.6986 -15.8925 -15.8925 -15.7026 -15.7026 -15.3946 -15.3946 -15.3801 -15.3801 -15.2070 -15.2070 -15.1910 -15.1910 3.1726 3.1726 3.9175 3.9175 5.9927 5.9927 6.1302 6.1302 6.3982 6.3982 6.6422 6.6422 7.0472 7.0472 7.1896 7.1896 7.5724 7.5724 7.7342 7.7342 8.1267 8.1267 8.2970 8.2970 9.0747 9.0747 9.4281 9.4281 10.8618 10.8618 11.3709 11.3709 11.4484 11.4484 12.1219 12.1219 13.7811 13.7811 13.8666 13.8666 14.3773 14.3773 14.9195 14.9195 15.0033 15.0033 k = 0.3523 0.2034 0.3096 ( 4336 PWs) bands (ev): -36.9124 -36.9124 -36.6985 -36.6985 -15.8927 -15.8927 -15.7029 -15.7029 -15.3948 -15.3948 -15.3804 -15.3804 -15.2077 -15.2077 -15.1910 -15.1910 3.2123 3.2123 3.9606 3.9606 5.9988 5.9988 6.1603 6.1603 6.3945 6.3945 6.6517 6.6517 7.0423 7.0423 7.1985 7.1985 7.5770 7.5770 7.7431 7.7431 8.1307 8.1307 8.3087 8.3087 8.9598 8.9598 9.3498 9.3498 10.8175 10.8175 11.3217 11.3217 11.3978 11.3978 12.1708 12.1708 13.7699 13.7699 13.8656 13.8656 14.3941 14.3941 14.9309 14.9309 14.9933 14.9933 k = 0.3636 0.2099 0.3096 ( 4348 PWs) bands (ev): -36.9123 -36.9123 -36.6985 -36.6985 -15.8929 -15.8929 -15.7033 -15.7033 -15.3951 -15.3951 -15.3807 -15.3807 -15.2083 -15.2083 -15.1910 -15.1910 3.2508 3.2508 4.0017 4.0017 6.0043 6.0043 6.1938 6.1938 6.3911 6.3911 6.6617 6.6617 7.0358 7.0358 7.2050 7.2050 7.5818 7.5818 7.7528 7.7528 8.1342 8.1342 8.3204 8.3204 8.8467 8.8467 9.2767 9.2767 10.7761 10.7761 11.2743 11.2743 11.3494 11.3494 12.2188 12.2188 13.7556 13.7556 13.8696 13.8696 14.4115 14.4115 14.9385 14.9385 14.9875 14.9875 k = 0.3750 0.2165 0.3096 ( 4342 PWs) bands (ev): -36.9123 -36.9123 -36.6984 -36.6984 -15.8930 -15.8930 -15.7035 -15.7035 -15.3952 -15.3952 -15.3809 -15.3809 -15.2089 -15.2089 -15.1910 -15.1910 3.2877 3.2877 4.0406 4.0406 6.0092 6.0092 6.2308 6.2308 6.3879 6.3879 6.6725 6.6725 7.0275 7.0275 7.2086 7.2086 7.5867 7.5867 7.7632 7.7632 8.1373 8.1373 8.3318 8.3318 8.7371 8.7371 9.2085 9.2085 10.7376 10.7376 11.2291 11.2291 11.3036 11.3036 12.2656 12.2656 13.7388 13.7388 13.8778 13.8778 14.4292 14.4292 14.9416 14.9416 14.9867 14.9867 k = 0.3864 0.2231 0.3096 ( 4342 PWs) bands (ev): -36.9123 -36.9123 -36.6984 -36.6984 -15.8932 -15.8932 -15.7038 -15.7038 -15.3955 -15.3955 -15.3812 -15.3812 -15.2094 -15.2094 -15.1910 -15.1910 3.3228 3.3228 4.0770 4.0770 6.0133 6.0133 6.2714 6.2714 6.3851 6.3851 6.6839 6.6839 7.0178 7.0178 7.2086 7.2086 7.5915 7.5915 7.7742 7.7742 8.1399 8.1399 8.3426 8.3426 8.6322 8.6322 9.1452 9.1452 10.7020 10.7020 11.1866 11.1866 11.2608 11.2608 12.3107 12.3107 13.7207 13.7207 13.8891 13.8891 14.4470 14.4470 14.9412 14.9412 14.9894 14.9894 k = 0.3977 0.2296 0.3096 ( 4336 PWs) bands (ev): -36.9122 -36.9122 -36.6984 -36.6984 -15.8933 -15.8933 -15.7040 -15.7040 -15.3956 -15.3956 -15.3813 -15.3813 -15.2099 -15.2099 -15.1910 -15.1910 3.3558 3.3558 4.1106 4.1106 6.0167 6.0167 6.3155 6.3155 6.3827 6.3827 6.6960 6.6960 7.0065 7.0065 7.2045 7.2045 7.5960 7.5960 7.7857 7.7857 8.1420 8.1420 8.3526 8.3526 8.5337 8.5337 9.0870 9.0870 10.6697 10.6697 11.1469 11.1469 11.2211 11.2211 12.3537 12.3537 13.7019 13.7019 13.9030 13.9030 14.4643 14.4643 14.9396 14.9396 14.9919 14.9919 k = 0.4091 0.2362 0.3096 ( 4332 PWs) bands (ev): -36.9122 -36.9122 -36.6983 -36.6983 -15.8934 -15.8934 -15.7042 -15.7042 -15.3958 -15.3958 -15.3815 -15.3815 -15.2103 -15.2103 -15.1910 -15.1910 3.3864 3.3864 4.1411 4.1411 6.0195 6.0195 6.3620 6.3620 6.3817 6.3817 6.7088 6.7088 6.9940 6.9940 7.1954 7.1954 7.6001 7.6001 7.7973 7.7973 8.1432 8.1432 8.3609 8.3609 8.4437 8.4437 9.0339 9.0339 10.6406 10.6406 11.1104 11.1104 11.1848 11.1848 12.3940 12.3940 13.6831 13.6831 13.9186 13.9186 14.4810 14.4810 14.9380 14.9380 14.9839 14.9839 k = 0.4205 0.2427 0.3096 ( 4336 PWs) bands (ev): -36.9122 -36.9122 -36.6983 -36.6983 -15.8936 -15.8936 -15.7045 -15.7045 -15.3960 -15.3960 -15.3817 -15.3817 -15.2107 -15.2107 -15.1910 -15.1910 3.4142 3.4142 4.1685 4.1685 6.0216 6.0216 6.3772 6.3772 6.4154 6.4154 6.7223 6.7223 6.9805 6.9805 7.1808 7.1808 7.6036 7.6036 7.8089 7.8089 8.1430 8.1430 8.3513 8.3513 8.3800 8.3800 8.9863 8.9863 10.6147 10.6147 11.0773 11.0773 11.1523 11.1523 12.4313 12.4313 13.6649 13.6649 13.9352 13.9352 14.4967 14.4967 14.9366 14.9366 14.9546 14.9546 k = 0.4318 0.2493 0.3096 ( 4344 PWs) bands (ev): -36.9122 -36.9122 -36.6983 -36.6983 -15.8937 -15.8937 -15.7046 -15.7046 -15.3961 -15.3961 -15.3818 -15.3818 -15.2111 -15.2111 -15.1910 -15.1910 3.4390 3.4390 4.1924 4.1924 6.0232 6.0232 6.3761 6.3761 6.4686 6.4686 6.7364 6.7364 6.9661 6.9661 7.1600 7.1600 7.6064 7.6064 7.8199 7.8199 8.1401 8.1401 8.2884 8.2884 8.3806 8.3806 8.9444 8.9444 10.5922 10.5922 11.0479 11.0479 11.1236 11.1236 12.4651 12.4651 13.6478 13.6478 13.9522 13.9522 14.5110 14.5110 14.9172 14.9172 14.9378 14.9378 k = 0.4432 0.2559 0.3096 ( 4348 PWs) bands (ev): -36.9121 -36.9121 -36.6983 -36.6983 -15.8938 -15.8938 -15.7048 -15.7048 -15.3963 -15.3963 -15.3819 -15.3819 -15.2114 -15.2114 -15.1911 -15.1911 3.4605 3.4605 4.2129 4.2129 6.0243 6.0243 6.3749 6.3749 6.5242 6.5242 6.7510 6.7510 6.9512 6.9512 7.1327 7.1327 7.6085 7.6085 7.8302 7.8302 8.1316 8.1316 8.2358 8.2358 8.3859 8.3859 8.9085 8.9085 10.5730 10.5730 11.0226 11.0226 11.0991 11.0991 12.4948 12.4948 13.6322 13.6322 13.9689 13.9689 14.5237 14.5237 14.8827 14.8827 14.9378 14.9378 k = 0.4545 0.2624 0.3096 ( 4344 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8939 -15.8939 -15.7049 -15.7049 -15.3964 -15.3964 -15.3820 -15.3820 -15.2116 -15.2116 -15.1910 -15.1910 3.4784 3.4784 4.2298 4.2298 6.0250 6.0250 6.3739 6.3739 6.5806 6.5806 6.7659 6.7659 6.9363 6.9363 7.0993 7.0993 7.6098 7.6098 7.8393 7.8393 8.1136 8.1136 8.2034 8.2034 8.3904 8.3904 8.8787 8.8787 10.5573 10.5573 11.0015 11.0015 11.0788 11.0788 12.5200 12.5200 13.6187 13.6187 13.9844 13.9844 14.5346 14.5346 14.8515 14.8515 14.9384 14.9384 k = 0.4659 0.2690 0.3096 ( 4328 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8939 -15.8939 -15.7050 -15.7050 -15.3964 -15.3964 -15.3821 -15.3821 -15.2118 -15.2118 -15.1910 -15.1910 3.4926 3.4926 4.2429 4.2429 6.0255 6.0255 6.3732 6.3732 6.6359 6.6359 6.7810 6.7810 6.9221 6.9221 7.0611 7.0611 7.6106 7.6106 7.8468 7.8468 8.0893 8.0893 8.1888 8.1888 8.3938 8.3938 8.8554 8.8554 10.5451 10.5451 10.9848 10.9848 11.0629 11.0629 12.5402 12.5402 13.6077 13.6077 13.9978 13.9978 14.5433 14.5433 14.8254 14.8254 14.9393 14.9393 k = 0.4773 0.2756 0.3096 ( 4328 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8939 -15.8939 -15.7051 -15.7051 -15.3965 -15.3965 -15.3821 -15.3821 -15.2119 -15.2119 -15.1910 -15.1910 3.5029 3.5029 4.2524 4.2524 6.0257 6.0257 6.3727 6.3727 6.6860 6.6860 6.7961 6.7961 6.9097 6.9097 7.0209 7.0209 7.6110 7.6110 7.8525 7.8525 8.0676 8.0676 8.1829 8.1829 8.3962 8.3962 8.8387 8.8387 10.5364 10.5364 10.9728 10.9728 11.0515 11.0515 12.5550 12.5550 13.5995 13.5995 14.0082 14.0082 14.5497 14.5497 14.8056 14.8056 14.9401 14.9401 k = 0.4886 0.2821 0.3096 ( 4332 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7051 -15.7051 -15.3965 -15.3965 -15.3821 -15.3821 -15.2120 -15.2120 -15.1910 -15.1910 3.5091 3.5091 4.2580 4.2580 6.0259 6.0259 6.3724 6.3724 6.7233 6.7233 6.8101 6.8101 6.9010 6.9010 6.9857 6.9857 7.6111 7.6111 7.8560 7.8560 8.0536 8.0536 8.1807 8.1807 8.3976 8.3976 8.8286 8.8286 10.5311 10.5311 10.9656 10.9656 11.0446 11.0446 12.5640 12.5640 13.5944 13.5944 14.0148 14.0148 14.5536 14.5536 14.7933 14.7933 14.9407 14.9407 k = 0.5000 0.2887 0.3096 ( 4324 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7051 -15.7051 -15.3965 -15.3965 -15.3821 -15.3821 -15.2120 -15.2120 -15.1910 -15.1910 3.5112 3.5112 4.2599 4.2599 6.0259 6.0259 6.3723 6.3723 6.7374 6.7374 6.8172 6.8172 6.8978 6.8978 6.9701 6.9701 7.6111 7.6111 7.8572 7.8572 8.0488 8.0488 8.1801 8.1801 8.3980 8.3980 8.8252 8.8252 10.5294 10.5294 10.9632 10.9632 11.0423 11.0423 12.5670 12.5670 13.5927 13.5927 14.0171 14.0171 14.5549 14.5549 14.7891 14.7891 14.9409 14.9409 k = 0.5000 0.2887 0.3096 ( 4324 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7051 -15.7051 -15.3965 -15.3965 -15.3821 -15.3821 -15.2120 -15.2120 -15.1910 -15.1910 3.5112 3.5112 4.2599 4.2599 6.0259 6.0259 6.3723 6.3723 6.7374 6.7374 6.8172 6.8172 6.8978 6.8978 6.9701 6.9701 7.6111 7.6111 7.8572 7.8572 8.0488 8.0488 8.1801 8.1801 8.3980 8.3980 8.8252 8.8252 10.5294 10.5294 10.9632 10.9632 11.0423 11.0423 12.5670 12.5670 13.5927 13.5927 14.0171 14.0171 14.5549 14.5549 14.7891 14.7891 14.9409 14.9409 k = 0.4933 0.3002 0.3096 ( 4338 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7052 -15.7050 -15.3966 -15.3965 -15.3822 -15.3822 -15.2122 -15.2119 -15.1911 -15.1910 3.5111 3.5124 4.2569 4.2645 6.0242 6.0294 6.3714 6.3732 6.7139 6.7542 6.8167 6.8189 6.8884 6.9058 6.9621 6.9862 7.6092 7.6129 7.8559 7.8578 8.0273 8.0713 8.1777 8.1798 8.3986 8.3987 8.8183 8.8324 10.5167 10.5363 10.9587 10.9685 11.0243 11.0518 12.5654 12.5694 13.5914 13.5922 14.0148 14.0184 14.5428 14.5552 14.7851 14.8009 14.9386 14.9436 k = 0.4867 0.3118 0.3096 ( 4338 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7054 -15.7049 -15.3966 -15.3964 -15.3823 -15.3822 -15.2123 -15.2117 -15.1911 -15.1911 3.5122 3.5148 4.2554 4.2706 6.0244 6.0346 6.3707 6.3742 6.6858 6.7634 6.8165 6.8215 6.8796 6.9109 6.9620 7.0102 7.6073 7.6147 7.8541 7.8577 8.0067 8.0950 8.1730 8.1765 8.4002 8.4007 8.8117 8.8398 10.4986 10.5377 10.9521 10.9754 11.0011 11.0522 12.5647 12.5727 13.5883 13.5899 14.0114 14.0186 14.5226 14.5433 14.7895 14.8165 14.9369 14.9468 k = 0.4800 0.3233 0.3096 ( 4338 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7055 -15.7048 -15.3966 -15.3963 -15.3824 -15.3822 -15.2125 -15.2116 -15.1912 -15.1911 3.5144 3.5184 4.2553 4.2781 6.0264 6.0416 6.3700 6.3754 6.6553 6.7663 6.8147 6.8247 6.8736 6.9133 6.9674 7.0409 7.6052 7.6164 7.8518 7.8571 7.9868 8.1202 8.1662 8.1703 8.4029 8.4040 8.8056 8.8472 10.4756 10.5340 10.9320 10.9829 10.9840 11.0439 12.5650 12.5767 13.5835 13.5858 14.0070 14.0176 14.4984 14.5227 14.7988 14.8315 14.9354 14.9500 k = 0.4733 0.3349 0.3096 ( 4340 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8941 -15.8940 -15.7056 -15.7048 -15.3966 -15.3962 -15.3826 -15.3823 -15.2127 -15.2114 -15.1913 -15.1912 3.5177 3.5230 4.2567 4.2872 6.0302 6.0503 6.3693 6.3767 6.6239 6.7648 6.8098 6.8282 6.8711 6.9146 6.9754 7.0766 7.6031 7.6180 7.8489 7.8560 7.9674 8.1469 8.1579 8.1613 8.4063 8.4084 8.7999 8.8545 10.4484 10.5259 10.8915 10.9800 10.9883 11.0295 12.5661 12.5815 13.5768 13.5800 14.0014 14.0155 14.4733 14.4978 14.8082 14.8425 14.9341 14.9530 k = 0.4667 0.3464 0.3096 ( 4344 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8941 -15.8940 -15.7058 -15.7047 -15.3966 -15.3961 -15.3827 -15.3825 -15.2128 -15.2112 -15.1914 -15.1913 3.5221 3.5287 4.2594 4.2976 6.0358 6.0606 6.3685 6.3782 6.5928 6.7605 6.8028 6.8320 6.8715 6.9159 6.9838 7.1155 7.6009 7.6193 7.8457 7.8545 7.9486 8.1484 8.1488 8.1762 8.4105 8.4138 8.7947 8.8615 10.4177 10.5142 10.8382 10.9791 10.9813 11.0213 12.5682 12.5870 13.5685 13.5724 13.9946 14.0120 14.4493 14.4719 14.8144 14.8477 14.9326 14.9553 k = 0.4600 0.3580 0.3096 ( 4344 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8941 -15.8940 -15.7059 -15.7046 -15.3965 -15.3960 -15.3830 -15.3826 -15.2129 -15.2111 -15.1916 -15.1914 3.5275 3.5355 4.2634 4.3094 6.0431 6.0724 6.3675 6.3798 6.5629 6.7538 6.7956 6.8359 6.8737 6.9175 6.9916 7.1561 7.5985 7.6203 7.8420 7.8527 7.9303 8.1342 8.1380 8.2069 8.4152 8.4200 8.7899 8.8681 10.3842 10.4995 10.7762 10.9478 10.9839 11.0267 12.5712 12.5932 13.5584 13.5631 13.9868 14.0072 14.4277 14.4473 14.8154 14.8462 14.9306 14.9567 k = 0.4533 0.3695 0.3096 ( 4338 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8942 -15.8940 -15.7061 -15.7046 -15.3965 -15.3958 -15.3832 -15.3828 -15.2131 -15.2109 -15.1917 -15.1915 3.5339 3.5432 4.2686 4.3225 6.0521 6.0856 6.3663 6.3815 6.5347 6.7452 6.7894 6.8399 6.8767 6.9195 6.9981 7.1969 7.5960 7.6210 7.8380 7.8508 7.9128 8.1171 8.1272 8.2400 8.4205 8.4269 8.7854 8.8741 10.3488 10.4824 10.7079 10.9042 10.9866 11.0364 12.5753 12.6000 13.5466 13.5522 13.9779 14.0010 14.4093 14.4254 14.8104 14.8383 14.9280 14.9569 k = 0.4467 0.3811 0.3096 ( 4342 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8942 -15.8940 -15.7062 -15.7045 -15.3964 -15.3957 -15.3834 -15.3830 -15.2132 -15.2107 -15.1919 -15.1916 3.5411 3.5517 4.2748 4.3367 6.0628 6.1001 6.3647 6.3833 6.5088 6.7353 6.7849 6.8442 6.8804 6.9217 7.0030 7.2364 7.5934 7.6212 7.8337 7.8485 7.8970 8.0979 8.1162 8.2751 8.4262 8.4344 8.7811 8.8794 10.3120 10.4623 10.6350 10.8521 10.9884 11.0467 12.5803 12.6075 13.5333 13.5398 13.9683 13.9935 14.3944 14.4068 14.7994 14.8242 14.9247 14.9560 k = 0.4400 0.3926 0.3096 ( 4328 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8942 -15.8940 -15.7063 -15.7045 -15.3963 -15.3955 -15.3837 -15.3832 -15.2133 -15.2105 -15.1921 -15.1917 3.5492 3.5611 4.2821 4.3519 6.0751 6.1156 6.3625 6.3852 6.4857 6.7246 6.7820 6.8487 6.8846 6.9243 7.0062 7.2732 7.5908 7.6207 7.8292 7.8442 7.8849 8.0768 8.1054 8.3122 8.4324 8.4429 8.7771 8.8839 10.2746 10.4368 10.5620 10.7928 10.9890 11.0568 12.5862 12.6156 13.5185 13.5261 13.9583 13.9851 14.3831 14.3920 14.7831 14.8049 14.9206 14.9541 k = 0.4333 0.4041 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6981 -15.8943 -15.8941 -15.7065 -15.7044 -15.3962 -15.3953 -15.3840 -15.3834 -15.2135 -15.2104 -15.1923 -15.1919 3.5579 3.5712 4.2901 4.3680 6.0888 6.1320 6.3596 6.3871 6.4657 6.7138 6.7806 6.8535 6.8892 6.9269 7.0074 7.3055 7.5883 7.6195 7.8245 7.8350 7.8806 8.0541 8.0954 8.3502 8.4390 8.4531 8.7731 8.8874 10.2371 10.3972 10.4987 10.7274 10.9882 11.0662 12.5931 12.6243 13.5022 13.5110 13.9482 13.9761 14.3751 14.3808 14.7621 14.7809 14.9160 14.9512 k = 0.4267 0.4157 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9120 -36.6981 -36.6981 -15.8943 -15.8941 -15.7066 -15.7044 -15.3961 -15.3951 -15.3843 -15.3837 -15.2136 -15.2102 -15.1925 -15.1921 3.5673 3.5818 4.2989 4.3847 6.1040 6.1490 6.3559 6.3891 6.4493 6.7032 6.7807 6.8586 6.8943 6.9296 7.0067 7.3317 7.5862 7.6175 7.8197 7.8206 7.8848 8.0301 8.0867 8.3870 8.4460 8.4670 8.7692 8.8900 10.2000 10.3323 10.4577 10.6569 10.9858 11.0749 12.6010 12.6334 13.4848 13.4950 13.9387 13.9668 14.3701 14.3729 14.7374 14.7533 14.9110 14.9475 k = 0.4200 0.4272 0.3096 ( 4326 PWs) bands (ev): -36.9121 -36.9120 -36.6981 -36.6981 -15.8944 -15.8941 -15.7068 -15.7044 -15.3959 -15.3949 -15.3846 -15.3840 -15.2137 -15.2101 -15.1927 -15.1922 3.5771 3.5929 4.3081 4.4020 6.1205 6.1663 6.3515 6.3910 6.4365 6.6931 6.7822 6.8641 6.9000 6.9322 7.0042 7.3504 7.5848 7.6144 7.8034 7.8149 7.8954 8.0052 8.0802 8.4175 8.4534 8.4896 8.7653 8.8915 10.1638 10.2495 10.4328 10.5819 10.9819 11.0826 12.6096 12.6430 13.4663 13.4780 13.9300 13.9578 14.3678 14.3680 14.7098 14.7227 14.9057 14.9431 k = 0.4133 0.4388 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9120 -36.6981 -36.6981 -15.8944 -15.8942 -15.7069 -15.7044 -15.3958 -15.3946 -15.3849 -15.3843 -15.2139 -15.2099 -15.1930 -15.1924 3.5873 3.6043 4.3178 4.4195 6.1382 6.1835 6.3469 6.3928 6.4270 6.6835 6.7851 6.8700 6.9062 6.9347 6.9999 7.3605 7.5840 7.6101 7.7849 7.8101 7.9100 7.9798 8.0777 8.4374 8.4611 8.5248 8.7615 8.8920 10.1288 10.1592 10.4145 10.5035 10.9766 11.0893 12.6191 12.6529 13.4471 13.4605 13.9226 13.9495 14.3656 14.3675 14.6800 14.6900 14.9003 14.9383 k = 0.4067 0.4503 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8945 -15.8942 -15.7071 -15.7044 -15.3957 -15.3944 -15.3852 -15.3846 -15.2140 -15.2098 -15.1932 -15.1925 3.5977 3.6159 4.3277 4.4371 6.1568 6.2003 6.3427 6.3944 6.4203 6.6745 6.7896 6.8764 6.9131 6.9369 6.9942 7.3622 7.5838 7.6044 7.7657 7.8055 7.9257 7.9544 8.0815 8.4498 8.4690 8.5691 8.7581 8.8914 10.0660 10.0955 10.3996 10.4224 10.9701 11.0950 12.6292 12.6632 13.4272 13.4425 13.9167 13.9422 14.3651 14.3689 14.6490 14.6560 14.8949 14.9331 k = 0.4000 0.4619 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8945 -15.8942 -15.7072 -15.7044 -15.3955 -15.3942 -15.3856 -15.3849 -15.2141 -15.2097 -15.1934 -15.1927 3.6081 3.6275 4.3375 4.4544 6.1764 6.2163 6.3398 6.3957 6.4159 6.6663 6.7957 6.8831 6.9205 6.9386 6.9875 7.3562 7.5840 7.5972 7.7462 7.8012 7.9295 7.9386 8.0948 8.4585 8.4772 8.6174 8.7559 8.8899 9.9720 10.0642 10.3396 10.3868 10.9626 11.0998 12.6399 12.6737 13.4070 13.4244 13.9126 13.9363 14.3659 14.3714 14.6176 14.6216 14.8896 14.9278 k = 0.3933 0.4734 0.3096 ( 4330 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8946 -15.8943 -15.7073 -15.7044 -15.3954 -15.3940 -15.3859 -15.3852 -15.2142 -15.2096 -15.1936 -15.1928 3.6184 3.6390 4.3473 4.4713 6.1966 6.2312 6.3386 6.3966 6.4132 6.6588 6.8034 6.8901 6.9285 6.9393 6.9805 7.3439 7.5843 7.5883 7.7267 7.7973 7.9056 7.9460 8.1191 8.4654 8.4853 8.6647 8.7576 8.8874 9.8788 10.0348 10.2561 10.3756 10.9543 11.1037 12.6510 12.6842 13.3868 13.4064 13.9103 13.9318 14.3676 14.3745 14.5865 14.5875 14.8845 14.9225 k = 0.3867 0.4850 0.3096 ( 4336 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6981 -15.8946 -15.8943 -15.7075 -15.7045 -15.3952 -15.3938 -15.3862 -15.3856 -15.2143 -15.2095 -15.1939 -15.1929 3.6285 3.6501 4.3567 4.4875 6.2172 6.2447 6.3393 6.3969 6.4117 6.6521 6.8125 6.8971 6.9371 6.9383 6.9743 7.3265 7.5778 7.5845 7.7072 7.7938 7.8832 7.9482 8.1529 8.4713 8.4934 8.6998 8.7734 8.8839 9.7877 10.0074 10.1730 10.3659 10.9456 11.1067 12.6624 12.6948 13.3669 13.3888 13.9099 13.9289 14.3693 14.3775 14.5547 14.5567 14.8798 14.9173 k = 0.3800 0.4965 0.3096 ( 4336 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6981 -15.8947 -15.8944 -15.7076 -15.7045 -15.3951 -15.3936 -15.3865 -15.3859 -15.2145 -15.2094 -15.1940 -15.1930 3.6381 3.6606 4.3656 4.5027 6.2378 6.2570 6.3417 6.3965 6.4112 6.6463 6.8231 6.9035 6.9348 6.9462 6.9706 7.3054 7.5659 7.5845 7.6882 7.7909 7.8629 7.9468 8.1931 8.4764 8.5011 8.7120 8.8132 8.8797 9.7003 9.9813 10.0923 10.3574 10.9369 11.1089 12.6738 12.7051 13.3477 13.3720 13.9112 13.9276 14.3704 14.3797 14.5244 14.5293 14.8755 14.9124 k = 0.3733 0.5081 0.3096 ( 4332 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6980 -15.8947 -15.8944 -15.7077 -15.7045 -15.3950 -15.3934 -15.3868 -15.3861 -15.2146 -15.2093 -15.1942 -15.1931 3.6470 3.6705 4.3739 4.5166 6.2583 6.2683 6.3450 6.3953 6.4115 6.6413 6.8350 6.9073 6.9305 6.9555 6.9697 7.2821 7.5529 7.5843 7.6698 7.7884 7.8450 7.9437 8.2363 8.4808 8.5083 8.7123 8.8652 8.8747 9.6182 9.9527 10.0192 10.3501 10.9283 11.1105 12.6850 12.7151 13.3296 13.3563 13.9140 13.9277 14.3700 14.3798 14.4982 14.5054 14.8716 14.9080 k = 0.3667 0.5196 0.3096 ( 4324 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6980 -15.8947 -15.8944 -15.7078 -15.7045 -15.3948 -15.3932 -15.3870 -15.3864 -15.2146 -15.2093 -15.1943 -15.1932 3.6552 3.6793 4.3813 4.5290 6.2781 6.2789 6.3487 6.3931 6.4124 6.6373 6.8478 6.9049 6.9300 6.9649 6.9707 7.2577 7.5395 7.5840 7.6526 7.7865 7.8299 7.9399 8.2798 8.4847 8.5145 8.7092 8.8691 8.9198 9.5432 9.9072 9.9695 10.3437 10.9204 11.1115 12.6956 12.7244 13.3129 13.3420 13.9179 13.9290 14.3672 14.3767 14.4778 14.4864 14.8682 14.9040 k = 0.3600 0.5312 0.3096 ( 4324 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8944 -15.7078 -15.7045 -15.3947 -15.3930 -15.3872 -15.3866 -15.2147 -15.2092 -15.1944 -15.1933 3.6623 3.6871 4.3877 4.5396 6.2889 6.2969 6.3520 6.3897 6.4137 6.6343 6.8610 6.8970 6.9338 6.9725 6.9738 7.2336 7.5266 7.5837 7.6370 7.7848 7.8177 7.9362 8.3212 8.4880 8.5193 8.7051 8.8633 8.9731 9.4774 9.8447 9.9455 10.3383 10.9134 11.1121 12.7052 12.7328 13.2983 13.3294 13.9226 13.9312 14.3617 14.3695 14.4643 14.4730 14.8654 14.9006 k = 0.3533 0.5427 0.3096 ( 4336 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7079 -15.7045 -15.3947 -15.3929 -15.3874 -15.3868 -15.2148 -15.2092 -15.1945 -15.1933 3.6681 3.6935 4.3929 4.5482 6.2981 6.3141 6.3546 6.3852 6.4150 6.6323 6.8740 6.8879 6.9386 6.9742 6.9816 7.2116 7.5151 7.5834 7.6235 7.7833 7.8086 7.9331 8.3579 8.4906 8.5223 8.7010 8.8578 9.0218 9.4231 9.7843 9.9311 10.3339 10.9074 11.1122 12.7134 12.7398 13.2860 13.3190 13.9273 13.9337 14.3543 14.3595 14.4572 14.4649 14.8631 14.8979 k = 0.3467 0.5543 0.3096 ( 4336 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3869 -15.2149 -15.2092 -15.1946 -15.1934 3.6725 3.6983 4.3968 4.5546 6.3058 6.3291 6.3564 6.3796 6.4161 6.6311 6.8799 6.8858 6.9431 6.9753 6.9874 7.1935 7.5062 7.5832 7.6129 7.7819 7.8026 7.9307 8.3874 8.4926 8.5232 8.6975 8.8531 9.0621 9.3826 9.7344 9.9217 10.3306 10.9030 11.1122 12.7198 12.7453 13.2768 13.3112 13.9315 13.9362 14.3467 14.3495 14.4542 14.4608 14.8614 14.8959 k = 0.3400 0.5658 0.3096 ( 4342 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8949 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3870 -15.2149 -15.2092 -15.1947 -15.1934 3.6753 3.7013 4.3993 4.5585 6.3111 6.3408 6.3576 6.3738 6.4168 6.6306 6.8743 6.8946 6.9466 6.9753 6.9903 7.1816 7.5006 7.5831 7.6058 7.7807 7.7994 7.9293 8.4068 8.4938 8.5225 8.6951 8.8501 9.0892 9.3577 9.7012 9.9162 10.3285 10.9002 11.1121 12.7238 12.7489 13.2710 13.3063 13.9344 13.9380 14.3410 14.3423 14.4534 14.4592 14.8604 14.8946 k = 0.3333 0.5774 0.3096 ( 4338 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3871 -15.2149 -15.2092 -15.1947 -15.1934 3.6763 3.7024 4.4001 4.5599 6.3131 6.3458 6.3581 6.3707 6.4170 6.6305 6.8722 6.8981 6.9482 6.9749 6.9909 7.1776 7.4987 7.5831 7.6033 7.7802 7.7984 7.9288 8.4135 8.4943 8.5219 8.6942 8.8491 9.0988 9.3494 9.6895 9.9143 10.3277 10.8992 11.1120 12.7253 12.7501 13.2690 13.3046 13.9355 13.9387 14.3389 14.3397 14.4533 14.4589 14.8600 14.8942 k = 0.3333 0.5774 0.3096 ( 4338 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3871 -15.2149 -15.2092 -15.1947 -15.1934 3.6763 3.7024 4.4001 4.5599 6.3131 6.3458 6.3581 6.3707 6.4170 6.6305 6.8722 6.8981 6.9482 6.9749 6.9909 7.1776 7.4987 7.5831 7.6033 7.7802 7.7984 7.9288 8.4135 8.4943 8.5219 8.6942 8.8491 9.0988 9.3494 9.6895 9.9143 10.3277 10.8992 11.1120 12.7253 12.7501 13.2690 13.3046 13.9355 13.9387 14.3389 14.3397 14.4533 14.4589 14.8600 14.8942 k = 0.3267 0.5658 0.3096 ( 4342 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8949 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3870 -15.2149 -15.2092 -15.1947 -15.1934 3.6753 3.7012 4.3992 4.5585 6.3110 6.3410 6.3573 6.3736 6.4169 6.6305 6.8744 6.8938 6.9462 6.9759 6.9912 7.1814 7.5005 7.5831 7.6061 7.7807 7.7994 7.9292 8.4073 8.4938 8.5227 8.6953 8.8500 9.0895 9.3575 9.7010 9.9162 10.3286 10.9002 11.1121 12.7238 12.7488 13.2710 13.3063 13.9344 13.9379 14.3412 14.3425 14.4532 14.4590 14.8604 14.8946 k = 0.3200 0.5543 0.3096 ( 4336 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7045 -15.3946 -15.3928 -15.3876 -15.3869 -15.2149 -15.2092 -15.1946 -15.1934 3.6721 3.6978 4.3965 4.5542 6.3050 6.3301 6.3547 6.3786 6.4164 6.6298 6.8807 6.8807 6.9409 6.9792 6.9931 7.1918 7.5054 7.5830 7.6147 7.7816 7.8028 7.9301 8.3912 8.4925 8.5243 8.6988 8.8522 9.0643 9.3807 9.7329 9.9218 10.3313 10.9033 11.1126 12.7192 12.7447 13.2773 13.3117 13.9310 13.9357 14.3483 14.3510 14.4530 14.4594 14.8616 14.8960 k = 0.3133 0.5427 0.3096 ( 4328 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8944 -15.7079 -15.7045 -15.3946 -15.3929 -15.3874 -15.3868 -15.2148 -15.2092 -15.1945 -15.1933 3.6665 3.6919 4.3917 4.5470 6.2951 6.3165 6.3496 6.3828 6.4157 6.6280 6.8601 6.8886 6.9356 6.9848 6.9969 7.2069 7.5126 7.5831 7.6293 7.7823 7.8094 7.9309 8.3706 8.4901 8.5254 8.7052 8.8553 9.0287 9.4170 9.7801 9.9314 10.3363 10.9086 11.1136 12.7114 12.7376 13.2878 13.3207 13.9256 13.9321 14.3597 14.3644 14.4527 14.4602 14.8636 14.8984 k = 0.3067 0.5312 0.3096 ( 4328 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6980 -15.8948 -15.8944 -15.7078 -15.7045 -15.3947 -15.3930 -15.3873 -15.3866 -15.2147 -15.2092 -15.1945 -15.1933 3.6586 3.6833 4.3849 4.5368 6.2818 6.3010 6.3420 6.3856 6.4147 6.6245 6.8346 6.8904 6.9383 6.9926 7.0018 7.2246 7.5210 7.5833 7.6494 7.7823 7.8195 7.9309 8.3503 8.4869 8.5253 8.7150 8.8587 8.9876 9.4640 9.8369 9.9459 10.3437 10.9161 11.1152 12.7006 12.7276 13.3022 13.3333 13.9188 13.9276 14.3740 14.3807 14.4539 14.4622 14.8667 14.9018 k = 0.3000 0.5196 0.3096 ( 4330 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6980 -15.8947 -15.8944 -15.7077 -15.7044 -15.3947 -15.3931 -15.3871 -15.3864 -15.2146 -15.2091 -15.1944 -15.1932 3.6480 3.6720 4.3758 4.5235 6.2653 6.2843 6.3319 6.3867 6.4134 6.6185 6.8067 6.8818 6.9522 7.0038 7.0073 7.2434 7.5296 7.5838 7.6742 7.7815 7.8331 7.9292 8.3349 8.4829 8.5238 8.7286 8.8627 8.9452 9.5196 9.8972 9.9678 10.3540 10.9259 11.1176 12.6869 12.7146 13.3202 13.3493 13.9111 13.9225 14.3882 14.3954 14.4603 14.4678 14.8708 14.9064 k = 0.2933 0.5081 0.3096 ( 4334 PWs) bands (ev): -36.9120 -36.9119 -36.6981 -36.6981 -15.8947 -15.8943 -15.7076 -15.7044 -15.3948 -15.3932 -15.3868 -15.3862 -15.2144 -15.2091 -15.1943 -15.1932 3.6349 3.6580 4.3644 4.5070 6.2463 6.2664 6.3198 6.3862 6.4121 6.6093 6.7784 6.8679 6.9694 7.0131 7.0208 7.2620 7.5374 7.5846 7.7021 7.7800 7.8495 7.9255 8.3275 8.4780 8.5212 8.7465 8.8672 8.9041 9.5819 9.9491 10.0068 10.3673 10.9381 11.1210 12.6706 12.6988 13.3416 13.3683 13.9030 13.9174 14.3978 14.4022 14.4774 14.4809 14.8760 14.9121 k = 0.2867 0.4965 0.3096 ( 4338 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8946 -15.8943 -15.7075 -15.7043 -15.3949 -15.3933 -15.3866 -15.3859 -15.2142 -15.2090 -15.1941 -15.1931 3.6190 3.6411 4.3506 4.4874 6.2254 6.2479 6.3058 6.3842 6.4108 6.5961 6.7517 6.8520 6.9838 7.0191 7.0454 7.2795 7.5440 7.5856 7.7303 7.7780 7.8682 7.9208 8.3304 8.4725 8.5182 8.7690 8.8666 8.8725 9.6493 9.9847 10.0694 10.3840 10.9526 11.1256 12.6520 12.6803 13.3658 13.3903 13.8949 13.9126 14.4002 14.4003 14.5037 14.5055 14.8825 14.9190 k = 0.2800 0.4850 0.3096 ( 4342 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8945 -15.8942 -15.7073 -15.7043 -15.3950 -15.3935 -15.3863 -15.3856 -15.2140 -15.2089 -15.1940 -15.1930 3.6004 3.6215 4.3343 4.4646 6.2031 6.2289 6.2902 6.3803 6.4096 6.5787 6.7281 6.8355 6.9949 7.0250 7.0757 7.2952 7.5489 7.5868 7.7542 7.7756 7.8884 7.9187 8.3433 8.4663 8.5163 8.7959 8.8349 8.8791 9.7207 10.0156 10.1427 10.4042 10.9696 11.1316 12.6311 12.6591 13.3926 13.4147 13.8874 13.9086 14.3930 14.3964 14.5345 14.5408 14.8904 14.9272 k = 0.2733 0.4734 0.3096 ( 4346 PWs) bands (ev): -36.9121 -36.9119 -36.6981 -36.6981 -15.8945 -15.8942 -15.7072 -15.7042 -15.3950 -15.3936 -15.3860 -15.3853 -15.2137 -15.2088 -15.1939 -15.1930 3.5792 3.5990 4.3154 4.4387 6.1800 6.2097 6.2735 6.3742 6.4087 6.5574 6.7084 6.8190 7.0043 7.0309 7.1083 7.3085 7.5519 7.5880 7.7678 7.7729 7.9092 7.9250 8.3639 8.4596 8.5184 8.8056 8.8323 8.8874 9.7951 10.0479 10.2199 10.4280 10.9890 11.1390 12.6083 12.6355 13.4215 13.4414 13.8807 13.9056 14.3825 14.3885 14.5707 14.5805 14.8997 14.9366 k = 0.2667 0.4619 0.3096 ( 4340 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6981 -15.8943 -15.8941 -15.7069 -15.7040 -15.3950 -15.3936 -15.3856 -15.3850 -15.2133 -15.2087 -15.1937 -15.1928 3.5553 3.5738 4.2939 4.4097 6.1568 6.1905 6.2559 6.3654 6.4080 6.5340 6.6925 6.8027 7.0127 7.0365 7.1408 7.3193 7.5532 7.5890 7.7679 7.7701 7.9298 7.9430 8.3856 8.4522 8.5303 8.7890 8.8695 8.8980 9.8717 10.0833 10.2991 10.4555 11.0111 11.1482 12.5838 12.6096 13.4522 13.4700 13.8749 13.9039 14.3696 14.3778 14.6108 14.6235 14.9104 14.9471 k = 0.2600 0.4503 0.3096 ( 4340 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8942 -15.8939 -15.7067 -15.7039 -15.3950 -15.3937 -15.3853 -15.3846 -15.2130 -15.2085 -15.1936 -15.1927 3.5288 3.5461 4.2697 4.3778 6.1339 6.1714 6.2378 6.3531 6.4076 6.5108 6.6796 6.7869 7.0206 7.0418 7.1714 7.3272 7.5529 7.5896 7.7578 7.7672 7.9496 7.9699 8.3999 8.4441 8.5597 8.7805 8.9116 8.9133 9.9501 10.1220 10.3792 10.4867 11.0359 11.1591 12.5575 12.5815 13.4844 13.5003 13.8702 13.9037 14.3550 14.3648 14.6539 14.6690 14.9225 14.9585 k = 0.2533 0.4388 0.3096 ( 4340 PWs) bands (ev): -36.9121 -36.9120 -36.6982 -36.6982 -15.8941 -15.8938 -15.7065 -15.7038 -15.3950 -15.3938 -15.3849 -15.3843 -15.2126 -15.2083 -15.1934 -15.1926 3.4999 3.5158 4.2429 4.3429 6.1117 6.1528 6.2192 6.3364 6.4075 6.4902 6.6690 6.7717 7.0282 7.0466 7.1984 7.3320 7.5514 7.5892 7.7432 7.7642 7.9679 8.0005 8.4032 8.4352 8.6092 8.7822 8.9291 8.9626 10.0297 10.1645 10.4598 10.5213 11.0633 11.1721 12.5298 12.5513 13.5176 13.5317 13.8667 13.9049 14.3389 14.3501 14.6991 14.7164 14.9359 14.9700 k = 0.2467 0.4272 0.3096 ( 4336 PWs) bands (ev): -36.9122 -36.9120 -36.6982 -36.6982 -15.8940 -15.8937 -15.7062 -15.7036 -15.3950 -15.3938 -15.3845 -15.3839 -15.2121 -15.2080 -15.1933 -15.1925 3.4686 3.4832 4.2133 4.3053 6.0905 6.1345 6.2006 6.3152 6.4076 6.4735 6.6599 6.7570 7.0354 7.0506 7.2208 7.3339 7.5491 7.5875 7.7281 7.7608 7.9843 8.0311 8.3986 8.4254 8.6746 8.7954 8.9515 9.0172 10.1101 10.2106 10.5403 10.5594 11.0936 11.1871 12.5006 12.5192 13.5517 13.5642 13.8645 13.9079 14.3217 14.3340 14.7458 14.7651 14.9502 14.9800 k = 0.2400 0.4157 0.3096 ( 4340 PWs) bands (ev): -36.9122 -36.9121 -36.6983 -36.6983 -15.8938 -15.8936 -15.7059 -15.7034 -15.3950 -15.3938 -15.3841 -15.3835 -15.2117 -15.2078 -15.1931 -15.1924 3.4352 3.4485 4.1811 4.2651 6.0705 6.1169 6.1820 6.2904 6.4080 6.4610 6.6518 6.7428 7.0422 7.0539 7.2376 7.3326 7.5467 7.5839 7.7150 7.7571 7.9984 8.0596 8.3893 8.4145 8.7512 8.8204 8.9799 9.0766 10.1911 10.2605 10.6007 10.6205 11.1267 11.2044 12.4702 12.4853 13.5863 13.5973 13.8635 13.9124 14.3036 14.3167 14.7934 14.8147 14.9643 14.9849 k = 0.2333 0.4041 0.3096 ( 4352 PWs) bands (ev): -36.9122 -36.9121 -36.6983 -36.6983 -15.8937 -15.8934 -15.7056 -15.7033 -15.3949 -15.3938 -15.3837 -15.3832 -15.2112 -15.2075 -15.1930 -15.1923 3.3998 3.4118 4.1465 4.2225 6.0519 6.0999 6.1636 6.2632 6.4087 6.4520 6.6444 6.7293 7.0485 7.0563 7.2485 7.3281 7.5446 7.5786 7.7049 7.7527 8.0103 8.0850 8.3775 8.4028 8.8352 8.8573 9.0158 9.1405 10.2721 10.3141 10.6448 10.6999 11.1628 11.2239 12.4388 12.4497 13.6211 13.6306 13.8639 13.9187 14.2849 14.2985 14.8407 14.8642 14.9764 14.9793 k = 0.2267 0.3926 0.3096 ( 4356 PWs) bands (ev): -36.9123 -36.9122 -36.6983 -36.6983 -15.8935 -15.8933 -15.7053 -15.7030 -15.3948 -15.3938 -15.3833 -15.3828 -15.2106 -15.2071 -15.1928 -15.1922 3.3627 3.3734 4.1094 4.1778 6.0349 6.0835 6.1455 6.2350 6.4095 6.4456 6.6376 6.7163 7.0543 7.0577 7.2533 7.3206 7.5434 7.5720 7.6982 7.7477 8.0200 8.1063 8.3641 8.3901 8.9057 8.9226 9.0620 9.2084 10.3530 10.3713 10.6917 10.7783 11.2019 11.2459 12.4064 12.4128 13.6559 13.6637 13.8658 13.9266 14.2659 14.2797 14.8843 14.9123 14.9642 14.9830 k = 0.2200 0.3811 0.3096 ( 4356 PWs) bands (ev): -36.9123 -36.9122 -36.6984 -36.6984 -15.8933 -15.8931 -15.7049 -15.7028 -15.3947 -15.3938 -15.3829 -15.3824 -15.2100 -15.2068 -15.1927 -15.1921 3.3240 3.3335 4.0700 4.1312 6.0194 6.0679 6.1277 6.2069 6.4106 6.4413 6.6312 6.7038 7.0582 7.0594 7.2525 7.3102 7.5431 7.5651 7.6942 7.7420 8.0279 8.1235 8.3499 8.3768 8.9647 9.0077 9.1231 9.2801 10.4321 10.4335 10.7410 10.8554 11.2439 11.2703 12.3734 12.3747 13.6903 13.6963 13.8693 13.9361 14.2470 14.2606 14.9039 14.9507 14.9640 14.9868 k = 0.2133 0.3695 0.3096 ( 4348 PWs) bands (ev): -36.9123 -36.9122 -36.6984 -36.6984 -15.8931 -15.8929 -15.7045 -15.7026 -15.3946 -15.3937 -15.3824 -15.3819 -15.2094 -15.2063 -15.1925 -15.1920 3.2839 3.2923 4.0286 4.0828 6.0055 6.0531 6.1104 6.1796 6.4119 6.4383 6.6251 6.6919 7.0577 7.0638 7.2468 7.2970 7.5436 7.5586 7.6923 7.7358 8.0342 8.1364 8.3352 8.3630 9.0332 9.0843 9.2043 9.3552 10.4962 10.5132 10.7923 10.9306 11.2890 11.2973 12.3357 12.3401 13.7241 13.7276 13.8747 13.9472 14.2285 14.2418 14.8825 14.9487 14.9993 15.0177 k = 0.2067 0.3580 0.3096 ( 4342 PWs) bands (ev): -36.9124 -36.9123 -36.6985 -36.6985 -15.8929 -15.8927 -15.7041 -15.7023 -15.3945 -15.3936 -15.3820 -15.3815 -15.2087 -15.2058 -15.1923 -15.1919 3.2427 3.2501 3.9853 4.0331 5.9931 6.0390 6.0936 6.1534 6.4134 6.4365 6.6192 6.6804 7.0562 7.0673 7.2370 7.2814 7.5447 7.5531 7.6917 7.7291 8.0392 8.1453 8.3205 8.3487 9.1099 9.1537 9.3032 9.4334 10.5635 10.5918 10.8456 11.0036 11.3267 11.3368 12.2961 12.3070 13.7568 13.7570 13.8823 13.9595 14.2108 14.2235 14.8500 14.9269 15.0414 15.0585 k = 0.2000 0.3464 0.3096 ( 4338 PWs) bands (ev): -36.9124 -36.9123 -36.6985 -36.6985 -15.8927 -15.8925 -15.7037 -15.7020 -15.3943 -15.3936 -15.3815 -15.3811 -15.2080 -15.2053 -15.1922 -15.1918 3.2006 3.2071 3.9404 3.9823 5.9821 6.0257 6.0773 6.1288 6.4150 6.4355 6.6135 6.6694 7.0538 7.0697 7.2242 7.2639 7.5462 7.5491 7.6917 7.7221 8.0433 8.1503 8.3060 8.3343 9.1932 9.2215 9.4133 9.5148 10.6338 10.6688 10.9004 11.0738 11.3588 11.3874 12.2564 12.2746 13.7832 13.7888 13.8928 13.9729 14.1941 14.2063 14.8147 14.9001 15.0816 15.0966 k = 0.1933 0.3349 0.3096 ( 4334 PWs) bands (ev): -36.9124 -36.9124 -36.6986 -36.6986 -15.8925 -15.8923 -15.7033 -15.7017 -15.3942 -15.3935 -15.3810 -15.3806 -15.2072 -15.2048 -15.1921 -15.1917 3.1578 3.1634 3.8942 3.9306 5.9725 6.0130 6.0615 6.1058 6.4168 6.4352 6.6079 6.6588 7.0506 7.0711 7.2091 7.2450 7.5465 7.5476 7.6919 7.7152 8.0466 8.1518 8.2922 8.3198 9.2818 9.2909 9.5304 9.5992 10.7066 10.7439 10.9566 11.1406 11.3933 11.4403 12.2171 12.2435 13.8059 13.8193 13.9066 13.9867 14.1790 14.1909 14.7785 14.8714 15.1174 15.1303 k = 0.1867 0.3233 0.3096 ( 4340 PWs) bands (ev): -36.9125 -36.9124 -36.6986 -36.6986 -15.8923 -15.8921 -15.7029 -15.7014 -15.3940 -15.3934 -15.3805 -15.3802 -15.2065 -15.2042 -15.1920 -15.1916 3.1145 3.1194 3.8468 3.8784 5.9641 6.0011 6.0463 6.0844 6.4186 6.4355 6.6024 6.6487 7.0466 7.0714 7.1925 7.2251 7.5452 7.5489 7.6920 7.7083 8.0493 8.1501 8.2795 8.3055 9.3630 9.3743 9.6521 9.6869 10.7818 10.8165 11.0141 11.2032 11.4302 11.4952 12.1789 12.2147 13.8247 13.8484 13.9234 14.0005 14.1658 14.1780 14.7419 14.8419 15.1469 15.1597 k = 0.1800 0.3118 0.3096 ( 4328 PWs) bands (ev): -36.9125 -36.9125 -36.6987 -36.6987 -15.8920 -15.8919 -15.7025 -15.7011 -15.3939 -15.3932 -15.3800 -15.3797 -15.2057 -15.2036 -15.1918 -15.1915 3.0710 3.0752 3.7987 3.8258 5.9567 5.9898 6.0316 6.0647 6.4206 6.4363 6.5969 6.6389 7.0420 7.0705 7.1750 7.2047 7.5451 7.5499 7.6918 7.7019 8.0515 8.1456 8.2680 8.2916 9.4378 9.4691 9.7775 9.7782 10.8587 10.8863 11.0724 11.2609 11.4692 11.5517 12.1425 12.1895 13.8402 13.8759 13.9425 14.0135 14.1550 14.1688 14.7053 14.8123 15.1688 15.1848 k = 0.1733 0.3002 0.3096 ( 4328 PWs) bands (ev): -36.9126 -36.9125 -36.6987 -36.6987 -15.8918 -15.8917 -15.7020 -15.7008 -15.3937 -15.3931 -15.3795 -15.3792 -15.2049 -15.2030 -15.1917 -15.1914 3.0275 3.0310 3.7500 3.7732 5.9502 5.9791 6.0175 6.0466 6.4227 6.4375 6.5914 6.6295 7.0369 7.0683 7.1572 7.1841 7.5461 7.5507 7.6911 7.6958 8.0531 8.1387 8.2580 8.2782 9.5152 9.5648 9.8734 9.9057 10.9370 10.9528 11.1313 11.3130 11.5098 11.6090 12.1091 12.1692 13.8535 13.9016 13.9624 14.0248 14.1468 14.1641 14.6688 14.7829 15.1825 15.2050 k = 0.1667 0.2887 0.3096 ( 4336 PWs) bands (ev): -36.9126 -36.9126 -36.6988 -36.6988 -15.8916 -15.8915 -15.7016 -15.7005 -15.3935 -15.3930 -15.3791 -15.3787 -15.2041 -15.2024 -15.1916 -15.1914 2.9841 2.9871 3.7011 3.7208 5.9444 5.9688 6.0041 6.0301 6.4249 6.4390 6.5858 6.6204 7.0314 7.0649 7.1394 7.1636 7.5479 7.5513 7.6899 7.6902 8.0543 8.1300 8.2495 8.2656 9.5949 9.6601 9.9730 10.0361 11.0155 11.0160 11.1902 11.3585 11.5513 11.6663 12.0800 12.1555 13.8658 13.9251 13.9817 14.0343 14.1416 14.1647 14.6326 14.7540 15.1882 15.2194 k = 0.1600 0.2771 0.3096 ( 4332 PWs) bands (ev): -36.9127 -36.9126 -36.6988 -36.6988 -15.8913 -15.8912 -15.7012 -15.7001 -15.3933 -15.3929 -15.3785 -15.3783 -15.2033 -15.2017 -15.1915 -15.1913 2.9410 2.9435 3.6521 3.6688 5.9390 5.9588 5.9915 6.0153 6.4271 6.4408 6.5803 6.6117 7.0255 7.0603 7.1220 7.1436 7.5503 7.5518 7.6850 7.6880 8.0548 8.1199 8.2423 8.2539 9.6763 9.7540 10.0770 10.1683 11.0740 11.0948 11.2483 11.3970 11.5930 11.7226 12.0571 12.1502 13.8780 13.9459 13.9996 14.0429 14.1397 14.1703 14.5968 14.7257 15.1864 15.2268 k = 0.1533 0.2656 0.3096 ( 4328 PWs) bands (ev): -36.9127 -36.9127 -36.6989 -36.6989 -15.8911 -15.8910 -15.7007 -15.6998 -15.3932 -15.3928 -15.3780 -15.3777 -15.2024 -15.2011 -15.1914 -15.1912 2.8985 2.9006 3.6034 3.6174 5.9338 5.9490 5.9799 6.0020 6.4294 6.4428 6.5748 6.6033 7.0194 7.0547 7.1051 7.1241 7.5523 7.5533 7.6802 7.6853 8.0547 8.1090 8.2363 8.2434 9.7591 9.8457 10.1853 10.3014 11.1276 11.1722 11.3048 11.4282 11.6345 11.7766 12.0427 12.1548 13.8908 13.9633 14.0152 14.0521 14.1412 14.1801 14.5616 14.6982 15.1782 15.2262 k = 0.1467 0.2540 0.3096 ( 4340 PWs) bands (ev): -36.9127 -36.9127 -36.6989 -36.6989 -15.8909 -15.8908 -15.7003 -15.6995 -15.3930 -15.3927 -15.3775 -15.3773 -15.2016 -15.2004 -15.1913 -15.1912 2.8567 2.8584 3.5552 3.5669 5.9282 5.9392 5.9695 5.9904 6.4316 6.4450 6.5692 6.5952 7.0132 7.0480 7.0889 7.1054 7.5530 7.5567 7.6757 7.6820 8.0539 8.0977 8.2312 8.2341 9.8428 9.9347 10.2975 10.4349 11.1757 11.2463 11.3589 11.4529 11.6757 11.8267 12.0396 12.1700 13.9049 13.9771 14.0283 14.0634 14.1461 14.1930 14.5272 14.6716 15.1650 15.2180 k = 0.1400 0.2425 0.3096 ( 4346 PWs) bands (ev): -36.9128 -36.9128 -36.6990 -36.6990 -15.8907 -15.8906 -15.6999 -15.6991 -15.3929 -15.3925 -15.3770 -15.3768 -15.2008 -15.1997 -15.1912 -15.1911 2.8158 2.8172 3.5078 3.5175 5.9219 5.9292 5.9607 5.9803 6.4339 6.4472 6.5636 6.5874 7.0069 7.0406 7.0736 7.0876 7.5539 7.5604 7.6714 7.6780 8.0523 8.0865 8.2261 8.2271 9.9271 10.0209 10.4125 10.5678 11.2175 11.3129 11.4104 11.4752 11.7172 11.8722 12.0500 12.1957 13.9206 13.9881 14.0386 14.0768 14.1544 14.2080 14.4935 14.6459 15.1478 15.2032 k = 0.1333 0.2309 0.3096 ( 4338 PWs) bands (ev): -36.9128 -36.9128 -36.6991 -36.6991 -15.8904 -15.8903 -15.6994 -15.6988 -15.3927 -15.3924 -15.3765 -15.3763 -15.2000 -15.1990 -15.1911 -15.1910 2.7758 2.7770 3.4613 3.4693 5.9147 5.9192 5.9536 5.9716 6.4362 6.4495 6.5580 6.5799 7.0007 7.0327 7.0591 7.0709 7.5552 7.5643 7.6672 7.6734 8.0499 8.0757 8.2196 8.2236 10.0115 10.1044 10.5291 10.6984 11.2526 11.3638 11.4596 11.5042 11.7592 11.9137 12.0739 12.2307 13.9383 13.9982 14.0465 14.0911 14.1658 14.2247 14.4610 14.6211 15.1275 15.1835 k = 0.1267 0.2194 0.3096 ( 4330 PWs) bands (ev): -36.9129 -36.9129 -36.6991 -36.6991 -15.8902 -15.8901 -15.6990 -15.6984 -15.3925 -15.3923 -15.3759 -15.3757 -15.1991 -15.1983 -15.1911 -15.1910 2.7370 2.7379 3.4160 3.4225 5.9064 5.9090 5.9481 5.9643 6.4385 6.4519 6.5525 6.5727 6.9946 7.0244 7.0456 7.0553 7.5568 7.5683 7.6631 7.6682 8.0469 8.0654 8.2146 8.2208 10.0955 10.1851 10.6453 10.8240 11.2823 11.3917 11.5075 11.5496 11.8018 11.9540 12.1083 12.2732 13.9579 14.0089 14.0526 14.1047 14.1801 14.2427 14.4300 14.5971 15.1050 15.1606 k = 0.1200 0.2078 0.3096 ( 4334 PWs) bands (ev): -36.9129 -36.9129 -36.6992 -36.6992 -15.8899 -15.8899 -15.6986 -15.6981 -15.3924 -15.3922 -15.3754 -15.3753 -15.1983 -15.1976 -15.1910 -15.1909 2.6995 2.7002 3.3720 3.3773 5.8974 5.8989 5.9440 5.9580 6.4407 6.4541 6.5470 6.5656 6.9886 7.0160 7.0328 7.0408 7.5587 7.5724 7.6590 7.6626 8.0431 8.0558 8.2108 8.2184 10.1788 10.2633 10.7580 10.9386 11.3122 11.4038 11.5551 11.6077 11.8449 11.9956 12.1492 12.3216 13.9785 14.0215 14.0582 14.1163 14.1968 14.2612 14.4015 14.5739 15.0806 15.1338 k = 0.1133 0.1963 0.3096 ( 4316 PWs) bands (ev): -36.9130 -36.9130 -36.6992 -36.6992 -15.8897 -15.8896 -15.6981 -15.6977 -15.3922 -15.3920 -15.3749 -15.3747 -15.1975 -15.1969 -15.1909 -15.1909 2.6634 2.6640 3.3295 3.3338 5.8881 5.8889 5.9408 5.9526 6.4429 6.4562 6.5416 6.5589 6.9827 7.0079 7.0209 7.0277 7.5610 7.5763 7.6549 7.6566 8.0389 8.0470 8.2082 8.2166 10.2609 10.3390 10.8626 11.0310 11.3542 11.4138 11.6031 11.6702 11.8883 12.0393 12.1939 12.3742 13.9974 14.0369 14.0663 14.1252 14.2160 14.2776 14.3779 14.5512 15.0549 15.1061 k = 0.1067 0.1848 0.3096 ( 4316 PWs) bands (ev): -36.9130 -36.9130 -36.6993 -36.6993 -15.8895 -15.8894 -15.6978 -15.6974 -15.3921 -15.3919 -15.3744 -15.3743 -15.1967 -15.1962 -15.1909 -15.1908 2.6288 2.6293 3.2887 3.2921 5.8787 5.8790 5.9382 5.9480 6.4451 6.4582 6.5363 6.5523 6.9771 7.0001 7.0097 7.0158 7.5634 7.5801 7.6506 7.6509 8.0344 8.0390 8.2067 8.2152 10.3414 10.4120 10.9515 11.0879 11.4231 11.4341 11.6519 11.7325 11.9316 12.0836 12.2415 12.4298 14.0099 14.0551 14.0817 14.1313 14.2373 14.2846 14.3666 14.5288 15.0280 15.0751 k = 0.1000 0.1732 0.3096 ( 4332 PWs) bands (ev): -36.9131 -36.9130 -36.6993 -36.6993 -15.8893 -15.8893 -15.6974 -15.6971 -15.3920 -15.3919 -15.3739 -15.3738 -15.1960 -15.1955 -15.1909 -15.1908 2.5958 2.5962 3.2498 3.2525 5.8693 5.8695 5.9359 5.9439 6.4472 6.4599 6.5312 6.5460 6.9717 6.9928 6.9992 7.0051 7.5659 7.5834 7.6446 7.6469 8.0296 8.0317 8.2060 8.2142 10.4198 10.4824 11.0157 11.1096 11.4761 11.5199 11.7016 11.7926 11.9746 12.1262 12.2922 12.4873 14.0137 14.0756 14.1066 14.1351 14.2605 14.2747 14.3745 14.5064 15.0002 15.0412 k = 0.0933 0.1617 0.3096 ( 4324 PWs) bands (ev): -36.9131 -36.9131 -36.6994 -36.6994 -15.8891 -15.8890 -15.6970 -15.6968 -15.3919 -15.3918 -15.3734 -15.3733 -15.1952 -15.1949 -15.1908 -15.1908 2.5645 2.5648 3.2127 3.2149 5.8603 5.8603 5.9340 5.9403 6.4492 6.4614 6.5263 6.5398 6.9665 6.9862 6.9895 6.9958 7.5685 7.5863 7.6391 7.6432 8.0247 8.0252 8.2060 8.2136 10.4956 10.5501 11.0509 11.1093 11.5449 11.6323 11.7525 11.8495 12.0173 12.1652 12.3467 12.5461 14.0116 14.0960 14.1384 14.1396 14.2540 14.2855 14.3951 14.4841 14.9714 14.9936 k = 0.0867 0.1501 0.3096 ( 4324 PWs) bands (ev): -36.9131 -36.9131 -36.6994 -36.6994 -15.8889 -15.8889 -15.6967 -15.6965 -15.3918 -15.3917 -15.3730 -15.3729 -15.1945 -15.1943 -15.1908 -15.1907 2.5351 2.5353 3.1778 3.1794 5.8515 5.8515 5.9321 5.9371 6.4512 6.4627 6.5216 6.5339 6.9616 6.9795 6.9813 6.9877 7.5708 7.5884 7.6342 7.6397 8.0193 8.0199 8.2065 8.2132 10.5684 10.6148 11.0622 11.0975 11.6360 11.7466 11.8085 11.9029 12.0595 12.1991 12.4056 12.6055 14.0059 14.1081 14.1526 14.1740 14.2302 14.3115 14.4204 14.4618 14.9368 14.9412 k = 0.0800 0.1386 0.3096 ( 4320 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8887 -15.8887 -15.6964 -15.6962 -15.3917 -15.3916 -15.3725 -15.3725 -15.1939 -15.1937 -15.1907 -15.1907 2.5075 2.5076 3.1450 3.1463 5.8431 5.8432 5.9304 5.9343 6.4531 6.4638 6.5171 6.5282 6.9568 6.9714 6.9758 6.9808 7.5728 7.5894 7.6304 7.6368 8.0142 8.0153 8.2074 8.2131 10.6377 10.6763 11.0581 11.0798 11.7399 11.8324 11.8942 11.9525 12.1014 12.2275 12.4686 12.6649 13.9985 14.1078 14.1757 14.2085 14.2113 14.3377 14.4405 14.4471 14.8761 14.9065 k = 0.0733 0.1270 0.3096 ( 4316 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8885 -15.8885 -15.6961 -15.6960 -15.3916 -15.3915 -15.3721 -15.3721 -15.1933 -15.1931 -15.1907 -15.1907 2.4818 2.4819 3.1146 3.1155 5.8353 5.8354 5.9288 5.9317 6.4550 6.4646 6.5129 6.5228 6.9523 6.9638 6.9714 6.9750 7.5743 7.5891 7.6281 7.6344 8.0096 8.0110 8.2086 8.2132 10.7030 10.7344 11.0456 11.0593 11.8484 11.8874 11.9990 12.0088 12.1438 12.2508 12.5353 12.7240 13.9899 14.1007 14.1746 14.2187 14.2481 14.3603 14.4238 14.4736 14.8126 14.8562 k = 0.0667 0.1155 0.3096 ( 4312 PWs) bands (ev): -36.9132 -36.9132 -36.6995 -36.6995 -15.8884 -15.8883 -15.6958 -15.6957 -15.3915 -15.3914 -15.3717 -15.3717 -15.1927 -15.1926 -15.1906 -15.1906 2.4582 2.4583 3.0865 3.0872 5.8280 5.8281 5.9272 5.9293 6.4568 6.4653 6.5090 6.5175 6.9481 6.9569 6.9677 6.9703 7.5751 7.5874 7.6272 7.6328 8.0055 8.0069 8.2099 8.2136 10.7639 10.7887 11.0289 11.0379 11.9362 11.9526 12.0444 12.1249 12.1885 12.2697 12.6052 12.7822 13.9810 14.0891 14.1544 14.2535 14.2810 14.3689 14.4242 14.4986 14.7471 14.7958 k = 0.0600 0.1039 0.3096 ( 4304 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8882 -15.8882 -15.6955 -15.6955 -15.3914 -15.3914 -15.3713 -15.3713 -15.1922 -15.1921 -15.1906 -15.1906 2.4367 2.4367 3.0608 3.0613 5.8213 5.8214 5.9258 5.9273 6.4586 6.4658 6.5054 6.5126 6.9442 6.9507 6.9647 6.9665 7.5752 7.5848 7.6276 7.6319 8.0019 8.0031 8.2112 8.2140 10.8199 10.8389 11.0106 11.0166 11.9825 12.0358 12.0978 12.2366 12.2397 12.2848 12.6781 12.8394 13.9720 14.0732 14.1362 14.2921 14.2993 14.3700 14.4440 14.5208 14.6807 14.7330 k = 0.0533 0.0924 0.3096 ( 4304 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8881 -15.8881 -15.6953 -15.6953 -15.3913 -15.3913 -15.3710 -15.3710 -15.1917 -15.1917 -15.1905 -15.1905 2.4173 2.4173 3.0377 3.0380 5.8152 5.8152 5.9243 5.9254 6.4602 6.4662 6.5020 6.5079 6.9406 6.9452 6.9622 6.9634 7.5747 7.5816 7.6287 7.6318 7.9988 7.9998 8.2126 8.2146 10.8705 10.8846 10.9922 10.9965 12.0263 12.0846 12.1623 12.2968 12.3053 12.3415 12.7534 12.8950 13.9634 14.0533 14.1223 14.2905 14.3319 14.3888 14.4675 14.5370 14.6156 14.6717 k = 0.0467 0.0808 0.3096 ( 4302 PWs) bands (ev): -36.9133 -36.9133 -36.6996 -36.6996 -15.8879 -15.8879 -15.6951 -15.6951 -15.3913 -15.3913 -15.3707 -15.3707 -15.1913 -15.1913 -15.1904 -15.1904 2.4000 2.4001 3.0172 3.0174 5.8097 5.8098 5.9230 5.9237 6.4619 6.4665 6.4989 6.5035 6.9374 6.9405 6.9603 6.9610 7.5736 7.5782 7.6302 7.6322 7.9960 7.9968 8.2138 8.2153 10.9147 10.9251 10.9753 10.9787 12.0672 12.1167 12.2152 12.3064 12.3876 12.4376 12.8308 12.9489 13.9554 14.0307 14.1126 14.2668 14.3719 14.4175 14.4810 14.5356 14.5611 14.6238 k = 0.0400 0.0693 0.3096 ( 4306 PWs) bands (ev): -36.9133 -36.9133 -36.6997 -36.6997 -15.8878 -15.8878 -15.6949 -15.6949 -15.3913 -15.3912 -15.3704 -15.3704 -15.1911 -15.1911 -15.1903 -15.1903 2.3850 2.3850 2.9993 2.9994 5.8049 5.8049 5.9218 5.9223 6.4634 6.4669 6.4960 6.4994 6.9345 6.9365 6.9587 6.9592 7.5721 7.5750 7.6319 7.6331 7.9937 7.9942 8.2150 8.2159 10.9450 10.9501 10.9703 10.9708 12.1045 12.1419 12.2541 12.3143 12.4768 12.5234 12.9089 13.0008 13.9484 14.0072 14.1068 14.2384 14.4112 14.4400 14.4592 14.4955 14.5492 14.6107 k = 0.0333 0.0577 0.3096 ( 4318 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8878 -15.8878 -15.6948 -15.6948 -15.3912 -15.3912 -15.3703 -15.3702 -15.1910 -15.1910 -15.1902 -15.1901 2.3722 2.3723 2.9840 2.9841 5.8008 5.8008 5.9208 5.9210 6.4649 6.4672 6.4935 6.4957 6.9320 6.9332 6.9575 6.9578 7.5705 7.5721 7.6335 7.6341 7.9917 7.9920 8.2160 8.2166 10.9402 10.9407 10.9943 10.9967 12.1373 12.1625 12.2837 12.3210 12.5626 12.5981 12.9855 13.0505 13.9424 13.9846 14.1045 14.2089 14.3916 14.4336 14.4492 14.4795 14.5647 14.6157 k = 0.0267 0.0462 0.3096 ( 4318 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8877 -15.8877 -15.6947 -15.6947 -15.3912 -15.3912 -15.3701 -15.3701 -15.1909 -15.1909 -15.1900 -15.1900 2.3618 2.3618 2.9715 2.9715 5.7974 5.7974 5.9199 5.9200 6.4663 6.4677 6.4912 6.4925 6.9300 6.9306 6.9567 6.9568 7.5689 7.5697 7.6350 7.6353 7.9901 7.9902 8.2169 8.2172 10.9290 10.9290 11.0207 11.0221 12.1647 12.1793 12.3066 12.3271 12.6387 12.6610 13.0576 13.0974 13.9376 13.9643 14.1059 14.1806 14.3337 14.3686 14.4842 14.5060 14.5824 14.6223 k = 0.0200 0.0346 0.3096 ( 4322 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8877 -15.8877 -15.6946 -15.6946 -15.3912 -15.3912 -15.3699 -15.3699 -15.1908 -15.1908 -15.1898 -15.1898 2.3536 2.3536 2.9617 2.9618 5.7947 5.7947 5.9191 5.9192 6.4675 6.4682 6.4892 6.4899 6.9284 6.9286 6.9560 6.9561 7.5674 7.5678 7.6361 7.6363 7.9888 7.9889 8.2176 8.2177 10.9194 10.9195 11.0418 11.0425 12.1859 12.1926 12.3236 12.3328 12.7007 12.7116 13.1207 13.1403 13.9338 13.9475 14.1112 14.1566 14.2807 14.3054 14.5165 14.5303 14.5971 14.6258 k = 0.0133 0.0231 0.3096 ( 4322 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3912 -15.3912 -15.3698 -15.3698 -15.1908 -15.1908 -15.1897 -15.1897 2.3477 2.3477 2.9547 2.9548 5.7928 5.7928 5.9186 5.9186 6.4685 6.4687 6.4876 6.4878 6.9272 6.9272 6.9556 6.9556 7.5663 7.5664 7.6370 7.6371 7.9879 7.9879 8.2180 8.2181 10.9124 10.9124 11.0570 11.0572 12.2004 12.2025 12.3352 12.3381 12.7456 12.7492 13.1701 13.1766 13.9304 13.9352 14.1207 14.1412 14.2356 14.2487 14.5451 14.5521 14.6063 14.6221 k = 0.0067 0.0115 0.3096 ( 4330 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3912 -15.3912 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3442 2.3442 2.9505 2.9505 5.7917 5.7917 5.9183 5.9183 6.4691 6.4691 6.4865 6.4866 6.9264 6.9265 6.9554 6.9554 7.5656 7.5656 7.6375 7.6376 7.9873 7.9873 8.2183 8.2183 10.9081 10.9081 11.0662 11.0662 12.2086 12.2088 12.3417 12.3421 12.7723 12.7728 13.2012 13.2021 13.9275 13.9282 14.1337 14.1380 14.2006 14.2039 14.5694 14.5714 14.6063 14.6098 k = 0.0000 0.0000 0.3096 ( 4326 PWs) bands (ev): -36.9134 -36.9134 -36.6997 -36.6997 -15.8876 -15.8876 -15.6945 -15.6945 -15.3911 -15.3911 -15.3698 -15.3698 -15.1908 -15.1908 -15.1896 -15.1896 2.3430 2.3430 2.9491 2.9491 5.7913 5.7913 5.9182 5.9182 6.4693 6.4693 6.4862 6.4862 6.9262 6.9262 6.9553 6.9553 7.5654 7.5654 7.6377 7.6377 7.9871 7.9871 8.2184 8.2184 10.9067 10.9067 11.0692 11.0692 12.2111 12.2111 12.3437 12.3437 12.7810 12.7810 13.2116 13.2116 13.9261 13.9261 14.1424 14.1424 14.1836 14.1836 14.5838 14.5838 14.5992 14.5992 k = 0.5000 0.2887 0.3096 ( 4324 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7051 -15.7051 -15.3965 -15.3965 -15.3821 -15.3821 -15.2120 -15.2120 -15.1910 -15.1910 3.5112 3.5112 4.2599 4.2599 6.0259 6.0259 6.3723 6.3723 6.7374 6.7374 6.8172 6.8172 6.8978 6.8978 6.9701 6.9701 7.6111 7.6111 7.8572 7.8572 8.0488 8.0488 8.1801 8.1801 8.3980 8.3980 8.8252 8.8252 10.5294 10.5294 10.9632 10.9632 11.0423 11.0423 12.5670 12.5670 13.5927 13.5927 14.0171 14.0171 14.5549 14.5549 14.7891 14.7891 14.9409 14.9409 k = 0.5000 0.2887 0.2967 ( 4330 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8940 -15.8940 -15.7051 -15.7051 -15.3966 -15.3965 -15.3822 -15.3822 -15.2120 -15.2120 -15.1910 -15.1910 3.5103 3.5107 4.2605 4.2615 6.0189 6.0309 6.3675 6.3774 6.7301 6.7425 6.8044 6.8259 6.8836 6.8945 6.9716 6.9901 7.6074 7.6123 7.8567 7.8602 8.0483 8.0484 8.1756 8.1841 8.4022 8.4035 8.8217 8.8300 10.5167 10.5369 10.9607 10.9639 11.0423 11.0436 12.5572 12.5762 13.5828 13.5988 14.0110 14.0155 14.5551 14.5552 14.7873 14.7885 14.9425 14.9489 k = 0.5000 0.2887 0.2838 ( 4340 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8941 -15.8940 -15.7052 -15.7052 -15.3967 -15.3966 -15.3822 -15.3822 -15.2120 -15.2120 -15.1909 -15.1908 3.5082 3.5090 4.2632 4.2651 6.0101 6.0337 6.3635 6.3828 6.7205 6.7455 6.7848 6.8318 6.8623 6.8816 6.9894 7.0196 7.6015 7.6110 7.8588 7.8656 8.0471 8.0475 8.1713 8.1874 8.4157 8.4186 8.8194 8.8360 10.4992 10.5394 10.9568 10.9630 11.0437 11.0461 12.5464 12.5843 13.5693 13.6009 13.9977 14.0062 14.5560 14.5562 14.7834 14.7863 14.9531 14.9653 k = 0.5000 0.2887 0.2709 ( 4340 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8942 -15.8941 -15.7053 -15.7052 -15.3968 -15.3967 -15.3823 -15.3823 -15.2120 -15.2119 -15.1906 -15.1905 3.5048 3.5059 4.2680 4.2708 5.9998 6.0340 6.3603 6.3882 6.7087 6.7464 6.7579 6.8301 6.8460 6.8716 7.0120 7.0514 7.5937 7.6075 7.8632 7.8729 8.0452 8.0462 8.1675 8.1897 8.4379 8.4430 8.8183 8.8434 10.4770 10.5368 10.9518 10.9607 11.0464 11.0494 12.5342 12.5908 13.5531 13.5994 13.9785 13.9902 14.5574 14.5577 14.7782 14.7832 14.9702 14.9871 k = 0.5000 0.2887 0.2580 ( 4338 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8943 -15.8942 -15.7054 -15.7053 -15.3970 -15.3968 -15.3824 -15.3823 -15.2119 -15.2118 -15.1903 -15.1901 3.5003 3.5017 4.2747 4.2784 5.9882 6.0319 6.3583 6.3932 6.6947 6.7256 6.7455 6.8107 6.8471 6.8664 7.0355 7.0829 7.5846 7.6021 7.8693 7.8817 8.0428 8.0448 8.1646 8.1911 8.4683 8.4757 8.8183 8.8523 10.4507 10.5294 10.9460 10.9573 11.0500 11.0534 12.5195 12.5945 13.5352 13.5947 13.9550 13.9690 14.5593 14.5598 14.7723 14.7797 14.9892 15.0075 k = 0.5000 0.2887 0.2451 ( 4336 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8944 -15.8943 -15.7055 -15.7054 -15.3972 -15.3969 -15.3824 -15.3824 -15.2118 -15.2117 -15.1898 -15.1896 3.4948 3.4965 4.2832 4.2877 5.9756 6.0271 6.3573 6.3977 6.6785 6.6907 6.7429 6.7892 6.8515 6.8647 7.0588 7.1132 7.5744 7.5953 7.8766 7.8914 8.0403 8.0437 8.1624 8.1919 8.5065 8.5154 8.8196 8.8630 10.4206 10.5176 10.9396 10.9531 11.0544 11.0578 12.5009 12.5939 13.5167 13.5874 13.9287 13.9444 14.5618 14.5624 14.7660 14.7760 15.0032 15.0173 k = 0.5000 0.2887 0.2322 ( 4332 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8946 -15.8945 -15.7056 -15.7055 -15.3974 -15.3971 -15.3825 -15.3825 -15.2117 -15.2116 -15.1893 -15.1891 3.4885 3.4904 4.2933 4.2984 5.9620 6.0199 6.3576 6.4014 6.6550 6.6604 6.7392 6.7692 6.8561 6.8649 7.0814 7.1415 7.5638 7.5875 7.8847 7.9016 8.0378 8.0430 8.1610 8.1924 8.5521 8.5605 8.8220 8.8759 10.3873 10.5017 10.9330 10.9485 11.0592 11.0624 12.4768 12.5875 13.4992 13.5785 13.9013 13.9185 14.5647 14.5654 14.7591 14.7719 15.0096 15.0199 k = 0.5000 0.2887 0.2193 ( 4344 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8948 -15.8947 -15.7058 -15.7057 -15.3977 -15.3974 -15.3827 -15.3826 -15.2116 -15.2115 -15.1887 -15.1884 3.4815 3.4836 4.3047 4.3105 5.9479 6.0102 6.3589 6.4040 6.6197 6.6412 6.7345 6.7510 6.8606 6.8664 7.1032 7.1678 7.5528 7.5788 7.8932 7.9117 8.0356 8.0427 8.1602 8.1926 8.6047 8.6094 8.8257 8.8917 10.3513 10.4823 10.9261 10.9435 11.0642 11.0670 12.4458 12.5736 13.4840 13.5687 13.8741 13.8932 14.5680 14.5689 14.7514 14.7671 15.0118 15.0205 k = 0.5000 0.2887 0.2064 ( 4342 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8950 -15.8949 -15.7059 -15.7058 -15.3980 -15.3976 -15.3828 -15.3827 -15.2115 -15.2114 -15.1880 -15.1877 3.4740 3.4762 4.3174 4.3236 5.9332 5.9985 6.3613 6.4052 6.5855 6.6215 6.7292 6.7347 6.8649 6.8686 7.1241 7.1919 7.5419 7.5697 7.9020 7.9214 8.0341 8.0429 8.1599 8.1927 8.6597 8.6634 8.8308 8.9118 10.3133 10.4601 10.9193 10.9385 11.0693 11.0717 12.4069 12.5508 13.4721 13.5587 13.8485 13.8704 14.5718 14.5727 14.7429 14.7614 15.0123 15.0204 k = 0.5000 0.2887 0.1935 ( 4338 PWs) bands (ev): -36.9121 -36.9121 -36.6982 -36.6982 -15.8953 -15.8951 -15.7061 -15.7060 -15.3983 -15.3979 -15.3829 -15.3829 -15.2114 -15.2113 -15.1872 -15.1869 3.4661 3.4684 4.3309 4.3375 5.9183 5.9849 6.3646 6.4047 6.5528 6.6024 6.7199 6.7233 6.8690 6.8712 7.1441 7.2138 7.5311 7.5601 7.9107 7.9305 8.0334 8.0436 8.1601 8.1928 8.7085 8.7271 8.8381 8.9381 10.2737 10.4357 10.9126 10.9335 11.0744 11.0763 12.3593 12.5183 13.4641 13.5489 13.8254 13.8516 14.5759 14.5767 14.7333 14.7547 15.0122 15.0201 k = 0.5000 0.2887 0.1806 ( 4338 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8955 -15.8953 -15.7063 -15.7062 -15.3986 -15.3982 -15.3831 -15.3830 -15.2113 -15.2112 -15.1864 -15.1861 3.4580 3.4603 4.3451 4.3519 5.9033 5.9697 6.3684 6.4022 6.5221 6.5847 6.7064 6.7171 6.8728 6.8740 7.1633 7.2337 7.5206 7.5502 7.9192 7.9384 8.0338 8.0447 8.1606 8.1927 8.7525 8.7907 8.8520 8.9730 10.2332 10.4099 10.9060 10.9285 11.0795 11.0809 12.3030 12.4755 13.4597 13.5394 13.8059 13.8380 14.5803 14.5810 14.7229 14.7467 15.0120 15.0199 k = 0.5000 0.2887 0.1677 ( 4334 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8957 -15.8955 -15.7065 -15.7064 -15.3989 -15.3985 -15.3832 -15.3831 -15.2111 -15.2110 -15.1856 -15.1853 3.4499 3.4522 4.3598 4.3667 5.8883 5.9535 6.3727 6.3975 6.4936 6.5690 6.6941 6.7107 6.8764 6.8767 7.1816 7.2517 7.5104 7.5400 7.9274 7.9451 8.0355 8.0463 8.1613 8.1925 8.7891 8.8305 8.8955 9.0182 10.1923 10.3833 10.8995 10.9237 11.0843 11.0853 12.2389 12.4229 13.4581 13.5298 13.7910 13.8303 14.5850 14.5853 14.7116 14.7377 15.0118 15.0199 k = 0.5000 0.2887 0.1548 ( 4344 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8960 -15.8958 -15.7067 -15.7066 -15.3992 -15.3988 -15.3833 -15.3832 -15.2110 -15.2109 -15.1848 -15.1845 3.4419 3.4441 4.3746 4.3815 5.8737 5.9365 6.3768 6.3906 6.4678 6.5558 6.6829 6.7042 6.8795 6.8797 7.1990 7.2680 7.5007 7.5296 7.9351 7.9504 8.0385 8.0483 8.1622 8.1921 8.8178 8.8450 8.9694 9.0730 10.1513 10.3565 10.8931 10.9190 11.0890 11.0895 12.1680 12.3612 13.4581 13.5199 13.7813 13.8287 14.5896 14.5899 14.6998 14.7275 15.0120 15.0202 k = 0.5000 0.2887 0.1419 ( 4344 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8963 -15.8960 -15.7069 -15.7068 -15.3996 -15.3991 -15.3834 -15.3834 -15.2109 -15.2108 -15.1839 -15.1836 3.4342 3.4363 4.3893 4.3961 5.8596 5.9190 6.3801 6.3817 6.4455 6.5449 6.6727 6.6977 6.8821 6.8828 7.2158 7.2827 7.4913 7.5190 7.9421 7.9544 8.0427 8.0508 8.1633 8.1917 8.8402 8.8547 9.0522 9.1350 10.1108 10.3303 10.8869 10.9145 11.0934 11.0935 12.0920 12.2918 13.4583 13.5094 13.7777 13.8328 14.5936 14.5949 14.6878 14.7163 15.0126 15.0210 k = 0.5000 0.2887 0.1290 ( 4344 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8965 -15.8963 -15.7071 -15.7070 -15.3999 -15.3995 -15.3835 -15.3835 -15.2108 -15.2107 -15.1831 -15.1828 3.4267 3.4287 4.4038 4.4104 5.8461 5.9015 6.3714 6.3805 6.4286 6.5361 6.6637 6.6912 6.8846 6.8856 7.2318 7.2960 7.4824 7.5082 7.9483 7.9573 8.0478 8.0538 8.1644 8.1910 8.8580 8.8635 9.1395 9.2012 10.0711 10.3052 10.8807 10.9101 11.0974 11.0975 12.0126 12.2162 13.4576 13.4984 13.7801 13.8417 14.5970 14.6000 14.6761 14.7044 15.0137 15.0223 k = 0.5000 0.2887 0.1161 ( 4336 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8967 -15.8965 -15.7072 -15.7071 -15.4001 -15.3997 -15.3836 -15.3836 -15.2107 -15.2106 -15.1823 -15.1820 3.4197 3.4216 4.4177 4.4240 5.8335 5.8844 6.3603 6.3749 6.4203 6.5288 6.6558 6.6848 6.8869 6.8881 7.2473 7.3081 7.4740 7.4973 7.9535 7.9593 8.0536 8.0573 8.1657 8.1902 8.8721 8.8726 9.2295 9.2691 10.0326 10.2816 10.8747 10.9058 11.1009 11.1013 11.9319 12.1361 13.4555 13.4872 13.7882 13.8542 14.5996 14.6050 14.6653 14.6919 15.0156 15.0243 k = 0.5000 0.2887 0.1032 ( 4330 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8969 -15.8967 -15.7074 -15.7073 -15.4004 -15.4000 -15.3837 -15.3837 -15.2106 -15.2105 -15.1815 -15.1813 3.4132 3.4149 4.4309 4.4368 5.8219 5.8678 6.3491 6.3636 6.4200 6.5225 6.6491 6.6785 6.8891 6.8904 7.2621 7.3190 7.4660 7.4864 7.9578 7.9607 8.0595 8.0613 8.1669 8.1893 8.8805 8.8848 9.3214 9.3366 9.9957 10.2597 10.8687 10.9016 11.1042 11.1047 11.8520 12.0532 13.4519 13.4761 13.8011 13.8688 14.6006 14.6099 14.6561 14.6790 15.0181 15.0269 k = 0.5000 0.2887 0.0903 ( 4338 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8971 -15.8970 -15.7076 -15.7075 -15.4007 -15.4003 -15.3838 -15.3838 -15.2105 -15.2104 -15.1808 -15.1806 3.4074 3.4089 4.4432 4.4485 5.8115 5.8521 6.3382 6.3504 6.4239 6.5166 6.6438 6.6725 6.8910 6.8923 7.2763 7.3288 7.4584 7.4755 7.9611 7.9616 8.0654 8.0656 8.1681 8.1881 8.8886 8.8952 9.4018 9.4139 9.9606 10.2392 10.8629 10.8972 11.1071 11.1078 11.7752 11.9694 13.4472 13.4654 13.8175 13.8841 14.5998 14.6143 14.6493 14.6663 15.0215 15.0301 k = 0.5000 0.2887 0.0774 ( 4342 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8973 -15.8972 -15.7077 -15.7076 -15.4009 -15.4006 -15.3839 -15.3839 -15.2104 -15.2104 -15.1802 -15.1800 3.4021 3.4035 4.4543 4.4590 5.8025 5.8376 6.3282 6.3379 6.4294 6.5108 6.6398 6.6667 6.8927 6.8940 7.2900 7.3376 7.4513 7.4647 7.9624 7.9635 8.0700 8.0709 8.1693 8.1868 8.8962 8.9038 9.4633 9.5057 9.9277 10.2195 10.8576 10.8927 11.1098 11.1104 11.7041 11.8866 13.4419 13.4555 13.8361 13.8990 14.5969 14.6179 14.6452 14.6542 15.0255 15.0339 k = 0.5000 0.2887 0.0645 ( 4334 PWs) bands (ev): -36.9122 -36.9122 -36.6981 -36.6981 -15.8975 -15.8973 -15.7078 -15.7078 -15.4011 -15.4008 -15.3839 -15.3839 -15.2104 -15.2103 -15.1796 -15.1794 3.3977 3.3988 4.4641 4.4682 5.7951 5.8245 6.3193 6.3268 6.4358 6.5049 6.6371 6.6612 6.8942 6.8954 7.3031 7.3452 7.4446 7.4543 7.9631 7.9652 8.0744 8.0759 8.1705 8.1854 8.9033 8.9110 9.5199 9.5951 9.8979 10.1993 10.8530 10.8879 11.1120 11.1127 11.6414 11.8069 13.4367 13.4467 13.8556 13.9123 14.5929 14.6196 14.6433 14.6440 15.0303 15.0381 k = 0.5000 0.2887 0.0516 ( 4330 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8976 -15.8975 -15.7079 -15.7079 -15.4012 -15.4010 -15.3840 -15.3840 -15.2103 -15.2103 -15.1791 -15.1790 3.3940 3.3949 4.4724 4.4758 5.7894 5.8130 6.3119 6.3174 6.4427 6.4987 6.6356 6.6560 6.8955 6.8965 7.3156 7.3516 7.4385 7.4446 7.9637 7.9662 8.0784 8.0802 8.1718 8.1838 8.9097 8.9166 9.5710 9.6783 9.8734 10.1767 10.8498 10.8827 11.1139 11.1145 11.5898 11.7324 13.4319 13.4391 13.8747 13.9231 14.5889 14.6170 14.6383 14.6428 15.0354 15.0424 k = 0.5000 0.2887 0.0387 ( 4344 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8977 -15.8976 -15.7080 -15.7080 -15.4014 -15.4012 -15.3841 -15.3840 -15.2103 -15.2102 -15.1787 -15.1786 3.3911 3.3918 4.4791 4.4817 5.7854 5.8031 6.3060 6.3099 6.4497 6.4922 6.6353 6.6513 6.8965 6.8973 7.3272 7.3562 7.4329 7.4359 7.9643 7.9666 8.0819 8.0835 8.1730 8.1821 8.9151 8.9208 9.6163 9.7431 9.8647 10.1491 10.8483 10.8768 11.1155 11.1159 11.5517 11.6656 13.4279 13.4329 13.8924 13.9305 14.5861 14.6100 14.6377 14.6427 15.0405 15.0464 k = 0.5000 0.2887 0.0258 ( 4348 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8977 -15.7081 -15.7081 -15.4014 -15.4013 -15.3841 -15.3841 -15.2103 -15.2102 -15.1785 -15.1784 3.3890 3.3895 4.4842 4.4859 5.7834 5.7952 6.3019 6.3044 6.4569 6.4855 6.6360 6.6470 6.8973 6.8979 7.3379 7.3585 7.4283 7.4291 7.9650 7.9667 8.0847 8.0859 8.1743 8.1805 8.9194 8.9234 9.6560 9.7622 9.8971 10.1141 10.8493 10.8706 11.1166 11.1169 11.5295 11.6091 13.4251 13.4282 13.9077 13.9341 14.5850 14.6019 14.6389 14.6427 15.0453 15.0496 k = 0.5000 0.2887 0.0129 ( 4350 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4015 -15.4014 -15.3841 -15.3841 -15.2102 -15.2102 -15.1783 -15.1783 3.3878 3.3881 4.4874 4.4883 5.7833 5.7892 6.2997 6.3009 6.4641 6.4785 6.6376 6.6432 6.8979 6.8981 7.3470 7.3579 7.4248 7.4249 7.9655 7.9665 8.0866 8.0872 8.1757 8.1788 8.9225 8.9246 9.6909 9.7470 9.9567 10.0701 10.8527 10.8641 11.1173 11.1174 11.5243 11.5653 13.4236 13.4251 13.9201 13.9336 14.5860 14.5947 14.6404 14.6423 15.0489 15.0512 k = 0.5000 0.2887-0.0000 ( 4342 PWs) bands (ev): -36.9123 -36.9123 -36.6980 -36.6980 -15.8978 -15.8978 -15.7081 -15.7081 -15.4015 -15.4015 -15.3841 -15.3841 -15.2102 -15.2102 -15.1782 -15.1782 3.3875 3.3875 4.4888 4.4888 5.7852 5.7852 6.2993 6.2993 6.4714 6.4714 6.6401 6.6401 6.8981 6.8981 7.3539 7.3539 7.4235 7.4235 7.9661 7.9661 8.0875 8.0875 8.1772 8.1772 8.9243 8.9243 9.7214 9.7214 10.0170 10.0170 10.8579 10.8579 11.1176 11.1176 11.5365 11.5365 13.4236 13.4236 13.9288 13.9288 14.5893 14.5893 14.6416 14.6416 15.0511 15.0511 k = 0.3333 0.5774-0.0000 ( 4377 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8986 -15.8985 -15.7105 -15.7081 -15.4004 -15.3997 -15.3881 -15.3879 -15.2145 -15.2084 -15.1806 -15.1796 3.5136 3.5563 4.7129 4.8642 6.1784 6.2674 6.2819 6.3025 6.3294 6.3477 6.6320 6.6715 6.8457 6.9877 7.0122 7.0354 7.3607 7.7581 7.8685 7.9615 7.9893 8.0258 8.4921 8.5395 8.6063 8.6896 9.0738 9.1264 9.7254 9.7893 10.5460 10.6575 10.6977 11.0681 11.6919 11.7573 13.7705 13.8081 13.9560 13.9787 14.4373 14.4462 14.5397 14.6559 14.9120 14.9642 k = 0.3333 0.5774 0.0129 ( 4377 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8985 -15.8985 -15.7105 -15.7081 -15.4004 -15.3996 -15.3881 -15.3879 -15.2145 -15.2085 -15.1807 -15.1797 3.5141 3.5568 4.7117 4.8630 6.1788 6.2676 6.2823 6.3027 6.3309 6.3492 6.6315 6.6713 6.8459 6.9886 7.0124 7.0358 7.3611 7.7570 7.8682 7.9599 7.9893 8.0252 8.4884 8.5406 8.6097 8.6920 9.0756 9.1263 9.7195 9.7812 10.5456 10.6590 10.6968 11.0656 11.6994 11.7630 13.7721 13.8096 13.9558 13.9786 14.4352 14.4462 14.5288 14.6393 14.9232 14.9787 k = 0.3333 0.5774 0.0258 ( 4374 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8985 -15.8984 -15.7104 -15.7080 -15.4003 -15.3995 -15.3881 -15.3879 -15.2145 -15.2085 -15.1809 -15.1799 3.5157 3.5583 4.7079 4.8592 6.1799 6.2681 6.2833 6.3036 6.3354 6.3534 6.6301 6.6710 6.8465 6.9913 7.0129 7.0367 7.3623 7.7537 7.8673 7.9553 7.9893 8.0236 8.4787 8.5438 8.6185 8.6991 9.0809 9.1259 9.7022 9.7573 10.5442 10.6634 10.6943 11.0584 11.7212 11.7798 13.7768 13.8141 13.9553 13.9783 14.4261 14.4462 14.5026 14.5964 14.9530 15.0153 k = 0.3333 0.5774 0.0387 ( 4374 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8984 -15.8983 -15.7104 -15.7079 -15.4002 -15.3994 -15.3881 -15.3878 -15.2145 -15.2085 -15.1812 -15.1802 3.5184 3.5608 4.7018 4.8530 6.1819 6.2689 6.2850 6.3049 6.3428 6.3605 6.6278 6.6703 6.8477 6.9957 7.0138 7.0383 7.3642 7.7485 7.8658 7.9478 7.9889 8.0210 8.4656 8.5490 8.6303 8.7108 9.0898 9.1251 9.6739 9.7193 10.5409 10.6707 10.6911 11.0464 11.7559 11.8070 13.7848 13.8216 13.9544 13.9778 14.4003 14.4463 14.4783 14.5382 14.9943 15.0630 k = 0.3333 0.5774 0.0516 ( 4374 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6978 -15.8983 -15.8982 -15.7103 -15.7078 -15.4000 -15.3992 -15.3881 -15.3878 -15.2145 -15.2085 -15.1815 -15.1805 3.5222 3.5643 4.6932 4.8444 6.1846 6.2700 6.2873 6.3068 6.3530 6.3703 6.6247 6.6695 6.8492 7.0018 7.0149 7.0404 7.3669 7.7414 7.8636 7.9378 7.9880 8.0175 8.4511 8.5561 8.6429 8.7267 9.1022 9.1240 9.6356 9.6694 10.5345 10.6808 10.6883 11.0299 11.8015 11.8437 13.7958 13.8321 13.9530 13.9771 14.3529 14.4464 14.4664 14.4718 15.0413 15.1151 k = 0.3333 0.5774 0.0645 ( 4374 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8982 -15.8981 -15.7102 -15.7077 -15.3998 -15.3990 -15.3881 -15.3878 -15.2146 -15.2085 -15.1820 -15.1810 3.5269 3.5687 4.6825 4.8337 6.1882 6.2715 6.2903 6.3090 6.3660 6.3828 6.6207 6.6684 6.8513 7.0094 7.0163 7.0429 7.3704 7.7328 7.8609 7.9256 7.9861 8.0131 8.4368 8.5649 8.6551 8.7465 9.1183 9.1226 9.5886 9.6098 10.5243 10.6868 10.6937 11.0090 11.8558 11.8886 13.8098 13.8455 13.9509 13.9761 14.2933 14.4005 14.4465 14.4616 15.0907 15.1683 k = 0.3333 0.5774 0.0774 ( 4377 PWs) bands (ev): -36.9122 -36.9120 -36.6979 -36.6979 -15.8980 -15.8979 -15.7101 -15.7076 -15.3996 -15.3987 -15.3881 -15.3878 -15.2146 -15.2086 -15.1826 -15.1816 3.5326 3.5740 4.6698 4.8210 6.1927 6.2732 6.2937 6.3116 6.3816 6.3979 6.6160 6.6672 6.8540 7.0179 7.0182 7.0458 7.3745 7.7229 7.8574 7.9117 7.9829 8.0080 8.4235 8.5751 8.6663 8.7698 9.1207 9.1379 9.5343 9.5429 10.5097 10.6873 10.7091 10.9840 11.9166 11.9402 13.8266 13.8616 13.9478 13.9750 14.2283 14.3263 14.4466 14.4592 15.1406 15.2209 k = 0.3333 0.5774 0.0903 ( 4371 PWs) bands (ev): -36.9121 -36.9120 -36.6979 -36.6979 -15.8978 -15.8977 -15.7100 -15.7074 -15.3993 -15.3984 -15.3881 -15.3877 -15.2146 -15.2086 -15.1833 -15.1822 3.5393 3.5802 4.6552 4.8065 6.1980 6.2752 6.2977 6.3144 6.3995 6.4155 6.6107 6.6658 6.8573 7.0197 7.0283 7.0489 7.3793 7.7120 7.8531 7.8967 7.9781 8.0024 8.4119 8.5864 8.6759 8.7962 9.1183 9.1608 9.4706 9.4743 10.4904 10.6903 10.7268 10.9554 11.9818 11.9970 13.8460 13.8803 13.9429 13.9737 14.1617 14.2504 14.4468 14.4579 15.1899 15.2720 k = 0.3333 0.5774 0.1032 ( 4371 PWs) bands (ev): -36.9121 -36.9120 -36.6979 -36.6979 -15.8976 -15.8975 -15.7099 -15.7072 -15.3990 -15.3980 -15.3880 -15.3877 -15.2146 -15.2086 -15.1840 -15.1830 3.5469 3.5871 4.6391 4.7904 6.2041 6.2774 6.3020 6.3175 6.4196 6.4355 6.6050 6.6643 6.8612 7.0216 7.0393 7.0521 7.3847 7.7004 7.8476 7.8812 7.9715 7.9963 8.4023 8.5987 8.6839 8.8253 9.1152 9.1869 9.3946 9.4104 10.4665 10.6960 10.7465 10.9237 12.0498 12.0574 13.8675 13.9015 13.9341 13.9721 14.0970 14.1739 14.4471 14.4571 15.2379 15.2684 k = 0.3333 0.5774 0.1161 ( 4371 PWs) bands (ev): -36.9121 -36.9120 -36.6979 -36.6979 -15.8974 -15.8972 -15.7097 -15.7070 -15.3987 -15.3976 -15.3880 -15.3876 -15.2147 -15.2087 -15.1849 -15.1838 3.5552 3.5948 4.6216 4.7730 6.2111 6.2799 6.3066 6.3206 6.4412 6.4578 6.5991 6.6627 6.8657 7.0235 7.0511 7.0551 7.3906 7.6883 7.8398 7.8666 7.9628 7.9899 8.3949 8.6113 8.6903 8.8567 9.1109 9.2159 9.3165 9.3444 10.4382 10.7042 10.7672 10.8900 12.1190 12.1200 13.8902 13.9162 13.9249 13.9705 14.0403 14.0984 14.4474 14.4567 15.2500 15.2841 k = 0.3333 0.5774 0.1290 ( 4359 PWs) bands (ev): -36.9121 -36.9120 -36.6979 -36.6979 -15.8972 -15.8970 -15.7095 -15.7068 -15.3984 -15.3972 -15.3879 -15.3875 -15.2146 -15.2087 -15.1857 -15.1846 3.5642 3.6031 4.6030 4.7546 6.2190 6.2825 6.3114 6.3238 6.4639 6.4821 6.5937 6.6612 6.8708 7.0253 7.0580 7.0635 7.3970 7.6760 7.8283 7.8549 7.9523 7.9834 8.3898 8.6240 8.6952 8.8901 9.1044 9.2377 9.2476 9.2790 10.4061 10.7148 10.7853 10.8580 12.1836 12.1880 13.8804 13.9101 13.9497 13.9697 14.0015 14.0281 14.4478 14.4564 15.2283 15.3112 k = 0.3333 0.5774 0.1419 ( 4359 PWs) bands (ev): -36.9121 -36.9119 -36.6979 -36.6979 -15.8969 -15.8967 -15.7094 -15.7066 -15.3980 -15.3968 -15.3879 -15.3875 -15.2147 -15.2088 -15.1866 -15.1855 3.5739 3.6119 4.5835 4.7355 6.2276 6.2853 6.3163 6.3268 6.4859 6.5082 6.5902 6.6599 6.8765 7.0270 7.0603 7.0762 7.4039 7.6636 7.8128 7.8463 7.9400 7.9768 8.3867 8.6362 8.6986 8.9247 9.0931 9.1595 9.2182 9.2815 10.3705 10.7276 10.7833 10.8454 12.2469 12.2559 13.8263 13.9034 13.9629 13.9815 13.9821 13.9874 14.4483 14.4563 15.2045 15.2826 k = 0.3333 0.5774 0.1548 ( 4359 PWs) bands (ev): -36.9121 -36.9119 -36.6979 -36.6979 -15.8967 -15.8965 -15.7092 -15.7063 -15.3976 -15.3963 -15.3879 -15.3875 -15.2147 -15.2088 -15.1875 -15.1864 3.5840 3.6211 4.5636 4.7160 6.2370 6.2881 6.3212 6.3298 6.5044 6.5357 6.5915 6.6589 6.8827 7.0284 7.0620 7.0890 7.4110 7.6515 7.7950 7.8396 7.9261 7.9704 8.3856 8.6471 8.7009 8.9587 9.0702 9.0846 9.1705 9.3174 10.3320 10.7422 10.7512 10.8623 12.3090 12.3218 13.7636 13.8468 13.9617 13.9712 13.9999 14.0106 14.4488 14.4563 15.1781 15.2515 k = 0.3333 0.5774 0.1677 ( 4353 PWs) bands (ev): -36.9121 -36.9119 -36.6980 -36.6979 -15.8964 -15.8962 -15.7091 -15.7061 -15.3972 -15.3959 -15.3878 -15.3874 -15.2147 -15.2088 -15.1884 -15.1873 3.5945 3.6306 4.5434 4.6963 6.2471 6.2911 6.3262 6.3326 6.5147 6.5639 6.6017 6.6590 6.8894 7.0294 7.0628 7.1017 7.4186 7.6399 7.7762 7.8337 7.9111 7.9641 8.3860 8.6559 8.7021 8.9745 9.0300 9.0313 9.1431 9.3548 10.2912 10.7096 10.7582 10.8881 12.3689 12.3847 13.6989 13.7776 13.9593 13.9648 14.0286 14.0418 14.4494 14.4563 15.1495 15.2182 k = 0.3333 0.5774 0.1806 ( 4353 PWs) bands (ev): -36.9121 -36.9119 -36.6980 -36.6979 -15.8962 -15.8960 -15.7089 -15.7059 -15.3969 -15.3955 -15.3878 -15.3873 -15.2147 -15.2089 -15.1894 -15.1882 3.6051 3.6402 4.5234 4.6768 6.2579 6.2940 6.3309 6.3351 6.5156 6.5912 6.6221 6.6613 6.8964 7.0299 7.0625 7.1139 7.4263 7.6289 7.7569 7.8281 7.8952 7.9581 8.3877 8.6610 8.7026 8.9220 8.9811 9.0501 9.1298 9.3934 10.2485 10.6650 10.7753 10.9163 12.4259 12.4440 13.6350 13.7081 13.9565 13.9600 14.0617 14.0745 14.4500 14.4565 15.1190 15.1830 k = 0.3333 0.5774 0.1935 ( 4371 PWs) bands (ev): -36.9121 -36.9119 -36.6980 -36.6980 -15.8960 -15.8958 -15.7088 -15.7057 -15.3965 -15.3950 -15.3878 -15.3873 -15.2148 -15.2090 -15.1903 -15.1891 3.6158 3.6497 4.5037 4.6578 6.2692 6.2969 6.3355 6.3374 6.5102 6.6137 6.6490 6.6695 6.9036 7.0297 7.0608 7.1256 7.4343 7.6189 7.7374 7.8230 7.8789 7.9525 8.3903 8.6605 8.7023 8.8556 8.9346 9.0871 9.1221 9.4327 10.2047 10.6193 10.7930 10.9453 12.4793 12.4992 13.5735 13.6410 13.9535 13.9561 14.0967 14.1083 14.4506 14.4567 15.0869 15.1464 k = 0.3333 0.5774 0.2064 ( 4359 PWs) bands (ev): -36.9121 -36.9119 -36.6980 -36.6980 -15.8958 -15.8955 -15.7087 -15.7055 -15.3961 -15.3946 -15.3878 -15.3873 -15.2148 -15.2090 -15.1911 -15.1899 3.6263 3.6590 4.4848 4.6397 6.2812 6.2998 6.3394 6.3398 6.5016 6.6265 6.6794 6.6884 6.9109 7.0287 7.0574 7.1364 7.4425 7.6100 7.7179 7.8181 7.8625 7.9474 8.3936 8.6521 8.7016 8.7917 8.8966 9.1167 9.1263 9.4724 10.1603 10.5734 10.8109 10.9740 12.5285 12.5498 13.5156 13.5775 13.9505 13.9527 14.1329 14.1428 14.4513 14.4570 15.0537 15.1089 k = 0.3333 0.5774 0.2193 ( 4347 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8956 -15.8953 -15.7085 -15.7053 -15.3958 -15.3942 -15.3877 -15.3872 -15.2148 -15.2090 -15.1919 -15.1907 3.6364 3.6679 4.4671 4.6227 6.2935 6.3025 6.3411 6.3438 6.4911 6.6311 6.7111 6.7159 6.9181 7.0267 7.0523 7.1461 7.4508 7.6024 7.6985 7.8137 7.8465 7.9429 8.3971 8.6346 8.7005 8.7327 8.8704 9.1125 9.1658 9.5116 10.1162 10.5280 10.8284 11.0018 12.5730 12.5954 13.4620 13.5187 13.9476 13.9497 14.1692 14.1773 14.4519 14.4573 15.0200 15.0711 k = 0.3333 0.5774 0.2322 ( 4347 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8954 -15.8951 -15.7084 -15.7051 -15.3955 -15.3938 -15.3877 -15.3872 -15.2149 -15.2091 -15.1926 -15.1914 3.6459 3.6762 4.4507 4.6072 6.3050 6.3062 6.3425 6.3474 6.4795 6.6324 6.7431 6.7470 6.9250 7.0235 7.0450 7.1547 7.4593 7.5961 7.6794 7.8097 7.8312 7.9390 8.4008 8.6095 8.6795 8.6993 8.8555 9.1090 9.2045 9.5499 10.0731 10.4843 10.8450 11.0279 12.6124 12.6355 13.4136 13.4654 13.9448 13.9470 14.2050 14.2112 14.4524 14.4576 14.9866 15.0338 k = 0.3333 0.5774 0.2451 ( 4335 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8952 -15.8949 -15.7083 -15.7049 -15.3952 -15.3935 -15.3877 -15.3871 -15.2149 -15.2091 -15.1931 -15.1919 3.6545 3.6837 4.4361 4.5935 6.3073 6.3192 6.3436 6.3506 6.4674 6.6324 6.7743 6.7790 6.9314 7.0190 7.0356 7.1618 7.4678 7.5913 7.6610 7.8063 7.8172 7.9358 8.4043 8.5810 8.6330 8.6980 8.8487 9.1060 9.2416 9.5862 10.0321 10.4430 10.8602 11.0517 12.6463 12.6700 13.3712 13.4185 13.9422 13.9446 14.2395 14.2438 14.4529 14.4580 14.9543 14.9981 k = 0.3333 0.5774 0.2580 ( 4338 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8951 -15.8948 -15.7082 -15.7048 -15.3950 -15.3932 -15.3877 -15.3871 -15.2149 -15.2091 -15.1937 -15.1925 3.6619 3.6901 4.4236 4.5817 6.3093 6.3322 6.3445 6.3532 6.4549 6.6320 6.8036 6.8106 6.9370 7.0132 7.0239 7.1676 7.4763 7.5878 7.6437 7.8035 7.8048 7.9332 8.4074 8.5529 8.5939 8.6968 8.8466 9.1035 9.2757 9.6193 9.9945 10.4057 10.8735 11.0723 12.6744 12.6986 13.3353 13.3787 13.9399 13.9426 14.2712 14.2739 14.4532 14.4583 14.9244 14.9651 k = 0.3333 0.5774 0.2709 ( 4341 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8950 -15.8946 -15.7081 -15.7047 -15.3948 -15.3930 -15.3877 -15.3871 -15.2149 -15.2092 -15.1941 -15.1929 3.6680 3.6953 4.4136 4.5723 6.3109 6.3449 6.3451 6.3553 6.4424 6.6314 6.8300 6.8407 6.9417 7.0063 7.0101 7.1721 7.4844 7.5854 7.6281 7.7945 7.8012 7.9312 8.4100 8.5286 8.5628 8.6957 8.8469 9.1015 9.3054 9.6479 9.9620 10.3737 10.8844 11.0892 12.6965 12.7210 13.3067 13.3468 13.9381 13.9409 14.2989 14.3001 14.4534 14.4585 14.8984 14.9364 k = 0.3333 0.5774 0.2838 ( 4335 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8949 -15.8946 -15.7080 -15.7046 -15.3946 -15.3929 -15.3877 -15.3871 -15.2149 -15.2092 -15.1944 -15.1932 3.6726 3.6992 4.4062 4.5655 6.3121 6.3455 6.3568 6.3569 6.4307 6.6310 6.8518 6.8678 6.9452 6.9952 6.9992 7.1751 7.4916 7.5840 7.6152 7.7867 7.7996 7.9299 8.4119 8.5099 8.5402 8.6949 8.8479 9.1000 9.3289 9.6702 9.9365 10.3490 10.8925 11.1017 12.7125 12.7372 13.2859 13.3235 13.9367 13.9397 14.3207 14.3208 14.4534 14.4587 14.8779 14.9138 k = 0.3333 0.5774 0.2967 ( 4329 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3870 -15.2149 -15.2092 -15.1946 -15.1933 3.6753 3.7016 4.4016 4.5613 6.3128 6.3457 6.3578 6.3666 6.4211 6.6307 6.8668 6.8891 6.9474 6.9814 6.9933 7.1770 7.4968 7.5833 7.6065 7.7819 7.7987 7.9291 8.4131 8.4982 8.5265 8.6944 8.8488 9.0991 9.3441 9.6846 9.9201 10.3332 10.8975 11.1094 12.7221 12.7469 13.2732 13.3094 13.9358 13.9389 14.3342 14.3348 14.4534 14.4588 14.8646 14.8993 k = 0.3333 0.5774 0.3096 ( 4338 PWs) bands (ev): -36.9120 -36.9119 -36.6980 -36.6980 -15.8948 -15.8945 -15.7080 -15.7046 -15.3946 -15.3928 -15.3876 -15.3871 -15.2149 -15.2092 -15.1947 -15.1934 3.6763 3.7024 4.4001 4.5599 6.3131 6.3458 6.3581 6.3707 6.4170 6.6305 6.8722 6.8981 6.9482 6.9749 6.9909 7.1776 7.4987 7.5831 7.6033 7.7802 7.7984 7.9288 8.4135 8.4943 8.5219 8.6942 8.8491 9.0988 9.3494 9.6895 9.9143 10.3277 10.8992 11.1120 12.7253 12.7501 13.2690 13.3046 13.9355 13.9387 14.3389 14.3397 14.4533 14.4589 14.8600 14.8942 Writing output data file ScSiAu.save init_run : 4.56s CPU 13.84s WALL ( 1 calls) electrons : 1910.43s CPU 1923.08s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.53s CPU 1.44s WALL ( 1 calls) Called by electrons: c_bands : 1910.41s CPU 1922.81s WALL ( 1 calls) v_of_rho : 0.23s CPU 0.90s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.21s CPU 0.56s WALL ( 1 calls) newd : 0.70s CPU 0.82s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.10s WALL ( 319 calls) cegterg : 1831.29s CPU 1841.05s WALL ( 1538 calls) Called by sum_band: Called by *egterg: h_psi : 684.57s CPU 702.33s WALL ( 30406 calls) s_psi : 106.67s CPU 107.21s WALL ( 30406 calls) g_psi : 1.54s CPU 1.58s WALL ( 28549 calls) cdiaghg : 777.14s CPU 770.73s WALL ( 28868 calls) cegterg:over : 143.17s CPU 137.41s WALL ( 28549 calls) cegterg:upda : 33.57s CPU 41.42s WALL ( 28549 calls) cegterg:last : 26.55s CPU 27.87s WALL ( 3671 calls) Called by h_psi: h_psi:vloc : 491.20s CPU 505.57s WALL ( 30406 calls) h_psi:vnl : 192.72s CPU 194.88s WALL ( 30406 calls) add_vuspsi : 74.35s CPU 83.67s WALL ( 30406 calls) General routines calbec : 118.27s CPU 110.93s WALL ( 30406 calls) fft : 0.54s CPU 1.40s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 467.38s CPU 474.55s WALL ( 2610776 calls) interpolate : 0.02s CPU 0.05s WALL ( 4 calls) davcio : 0.03s CPU 1.44s WALL ( 638 calls) Parallel routines fft_scatter : 287.84s CPU 287.75s WALL ( 2610799 calls) PWSCF : 33m 4.88s CPU 35m56.20s WALL This run was terminated on: 9: 8:27 19Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=