Program PWSCF v.5.1.1 starts on 17Oct2015 at 23: 0:20 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: ./CaAgBi.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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 32 21 6 1686 917 142 Max 33 22 7 1693 940 149 Sum 1555 1039 301 81131 44661 6911 bravais-lattice index = 14 lattice parameter (alat) = 9.0920 a.u. unit-cell volume = 1058.9221 (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 = 46.0000 Ry charge density cutoff = 274.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.092039 celldm(2)= 1.000000 celldm(3)= 1.626858 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 1.626858 ) 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 0.614682 ) PseudoPot. # 1 for Bi read from file: /home/autes/Pseudo/Bi_MT_PBE.UPF MD5 check sum: b574f8a1102dd4d1778b4090b55884d0 Pseudo is Norm-conserving, Zval = 5.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1283 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Ca read from file: /home/autes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ag read from file: /home/autes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Bi 5.00 208.98040 Bi( 1.00) Ca 10.00 40.07800 Ca( 1.00) Ag 11.00 107.86820 Ag( 1.00) 12 Sym. Ops. (no inversion) found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) isym = 3 60 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 3) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) isym = 4 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 4) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) isym = 5 120 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 6) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) 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. 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 9) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) isym = 10 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8134288 ) 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 C_6v (6mm) there are 9 classes and 3 irreducible representations the character table: E -E C2 2C3 -2C3 2C6 -2C6 3s_v 3s_d -C2 -3s_v -3s_d G_7 2.00 -2.00 0.00 1.00 -1.00 1.73 -1.73 0.00 0.00 G_8 2.00 -2.00 0.00 1.00 -1.00 -1.73 1.73 0.00 0.00 G_9 2.00 -2.00 0.00 -2.00 2.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C6 3 4 2C3 5 6 3s_v-3s_v 7 -7 9 10 -10 -9 3s_d-3s_d 8 -8 12 -11 11 -12 -E -1 -2C6 -3 -4 -2C3 -5 -6 Cartesian axes number of k points= 280 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0131579 0.0075967 -0.0000000), wk = 0.0035714 k( 3) = ( 0.0263158 0.0151934 -0.0000000), wk = 0.0035714 k( 4) = ( 0.0394737 0.0227901 -0.0000000), wk = 0.0035714 k( 5) = ( 0.0526316 0.0303869 -0.0000000), wk = 0.0035714 k( 6) = ( 0.0657895 0.0379836 -0.0000000), wk = 0.0035714 k( 7) = ( 0.0789474 0.0455803 -0.0000000), wk = 0.0035714 k( 8) = ( 0.0921053 0.0531770 -0.0000000), wk = 0.0035714 k( 9) = ( 0.1052632 0.0607737 -0.0000000), wk = 0.0035714 k( 10) = ( 0.1184210 0.0683704 -0.0000000), wk = 0.0035714 k( 11) = ( 0.1315790 0.0759671 -0.0000000), wk = 0.0035714 k( 12) = ( 0.1447368 0.0835639 -0.0000000), wk = 0.0035714 k( 13) = ( 0.1578947 0.0911606 -0.0000000), wk = 0.0035714 k( 14) = ( 0.1710526 0.0987573 -0.0000000), wk = 0.0035714 k( 15) = ( 0.1842105 0.1063540 -0.0000000), wk = 0.0035714 k( 16) = ( 0.1973684 0.1139507 -0.0000000), wk = 0.0035714 k( 17) = ( 0.2105263 0.1215474 -0.0000000), wk = 0.0035714 k( 18) = ( 0.2236842 0.1291441 -0.0000000), wk = 0.0035714 k( 19) = ( 0.2368421 0.1367409 -0.0000000), wk = 0.0035714 k( 20) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0035714 k( 21) = ( 0.2631579 0.1519343 -0.0000000), wk = 0.0035714 k( 22) = ( 0.2763158 0.1595310 -0.0000000), wk = 0.0035714 k( 23) = ( 0.2894737 0.1671277 -0.0000000), wk = 0.0035714 k( 24) = ( 0.3026316 0.1747244 -0.0000000), wk = 0.0035714 k( 25) = ( 0.3157895 0.1823211 -0.0000000), wk = 0.0035714 k( 26) = ( 0.3289474 0.1899179 -0.0000000), wk = 0.0035714 k( 27) = ( 0.3421053 0.1975146 -0.0000000), wk = 0.0035714 k( 28) = ( 0.3552632 0.2051113 -0.0000000), wk = 0.0035714 k( 29) = ( 0.3684211 0.2127080 -0.0000000), wk = 0.0035714 k( 30) = ( 0.3815789 0.2203047 -0.0000000), wk = 0.0035714 k( 31) = ( 0.3947368 0.2279014 -0.0000000), wk = 0.0035714 k( 32) = ( 0.4078947 0.2354981 -0.0000000), wk = 0.0035714 k( 33) = ( 0.4210526 0.2430948 -0.0000000), wk = 0.0035714 k( 34) = ( 0.4342105 0.2506916 -0.0000000), wk = 0.0035714 k( 35) = ( 0.4473684 0.2582883 -0.0000000), wk = 0.0035714 k( 36) = ( 0.4605263 0.2658850 -0.0000000), wk = 0.0035714 k( 37) = ( 0.4736842 0.2734817 -0.0000000), wk = 0.0035714 k( 38) = ( 0.4868421 0.2810784 -0.0000000), wk = 0.0035714 k( 39) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 40) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 41) = ( 0.4924242 0.3017967 -0.0000000), wk = 0.0035714 k( 42) = ( 0.4848485 0.3149183 -0.0000000), wk = 0.0035714 k( 43) = ( 0.4772727 0.3280399 -0.0000000), wk = 0.0035714 k( 44) = ( 0.4696970 0.3411615 -0.0000000), wk = 0.0035714 k( 45) = ( 0.4621212 0.3542831 -0.0000000), wk = 0.0035714 k( 46) = ( 0.4545455 0.3674047 -0.0000000), wk = 0.0035714 k( 47) = ( 0.4469697 0.3805263 -0.0000000), wk = 0.0035714 k( 48) = ( 0.4393939 0.3936479 -0.0000000), wk = 0.0035714 k( 49) = ( 0.4318182 0.4067695 -0.0000000), wk = 0.0035714 k( 50) = ( 0.4242424 0.4198911 -0.0000000), wk = 0.0035714 k( 51) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0035714 k( 52) = ( 0.4090909 0.4461343 -0.0000000), wk = 0.0035714 k( 53) = ( 0.4015151 0.4592559 -0.0000000), wk = 0.0035714 k( 54) = ( 0.3939394 0.4723775 -0.0000000), wk = 0.0035714 k( 55) = ( 0.3863636 0.4854991 -0.0000000), wk = 0.0035714 k( 56) = ( 0.3787879 0.4986207 -0.0000000), wk = 0.0035714 k( 57) = ( 0.3712121 0.5117423 -0.0000000), wk = 0.0035714 k( 58) = ( 0.3636364 0.5248639 -0.0000000), wk = 0.0035714 k( 59) = ( 0.3560606 0.5379855 -0.0000000), wk = 0.0035714 k( 60) = ( 0.3484849 0.5511071 -0.0000000), wk = 0.0035714 k( 61) = ( 0.3409091 0.5642287 -0.0000000), wk = 0.0035714 k( 62) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 63) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 64) = ( 0.3257576 0.5642287 -0.0000000), wk = 0.0035714 k( 65) = ( 0.3181818 0.5511071 -0.0000000), wk = 0.0035714 k( 66) = ( 0.3106061 0.5379855 -0.0000000), wk = 0.0035714 k( 67) = ( 0.3030303 0.5248639 -0.0000000), wk = 0.0035714 k( 68) = ( 0.2954545 0.5117423 -0.0000000), wk = 0.0035714 k( 69) = ( 0.2878788 0.4986207 -0.0000000), wk = 0.0035714 k( 70) = ( 0.2803030 0.4854991 -0.0000000), wk = 0.0035714 k( 71) = ( 0.2727273 0.4723775 -0.0000000), wk = 0.0035714 k( 72) = ( 0.2651515 0.4592559 -0.0000000), wk = 0.0035714 k( 73) = ( 0.2575758 0.4461343 -0.0000000), wk = 0.0035714 k( 74) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0035714 k( 75) = ( 0.2424242 0.4198911 -0.0000000), wk = 0.0035714 k( 76) = ( 0.2348485 0.4067695 -0.0000000), wk = 0.0035714 k( 77) = ( 0.2272727 0.3936479 -0.0000000), wk = 0.0035714 k( 78) = ( 0.2196970 0.3805263 -0.0000000), wk = 0.0035714 k( 79) = ( 0.2121212 0.3674047 -0.0000000), wk = 0.0035714 k( 80) = ( 0.2045454 0.3542831 -0.0000000), wk = 0.0035714 k( 81) = ( 0.1969697 0.3411615 -0.0000000), wk = 0.0035714 k( 82) = ( 0.1893939 0.3280399 -0.0000000), wk = 0.0035714 k( 83) = ( 0.1818182 0.3149183 -0.0000000), wk = 0.0035714 k( 84) = ( 0.1742424 0.3017967 -0.0000000), wk = 0.0035714 k( 85) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0035714 k( 86) = ( 0.1590909 0.2755535 -0.0000000), wk = 0.0035714 k( 87) = ( 0.1515151 0.2624319 -0.0000000), wk = 0.0035714 k( 88) = ( 0.1439394 0.2493103 -0.0000000), wk = 0.0035714 k( 89) = ( 0.1363636 0.2361888 -0.0000000), wk = 0.0035714 k( 90) = ( 0.1287879 0.2230672 -0.0000000), wk = 0.0035714 k( 91) = ( 0.1212121 0.2099456 -0.0000000), wk = 0.0035714 k( 92) = ( 0.1136364 0.1968239 -0.0000000), wk = 0.0035714 k( 93) = ( 0.1060606 0.1837024 -0.0000000), wk = 0.0035714 k( 94) = ( 0.0984848 0.1705808 -0.0000000), wk = 0.0035714 k( 95) = ( 0.0909091 0.1574592 -0.0000000), wk = 0.0035714 k( 96) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0035714 k( 97) = ( 0.0757576 0.1312160 -0.0000000), wk = 0.0035714 k( 98) = ( 0.0681818 0.1180944 -0.0000000), wk = 0.0035714 k( 99) = ( 0.0606061 0.1049728 -0.0000000), wk = 0.0035714 k( 100) = ( 0.0530303 0.0918512 -0.0000000), wk = 0.0035714 k( 101) = ( 0.0454546 0.0787296 -0.0000000), wk = 0.0035714 k( 102) = ( 0.0378788 0.0656080 -0.0000000), wk = 0.0035714 k( 103) = ( 0.0303030 0.0524864 -0.0000000), wk = 0.0035714 k( 104) = ( 0.0227273 0.0393648 -0.0000000), wk = 0.0035714 k( 105) = ( 0.0151515 0.0262432 -0.0000000), wk = 0.0035714 k( 106) = ( 0.0075758 0.0131216 -0.0000000), wk = 0.0035714 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 109) = ( 0.0000000 0.0000000 0.0146353), wk = 0.0035714 k( 110) = ( 0.0000000 0.0000000 0.0292706), wk = 0.0035714 k( 111) = ( 0.0000000 0.0000000 0.0439059), wk = 0.0035714 k( 112) = ( 0.0000000 0.0000000 0.0585411), wk = 0.0035714 k( 113) = ( 0.0000000 0.0000000 0.0731764), wk = 0.0035714 k( 114) = ( 0.0000000 0.0000000 0.0878117), wk = 0.0035714 k( 115) = ( 0.0000000 0.0000000 0.1024470), wk = 0.0035714 k( 116) = ( 0.0000000 0.0000000 0.1170823), wk = 0.0035714 k( 117) = ( 0.0000000 0.0000000 0.1317176), wk = 0.0035714 k( 118) = ( 0.0000000 0.0000000 0.1463528), wk = 0.0035714 k( 119) = ( 0.0000000 0.0000000 0.1609881), wk = 0.0035714 k( 120) = ( 0.0000000 0.0000000 0.1756234), wk = 0.0035714 k( 121) = ( 0.0000000 0.0000000 0.1902587), wk = 0.0035714 k( 122) = ( 0.0000000 0.0000000 0.2048940), wk = 0.0035714 k( 123) = ( 0.0000000 0.0000000 0.2195293), wk = 0.0035714 k( 124) = ( 0.0000000 0.0000000 0.2341646), wk = 0.0035714 k( 125) = ( 0.0000000 0.0000000 0.2487998), wk = 0.0035714 k( 126) = ( 0.0000000 0.0000000 0.2634351), wk = 0.0035714 k( 127) = ( 0.0000000 0.0000000 0.2780704), wk = 0.0035714 k( 128) = ( 0.0000000 0.0000000 0.2927057), wk = 0.0035714 k( 129) = ( 0.0000000 0.0000000 0.3073410), wk = 0.0035714 k( 130) = ( 0.0000000 0.0000000 0.3073410), wk = 0.0035714 k( 131) = ( 0.0131579 0.0075967 0.3073410), wk = 0.0035714 k( 132) = ( 0.0263158 0.0151934 0.3073410), wk = 0.0035714 k( 133) = ( 0.0394737 0.0227901 0.3073410), wk = 0.0035714 k( 134) = ( 0.0526316 0.0303869 0.3073410), wk = 0.0035714 k( 135) = ( 0.0657895 0.0379836 0.3073410), wk = 0.0035714 k( 136) = ( 0.0789474 0.0455803 0.3073410), wk = 0.0035714 k( 137) = ( 0.0921053 0.0531770 0.3073410), wk = 0.0035714 k( 138) = ( 0.1052632 0.0607737 0.3073410), wk = 0.0035714 k( 139) = ( 0.1184210 0.0683704 0.3073410), wk = 0.0035714 k( 140) = ( 0.1315790 0.0759671 0.3073410), wk = 0.0035714 k( 141) = ( 0.1447368 0.0835639 0.3073410), wk = 0.0035714 k( 142) = ( 0.1578947 0.0911606 0.3073410), wk = 0.0035714 k( 143) = ( 0.1710526 0.0987573 0.3073410), wk = 0.0035714 k( 144) = ( 0.1842105 0.1063540 0.3073410), wk = 0.0035714 k( 145) = ( 0.1973684 0.1139507 0.3073410), wk = 0.0035714 k( 146) = ( 0.2105263 0.1215474 0.3073410), wk = 0.0035714 k( 147) = ( 0.2236842 0.1291441 0.3073410), wk = 0.0035714 k( 148) = ( 0.2368421 0.1367409 0.3073410), wk = 0.0035714 k( 149) = ( 0.2500000 0.1443376 0.3073410), wk = 0.0035714 k( 150) = ( 0.2631579 0.1519343 0.3073410), wk = 0.0035714 k( 151) = ( 0.2763158 0.1595310 0.3073410), wk = 0.0035714 k( 152) = ( 0.2894737 0.1671277 0.3073410), wk = 0.0035714 k( 153) = ( 0.3026316 0.1747244 0.3073410), wk = 0.0035714 k( 154) = ( 0.3157895 0.1823211 0.3073410), wk = 0.0035714 k( 155) = ( 0.3289474 0.1899179 0.3073410), wk = 0.0035714 k( 156) = ( 0.3421053 0.1975146 0.3073410), wk = 0.0035714 k( 157) = ( 0.3552632 0.2051113 0.3073410), wk = 0.0035714 k( 158) = ( 0.3684211 0.2127080 0.3073410), wk = 0.0035714 k( 159) = ( 0.3815789 0.2203047 0.3073410), wk = 0.0035714 k( 160) = ( 0.3947368 0.2279014 0.3073410), wk = 0.0035714 k( 161) = ( 0.4078947 0.2354981 0.3073410), wk = 0.0035714 k( 162) = ( 0.4210526 0.2430948 0.3073410), wk = 0.0035714 k( 163) = ( 0.4342105 0.2506916 0.3073410), wk = 0.0035714 k( 164) = ( 0.4473684 0.2582883 0.3073410), wk = 0.0035714 k( 165) = ( 0.4605263 0.2658850 0.3073410), wk = 0.0035714 k( 166) = ( 0.4736842 0.2734817 0.3073410), wk = 0.0035714 k( 167) = ( 0.4868421 0.2810784 0.3073410), wk = 0.0035714 k( 168) = ( 0.5000000 0.2886751 0.3073410), wk = 0.0035714 k( 169) = ( 0.5000000 0.2886751 0.3073410), wk = 0.0035714 k( 170) = ( 0.4924242 0.3017967 0.3073410), wk = 0.0035714 k( 171) = ( 0.4848485 0.3149183 0.3073410), wk = 0.0035714 k( 172) = ( 0.4772727 0.3280399 0.3073410), wk = 0.0035714 k( 173) = ( 0.4696970 0.3411615 0.3073410), wk = 0.0035714 k( 174) = ( 0.4621212 0.3542831 0.3073410), wk = 0.0035714 k( 175) = ( 0.4545455 0.3674047 0.3073410), wk = 0.0035714 k( 176) = ( 0.4469697 0.3805263 0.3073410), wk = 0.0035714 k( 177) = ( 0.4393939 0.3936479 0.3073410), wk = 0.0035714 k( 178) = ( 0.4318182 0.4067695 0.3073410), wk = 0.0035714 k( 179) = ( 0.4242424 0.4198911 0.3073410), wk = 0.0035714 k( 180) = ( 0.4166667 0.4330127 0.3073410), wk = 0.0035714 k( 181) = ( 0.4090909 0.4461343 0.3073410), wk = 0.0035714 k( 182) = ( 0.4015151 0.4592559 0.3073410), wk = 0.0035714 k( 183) = ( 0.3939394 0.4723775 0.3073410), wk = 0.0035714 k( 184) = ( 0.3863636 0.4854991 0.3073410), wk = 0.0035714 k( 185) = ( 0.3787879 0.4986207 0.3073410), wk = 0.0035714 k( 186) = ( 0.3712121 0.5117423 0.3073410), wk = 0.0035714 k( 187) = ( 0.3636364 0.5248639 0.3073410), wk = 0.0035714 k( 188) = ( 0.3560606 0.5379855 0.3073410), wk = 0.0035714 k( 189) = ( 0.3484849 0.5511071 0.3073410), wk = 0.0035714 k( 190) = ( 0.3409091 0.5642287 0.3073410), wk = 0.0035714 k( 191) = ( 0.3333333 0.5773503 0.3073410), wk = 0.0035714 k( 192) = ( 0.3333333 0.5773503 0.3073410), wk = 0.0035714 k( 193) = ( 0.3257576 0.5642287 0.3073410), wk = 0.0035714 k( 194) = ( 0.3181818 0.5511071 0.3073410), wk = 0.0035714 k( 195) = ( 0.3106061 0.5379855 0.3073410), wk = 0.0035714 k( 196) = ( 0.3030303 0.5248639 0.3073410), wk = 0.0035714 k( 197) = ( 0.2954545 0.5117423 0.3073410), wk = 0.0035714 k( 198) = ( 0.2878788 0.4986207 0.3073410), wk = 0.0035714 k( 199) = ( 0.2803030 0.4854991 0.3073410), wk = 0.0035714 k( 200) = ( 0.2727273 0.4723775 0.3073410), wk = 0.0035714 k( 201) = ( 0.2651515 0.4592559 0.3073410), wk = 0.0035714 k( 202) = ( 0.2575758 0.4461343 0.3073410), wk = 0.0035714 k( 203) = ( 0.2500000 0.4330127 0.3073410), wk = 0.0035714 k( 204) = ( 0.2424242 0.4198911 0.3073410), wk = 0.0035714 k( 205) = ( 0.2348485 0.4067695 0.3073410), wk = 0.0035714 k( 206) = ( 0.2272727 0.3936479 0.3073410), wk = 0.0035714 k( 207) = ( 0.2196970 0.3805263 0.3073410), wk = 0.0035714 k( 208) = ( 0.2121212 0.3674047 0.3073410), wk = 0.0035714 k( 209) = ( 0.2045454 0.3542831 0.3073410), wk = 0.0035714 k( 210) = ( 0.1969697 0.3411615 0.3073410), wk = 0.0035714 k( 211) = ( 0.1893939 0.3280399 0.3073410), wk = 0.0035714 k( 212) = ( 0.1818182 0.3149183 0.3073410), wk = 0.0035714 k( 213) = ( 0.1742424 0.3017967 0.3073410), wk = 0.0035714 k( 214) = ( 0.1666667 0.2886751 0.3073410), wk = 0.0035714 k( 215) = ( 0.1590909 0.2755535 0.3073410), wk = 0.0035714 k( 216) = ( 0.1515151 0.2624319 0.3073410), wk = 0.0035714 k( 217) = ( 0.1439394 0.2493103 0.3073410), wk = 0.0035714 k( 218) = ( 0.1363636 0.2361888 0.3073410), wk = 0.0035714 k( 219) = ( 0.1287879 0.2230672 0.3073410), wk = 0.0035714 k( 220) = ( 0.1212121 0.2099456 0.3073410), wk = 0.0035714 k( 221) = ( 0.1136364 0.1968239 0.3073410), wk = 0.0035714 k( 222) = ( 0.1060606 0.1837024 0.3073410), wk = 0.0035714 k( 223) = ( 0.0984848 0.1705808 0.3073410), wk = 0.0035714 k( 224) = ( 0.0909091 0.1574592 0.3073410), wk = 0.0035714 k( 225) = ( 0.0833333 0.1443376 0.3073410), wk = 0.0035714 k( 226) = ( 0.0757576 0.1312160 0.3073410), wk = 0.0035714 k( 227) = ( 0.0681818 0.1180944 0.3073410), wk = 0.0035714 k( 228) = ( 0.0606061 0.1049728 0.3073410), wk = 0.0035714 k( 229) = ( 0.0530303 0.0918512 0.3073410), wk = 0.0035714 k( 230) = ( 0.0454546 0.0787296 0.3073410), wk = 0.0035714 k( 231) = ( 0.0378788 0.0656080 0.3073410), wk = 0.0035714 k( 232) = ( 0.0303030 0.0524864 0.3073410), wk = 0.0035714 k( 233) = ( 0.0227273 0.0393648 0.3073410), wk = 0.0035714 k( 234) = ( 0.0151515 0.0262432 0.3073410), wk = 0.0035714 k( 235) = ( 0.0075758 0.0131216 0.3073410), wk = 0.0035714 k( 236) = ( 0.0000000 0.0000000 0.3073410), wk = 0.0035714 k( 237) = ( 0.5000000 0.2886751 0.3073410), wk = 0.0035714 k( 238) = ( 0.5000000 0.2886751 0.2927057), wk = 0.0035714 k( 239) = ( 0.5000000 0.2886751 0.2780704), wk = 0.0035714 k( 240) = ( 0.5000000 0.2886751 0.2634351), wk = 0.0035714 k( 241) = ( 0.5000000 0.2886751 0.2487998), wk = 0.0035714 k( 242) = ( 0.5000000 0.2886751 0.2341646), wk = 0.0035714 k( 243) = ( 0.5000000 0.2886751 0.2195293), wk = 0.0035714 k( 244) = ( 0.5000000 0.2886751 0.2048940), wk = 0.0035714 k( 245) = ( 0.5000000 0.2886751 0.1902587), wk = 0.0035714 k( 246) = ( 0.5000000 0.2886751 0.1756234), wk = 0.0035714 k( 247) = ( 0.5000000 0.2886751 0.1609881), wk = 0.0035714 k( 248) = ( 0.5000000 0.2886751 0.1463528), wk = 0.0035714 k( 249) = ( 0.5000000 0.2886751 0.1317176), wk = 0.0035714 k( 250) = ( 0.5000000 0.2886751 0.1170823), wk = 0.0035714 k( 251) = ( 0.5000000 0.2886751 0.1024470), wk = 0.0035714 k( 252) = ( 0.5000000 0.2886751 0.0878117), wk = 0.0035714 k( 253) = ( 0.5000000 0.2886751 0.0731764), wk = 0.0035714 k( 254) = ( 0.5000000 0.2886751 0.0585411), wk = 0.0035714 k( 255) = ( 0.5000000 0.2886751 0.0439059), wk = 0.0035714 k( 256) = ( 0.5000000 0.2886751 0.0292706), wk = 0.0035714 k( 257) = ( 0.5000000 0.2886751 0.0146353), wk = 0.0035714 k( 258) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035714 k( 259) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035714 k( 260) = ( 0.3333333 0.5773503 0.0146353), wk = 0.0035714 k( 261) = ( 0.3333333 0.5773503 0.0292706), wk = 0.0035714 k( 262) = ( 0.3333333 0.5773503 0.0439059), wk = 0.0035714 k( 263) = ( 0.3333333 0.5773503 0.0585411), wk = 0.0035714 k( 264) = ( 0.3333333 0.5773503 0.0731764), wk = 0.0035714 k( 265) = ( 0.3333333 0.5773503 0.0878117), wk = 0.0035714 k( 266) = ( 0.3333333 0.5773503 0.1024470), wk = 0.0035714 k( 267) = ( 0.3333333 0.5773503 0.1170823), wk = 0.0035714 k( 268) = ( 0.3333333 0.5773503 0.1317176), wk = 0.0035714 k( 269) = ( 0.3333333 0.5773503 0.1463528), wk = 0.0035714 k( 270) = ( 0.3333333 0.5773503 0.1609881), wk = 0.0035714 k( 271) = ( 0.3333333 0.5773503 0.1756234), wk = 0.0035714 k( 272) = ( 0.3333333 0.5773503 0.1902587), wk = 0.0035714 k( 273) = ( 0.3333333 0.5773503 0.2048940), wk = 0.0035714 k( 274) = ( 0.3333333 0.5773503 0.2195293), wk = 0.0035714 k( 275) = ( 0.3333333 0.5773503 0.2341646), wk = 0.0035714 k( 276) = ( 0.3333333 0.5773503 0.2487998), wk = 0.0035714 k( 277) = ( 0.3333333 0.5773503 0.2634351), wk = 0.0035714 k( 278) = ( 0.3333333 0.5773503 0.2780704), wk = 0.0035714 k( 279) = ( 0.3333333 0.5773503 0.2927057), wk = 0.0035714 k( 280) = ( 0.3333333 0.5773503 0.3073410), wk = 0.0035714 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0131579 0.0000000 0.0000000), wk = 0.0035714 k( 3) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0035714 k( 4) = ( 0.0394737 0.0000000 0.0000000), wk = 0.0035714 k( 5) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0035714 k( 6) = ( 0.0657895 0.0000000 0.0000000), wk = 0.0035714 k( 7) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0035714 k( 8) = ( 0.0921053 0.0000000 -0.0000000), wk = 0.0035714 k( 9) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0035714 k( 10) = ( 0.1184210 -0.0000000 0.0000000), wk = 0.0035714 k( 11) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0035714 k( 12) = ( 0.1447368 0.0000000 0.0000000), wk = 0.0035714 k( 13) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0035714 k( 14) = ( 0.1710526 0.0000000 0.0000000), wk = 0.0035714 k( 15) = ( 0.1842105 0.0000000 0.0000000), wk = 0.0035714 k( 16) = ( 0.1973684 0.0000000 0.0000000), wk = 0.0035714 k( 17) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0035714 k( 18) = ( 0.2236842 0.0000000 0.0000000), wk = 0.0035714 k( 19) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0035714 k( 20) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0035714 k( 21) = ( 0.2631579 0.0000000 -0.0000000), wk = 0.0035714 k( 22) = ( 0.2763158 0.0000000 0.0000000), wk = 0.0035714 k( 23) = ( 0.2894737 0.0000000 0.0000000), wk = 0.0035714 k( 24) = ( 0.3026316 0.0000000 0.0000000), wk = 0.0035714 k( 25) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0035714 k( 26) = ( 0.3289474 0.0000000 0.0000000), wk = 0.0035714 k( 27) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0035714 k( 28) = ( 0.3552632 0.0000000 0.0000000), wk = 0.0035714 k( 29) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0035714 k( 30) = ( 0.3815789 0.0000000 0.0000000), wk = 0.0035714 k( 31) = ( 0.3947368 0.0000000 0.0000000), wk = 0.0035714 k( 32) = ( 0.4078947 0.0000000 0.0000000), wk = 0.0035714 k( 33) = ( 0.4210526 -0.0000000 0.0000000), wk = 0.0035714 k( 34) = ( 0.4342105 0.0000000 -0.0000000), wk = 0.0035714 k( 35) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0035714 k( 36) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0035714 k( 37) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0035714 k( 38) = ( 0.4868421 -0.0000000 0.0000000), wk = 0.0035714 k( 39) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 40) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 41) = ( 0.4924242 0.0151515 0.0000000), wk = 0.0035714 k( 42) = ( 0.4848485 0.0303030 0.0000000), wk = 0.0035714 k( 43) = ( 0.4772727 0.0454546 0.0000000), wk = 0.0035714 k( 44) = ( 0.4696970 0.0606061 0.0000000), wk = 0.0035714 k( 45) = ( 0.4621212 0.0757576 0.0000000), wk = 0.0035714 k( 46) = ( 0.4545455 0.0909091 0.0000000), wk = 0.0035714 k( 47) = ( 0.4469697 0.1060606 0.0000000), wk = 0.0035714 k( 48) = ( 0.4393939 0.1212121 -0.0000000), wk = 0.0035714 k( 49) = ( 0.4318182 0.1363636 -0.0000000), wk = 0.0035714 k( 50) = ( 0.4242424 0.1515151 0.0000000), wk = 0.0035714 k( 51) = ( 0.4166667 0.1666667 -0.0000000), wk = 0.0035714 k( 52) = ( 0.4090909 0.1818182 0.0000000), wk = 0.0035714 k( 53) = ( 0.4015151 0.1969697 0.0000000), wk = 0.0035714 k( 54) = ( 0.3939394 0.2121212 0.0000000), wk = 0.0035714 k( 55) = ( 0.3863636 0.2272727 0.0000000), wk = 0.0035714 k( 56) = ( 0.3787879 0.2424242 0.0000000), wk = 0.0035714 k( 57) = ( 0.3712121 0.2575758 0.0000000), wk = 0.0035714 k( 58) = ( 0.3636364 0.2727273 0.0000000), wk = 0.0035714 k( 59) = ( 0.3560606 0.2878788 0.0000000), wk = 0.0035714 k( 60) = ( 0.3484849 0.3030303 0.0000000), wk = 0.0035714 k( 61) = ( 0.3409091 0.3181818 -0.0000000), wk = 0.0035714 k( 62) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 63) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 64) = ( 0.3257576 0.3257576 0.0000000), wk = 0.0035714 k( 65) = ( 0.3181818 0.3181818 0.0000000), wk = 0.0035714 k( 66) = ( 0.3106061 0.3106061 0.0000000), wk = 0.0035714 k( 67) = ( 0.3030303 0.3030303 0.0000000), wk = 0.0035714 k( 68) = ( 0.2954545 0.2954545 0.0000000), wk = 0.0035714 k( 69) = ( 0.2878788 0.2878788 0.0000000), wk = 0.0035714 k( 70) = ( 0.2803030 0.2803030 -0.0000000), wk = 0.0035714 k( 71) = ( 0.2727273 0.2727273 0.0000000), wk = 0.0035714 k( 72) = ( 0.2651515 0.2651515 0.0000000), wk = 0.0035714 k( 73) = ( 0.2575758 0.2575758 -0.0000000), wk = 0.0035714 k( 74) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0035714 k( 75) = ( 0.2424242 0.2424242 0.0000000), wk = 0.0035714 k( 76) = ( 0.2348485 0.2348485 0.0000000), wk = 0.0035714 k( 77) = ( 0.2272727 0.2272727 0.0000000), wk = 0.0035714 k( 78) = ( 0.2196970 0.2196970 0.0000000), wk = 0.0035714 k( 79) = ( 0.2121212 0.2121212 0.0000000), wk = 0.0035714 k( 80) = ( 0.2045454 0.2045454 0.0000000), wk = 0.0035714 k( 81) = ( 0.1969697 0.1969697 0.0000000), wk = 0.0035714 k( 82) = ( 0.1893939 0.1893939 0.0000000), wk = 0.0035714 k( 83) = ( 0.1818182 0.1818182 0.0000000), wk = 0.0035714 k( 84) = ( 0.1742424 0.1742424 -0.0000000), wk = 0.0035714 k( 85) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0035714 k( 86) = ( 0.1590909 0.1590909 0.0000000), wk = 0.0035714 k( 87) = ( 0.1515151 0.1515151 0.0000000), wk = 0.0035714 k( 88) = ( 0.1439394 0.1439394 -0.0000000), wk = 0.0035714 k( 89) = ( 0.1363636 0.1363636 0.0000000), wk = 0.0035714 k( 90) = ( 0.1287879 0.1287879 -0.0000000), wk = 0.0035714 k( 91) = ( 0.1212121 0.1212121 0.0000000), wk = 0.0035714 k( 92) = ( 0.1136364 0.1136364 -0.0000000), wk = 0.0035714 k( 93) = ( 0.1060606 0.1060606 0.0000000), wk = 0.0035714 k( 94) = ( 0.0984848 0.0984849 0.0000000), wk = 0.0035714 k( 95) = ( 0.0909091 0.0909091 0.0000000), wk = 0.0035714 k( 96) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0035714 k( 97) = ( 0.0757576 0.0757576 0.0000000), wk = 0.0035714 k( 98) = ( 0.0681818 0.0681818 0.0000000), wk = 0.0035714 k( 99) = ( 0.0606061 0.0606061 0.0000000), wk = 0.0035714 k( 100) = ( 0.0530303 0.0530303 0.0000000), wk = 0.0035714 k( 101) = ( 0.0454546 0.0454545 0.0000000), wk = 0.0035714 k( 102) = ( 0.0378788 0.0378788 0.0000000), wk = 0.0035714 k( 103) = ( 0.0303030 0.0303030 0.0000000), wk = 0.0035714 k( 104) = ( 0.0227273 0.0227273 0.0000000), wk = 0.0035714 k( 105) = ( 0.0151515 0.0151515 0.0000000), wk = 0.0035714 k( 106) = ( 0.0075758 0.0075758 0.0000000), wk = 0.0035714 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 109) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0035714 k( 110) = ( 0.0000000 0.0000000 0.0476190), wk = 0.0035714 k( 111) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0035714 k( 112) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0035714 k( 113) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0035714 k( 114) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0035714 k( 115) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0035714 k( 116) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0035714 k( 117) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0035714 k( 118) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0035714 k( 119) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0035714 k( 120) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0035714 k( 121) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0035714 k( 122) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0035714 k( 123) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0035714 k( 124) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0035714 k( 125) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0035714 k( 126) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0035714 k( 127) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0035714 k( 128) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0035714 k( 129) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 130) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 131) = ( 0.0131579 0.0000000 0.5000000), wk = 0.0035714 k( 132) = ( 0.0263158 0.0000000 0.5000000), wk = 0.0035714 k( 133) = ( 0.0394737 0.0000000 0.5000000), wk = 0.0035714 k( 134) = ( 0.0526316 0.0000000 0.5000000), wk = 0.0035714 k( 135) = ( 0.0657895 0.0000000 0.5000000), wk = 0.0035714 k( 136) = ( 0.0789474 0.0000000 0.5000000), wk = 0.0035714 k( 137) = ( 0.0921053 0.0000000 0.5000000), wk = 0.0035714 k( 138) = ( 0.1052632 0.0000000 0.5000000), wk = 0.0035714 k( 139) = ( 0.1184210 -0.0000000 0.5000000), wk = 0.0035714 k( 140) = ( 0.1315790 0.0000000 0.5000000), wk = 0.0035714 k( 141) = ( 0.1447368 0.0000000 0.5000000), wk = 0.0035714 k( 142) = ( 0.1578947 0.0000000 0.5000000), wk = 0.0035714 k( 143) = ( 0.1710526 0.0000000 0.5000000), wk = 0.0035714 k( 144) = ( 0.1842105 0.0000000 0.5000000), wk = 0.0035714 k( 145) = ( 0.1973684 0.0000000 0.5000000), wk = 0.0035714 k( 146) = ( 0.2105263 0.0000000 0.5000000), wk = 0.0035714 k( 147) = ( 0.2236842 0.0000000 0.5000000), wk = 0.0035714 k( 148) = ( 0.2368421 0.0000000 0.5000000), wk = 0.0035714 k( 149) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0035714 k( 150) = ( 0.2631579 0.0000000 0.5000000), wk = 0.0035714 k( 151) = ( 0.2763158 0.0000000 0.5000000), wk = 0.0035714 k( 152) = ( 0.2894737 0.0000000 0.5000000), wk = 0.0035714 k( 153) = ( 0.3026316 0.0000000 0.5000000), wk = 0.0035714 k( 154) = ( 0.3157895 0.0000000 0.5000000), wk = 0.0035714 k( 155) = ( 0.3289474 0.0000000 0.5000000), wk = 0.0035714 k( 156) = ( 0.3421053 0.0000000 0.5000000), wk = 0.0035714 k( 157) = ( 0.3552632 0.0000000 0.5000000), wk = 0.0035714 k( 158) = ( 0.3684211 0.0000000 0.5000000), wk = 0.0035714 k( 159) = ( 0.3815789 0.0000000 0.5000000), wk = 0.0035714 k( 160) = ( 0.3947368 0.0000000 0.5000000), wk = 0.0035714 k( 161) = ( 0.4078947 0.0000000 0.5000000), wk = 0.0035714 k( 162) = ( 0.4210526 -0.0000000 0.5000000), wk = 0.0035714 k( 163) = ( 0.4342105 0.0000000 0.5000000), wk = 0.0035714 k( 164) = ( 0.4473684 0.0000000 0.5000000), wk = 0.0035714 k( 165) = ( 0.4605263 0.0000000 0.5000000), wk = 0.0035714 k( 166) = ( 0.4736842 0.0000000 0.5000000), wk = 0.0035714 k( 167) = ( 0.4868421 -0.0000000 0.5000000), wk = 0.0035714 k( 168) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 169) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 170) = ( 0.4924242 0.0151515 0.5000000), wk = 0.0035714 k( 171) = ( 0.4848485 0.0303030 0.5000000), wk = 0.0035714 k( 172) = ( 0.4772727 0.0454546 0.5000000), wk = 0.0035714 k( 173) = ( 0.4696970 0.0606061 0.5000000), wk = 0.0035714 k( 174) = ( 0.4621212 0.0757576 0.5000000), wk = 0.0035714 k( 175) = ( 0.4545455 0.0909091 0.5000000), wk = 0.0035714 k( 176) = ( 0.4469697 0.1060606 0.5000000), wk = 0.0035714 k( 177) = ( 0.4393939 0.1212121 0.5000000), wk = 0.0035714 k( 178) = ( 0.4318182 0.1363636 0.5000000), wk = 0.0035714 k( 179) = ( 0.4242424 0.1515151 0.5000000), wk = 0.0035714 k( 180) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0035714 k( 181) = ( 0.4090909 0.1818182 0.5000000), wk = 0.0035714 k( 182) = ( 0.4015151 0.1969697 0.5000000), wk = 0.0035714 k( 183) = ( 0.3939394 0.2121212 0.5000000), wk = 0.0035714 k( 184) = ( 0.3863636 0.2272727 0.5000000), wk = 0.0035714 k( 185) = ( 0.3787879 0.2424242 0.5000000), wk = 0.0035714 k( 186) = ( 0.3712121 0.2575758 0.5000000), wk = 0.0035714 k( 187) = ( 0.3636364 0.2727273 0.5000000), wk = 0.0035714 k( 188) = ( 0.3560606 0.2878788 0.5000000), wk = 0.0035714 k( 189) = ( 0.3484849 0.3030303 0.5000000), wk = 0.0035714 k( 190) = ( 0.3409091 0.3181818 0.5000000), wk = 0.0035714 k( 191) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 k( 192) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 k( 193) = ( 0.3257576 0.3257576 0.5000000), wk = 0.0035714 k( 194) = ( 0.3181818 0.3181818 0.5000000), wk = 0.0035714 k( 195) = ( 0.3106061 0.3106061 0.5000000), wk = 0.0035714 k( 196) = ( 0.3030303 0.3030303 0.5000000), wk = 0.0035714 k( 197) = ( 0.2954545 0.2954545 0.5000000), wk = 0.0035714 k( 198) = ( 0.2878788 0.2878788 0.5000000), wk = 0.0035714 k( 199) = ( 0.2803030 0.2803030 0.5000000), wk = 0.0035714 k( 200) = ( 0.2727273 0.2727273 0.5000000), wk = 0.0035714 k( 201) = ( 0.2651515 0.2651515 0.5000000), wk = 0.0035714 k( 202) = ( 0.2575758 0.2575758 0.5000000), wk = 0.0035714 k( 203) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0035714 k( 204) = ( 0.2424242 0.2424242 0.5000000), wk = 0.0035714 k( 205) = ( 0.2348485 0.2348485 0.5000000), wk = 0.0035714 k( 206) = ( 0.2272727 0.2272727 0.5000000), wk = 0.0035714 k( 207) = ( 0.2196970 0.2196970 0.5000000), wk = 0.0035714 k( 208) = ( 0.2121212 0.2121212 0.5000000), wk = 0.0035714 k( 209) = ( 0.2045454 0.2045454 0.5000000), wk = 0.0035714 k( 210) = ( 0.1969697 0.1969697 0.5000000), wk = 0.0035714 k( 211) = ( 0.1893939 0.1893939 0.5000000), wk = 0.0035714 k( 212) = ( 0.1818182 0.1818182 0.5000000), wk = 0.0035714 k( 213) = ( 0.1742424 0.1742424 0.5000000), wk = 0.0035714 k( 214) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0035714 k( 215) = ( 0.1590909 0.1590909 0.5000000), wk = 0.0035714 k( 216) = ( 0.1515151 0.1515151 0.5000000), wk = 0.0035714 k( 217) = ( 0.1439394 0.1439394 0.5000000), wk = 0.0035714 k( 218) = ( 0.1363636 0.1363636 0.5000000), wk = 0.0035714 k( 219) = ( 0.1287879 0.1287879 0.5000000), wk = 0.0035714 k( 220) = ( 0.1212121 0.1212121 0.5000000), wk = 0.0035714 k( 221) = ( 0.1136364 0.1136364 0.5000000), wk = 0.0035714 k( 222) = ( 0.1060606 0.1060606 0.5000000), wk = 0.0035714 k( 223) = ( 0.0984848 0.0984849 0.5000000), wk = 0.0035714 k( 224) = ( 0.0909091 0.0909091 0.5000000), wk = 0.0035714 k( 225) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0035714 k( 226) = ( 0.0757576 0.0757576 0.5000000), wk = 0.0035714 k( 227) = ( 0.0681818 0.0681818 0.5000000), wk = 0.0035714 k( 228) = ( 0.0606061 0.0606061 0.5000000), wk = 0.0035714 k( 229) = ( 0.0530303 0.0530303 0.5000000), wk = 0.0035714 k( 230) = ( 0.0454546 0.0454545 0.5000000), wk = 0.0035714 k( 231) = ( 0.0378788 0.0378788 0.5000000), wk = 0.0035714 k( 232) = ( 0.0303030 0.0303030 0.5000000), wk = 0.0035714 k( 233) = ( 0.0227273 0.0227273 0.5000000), wk = 0.0035714 k( 234) = ( 0.0151515 0.0151515 0.5000000), wk = 0.0035714 k( 235) = ( 0.0075758 0.0075758 0.5000000), wk = 0.0035714 k( 236) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035714 k( 237) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 238) = ( 0.5000000 0.0000000 0.4761905), wk = 0.0035714 k( 239) = ( 0.5000000 0.0000000 0.4523810), wk = 0.0035714 k( 240) = ( 0.5000000 0.0000000 0.4285714), wk = 0.0035714 k( 241) = ( 0.5000000 0.0000000 0.4047619), wk = 0.0035714 k( 242) = ( 0.5000000 0.0000000 0.3809524), wk = 0.0035714 k( 243) = ( 0.5000000 0.0000000 0.3571429), wk = 0.0035714 k( 244) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0035714 k( 245) = ( 0.5000000 0.0000000 0.3095238), wk = 0.0035714 k( 246) = ( 0.5000000 0.0000000 0.2857143), wk = 0.0035714 k( 247) = ( 0.5000000 0.0000000 0.2619048), wk = 0.0035714 k( 248) = ( 0.5000000 0.0000000 0.2380952), wk = 0.0035714 k( 249) = ( 0.5000000 0.0000000 0.2142857), wk = 0.0035714 k( 250) = ( 0.5000000 0.0000000 0.1904762), wk = 0.0035714 k( 251) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0035714 k( 252) = ( 0.5000000 0.0000000 0.1428571), wk = 0.0035714 k( 253) = ( 0.5000000 0.0000000 0.1190476), wk = 0.0035714 k( 254) = ( 0.5000000 0.0000000 0.0952381), wk = 0.0035714 k( 255) = ( 0.5000000 0.0000000 0.0714286), wk = 0.0035714 k( 256) = ( 0.5000000 0.0000000 0.0476190), wk = 0.0035714 k( 257) = ( 0.5000000 0.0000000 0.0238095), wk = 0.0035714 k( 258) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035714 k( 259) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0035714 k( 260) = ( 0.3333333 0.3333333 0.0238095), wk = 0.0035714 k( 261) = ( 0.3333333 0.3333333 0.0476190), wk = 0.0035714 k( 262) = ( 0.3333333 0.3333333 0.0714286), wk = 0.0035714 k( 263) = ( 0.3333333 0.3333333 0.0952381), wk = 0.0035714 k( 264) = ( 0.3333333 0.3333333 0.1190476), wk = 0.0035714 k( 265) = ( 0.3333333 0.3333333 0.1428571), wk = 0.0035714 k( 266) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0035714 k( 267) = ( 0.3333333 0.3333333 0.1904762), wk = 0.0035714 k( 268) = ( 0.3333333 0.3333333 0.2142857), wk = 0.0035714 k( 269) = ( 0.3333333 0.3333333 0.2380952), wk = 0.0035714 k( 270) = ( 0.3333333 0.3333333 0.2619048), wk = 0.0035714 k( 271) = ( 0.3333333 0.3333333 0.2857143), wk = 0.0035714 k( 272) = ( 0.3333333 0.3333333 0.3095238), wk = 0.0035714 k( 273) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035714 k( 274) = ( 0.3333333 0.3333333 0.3571429), wk = 0.0035714 k( 275) = ( 0.3333333 0.3333333 0.3809524), wk = 0.0035714 k( 276) = ( 0.3333333 0.3333333 0.4047619), wk = 0.0035714 k( 277) = ( 0.3333333 0.3333333 0.4285714), wk = 0.0035714 k( 278) = ( 0.3333333 0.3333333 0.4523810), wk = 0.0035714 k( 279) = ( 0.3333333 0.3333333 0.4761905), wk = 0.0035714 k( 280) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035714 Dense grid: 81131 G-vectors FFT dimensions: ( 48, 48, 80) Smooth grid: 44661 G-vectors FFT dimensions: ( 40, 40, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.22 Mb ( 236, 62) NL pseudopotentials 0.30 Mb ( 118, 168) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1688) G-vector shells 0.01 Mb ( 812) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.89 Mb ( 236, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.32 Mb ( 168, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CaAgBi.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.5 secs Computing kpt #: 2 total cpu time spent up to now is 53.5 secs Computing kpt #: 3 total cpu time spent up to now is 58.9 secs Computing kpt #: 4 total cpu time spent up to now is 64.1 secs Computing kpt #: 5 total cpu time spent up to now is 69.8 secs Computing kpt #: 6 total cpu time spent up to now is 75.7 secs Computing kpt #: 7 total cpu time spent up to now is 81.8 secs Computing kpt #: 8 total cpu time spent up to now is 87.3 secs Computing kpt #: 9 total cpu time spent up to now is 94.1 secs Computing kpt #: 10 total cpu time spent up to now is 100.7 secs Computing kpt #: 11 total cpu time spent up to now is 107.1 secs Computing kpt #: 12 total cpu time spent up to now is 113.5 secs Computing kpt #: 13 total cpu time spent up to now is 119.2 secs Computing kpt #: 14 total cpu time spent up to now is 124.4 secs Computing kpt #: 15 total cpu time spent up to now is 130.2 secs Computing kpt #: 16 total cpu time spent up to now is 135.4 secs Computing kpt #: 17 total cpu time spent up to now is 140.6 secs Computing kpt #: 18 total cpu time spent up to now is 145.8 secs Computing kpt #: 19 total cpu time spent up to now is 151.2 secs Computing kpt #: 20 total cpu time spent up to now is 156.7 secs Computing kpt #: 21 total cpu time spent up to now is 162.0 secs Computing kpt #: 22 total cpu time spent up to now is 167.0 secs Computing kpt #: 23 total cpu time spent up to now is 172.1 secs Computing kpt #: 24 total cpu time spent up to now is 177.2 secs Computing kpt #: 25 total cpu time spent up to now is 182.1 secs Computing kpt #: 26 total cpu time spent up to now is 187.3 secs Computing kpt #: 27 total cpu time spent up to now is 192.7 secs Computing kpt #: 28 total cpu time spent up to now is 198.2 secs Computing kpt #: 29 total cpu time spent up to now is 204.1 secs Computing kpt #: 30 total cpu time spent up to now is 210.9 secs Computing kpt #: 31 total cpu time spent up to now is 216.6 secs Computing kpt #: 32 total cpu time spent up to now is 222.6 secs Computing kpt #: 33 total cpu time spent up to now is 228.8 secs Computing kpt #: 34 total cpu time spent up to now is 234.8 secs Computing kpt #: 35 total cpu time spent up to now is 242.1 secs Computing kpt #: 36 total cpu time spent up to now is 248.9 secs Computing kpt #: 37 total cpu time spent up to now is 257.2 secs Computing kpt #: 38 total cpu time spent up to now is 263.9 secs Computing kpt #: 39 total cpu time spent up to now is 270.4 secs Computing kpt #: 40 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 277.1 secs Computing kpt #: 41 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 284.1 secs Computing kpt #: 42 total cpu time spent up to now is 290.6 secs Computing kpt #: 43 total cpu time spent up to now is 297.0 secs Computing kpt #: 44 total cpu time spent up to now is 303.6 secs Computing kpt #: 45 total cpu time spent up to now is 310.5 secs Computing kpt #: 46 total cpu time spent up to now is 317.7 secs Computing kpt #: 47 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 325.4 secs Computing kpt #: 48 total cpu time spent up to now is 333.3 secs Computing kpt #: 49 total cpu time spent up to now is 339.1 secs Computing kpt #: 50 total cpu time spent up to now is 344.4 secs Computing kpt #: 51 total cpu time spent up to now is 349.6 secs Computing kpt #: 52 total cpu time spent up to now is 354.9 secs Computing kpt #: 53 total cpu time spent up to now is 360.6 secs Computing kpt #: 54 total cpu time spent up to now is 366.9 secs Computing kpt #: 55 total cpu time spent up to now is 372.7 secs Computing kpt #: 56 total cpu time spent up to now is 378.4 secs Computing kpt #: 57 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 385.3 secs Computing kpt #: 58 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 391.9 secs Computing kpt #: 59 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 399.4 secs Computing kpt #: 60 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 406.6 secs Computing kpt #: 61 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 413.3 secs Computing kpt #: 62 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 419.8 secs Computing kpt #: 63 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 426.2 secs Computing kpt #: 64 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 432.7 secs Computing kpt #: 65 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 439.4 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 446.1 secs Computing kpt #: 67 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 453.1 secs Computing kpt #: 68 total cpu time spent up to now is 458.6 secs Computing kpt #: 69 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 466.0 secs Computing kpt #: 70 total cpu time spent up to now is 472.0 secs Computing kpt #: 71 total cpu time spent up to now is 477.6 secs Computing kpt #: 72 total cpu time spent up to now is 482.9 secs Computing kpt #: 73 total cpu time spent up to now is 488.7 secs Computing kpt #: 74 total cpu time spent up to now is 494.0 secs Computing kpt #: 75 total cpu time spent up to now is 499.2 secs Computing kpt #: 76 total cpu time spent up to now is 504.8 secs Computing kpt #: 77 total cpu time spent up to now is 510.2 secs Computing kpt #: 78 total cpu time spent up to now is 516.4 secs Computing kpt #: 79 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 523.0 secs Computing kpt #: 80 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 529.7 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 536.8 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 544.0 secs Computing kpt #: 83 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 551.1 secs Computing kpt #: 84 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 558.3 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 565.5 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 573.2 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 580.4 secs Computing kpt #: 88 total cpu time spent up to now is 586.7 secs Computing kpt #: 89 total cpu time spent up to now is 592.2 secs Computing kpt #: 90 total cpu time spent up to now is 597.7 secs Computing kpt #: 91 total cpu time spent up to now is 602.9 secs Computing kpt #: 92 total cpu time spent up to now is 608.1 secs Computing kpt #: 93 total cpu time spent up to now is 613.4 secs Computing kpt #: 94 total cpu time spent up to now is 619.2 secs Computing kpt #: 95 total cpu time spent up to now is 626.3 secs Computing kpt #: 96 total cpu time spent up to now is 634.7 secs Computing kpt #: 97 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 642.0 secs Computing kpt #: 98 total cpu time spent up to now is 648.9 secs Computing kpt #: 99 total cpu time spent up to now is 654.5 secs Computing kpt #: 100 total cpu time spent up to now is 660.8 secs Computing kpt #: 101 total cpu time spent up to now is 666.1 secs Computing kpt #: 102 total cpu time spent up to now is 671.7 secs Computing kpt #: 103 total cpu time spent up to now is 677.1 secs Computing kpt #: 104 total cpu time spent up to now is 682.4 secs Computing kpt #: 105 total cpu time spent up to now is 687.5 secs Computing kpt #: 106 total cpu time spent up to now is 692.7 secs Computing kpt #: 107 total cpu time spent up to now is 697.5 secs Computing kpt #: 108 total cpu time spent up to now is 702.6 secs Computing kpt #: 109 total cpu time spent up to now is 707.3 secs Computing kpt #: 110 total cpu time spent up to now is 712.1 secs Computing kpt #: 111 total cpu time spent up to now is 716.9 secs Computing kpt #: 112 total cpu time spent up to now is 721.8 secs Computing kpt #: 113 total cpu time spent up to now is 726.7 secs Computing kpt #: 114 total cpu time spent up to now is 731.4 secs Computing kpt #: 115 total cpu time spent up to now is 736.2 secs Computing kpt #: 116 total cpu time spent up to now is 741.2 secs Computing kpt #: 117 total cpu time spent up to now is 746.1 secs Computing kpt #: 118 total cpu time spent up to now is 751.2 secs Computing kpt #: 119 total cpu time spent up to now is 756.2 secs Computing kpt #: 120 total cpu time spent up to now is 761.3 secs Computing kpt #: 121 total cpu time spent up to now is 766.2 secs Computing kpt #: 122 total cpu time spent up to now is 771.2 secs Computing kpt #: 123 total cpu time spent up to now is 776.4 secs Computing kpt #: 124 total cpu time spent up to now is 781.4 secs Computing kpt #: 125 total cpu time spent up to now is 786.6 secs Computing kpt #: 126 total cpu time spent up to now is 791.7 secs Computing kpt #: 127 total cpu time spent up to now is 797.0 secs Computing kpt #: 128 total cpu time spent up to now is 802.4 secs Computing kpt #: 129 total cpu time spent up to now is 807.8 secs Computing kpt #: 130 total cpu time spent up to now is 813.0 secs Computing kpt #: 131 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 819.9 secs Computing kpt #: 132 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 827.2 secs Computing kpt #: 133 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 834.0 secs Computing kpt #: 134 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 840.8 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 847.8 secs Computing kpt #: 136 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 854.7 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 861.5 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 868.5 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 875.4 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 882.2 secs Computing kpt #: 141 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 889.0 secs Computing kpt #: 142 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 895.8 secs Computing kpt #: 143 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 902.5 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 909.2 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 915.9 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 922.5 secs Computing kpt #: 147 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 929.5 secs Computing kpt #: 148 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 938.1 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 944.9 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 951.5 secs Computing kpt #: 151 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 958.0 secs Computing kpt #: 152 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 964.5 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 971.1 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 977.7 secs Computing kpt #: 155 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 984.4 secs Computing kpt #: 156 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 990.9 secs Computing kpt #: 157 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 997.4 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1004.0 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1010.5 secs Computing kpt #: 160 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1017.0 secs Computing kpt #: 161 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1023.5 secs Computing kpt #: 162 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1030.3 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1036.8 secs Computing kpt #: 164 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1043.4 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1049.9 secs Computing kpt #: 166 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1056.4 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1062.9 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1069.3 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1075.7 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1082.3 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1089.1 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1095.6 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1102.0 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1108.5 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1115.1 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1121.6 secs Computing kpt #: 177 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1128.2 secs Computing kpt #: 178 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1134.9 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1141.5 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1148.4 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1155.6 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1162.5 secs Computing kpt #: 183 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1169.2 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1176.6 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1183.7 secs Computing kpt #: 186 total cpu time spent up to now is 1190.1 secs Computing kpt #: 187 total cpu time spent up to now is 1195.3 secs Computing kpt #: 188 total cpu time spent up to now is 1201.3 secs Computing kpt #: 189 total cpu time spent up to now is 1206.3 secs Computing kpt #: 190 total cpu time spent up to now is 1211.4 secs Computing kpt #: 191 total cpu time spent up to now is 1216.9 secs Computing kpt #: 192 total cpu time spent up to now is 1221.8 secs Computing kpt #: 193 total cpu time spent up to now is 1227.0 secs Computing kpt #: 194 total cpu time spent up to now is 1234.4 secs Computing kpt #: 195 total cpu time spent up to now is 1239.9 secs Computing kpt #: 196 total cpu time spent up to now is 1245.6 secs Computing kpt #: 197 total cpu time spent up to now is 1252.2 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1259.1 secs Computing kpt #: 199 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1266.0 secs Computing kpt #: 200 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1272.9 secs Computing kpt #: 201 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1279.9 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1286.7 secs Computing kpt #: 203 total cpu time spent up to now is 1293.6 secs Computing kpt #: 204 total cpu time spent up to now is 1300.2 secs Computing kpt #: 205 total cpu time spent up to now is 1305.7 secs Computing kpt #: 206 total cpu time spent up to now is 1311.3 secs Computing kpt #: 207 total cpu time spent up to now is 1316.5 secs Computing kpt #: 208 total cpu time spent up to now is 1321.9 secs Computing kpt #: 209 total cpu time spent up to now is 1327.1 secs Computing kpt #: 210 total cpu time spent up to now is 1332.4 secs Computing kpt #: 211 total cpu time spent up to now is 1337.3 secs Computing kpt #: 212 total cpu time spent up to now is 1342.8 secs Computing kpt #: 213 total cpu time spent up to now is 1348.1 secs Computing kpt #: 214 total cpu time spent up to now is 1353.4 secs Computing kpt #: 215 total cpu time spent up to now is 1359.0 secs Computing kpt #: 216 total cpu time spent up to now is 1365.5 secs Computing kpt #: 217 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1372.3 secs Computing kpt #: 218 total cpu time spent up to now is 1378.7 secs Computing kpt #: 219 total cpu time spent up to now is 1385.6 secs Computing kpt #: 220 total cpu time spent up to now is 1392.2 secs Computing kpt #: 221 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1398.9 secs Computing kpt #: 222 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1405.4 secs Computing kpt #: 223 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1412.0 secs Computing kpt #: 224 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1418.8 secs Computing kpt #: 225 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1425.4 secs Computing kpt #: 226 total cpu time spent up to now is 1432.1 secs Computing kpt #: 227 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1438.7 secs Computing kpt #: 228 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1445.5 secs Computing kpt #: 229 total cpu time spent up to now is 1451.3 secs Computing kpt #: 230 total cpu time spent up to now is 1457.1 secs Computing kpt #: 231 total cpu time spent up to now is 1462.8 secs Computing kpt #: 232 total cpu time spent up to now is 1468.5 secs Computing kpt #: 233 total cpu time spent up to now is 1475.2 secs Computing kpt #: 234 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1482.1 secs Computing kpt #: 235 total cpu time spent up to now is 1488.4 secs Computing kpt #: 236 total cpu time spent up to now is 1493.6 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1500.0 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1506.5 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1513.1 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1519.6 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1526.2 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1534.4 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1541.3 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1548.0 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1554.8 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1561.6 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1568.7 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1575.5 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1582.2 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1589.2 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1596.1 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1603.0 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1609.8 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1616.7 secs Computing kpt #: 255 total cpu time spent up to now is 1623.4 secs Computing kpt #: 256 total cpu time spent up to now is 1629.9 secs Computing kpt #: 257 total cpu time spent up to now is 1636.2 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1642.8 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1649.4 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1655.9 secs Computing kpt #: 261 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1662.4 secs Computing kpt #: 262 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1669.0 secs Computing kpt #: 263 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1675.6 secs Computing kpt #: 264 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1681.9 secs Computing kpt #: 265 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1688.7 secs Computing kpt #: 266 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1695.2 secs Computing kpt #: 267 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1701.7 secs Computing kpt #: 268 total cpu time spent up to now is 1707.5 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1714.2 secs Computing kpt #: 270 total cpu time spent up to now is 1720.4 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1727.7 secs Computing kpt #: 272 total cpu time spent up to now is 1733.1 secs Computing kpt #: 273 total cpu time spent up to now is 1738.8 secs Computing kpt #: 274 total cpu time spent up to now is 1744.1 secs Computing kpt #: 275 total cpu time spent up to now is 1749.3 secs Computing kpt #: 276 total cpu time spent up to now is 1754.6 secs Computing kpt #: 277 total cpu time spent up to now is 1759.8 secs Computing kpt #: 278 total cpu time spent up to now is 1765.1 secs Computing kpt #: 279 total cpu time spent up to now is 1770.2 secs Computing kpt #: 280 total cpu time spent up to now is 1775.3 secs ethr = 1.92E-11, avg # of iterations = 97.4 total cpu time spent up to now is 1775.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3756 -14.3495 -14.3495 -14.0198 -14.0198 -13.9748 -13.9748 -13.9689 -13.9689 -13.9653 -13.9653 -2.8185 -2.8185 -2.2281 -2.2281 2.9608 2.9608 3.0247 3.0247 3.1328 3.1328 3.1493 3.1493 3.3084 3.3084 3.4992 3.4992 3.7708 3.7708 3.7739 3.7739 3.9018 3.9018 3.9254 3.9254 4.3179 4.3179 7.0795 7.0795 7.6812 7.6812 7.8352 7.8352 8.1857 8.1857 8.9867 8.9867 9.4869 9.4869 9.5848 9.5848 9.7923 9.7923 10.0802 10.0802 10.1052 10.1052 k = 0.0132 0.0076-0.0000 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3755 -14.3496 -14.3495 -14.0198 -14.0197 -13.9748 -13.9748 -13.9689 -13.9688 -13.9654 -13.9654 -2.8177 -2.8176 -2.2279 -2.2277 2.9611 2.9611 3.0248 3.0248 3.1323 3.1341 3.1470 3.1516 3.3072 3.3098 3.4903 3.5074 3.7704 3.7707 3.7724 3.7759 3.8854 3.9065 3.9300 3.9349 4.3157 4.3208 7.0638 7.0848 7.6417 7.6970 7.8274 7.8285 8.1418 8.2283 8.9888 9.0101 9.4788 9.4866 9.5693 9.5708 9.7751 9.7987 10.0965 10.0986 10.1151 10.1159 k = 0.0263 0.0152-0.0000 ( 5589 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3754 -14.3497 -14.3495 -14.0198 -14.0196 -13.9749 -13.9749 -13.9690 -13.9688 -13.9654 -13.9654 -2.8150 -2.8149 -2.2272 -2.2268 2.9619 2.9619 3.0250 3.0250 3.1327 3.1361 3.1446 3.1539 3.3063 3.3115 3.4811 3.5150 3.7689 3.7706 3.7723 3.7781 3.8681 3.9022 3.9381 3.9558 4.3142 4.3243 7.0375 7.0798 7.5852 7.6819 7.8040 7.8118 8.1032 8.2640 9.0153 9.0569 9.4636 9.4740 9.5285 9.5385 9.7492 9.7967 10.1314 10.1351 10.1515 10.1573 k = 0.0395 0.0228-0.0000 ( 5585 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3757 -14.3754 -14.3497 -14.3495 -14.0199 -14.0196 -13.9750 -13.9750 -13.9690 -13.9687 -13.9654 -13.9654 -2.8107 -2.8106 -2.2259 -2.2254 2.9631 2.9633 3.0252 3.0253 3.1339 3.1388 3.1423 3.1561 3.3057 3.3133 3.4717 3.5217 3.7669 3.7706 3.7726 3.7803 3.8519 3.8967 3.9476 3.9799 4.3135 4.3286 7.0004 7.0642 7.5161 7.6357 7.7677 7.7864 8.0739 8.2883 9.0613 9.1225 9.4348 9.4445 9.4818 9.5039 9.7214 9.7896 10.1636 10.1750 10.2185 10.2288 k = 0.0526 0.0304-0.0000 ( 5579 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3757 -14.3754 -14.3499 -14.3495 -14.0199 -14.0195 -13.9751 -13.9751 -13.9691 -13.9687 -13.9655 -13.9655 -2.8047 -2.8045 -2.2241 -2.2235 2.9648 2.9651 3.0256 3.0258 3.1359 3.1396 3.1425 3.1583 3.3053 3.3154 3.4622 3.5275 3.7648 3.7707 3.7730 3.7825 3.8375 3.8915 3.9580 4.0056 4.3136 4.3337 6.9524 7.0378 7.4377 7.5660 7.7226 7.7513 8.0532 8.2985 9.1193 9.2011 9.3776 9.3989 9.4545 9.4770 9.6981 9.7807 10.1982 10.2215 10.2972 10.3148 k = 0.0658 0.0380-0.0000 ( 5581 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3758 -14.3754 -14.3500 -14.3495 -14.0200 -14.0195 -13.9753 -13.9753 -13.9691 -13.9687 -13.9657 -13.9657 -2.7970 -2.7967 -2.2218 -2.2210 2.9669 2.9675 3.0260 3.0264 3.1373 3.1388 3.1464 3.1607 3.3053 3.3176 3.4527 3.5322 3.7626 3.7709 3.7733 3.7848 3.8250 3.8868 3.9691 4.0325 4.3149 4.3396 6.8936 6.9999 7.3529 7.4806 7.6728 7.7089 8.0363 8.2928 9.1781 9.2736 9.3192 9.3413 9.4388 9.4666 9.6816 9.7730 10.2346 10.2721 10.3792 10.4091 k = 0.0789 0.0456-0.0000 ( 5573 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3759 -14.3753 -14.3501 -14.3496 -14.0200 -14.0195 -13.9755 -13.9755 -13.9692 -13.9686 -13.9659 -13.9659 -2.7876 -2.7873 -2.2190 -2.2181 2.9693 2.9704 3.0264 3.0272 3.1352 3.1423 3.1510 3.1633 3.3056 3.3200 3.4433 3.5358 3.7605 3.7712 3.7735 3.7871 3.8145 3.8826 3.9808 4.0600 4.3176 4.3465 6.8247 6.9499 7.2648 7.3850 7.6210 7.6627 8.0182 8.2713 9.2183 9.2216 9.2764 9.3854 9.4281 9.4858 9.6718 9.7700 10.2728 10.3242 10.4594 10.5078 k = 0.0921 0.0532-0.0000 ( 5569 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3759 -14.3753 -14.3503 -14.3497 -14.0201 -14.0194 -13.9758 -13.9758 -13.9693 -13.9686 -13.9660 -13.9660 -2.7767 -2.7763 -2.2158 -2.2147 2.9720 2.9738 3.0269 3.0280 3.1332 3.1465 3.1561 3.1665 3.3063 3.3226 3.4342 3.5383 3.7583 3.7716 3.7732 3.7895 3.8062 3.8788 3.9928 4.0876 4.3223 4.3544 6.7462 6.8872 7.1761 7.2829 7.5693 7.6155 7.9959 8.2351 9.1384 9.1935 9.2554 9.4214 9.4671 9.5366 9.6707 9.7782 10.3129 10.3763 10.5346 10.6075 k = 0.1053 0.0608-0.0000 ( 5565 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3760 -14.3753 -14.3505 -14.3498 -14.0201 -14.0194 -13.9762 -13.9761 -13.9693 -13.9687 -13.9663 -13.9663 -2.7641 -2.7637 -2.2121 -2.2109 2.9749 2.9775 3.0274 3.0289 3.1315 3.1511 3.1617 3.1704 3.3073 3.3255 3.4254 3.5397 3.7561 3.7722 3.7724 3.7919 3.8001 3.8756 4.0050 4.1143 4.3297 4.3634 6.6593 6.8119 7.0890 7.1768 7.5187 7.5687 7.9678 8.1863 9.0562 9.1156 9.2662 9.4185 9.5292 9.5905 9.6950 9.8092 10.3551 10.4272 10.6028 10.7041 k = 0.1184 0.0684-0.0000 ( 5571 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3761 -14.3753 -14.3507 -14.3499 -14.0202 -14.0193 -13.9765 -13.9764 -13.9694 -13.9687 -13.9665 -13.9665 -2.7501 -2.7496 -2.2080 -2.2066 2.9778 2.9815 3.0279 3.0300 3.1302 3.1559 3.1677 3.1754 3.3086 3.3285 3.4171 3.5402 3.7540 3.7708 3.7729 3.7943 3.7964 3.8729 4.0172 4.1392 4.3407 4.3736 6.5651 6.7253 7.0045 7.0684 7.4696 7.5228 7.9338 8.1275 8.9733 9.0330 9.2744 9.4191 9.5607 9.6094 9.7697 9.8712 10.3997 10.4765 10.6638 10.7920 k = 0.1316 0.0760-0.0000 ( 5573 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3762 -14.3754 -14.3510 -14.3501 -14.0202 -14.0193 -13.9770 -13.9768 -13.9694 -13.9687 -13.9668 -13.9668 -2.7346 -2.7341 -2.2035 -2.2020 2.9806 2.9857 3.0287 3.0312 3.1293 3.1607 3.1741 3.1817 3.3103 3.3318 3.4092 3.5399 3.7518 3.7686 3.7737 3.7946 3.7968 3.8707 4.0291 4.1611 4.3566 4.3849 6.4650 6.6297 6.9225 6.9590 7.4220 7.4781 7.8940 8.0611 8.8903 8.9483 9.2824 9.4227 9.5672 9.6090 9.8712 9.9566 10.4466 10.5240 10.7184 10.8643 k = 0.1447 0.0836-0.0000 ( 5561 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3762 -14.3754 -14.3512 -14.3503 -14.0202 -14.0193 -13.9774 -13.9772 -13.9695 -13.9687 -13.9671 -13.9670 -2.7178 -2.7172 -2.1987 -2.1970 2.9830 2.9899 3.0298 3.0329 3.1290 3.1656 3.1808 3.1895 3.3122 3.3354 3.4019 3.5390 3.7498 3.7662 3.7747 3.7943 3.7992 3.8690 4.0404 4.1790 4.3781 4.3974 6.3602 6.5278 6.8422 6.8494 7.3758 7.4343 7.8491 7.9894 8.8075 8.8627 9.2908 9.4284 9.5604 9.6037 9.9810 10.0523 10.4962 10.5700 10.7676 10.9169 k = 0.1579 0.0912-0.0000 ( 5557 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3763 -14.3754 -14.3514 -14.3505 -14.0203 -14.0192 -13.9779 -13.9776 -13.9695 -13.9687 -13.9674 -13.9673 -2.6996 -2.6990 -2.1935 -2.1917 2.9849 2.9938 3.0315 3.0350 3.1293 3.1705 3.1877 3.1986 3.3145 3.3393 3.3951 3.5375 3.7479 3.7638 3.7758 3.7949 3.8017 3.8678 4.0510 4.1927 4.4056 4.4109 6.2519 6.4220 6.7402 6.7631 7.3306 7.3915 7.7999 7.9141 8.7251 8.7768 9.2987 9.4345 9.5479 9.5972 10.0931 10.1495 10.5486 10.6147 10.8125 10.9520 k = 0.1711 0.0988-0.0000 ( 5551 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3764 -14.3754 -14.3517 -14.3507 -14.0203 -14.0192 -13.9784 -13.9781 -13.9696 -13.9688 -13.9677 -13.9677 -2.6803 -2.6796 -2.1880 -2.1861 2.9861 2.9972 3.0340 3.0378 3.1303 3.1757 3.1947 3.2089 3.3171 3.3436 3.3890 3.5358 3.7461 3.7618 3.7771 3.7962 3.8041 3.8671 4.0606 4.2024 4.4252 4.4384 6.1413 6.3146 6.6317 6.6849 7.2864 7.3494 7.7472 7.8368 8.6435 8.6912 9.3053 9.4379 9.5356 9.5910 10.2044 10.2428 10.6040 10.6582 10.8537 10.9742 k = 0.1842 0.1064-0.0000 ( 5543 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3765 -14.3754 -14.3519 -14.3509 -14.0203 -14.0192 -13.9789 -13.9785 -13.9696 -13.9688 -13.9680 -13.9680 -2.6598 -2.6590 -2.1823 -2.1803 2.9864 2.9998 3.0373 3.0415 3.1320 3.1812 3.2018 3.2203 3.3199 3.3482 3.3835 3.5340 3.7444 3.7601 3.7785 3.7979 3.8066 3.8669 4.0692 4.2091 4.4399 4.4758 6.0295 6.2072 6.5242 6.6076 7.2428 7.3080 7.6918 7.7585 8.5628 8.6063 9.3091 9.4337 9.5294 9.5864 10.3125 10.3286 10.6623 10.7009 10.8916 10.9862 k = 0.1974 0.1140-0.0000 ( 5569 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3766 -14.3755 -14.3523 -14.3512 -14.0204 -14.0192 -13.9795 -13.9791 -13.9697 -13.9689 -13.9684 -13.9684 -2.6384 -2.6376 -2.1765 -2.1744 2.9858 3.0017 3.0416 3.0461 3.1344 3.1870 3.2089 3.2326 3.3229 3.3532 3.3785 3.5321 3.7427 3.7588 3.7801 3.8000 3.8090 3.8670 4.0766 4.2132 4.4545 4.5166 5.9174 6.1010 6.4179 6.5315 7.1997 7.2672 7.6345 7.6801 8.4831 8.5223 9.3089 9.4189 9.5329 9.5845 10.4045 10.4153 10.7225 10.7425 10.9257 10.9902 k = 0.2105 0.1215-0.0000 ( 5573 PWs) bands (ev): -33.0884 -33.0884 -33.0836 -33.0836 -14.3767 -14.3756 -14.3525 -14.3514 -14.0204 -14.0192 -13.9800 -13.9796 -13.9697 -13.9690 -13.9687 -13.9687 -2.6161 -2.6151 -2.1705 -2.1683 2.9846 3.0029 3.0466 3.0516 3.1376 3.1933 3.2159 3.2457 3.3261 3.3586 3.3744 3.5303 3.7412 3.7579 3.7819 3.8023 3.8114 3.8677 4.0828 4.2157 4.4683 4.5601 5.8059 5.9972 6.3128 6.4570 7.1570 7.2270 7.5759 7.6023 8.4045 8.4396 9.3037 9.3956 9.5444 9.5863 10.4701 10.5111 10.7826 10.7830 10.9558 10.9886 k = 0.2237 0.1291-0.0000 ( 5569 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3768 -14.3757 -14.3528 -14.3517 -14.0204 -14.0192 -13.9806 -13.9802 -13.9698 -13.9692 -13.9691 -13.9689 -2.5929 -2.5919 -2.1645 -2.1621 2.9829 3.0035 3.0524 3.0578 3.1415 3.1999 3.2228 3.2596 3.3294 3.3641 3.3713 3.5288 3.7399 3.7574 3.7838 3.8049 3.8139 3.8687 4.0879 4.2170 4.4807 4.6055 5.6961 5.8966 6.2092 6.3847 7.1147 7.1876 7.5166 7.5257 8.3273 8.3582 9.2932 9.3673 9.5604 9.5921 10.5255 10.5981 10.8199 10.8413 10.9814 10.9846 k = 0.2368 0.1367-0.0000 ( 5567 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3768 -14.3757 -14.3531 -14.3519 -14.0205 -14.0192 -13.9812 -13.9807 -13.9699 -13.9696 -13.9694 -13.9689 -2.5691 -2.5680 -2.1584 -2.1559 2.9811 3.0040 3.0587 3.0644 3.1463 3.2068 3.2295 3.2741 3.3329 3.3660 3.3729 3.5275 3.7388 3.7574 3.7859 3.8077 3.8164 3.8701 4.0918 4.2172 4.4908 4.6520 5.5889 5.8002 6.1071 6.3152 7.0728 7.1489 7.4508 7.4572 8.2514 8.2785 9.2778 9.3361 9.5789 9.6017 10.5719 10.6755 10.8511 10.8955 10.9832 11.0025 k = 0.2500 0.1443-0.0000 ( 5565 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3769 -14.3758 -14.3534 -14.3522 -14.0205 -14.0192 -13.9818 -13.9813 -13.9700 -13.9699 -13.9696 -13.9690 -2.5448 -2.5436 -2.1524 -2.1498 2.9793 3.0043 3.0653 3.0712 3.1518 3.2139 3.2359 3.2891 3.3365 3.3641 3.3794 3.5266 3.7379 3.7578 3.7882 3.8107 3.8189 3.8719 4.0945 4.2166 4.4975 4.6986 5.4856 5.7086 6.0066 6.2493 7.0313 7.1110 7.3780 7.3981 8.1770 8.2004 9.2581 9.3033 9.5987 9.6144 10.6103 10.7428 10.8708 10.9445 10.9915 11.0202 k = 0.2632 0.1519-0.0000 ( 5569 PWs) bands (ev): -33.0883 -33.0883 -33.0835 -33.0835 -14.3770 -14.3759 -14.3537 -14.3525 -14.0205 -14.0192 -13.9823 -13.9818 -13.9703 -13.9703 -13.9697 -13.9691 -2.5200 -2.5188 -2.1465 -2.1439 2.9777 3.0049 3.0721 3.0779 3.1582 3.2212 3.2420 3.3044 3.3402 3.3622 3.3869 3.5260 3.7373 3.7586 3.7907 3.8140 3.8215 3.8738 4.0961 4.2152 4.5001 4.7439 5.3879 5.6223 5.9079 6.1878 6.9903 7.0741 7.3076 7.3397 8.1042 8.1242 9.2350 9.2696 9.6193 9.6295 10.6415 10.7998 10.8766 10.9870 11.0132 11.0374 k = 0.2763 0.1595-0.0000 ( 5575 PWs) bands (ev): -33.0883 -33.0883 -33.0834 -33.0834 -14.3770 -14.3759 -14.3540 -14.3528 -14.0205 -14.0193 -13.9829 -13.9824 -13.9707 -13.9707 -13.9698 -13.9691 -2.4950 -2.4937 -2.1408 -2.1381 2.9764 3.0059 3.0791 3.0845 3.1653 3.2285 3.2477 3.3198 3.3440 3.3606 3.3950 3.5258 3.7371 3.7598 3.7933 3.8174 3.8243 3.8761 4.0966 4.2132 4.4977 4.7853 5.2983 5.5416 5.8111 6.1317 6.9497 7.0383 7.2401 7.2823 8.0329 8.0499 9.2096 9.2357 9.6400 9.6461 10.6664 10.8426 10.8783 11.0193 11.0445 11.0599 k = 0.2895 0.1671-0.0000 ( 5579 PWs) bands (ev): -33.0883 -33.0883 -33.0834 -33.0834 -14.3771 -14.3760 -14.3543 -14.3531 -14.0205 -14.0193 -13.9835 -13.9830 -13.9710 -13.9710 -13.9698 -13.9692 -2.4699 -2.4685 -2.1353 -2.1326 2.9758 3.0075 3.0860 3.0906 3.1731 3.2359 3.2532 3.3348 3.3479 3.3594 3.4036 3.5261 3.7374 3.7615 3.7961 3.8209 3.8271 3.8784 4.0959 4.2103 4.4899 4.8182 5.2221 5.4665 5.7167 6.0818 6.9097 7.0037 7.1756 7.2264 7.9634 7.9777 9.1828 9.2020 9.6605 9.6636 10.6858 10.8505 10.9033 11.0399 11.0801 11.0913 k = 0.3026 0.1747-0.0000 ( 5583 PWs) bands (ev): -33.0883 -33.0883 -33.0834 -33.0834 -14.3772 -14.3761 -14.3545 -14.3534 -14.0205 -14.0193 -13.9841 -13.9835 -13.9714 -13.9714 -13.9699 -13.9693 -2.4448 -2.4433 -2.1302 -2.1274 2.9758 3.0098 3.0928 3.0963 3.1817 3.2433 3.2583 3.3478 3.3536 3.3585 3.4126 3.5267 3.7383 3.7638 3.7991 3.8247 3.8301 3.8809 4.0940 4.2066 4.4766 4.8336 5.1681 5.3967 5.6250 6.0391 6.8702 6.9705 7.1147 7.1722 7.8956 7.9077 9.1551 9.1690 9.6804 9.6813 10.7004 10.8415 10.9378 11.0550 11.1172 11.1266 k = 0.3158 0.1823-0.0000 ( 5575 PWs) bands (ev): -33.0882 -33.0882 -33.0834 -33.0834 -14.3772 -14.3762 -14.3548 -14.3537 -14.0205 -14.0193 -13.9846 -13.9841 -13.9717 -13.9716 -13.9699 -13.9693 -2.4198 -2.4182 -2.1255 -2.1226 2.9767 3.0129 3.0994 3.1014 3.1909 3.2505 3.2631 3.3535 3.3579 3.3657 3.4220 3.5277 3.7398 3.7668 3.8023 3.8286 3.8333 3.8835 4.0907 4.2018 4.4582 4.8216 5.1459 5.3316 5.5370 6.0041 6.8314 6.9387 7.0576 7.1200 7.8297 7.8399 9.1273 9.1369 9.6987 9.6995 10.7115 10.8307 10.9695 11.0686 11.1547 11.1624 k = 0.3289 0.1899-0.0000 ( 5581 PWs) bands (ev): -33.0882 -33.0882 -33.0834 -33.0833 -14.3772 -14.3763 -14.3550 -14.3540 -14.0205 -14.0193 -13.9851 -13.9846 -13.9720 -13.9720 -13.9699 -13.9694 -2.3951 -2.3935 -2.1212 -2.1183 2.9785 3.0169 3.1056 3.1059 3.2004 3.2575 3.2677 3.3571 3.3575 3.3785 3.4315 3.5292 3.7420 3.7705 3.8056 3.8327 3.8365 3.8861 4.0860 4.1955 4.4358 4.7835 5.1530 5.2703 5.4545 5.9771 6.7933 6.9083 7.0046 7.0700 7.7658 7.7746 9.0999 9.1061 9.7154 9.7173 10.7197 10.8202 10.9976 11.0819 11.1916 11.1975 k = 0.3421 0.1975-0.0000 ( 5577 PWs) bands (ev): -33.0882 -33.0882 -33.0833 -33.0833 -14.3773 -14.3763 -14.3552 -14.3543 -14.0204 -14.0194 -13.9856 -13.9851 -13.9723 -13.9723 -13.9699 -13.9694 -2.3710 -2.3692 -2.1175 -2.1145 2.9814 3.0220 3.1096 3.1115 3.2102 3.2643 3.2721 3.3572 3.3603 3.3898 3.4413 3.5310 3.7450 3.7751 3.8089 3.8369 3.8399 3.8886 4.0795 4.1875 4.4109 4.7318 5.1721 5.2119 5.3833 5.9578 6.7563 6.8796 6.9561 7.0225 7.7040 7.7117 9.0732 9.0769 9.7311 9.7338 10.7262 10.8107 11.0225 11.0947 11.2274 11.2314 k = 0.3553 0.2051-0.0000 ( 5587 PWs) bands (ev): -33.0882 -33.0882 -33.0833 -33.0833 -14.3773 -14.3764 -14.3555 -14.3545 -14.0204 -14.0194 -13.9861 -13.9856 -13.9726 -13.9726 -13.9700 -13.9695 -2.3474 -2.3456 -2.1144 -2.1113 2.9853 3.0281 3.1126 3.1168 3.2200 3.2708 3.2765 3.3570 3.3631 3.3990 3.4510 3.5332 3.7487 3.7809 3.8124 3.8413 3.8434 3.8911 4.0711 4.1770 4.3854 4.6771 5.1558 5.1755 5.3414 5.9456 6.7205 6.8523 6.9123 6.9778 7.6445 7.6516 9.0477 9.0494 9.7454 9.7486 10.7315 10.8025 11.0444 11.1070 11.2618 11.2639 k = 0.3684 0.2127-0.0000 ( 5591 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3773 -14.3765 -14.3557 -14.3548 -14.0204 -14.0194 -13.9865 -13.9861 -13.9729 -13.9729 -13.9700 -13.9695 -2.3247 -2.3228 -2.1119 -2.1089 2.9904 3.0352 3.1149 3.1216 3.2296 3.2770 3.2809 3.3569 3.3655 3.4057 3.4607 3.5356 3.7532 3.7880 3.8158 3.8459 3.8470 3.8934 4.0604 4.1636 4.3612 4.6254 5.1015 5.1380 5.3488 5.9392 6.6866 6.8265 6.8731 6.9361 7.5875 7.5945 9.0236 9.0238 9.7582 9.7617 10.7363 10.7958 11.0639 11.1183 11.2942 11.2946 k = 0.3816 0.2203-0.0000 ( 5589 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3774 -14.3766 -14.3558 -14.3550 -14.0204 -14.0195 -13.9869 -13.9864 -13.9732 -13.9731 -13.9700 -13.9696 -2.3028 -2.3008 -2.1102 -2.1072 2.9965 3.0434 3.1165 3.1259 3.2387 3.2829 3.2855 3.3568 3.3674 3.4093 3.4702 3.5382 3.7583 3.7965 3.8193 3.8505 3.8507 3.8956 4.0475 4.1468 4.3402 4.5798 5.0488 5.0769 5.3860 5.9369 6.6552 6.8020 6.8388 6.8977 7.5335 7.5406 9.0004 9.0013 9.7693 9.7730 10.7409 10.7907 11.0810 11.1285 11.3232 11.3243 k = 0.3947 0.2279-0.0000 ( 5591 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3774 -14.3767 -14.3560 -14.3553 -14.0204 -14.0196 -13.9872 -13.9868 -13.9734 -13.9734 -13.9700 -13.9696 -2.2819 -2.2799 -2.1093 -2.1063 3.0036 3.0524 3.1172 3.1295 3.2472 3.2884 3.2906 3.3566 3.3688 3.4098 3.4794 3.5406 3.7640 3.8060 3.8227 3.8539 3.8560 3.8976 4.0325 4.1265 4.3239 4.5419 4.9978 5.0109 5.4334 5.9367 6.6274 6.7785 6.8091 6.8629 7.4827 7.4902 8.9793 8.9808 9.7787 9.7824 10.7456 10.7870 11.0959 11.1373 11.3493 11.3516 k = 0.4079 0.2355-0.0000 ( 5613 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3775 -14.3769 -14.3561 -14.3555 -14.0204 -14.0197 -13.9875 -13.9872 -13.9737 -13.9736 -13.9700 -13.9697 -2.2623 -2.2602 -2.1094 -2.1065 3.0117 3.0620 3.1171 3.1324 3.2549 3.2935 3.2959 3.3563 3.3694 3.4072 3.4882 3.5426 3.7703 3.8162 3.8258 3.8571 3.8619 3.8993 4.0161 4.1030 4.3130 4.5119 4.9463 4.9490 5.4843 5.9367 6.6040 6.7556 6.7840 6.8321 7.4358 7.4436 8.9604 8.9623 9.7864 9.7900 10.7505 10.7845 11.1088 11.1446 11.3727 11.3759 k = 0.4211 0.2431-0.0000 ( 5609 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3775 -14.3769 -14.3562 -14.3556 -14.0204 -14.0197 -13.9878 -13.9875 -13.9739 -13.9738 -13.9700 -13.9697 -2.2440 -2.2419 -2.1103 -2.1074 3.0207 3.0720 3.1162 3.1346 3.2622 3.2982 3.3014 3.3563 3.3691 3.4018 3.4967 3.5441 3.7773 3.8262 3.8288 3.8599 3.8687 3.9008 3.9993 4.0775 4.3080 4.4889 4.8859 4.9027 5.5361 5.9347 6.5862 6.7330 6.7632 6.8054 7.3932 7.4014 8.9441 8.9461 9.7926 9.7960 10.7555 10.7831 11.1199 11.1504 11.3932 11.3970 k = 0.4342 0.2507-0.0000 ( 5603 PWs) bands (ev): -33.0881 -33.0881 -33.0832 -33.0832 -14.3775 -14.3770 -14.3563 -14.3558 -14.0203 -14.0198 -13.9880 -13.9878 -13.9740 -13.9740 -13.9700 -13.9697 -2.2271 -2.2250 -2.1120 -2.1092 3.0304 3.0818 3.1145 3.1360 3.2692 3.3024 3.3069 3.3565 3.3674 3.3943 3.5046 3.5449 3.7849 3.8313 3.8351 3.8622 3.8768 3.9020 3.9832 4.0513 4.3089 4.4712 4.8318 4.8595 5.5877 5.9288 6.5747 6.7104 6.7467 6.7830 7.3557 7.3640 8.9302 8.9322 9.7974 9.8004 10.7605 10.7825 11.1292 11.1546 11.4107 11.4146 k = 0.4474 0.2583-0.0000 ( 5591 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3771 -14.3563 -14.3559 -14.0203 -14.0198 -13.9882 -13.9879 -13.9741 -13.9741 -13.9699 -13.9697 -2.2120 -2.2099 -2.1144 -2.1118 3.0405 3.0904 3.1128 3.1366 3.2766 3.3062 3.3118 3.3571 3.3637 3.3861 3.5120 3.5447 3.7931 3.8333 3.8423 3.8635 3.8859 3.9029 3.9689 4.0259 4.3156 4.4565 4.7860 4.8201 5.6380 5.9178 6.5699 6.6880 6.7342 6.7644 7.3241 7.3319 8.9188 8.9206 9.8010 9.8036 10.7653 10.7823 11.1370 11.1573 11.4251 11.4288 k = 0.4605 0.2659-0.0000 ( 5589 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3771 -14.3563 -14.3561 -14.0202 -14.0199 -13.9883 -13.9881 -13.9742 -13.9742 -13.9699 -13.9698 -2.1988 -2.1969 -2.1175 -2.1152 3.0507 3.0949 3.1131 3.1363 3.2846 3.3094 3.3157 3.3564 3.3584 3.3791 3.5188 3.5436 3.8019 3.8343 3.8478 3.8638 3.8949 3.9037 3.9573 4.0027 4.3275 4.4420 4.7506 4.7853 5.6865 5.9007 6.5716 6.6660 6.7258 6.7494 7.2990 7.3057 8.9101 8.9115 9.8037 9.8057 10.7698 10.7822 11.1434 11.1587 11.4365 11.4396 k = 0.4737 0.2735-0.0000 ( 5581 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3563 -14.3561 -14.0202 -14.0199 -13.9883 -13.9882 -13.9743 -13.9743 -13.9699 -13.9698 -2.1881 -2.1866 -2.1206 -2.1188 3.0609 3.0931 3.1175 3.1348 3.2937 3.3119 3.3185 3.3459 3.3604 3.3740 3.5249 3.5416 3.8109 3.8339 3.8520 3.8629 3.9024 3.9047 3.9502 3.9828 4.3439 4.4257 4.7277 4.7562 5.7324 5.8775 6.5790 6.6449 6.7211 6.7374 7.2810 7.2860 8.9039 8.9049 9.8055 9.8069 10.7738 10.7819 11.1486 11.1588 11.4447 11.4470 k = 0.4868 0.2811-0.0000 ( 5595 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3773 -14.3563 -14.3562 -14.0201 -14.0200 -13.9884 -13.9884 -13.9743 -13.9743 -13.9699 -13.9698 -2.1808 -2.1799 -2.1230 -2.1220 3.0707 3.0874 3.1232 3.1322 3.3033 3.3130 3.3206 3.3342 3.3631 3.3700 3.5303 3.5386 3.8194 3.8314 3.8553 3.8608 3.9059 3.9065 3.9492 3.9668 4.3637 4.4065 4.7179 4.7341 5.7752 5.8484 6.5910 6.6249 6.7202 6.7285 7.2707 7.2733 8.9002 8.9008 9.8067 9.8074 10.7770 10.7810 11.1527 11.1578 11.4499 11.4511 k = 0.5000 0.2887-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3773 -14.3563 -14.3563 -14.0201 -14.0201 -13.9884 -13.9884 -13.9743 -13.9743 -13.9698 -13.9698 -2.1777 -2.1777 -2.1236 -2.1236 3.0797 3.0797 3.1283 3.1283 3.3111 3.3111 3.3248 3.3248 3.3664 3.3664 3.5349 3.5349 3.8266 3.8266 3.8582 3.8582 3.9071 3.9071 3.9553 3.9553 4.3852 4.3852 4.7207 4.7207 5.8141 5.8141 6.6067 6.6067 6.7227 6.7227 7.2681 7.2681 8.8992 8.8992 9.8073 9.8073 10.7794 10.7794 11.1558 11.1558 11.4521 11.4521 k = 0.5000 0.2887-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3773 -14.3563 -14.3563 -14.0201 -14.0201 -13.9884 -13.9884 -13.9743 -13.9743 -13.9698 -13.9698 -2.1777 -2.1777 -2.1236 -2.1236 3.0797 3.0797 3.1283 3.1283 3.3111 3.3111 3.3248 3.3248 3.3664 3.3664 3.5349 3.5349 3.8266 3.8266 3.8582 3.8582 3.9071 3.9071 3.9553 3.9553 4.3852 4.3852 4.7207 4.7207 5.8141 5.8141 6.6067 6.6067 6.7227 6.7227 7.2681 7.2681 8.8992 8.8992 9.8073 9.8073 10.7794 10.7794 11.1558 11.1558 11.4521 11.4521 k = 0.4924 0.3018-0.0000 ( 5590 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3773 -14.3563 -14.3563 -14.0201 -14.0201 -13.9884 -13.9884 -13.9744 -13.9743 -13.9698 -13.9698 -2.1776 -2.1775 -2.1235 -2.1233 3.0790 3.0819 3.1278 3.1301 3.3109 3.3111 3.3182 3.3316 3.3659 3.3676 3.5346 3.5353 3.8164 3.8363 3.8556 3.8605 3.9030 3.9116 3.9509 3.9594 4.3797 4.3907 4.7168 4.7244 5.7817 5.8444 6.5884 6.6225 6.6713 6.7574 7.2550 7.2775 8.8931 8.9271 9.8048 9.8164 10.7720 10.7900 11.1540 11.1580 11.4496 11.4526 k = 0.4848 0.3149-0.0000 ( 5570 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3772 -14.3563 -14.3562 -14.0201 -14.0200 -13.9884 -13.9884 -13.9744 -13.9743 -13.9699 -13.9698 -2.1769 -2.1767 -2.1229 -2.1227 3.0799 3.0859 3.1287 3.1332 3.3106 3.3108 3.3121 3.3387 3.3661 3.3696 3.5346 3.5359 3.8061 3.8456 3.8528 3.8628 3.8993 3.9167 3.9465 3.9635 4.3743 4.3962 4.7127 4.7278 5.7468 5.8731 6.5680 6.6046 6.6356 6.7754 7.2386 7.2829 8.9093 8.9750 9.8087 9.8319 10.7676 10.8036 11.1526 11.1608 11.4451 11.4513 k = 0.4773 0.3280-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3772 -14.3564 -14.3563 -14.0201 -14.0200 -13.9885 -13.9884 -13.9744 -13.9743 -13.9699 -13.9698 -2.1758 -2.1754 -2.1220 -2.1217 3.0820 3.0915 3.1310 3.1375 3.3057 3.3103 3.3110 3.3460 3.3670 3.3723 3.5348 3.5364 3.7956 3.8497 3.8541 3.8648 3.8961 3.9220 3.9421 3.9673 4.3687 4.4018 4.7085 4.7309 5.7086 5.9006 6.5246 6.5455 6.6456 6.7780 7.2196 7.2842 8.9466 9.0403 9.8189 9.8533 10.7662 10.8201 11.1512 11.1641 11.4385 11.4480 k = 0.4697 0.3412-0.0000 ( 5576 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3772 -14.3564 -14.3563 -14.0200 -14.0199 -13.9885 -13.9884 -13.9744 -13.9743 -13.9700 -13.9699 -2.1742 -2.1737 -2.1208 -2.1203 3.0852 3.0986 3.1349 3.1431 3.2999 3.3101 3.3108 3.3535 3.3685 3.3759 3.5353 3.5369 3.7853 3.8464 3.8616 3.8670 3.8934 3.9266 3.9389 3.9709 4.3631 4.4074 4.7042 4.7335 5.6668 5.9272 6.4342 6.5214 6.6521 6.7680 7.1987 7.2815 9.0029 9.1199 9.8351 9.8803 10.7674 10.8392 11.1496 11.1676 11.4296 11.4424 k = 0.4621 0.3543-0.0000 ( 5580 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3565 -14.3563 -14.0200 -14.0199 -13.9885 -13.9884 -13.9745 -13.9744 -13.9701 -13.9699 -2.1722 -2.1716 -2.1192 -2.1187 3.0892 3.1069 3.1403 3.1502 3.2944 3.3100 3.3105 3.3608 3.3705 3.3806 3.5362 3.5374 3.7751 3.8427 3.8667 3.8706 3.8911 3.9269 3.9404 3.9744 4.3574 4.4131 4.6999 4.7356 5.6208 5.9529 6.3361 6.4958 6.6541 6.7494 7.1769 7.2749 9.0751 9.2108 9.8567 9.9121 10.7709 10.8605 11.1470 11.1711 11.4180 11.4340 k = 0.4545 0.3674-0.0000 ( 5584 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3565 -14.3563 -14.0200 -14.0199 -13.9886 -13.9884 -13.9746 -13.9745 -13.9702 -13.9700 -2.1697 -2.1691 -2.1174 -2.1167 3.0937 3.1162 3.1475 3.1588 3.2893 3.3101 3.3102 3.3675 3.3732 3.3868 3.5376 3.5377 3.7654 3.8388 3.8688 3.8763 3.8892 3.9228 3.9467 3.9776 4.3517 4.4191 4.6956 4.7370 5.5702 5.9770 6.2334 6.4693 6.6496 6.7274 7.1548 7.2649 9.1597 9.3100 9.8833 9.9482 10.7760 10.8832 11.1427 11.1741 11.4031 11.4220 k = 0.4470 0.3805-0.0000 ( 5582 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3565 -14.3563 -14.0200 -14.0199 -13.9886 -13.9884 -13.9747 -13.9745 -13.9703 -13.9701 -2.1669 -2.1661 -2.1153 -2.1145 3.0985 3.1258 3.1561 3.1692 3.2848 3.3098 3.3105 3.3733 3.3763 3.3948 3.5379 3.5394 3.7562 3.8346 3.8701 3.8818 3.8878 3.9176 3.9544 3.9807 4.3460 4.4252 4.6913 4.7376 5.5149 5.9952 6.1327 6.4422 6.6353 6.7084 7.1334 7.2517 9.2531 9.4151 9.9143 9.9877 10.7821 10.9064 11.1359 11.1758 11.3842 11.4050 k = 0.4394 0.3936-0.0000 ( 5576 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3566 -14.3564 -14.0200 -14.0198 -13.9886 -13.9884 -13.9747 -13.9746 -13.9704 -13.9702 -2.1636 -2.1628 -2.1130 -2.1121 3.1035 3.1354 3.1661 3.1813 3.2812 3.3095 3.3112 3.3783 3.3800 3.4046 3.5377 3.5417 3.7478 3.8302 3.8710 3.8868 3.8868 3.9119 3.9626 3.9836 4.3402 4.4316 4.6871 4.7372 5.4552 5.9728 6.0706 6.4149 6.6101 6.6962 7.1131 7.2357 9.3522 9.5235 9.9495 10.0299 10.7882 10.9288 11.1255 11.1754 11.3607 11.3819 k = 0.4318 0.4068-0.0000 ( 5568 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3774 -14.3772 -14.3566 -14.3564 -14.0200 -14.0198 -13.9886 -13.9884 -13.9748 -13.9747 -13.9705 -13.9703 -2.1601 -2.1591 -2.1106 -2.1096 3.1087 3.1446 3.1770 3.1948 3.2788 3.3091 3.3125 3.3827 3.3843 3.4156 3.5373 3.5447 3.7404 3.8257 3.8714 3.8862 3.8911 3.9063 3.9709 3.9863 4.3343 4.4383 4.6830 4.7358 5.3913 5.8800 6.0783 6.3881 6.5778 6.6892 7.0943 7.2172 9.4538 9.6333 9.9883 10.0741 10.7932 10.9485 11.1107 11.1717 11.3331 11.3529 k = 0.4242 0.4199-0.0000 ( 5572 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3775 -14.3772 -14.3567 -14.3564 -14.0200 -14.0197 -13.9887 -13.9885 -13.9749 -13.9747 -13.9707 -13.9704 -2.1562 -2.1551 -2.1081 -2.1070 3.1139 3.1531 3.1886 3.2088 3.2784 3.3087 3.3142 3.3868 3.3892 3.4275 3.5364 3.5484 3.7344 3.8212 3.8712 3.8859 3.8935 3.9024 3.9791 3.9889 4.3284 4.4455 4.6792 4.7332 5.3241 5.7724 6.1013 6.3623 6.5425 6.6850 7.0771 7.1964 9.5553 9.7427 10.0305 10.1198 10.7960 10.9624 11.0915 11.1631 11.3039 11.3201 k = 0.4167 0.4330-0.0000 ( 5576 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3775 -14.3772 -14.3568 -14.3565 -14.0199 -14.0197 -13.9887 -13.9885 -13.9750 -13.9748 -13.9708 -13.9705 -2.1521 -2.1508 -2.1057 -2.1045 3.1191 3.1609 3.2003 3.2218 3.2811 3.3084 3.3164 3.3907 3.3946 3.4397 3.5352 3.5529 3.7302 3.8166 3.8699 3.8861 3.8909 3.9035 3.9867 3.9913 4.3224 4.4532 4.6759 4.7292 5.2544 5.6636 6.1270 6.3382 6.5064 6.6831 7.0614 7.1736 9.6542 9.8500 10.0760 10.1666 10.7956 10.9666 11.0685 11.1475 11.2768 11.2868 k = 0.4091 0.4461-0.0000 ( 5586 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3775 -14.3772 -14.3568 -14.3566 -14.0199 -14.0197 -13.9888 -13.9886 -13.9751 -13.9749 -13.9709 -13.9706 -2.1478 -2.1464 -2.1033 -2.1020 3.1244 3.1676 3.2120 3.2320 3.2880 3.3087 3.3191 3.3946 3.4008 3.4515 3.5337 3.5583 3.7282 3.8121 3.8667 3.8865 3.8867 3.9072 3.9935 3.9936 4.3164 4.4616 4.6732 4.7238 5.1833 5.5565 6.1530 6.3170 6.4705 6.6836 7.0467 7.1490 9.7481 9.9537 10.1248 10.2140 10.7910 10.9570 11.0430 11.1233 11.2557 11.2559 k = 0.4015 0.4593-0.0000 ( 5584 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3775 -14.3772 -14.3569 -14.3566 -14.0199 -14.0196 -13.9888 -13.9886 -13.9752 -13.9750 -13.9710 -13.9707 -2.1433 -2.1418 -2.1010 -2.0996 3.1297 3.1731 3.2232 3.2390 3.2969 3.3118 3.3223 3.3984 3.4078 3.4622 3.5319 3.5649 3.7289 3.8078 3.8612 3.8836 3.8874 3.9113 3.9958 3.9990 4.3104 4.4708 4.6715 4.7169 5.1120 5.4523 6.1773 6.3004 6.4355 6.6868 7.0326 7.1227 9.8350 10.0527 10.1768 10.2620 10.7820 10.9336 11.0149 11.0904 11.2281 11.2431 k = 0.3939 0.4724-0.0000 ( 5582 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3775 -14.3773 -14.3569 -14.3567 -14.0198 -14.0196 -13.9889 -13.9887 -13.9753 -13.9751 -13.9711 -13.9709 -2.1386 -2.1371 -2.0989 -2.0974 3.1350 3.1772 3.2337 3.2439 3.3006 3.3235 3.3259 3.4022 3.4157 3.4709 3.5300 3.5728 3.7328 3.8039 3.8534 3.8817 3.8885 3.9154 3.9979 4.0029 4.3046 4.4809 4.6711 4.7085 5.0419 5.3523 6.1968 6.2917 6.4019 6.6931 7.0186 7.0950 9.9133 10.1455 10.2315 10.3105 10.7689 10.9007 10.9826 11.0503 11.2035 11.2373 k = 0.3864 0.4855-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3775 -14.3773 -14.3570 -14.3567 -14.0198 -14.0196 -13.9889 -13.9887 -13.9754 -13.9752 -13.9712 -13.9709 -2.1339 -2.1322 -2.0972 -2.0957 3.1402 3.1798 3.2434 3.2480 3.3005 3.3297 3.3402 3.4061 3.4245 3.4766 3.5281 3.5822 3.7402 3.8006 3.8439 3.8805 3.8900 3.9196 4.0000 4.0044 4.2988 4.4922 4.6726 4.6987 4.9743 5.2572 6.2069 6.2955 6.3701 6.7025 7.0042 7.0661 9.9823 10.2311 10.2883 10.3599 10.7525 10.8637 10.9463 11.0054 11.1809 11.2354 k = 0.3788 0.4986-0.0000 ( 5562 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3775 -14.3773 -14.3570 -14.3567 -14.0197 -14.0195 -13.9889 -13.9887 -13.9754 -13.9752 -13.9713 -13.9710 -2.1291 -2.1273 -2.0959 -2.0943 3.1453 3.1810 3.2522 3.2522 3.2993 3.3336 3.3579 3.4099 3.4342 3.4790 3.5260 3.5932 3.7506 3.7983 3.8332 3.8795 3.8918 3.9237 4.0021 4.0033 4.2935 4.5049 4.6764 4.6875 4.9104 5.1681 6.2077 6.3116 6.3404 6.7151 6.9891 7.0363 10.0417 10.3078 10.3454 10.4108 10.7339 10.8264 10.9074 10.9578 11.1598 11.2347 k = 0.3712 0.5117-0.0000 ( 5554 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3773 -14.3570 -14.3568 -14.0197 -14.0195 -13.9890 -13.9888 -13.9754 -13.9753 -13.9713 -13.9711 -2.1244 -2.1225 -2.0951 -2.0934 3.1502 3.1809 3.2564 3.2601 3.2977 3.3373 3.3750 3.4137 3.4446 3.4782 3.5233 3.6057 3.7624 3.7984 3.8214 3.8786 3.8940 3.9275 3.9989 4.0041 4.2886 4.5192 4.6753 4.6828 4.8518 5.0857 6.2047 6.3131 6.3343 6.7310 6.9728 7.0062 10.0918 10.3746 10.4008 10.4636 10.7144 10.7916 10.8675 10.9089 11.1400 11.2339 k = 0.3636 0.5249-0.0000 ( 5562 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3773 -14.3570 -14.3568 -14.0197 -14.0195 -13.9890 -13.9888 -13.9755 -13.9754 -13.9714 -13.9712 -2.1198 -2.1177 -2.0949 -2.0932 3.1549 3.1799 3.2604 3.2670 3.2958 3.3406 3.3909 3.4173 3.4555 3.4746 3.5198 3.6197 3.7714 3.8039 3.8088 3.8774 3.8965 3.9307 3.9913 4.0060 4.2845 4.5355 4.6624 4.6915 4.8002 5.0108 6.2020 6.2886 6.3588 6.7498 6.9552 6.9766 10.1329 10.4312 10.4524 10.5177 10.6947 10.7615 10.8281 10.8603 11.1217 11.2329 k = 0.3561 0.5380-0.0000 ( 5572 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3774 -14.3570 -14.3569 -14.0197 -14.0196 -13.9890 -13.9889 -13.9756 -13.9754 -13.9714 -13.9713 -2.1153 -2.1131 -2.0955 -2.0937 3.1593 3.1781 3.2640 3.2730 3.2936 3.3434 3.4054 3.4206 3.4665 3.4688 3.5150 3.6345 3.7748 3.7960 3.8167 3.8758 3.8996 3.9328 3.9811 4.0078 4.2813 4.5539 4.6494 4.6984 4.7612 4.9443 6.2017 6.2670 6.3821 6.7711 6.9363 6.9486 10.1651 10.4794 10.4976 10.5702 10.6747 10.7380 10.7905 10.8142 11.1052 11.2322 k = 0.3485 0.5511-0.0000 ( 5568 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3774 -14.3570 -14.3569 -14.0197 -14.0196 -13.9891 -13.9889 -13.9756 -13.9755 -13.9714 -13.9713 -2.1111 -2.1086 -2.0967 -2.0950 3.1634 3.1759 3.2670 3.2782 3.2912 3.3457 3.4187 3.4234 3.4613 3.4771 3.5092 3.6488 3.7748 3.7839 3.8330 3.8733 3.9037 3.9324 3.9704 4.0092 4.2791 4.5747 4.6374 4.6873 4.7521 4.8866 6.2043 6.2483 6.4018 6.7943 6.9168 6.9239 10.1882 10.5211 10.5344 10.6180 10.6527 10.7221 10.7566 10.7740 11.0916 11.2323 k = 0.3409 0.5642-0.0000 ( 5554 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3774 -14.3774 -14.3570 -14.3569 -14.0196 -14.0196 -13.9890 -13.9889 -13.9756 -13.9754 -13.9714 -13.9713 -2.1072 -2.1044 -2.0986 -2.0972 3.1672 3.1733 3.2689 3.2825 3.2887 3.3471 3.4254 3.4309 3.4523 3.4869 3.5024 3.6599 3.7737 3.7749 3.8487 3.8689 3.9094 3.9270 3.9633 4.0102 4.2780 4.5965 4.6289 4.6612 4.7705 4.8384 6.2104 6.2327 6.4154 6.8164 6.8993 6.9048 10.2021 10.5568 10.5610 10.6247 10.6585 10.7095 10.7329 10.7449 11.0823 11.2336 k = 0.3333 0.5774-0.0000 ( 5556 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3774 -14.3774 -14.3569 -14.3569 -14.0196 -14.0196 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9714 -2.1049 -2.1005 -2.1003 -2.1003 3.1704 3.1704 3.2696 3.2859 3.2859 3.3477 3.4262 3.4420 3.4420 3.4952 3.4952 3.6643 3.7722 3.7722 3.8611 3.8611 3.9176 3.9176 3.9613 4.0106 4.2776 4.6072 4.6369 4.6369 4.8000 4.8000 6.2200 6.2200 6.4204 6.8276 6.8938 6.8938 10.2067 10.5776 10.5776 10.5982 10.6881 10.6881 10.7310 10.7310 11.0788 11.2364 k = 0.3333 0.5774-0.0000 ( 5556 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3774 -14.3774 -14.3569 -14.3569 -14.0196 -14.0196 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9714 -2.1049 -2.1005 -2.1003 -2.1003 3.1704 3.1704 3.2696 3.2859 3.2859 3.3477 3.4262 3.4420 3.4420 3.4952 3.4952 3.6643 3.7722 3.7722 3.8611 3.8611 3.9176 3.9176 3.9613 4.0106 4.2776 4.6072 4.6369 4.6369 4.8000 4.8000 6.2200 6.2200 6.4204 6.8276 6.8938 6.8938 10.2067 10.5776 10.5776 10.5982 10.6881 10.6881 10.7310 10.7310 11.0788 11.2364 k = 0.3258 0.5642-0.0000 ( 5556 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3774 -14.3570 -14.3569 -14.0196 -14.0196 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9713 -2.1076 -2.1047 -2.0985 -2.0968 3.1673 3.1731 3.2689 3.2828 3.2884 3.3470 3.4244 3.4319 3.4522 3.4877 3.5015 3.6600 3.7707 3.7779 3.8483 3.8689 3.9091 3.9286 3.9624 4.0103 4.2779 4.6039 4.6185 4.6644 4.7724 4.8366 6.2100 6.2330 6.4149 6.8166 6.8930 6.9115 10.2023 10.5407 10.5868 10.6171 10.6655 10.7058 10.7312 10.7407 11.0826 11.2351 k = 0.3182 0.5511-0.0000 ( 5566 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3774 -14.3570 -14.3569 -14.0197 -14.0196 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9713 -2.1127 -2.1102 -2.0956 -2.0936 3.1641 3.1750 3.2669 3.2790 3.2898 3.3449 3.4152 3.4272 3.4613 3.4804 3.5052 3.6494 3.7691 3.7897 3.8311 3.8724 3.9041 3.9413 3.9649 4.0100 4.2784 4.6001 4.6071 4.6949 4.7592 4.8793 6.2023 6.2491 6.3986 6.7939 6.9032 6.9426 10.1900 10.4938 10.5916 10.6370 10.6460 10.7165 10.7372 10.7539 11.0939 11.2382 k = 0.3106 0.5380-0.0000 ( 5574 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3775 -14.3774 -14.3570 -14.3569 -14.0197 -14.0195 -13.9890 -13.9888 -13.9756 -13.9755 -13.9714 -13.9713 -2.1193 -2.1169 -2.0930 -2.0907 3.1608 3.1761 3.2635 3.2742 3.2901 3.3407 3.4029 3.4245 3.4688 3.4734 3.5059 3.6370 3.7676 3.8011 3.8144 3.8729 3.9021 3.9530 3.9685 4.0111 4.2789 4.5972 4.6029 4.7152 4.7720 4.9277 6.1964 6.2673 6.3733 6.7678 6.9238 6.9792 10.1708 10.4447 10.5923 10.6315 10.6517 10.7207 10.7480 10.7681 11.1109 11.2462 k = 0.3030 0.5249-0.0000 ( 5582 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3776 -14.3773 -14.3570 -14.3568 -14.0198 -14.0195 -13.9890 -13.9888 -13.9756 -13.9754 -13.9714 -13.9712 -2.1272 -2.1248 -2.0907 -2.0883 3.1575 3.1762 3.2586 3.2685 3.2892 3.3339 3.3913 3.4212 3.4667 3.4728 3.5046 3.6262 3.7660 3.7877 3.8218 3.8712 3.9020 3.9610 3.9732 4.0160 4.2793 4.5947 4.6062 4.7249 4.8110 4.9815 6.1917 6.2822 6.3461 6.7412 6.9532 7.0193 10.1461 10.3951 10.5853 10.6255 10.6611 10.7137 10.7692 10.7831 11.1303 11.2589 k = 0.2955 0.5117-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3776 -14.3773 -14.3570 -14.3567 -14.0198 -14.0195 -13.9889 -13.9887 -13.9755 -13.9753 -13.9714 -13.9711 -2.1364 -2.1341 -2.0888 -2.0863 3.1541 3.1749 3.2513 3.2624 3.2867 3.3243 3.3816 3.4174 3.4602 3.4702 3.5047 3.6182 3.7644 3.7680 3.8341 3.8682 3.9029 3.9635 3.9797 4.0264 4.2799 4.5928 4.6168 4.7380 4.8613 5.0404 6.1872 6.2710 6.3423 6.7159 6.9896 7.0620 10.1172 10.3455 10.5703 10.6273 10.6652 10.6996 10.7984 10.7996 11.1477 11.2658 k = 0.2879 0.4986-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3776 -14.3772 -14.3570 -14.3566 -14.0198 -14.0195 -13.9888 -13.9886 -13.9753 -13.9752 -13.9713 -13.9710 -2.1470 -2.1447 -2.0875 -2.0849 3.1506 3.1718 3.2409 3.2565 3.2818 3.3134 3.3741 3.4132 3.4539 3.4606 3.5082 3.6124 3.7495 3.7627 3.8440 3.8642 3.9041 3.9616 3.9885 4.0412 4.2809 4.5922 4.6345 4.7578 4.9176 5.1039 6.1819 6.2318 6.3655 6.6935 7.0315 7.1070 10.0853 10.2963 10.5509 10.6318 10.6628 10.6828 10.8195 10.8343 11.1593 11.2697 k = 0.2803 0.4855-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0831 -33.0831 -14.3776 -14.3772 -14.3569 -14.3565 -14.0199 -14.0195 -13.9887 -13.9884 -13.9752 -13.9751 -13.9713 -13.9709 -2.1590 -2.1567 -2.0866 -2.0839 3.1471 3.1667 3.2275 3.2508 3.2738 3.3036 3.3680 3.4088 3.4475 3.4477 3.5134 3.6068 3.7333 3.7610 3.8509 3.8597 3.9047 3.9574 3.9996 4.0582 4.2830 4.5939 4.6590 4.7841 4.9778 5.1718 6.1746 6.1848 6.3975 6.6757 7.0776 7.1542 10.0512 10.2480 10.5289 10.6356 10.6487 10.6705 10.8443 10.8759 11.1628 11.2672 k = 0.2727 0.4724-0.0000 ( 5570 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3776 -14.3771 -14.3568 -14.3563 -14.0200 -14.0194 -13.9885 -13.9882 -13.9751 -13.9749 -13.9712 -13.9708 -2.1723 -2.1700 -2.0862 -2.0835 3.1434 3.1590 3.2117 3.2449 3.2631 3.2961 3.3626 3.4045 3.4345 3.4411 3.5188 3.5997 3.7206 3.7592 3.8549 3.8553 3.9042 3.9520 4.0126 4.0761 4.2868 4.5990 4.6897 4.8161 5.0405 5.2437 6.1360 6.1642 6.4339 6.6640 7.1272 7.2033 10.0158 10.2005 10.5049 10.6246 10.6369 10.6622 10.8752 10.9228 11.1576 11.2546 k = 0.2652 0.4593-0.0000 ( 5562 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3776 -14.3770 -14.3567 -14.3562 -14.0200 -14.0194 -13.9883 -13.9880 -13.9749 -13.9748 -13.9712 -13.9707 -2.1869 -2.1847 -2.0864 -2.0836 3.1395 3.1486 3.1941 3.2388 3.2514 3.2903 3.3574 3.4004 3.4222 3.4345 3.5238 3.5898 3.7118 3.7573 3.8500 3.8577 3.9024 3.9460 4.0264 4.0939 4.2930 4.6081 4.7263 4.8531 5.1041 5.3192 6.0882 6.1501 6.4739 6.6597 7.1797 7.2542 9.9797 10.1542 10.4792 10.5962 10.6349 10.6531 10.9126 10.9742 11.1440 11.2307 k = 0.2576 0.4461-0.0000 ( 5566 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3776 -14.3770 -14.3566 -14.3560 -14.0201 -14.0194 -13.9881 -13.9877 -13.9747 -13.9746 -13.9711 -13.9706 -2.2029 -2.2008 -2.0872 -2.0843 3.1352 3.1359 3.1758 3.2324 3.2401 3.2852 3.3520 3.3964 3.4115 3.4279 3.5279 3.5769 3.7067 3.7554 3.8452 3.8586 3.8994 3.9398 4.0401 4.1110 4.3021 4.6219 4.7684 4.8947 5.1665 5.3979 6.0441 6.1320 6.5170 6.6635 7.2345 7.3069 9.9432 10.1092 10.4520 10.5645 10.6294 10.6425 10.9562 11.0294 11.1239 11.1985 k = 0.2500 0.4330-0.0000 ( 5570 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3776 -14.3769 -14.3565 -14.3558 -14.0201 -14.0194 -13.9878 -13.9875 -13.9745 -13.9744 -13.9710 -13.9704 -2.2202 -2.2181 -2.0885 -2.0856 3.1213 3.1297 3.1581 3.2256 3.2297 3.2804 3.3465 3.3925 3.4023 3.4213 3.5303 3.5622 3.7048 3.7534 3.8406 3.8583 3.8955 3.9334 4.0528 4.1269 4.3144 4.6405 4.8156 4.9404 5.2249 5.4793 6.0068 6.1106 6.5630 6.6754 7.2914 7.3611 9.9069 10.0656 10.4235 10.5297 10.6205 10.6305 11.0051 11.0832 11.1042 11.1623 k = 0.2424 0.4199-0.0000 ( 5558 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3775 -14.3768 -14.3563 -14.3556 -14.0202 -14.0194 -13.9875 -13.9872 -13.9743 -13.9742 -13.9709 -13.9703 -2.2387 -2.2367 -2.0903 -2.0874 3.1060 3.1214 3.1434 3.2186 3.2199 3.2760 3.3407 3.3888 3.3947 3.4148 3.5283 3.5492 3.7049 3.7515 3.8363 3.8570 3.8911 3.9270 4.0640 4.1413 4.3300 4.6640 4.8676 4.9902 5.2758 5.5629 5.9803 6.0871 6.6119 6.6950 7.3501 7.4168 9.8709 10.0236 10.3935 10.4915 10.6085 10.6175 11.0572 11.0707 11.1263 11.1513 k = 0.2348 0.4068-0.0000 ( 5574 PWs) bands (ev): -33.0881 -33.0881 -33.0832 -33.0832 -14.3775 -14.3767 -14.3563 -14.3554 -14.0202 -14.0193 -13.9873 -13.9869 -13.9740 -13.9739 -13.9709 -13.9703 -2.2584 -2.2564 -2.0927 -2.0898 3.0904 3.1084 3.1339 3.2103 3.2113 3.2716 3.3346 3.3852 3.3882 3.4082 3.5159 3.5444 3.7064 3.7495 3.8322 3.8547 3.8864 3.9207 4.0733 4.1541 4.3486 4.6920 4.9241 5.0438 5.3148 5.6478 5.9693 6.0633 6.6633 6.7216 7.4105 7.4738 9.8357 9.9832 10.3621 10.4498 10.5935 10.6036 11.0451 11.0813 11.1227 11.2128 k = 0.2273 0.3936-0.0000 ( 5576 PWs) bands (ev): -33.0881 -33.0881 -33.0832 -33.0832 -14.3775 -14.3767 -14.3561 -14.3552 -14.0203 -14.0193 -13.9870 -13.9865 -13.9737 -13.9737 -13.9708 -13.9702 -2.2792 -2.2772 -2.0956 -2.0926 3.0755 3.0932 3.1278 3.2006 3.2037 3.2674 3.3282 3.3817 3.3828 3.4019 3.4977 3.5441 3.7086 3.7476 3.8283 3.8517 3.8817 3.9145 4.0810 4.1651 4.3694 4.7237 4.9850 5.1011 5.3387 5.7327 5.9780 6.0417 6.7172 6.7544 7.4722 7.5321 9.8014 9.9446 10.3292 10.4046 10.5758 10.5891 11.0209 11.0505 11.1782 11.2743 k = 0.2197 0.3805-0.0000 ( 5584 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3775 -14.3766 -14.3559 -14.3550 -14.0203 -14.0193 -13.9866 -13.9862 -13.9735 -13.9734 -13.9707 -13.9701 -2.3009 -2.2991 -2.0989 -2.0960 3.0615 3.0782 3.1227 3.1907 3.1961 3.2633 3.3215 3.3782 3.3783 3.3957 3.4779 3.5442 3.7112 3.7459 3.8247 3.8478 3.8771 3.9085 4.0871 4.1746 4.3917 4.7578 5.0500 5.1619 5.3471 5.8138 6.0078 6.0273 6.7735 6.7927 7.5353 7.5915 9.7681 9.9080 10.2946 10.3560 10.5557 10.5740 10.9993 11.0196 11.2376 11.3330 k = 0.2121 0.3674-0.0000 ( 5578 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3775 -14.3765 -14.3557 -14.3547 -14.0204 -14.0193 -13.9862 -13.9857 -13.9732 -13.9731 -13.9706 -13.9699 -2.3235 -2.3217 -2.1028 -2.0998 3.0488 3.0642 3.1179 3.1805 3.1885 3.2593 3.3146 3.3742 3.3749 3.3898 3.4578 3.5439 3.7141 3.7444 3.8213 3.8435 3.8727 3.9027 4.0918 4.1827 4.4145 4.7924 5.1190 5.2259 5.3439 5.8801 6.0319 6.0567 6.8319 6.8358 7.5995 7.6519 9.7362 9.8735 10.2585 10.3046 10.5334 10.5582 10.9809 10.9918 11.2962 11.3780 k = 0.2045 0.3543-0.0000 ( 5578 PWs) bands (ev): -33.0881 -33.0881 -33.0833 -33.0833 -14.3774 -14.3764 -14.3555 -14.3545 -14.0204 -14.0193 -13.9858 -13.9853 -13.9728 -13.9728 -13.9706 -13.9698 -2.3469 -2.3452 -2.1070 -2.1041 3.0374 3.0517 3.1131 3.1700 3.1810 3.2551 3.3075 3.3706 3.3715 3.3843 3.4378 3.5433 3.7169 3.7430 3.8181 3.8387 3.8684 3.8972 4.0955 4.1895 4.4367 4.8243 5.1919 5.2914 5.3374 5.9127 6.0757 6.1205 6.8830 6.8924 7.6649 7.7133 9.7057 9.8410 10.2207 10.2505 10.5091 10.5417 10.9661 10.9676 11.3507 11.3861 k = 0.1970 0.3412-0.0000 ( 5574 PWs) bands (ev): -33.0882 -33.0882 -33.0833 -33.0833 -14.3773 -14.3763 -14.3553 -14.3542 -14.0204 -14.0193 -13.9853 -13.9848 -13.9725 -13.9724 -13.9705 -13.9697 -2.3709 -2.3693 -2.1117 -2.1088 3.0276 3.0407 3.1080 3.1593 3.1738 3.2508 3.3002 3.3670 3.3681 3.3792 3.4184 3.5422 3.7198 3.7419 3.8151 3.8337 3.8643 3.8921 4.0982 4.1952 4.4573 4.8496 5.2684 5.3229 5.3710 5.9202 6.1510 6.1951 6.9339 6.9547 7.7313 7.7755 9.6767 9.8109 10.1815 10.1946 10.4832 10.5242 10.9469 10.9548 11.3839 11.3900 k = 0.1894 0.3280-0.0000 ( 5574 PWs) bands (ev): -33.0882 -33.0882 -33.0833 -33.0833 -14.3773 -14.3762 -14.3551 -14.3539 -14.0204 -14.0192 -13.9849 -13.9844 -13.9721 -13.9721 -13.9704 -13.9696 -2.3954 -2.3939 -2.1167 -2.1138 3.0192 3.0313 3.1026 3.1484 3.1670 3.2462 3.2929 3.3628 3.3646 3.3748 3.4002 3.5408 3.7225 3.7410 3.8122 3.8287 3.8602 3.8873 4.1002 4.2001 4.4755 4.8634 5.3290 5.3485 5.4434 5.9231 6.2379 6.2770 6.9880 7.0187 7.7987 7.8384 9.6493 9.7830 10.1373 10.1412 10.4557 10.5054 10.9294 10.9471 11.3799 11.3943 k = 0.1818 0.3149-0.0000 ( 5570 PWs) bands (ev): -33.0882 -33.0882 -33.0834 -33.0834 -14.3772 -14.3761 -14.3548 -14.3537 -14.0204 -14.0192 -13.9844 -13.9839 -13.9718 -13.9717 -13.9704 -13.9696 -2.4203 -2.4188 -2.1220 -2.1192 3.0123 3.0235 3.0969 3.1376 3.1607 3.2414 3.2854 3.3565 3.3608 3.3712 3.3847 3.5391 3.7252 3.7404 3.8094 3.8239 3.8561 3.8829 4.1013 4.2041 4.4903 4.8622 5.3489 5.4319 5.5210 5.9300 6.3286 6.3638 7.0449 7.0841 7.8671 7.9020 9.6236 9.7576 10.0793 10.1001 10.4268 10.4852 10.9146 10.9428 11.3756 11.3927 k = 0.1742 0.3018-0.0000 ( 5566 PWs) bands (ev): -33.0882 -33.0882 -33.0834 -33.0834 -14.3771 -14.3760 -14.3545 -14.3534 -14.0204 -14.0192 -13.9839 -13.9833 -13.9714 -13.9714 -13.9703 -13.9695 -2.4455 -2.4441 -2.1276 -2.1248 3.0068 3.0171 3.0907 3.1267 3.1549 3.2363 3.2779 3.3457 3.3567 3.3686 3.3741 3.5374 3.7278 3.7401 3.8068 3.8193 3.8520 3.8789 4.1018 4.2076 4.5011 4.8461 5.3856 5.5185 5.6020 5.9438 6.4205 6.4537 7.1042 7.1509 7.9364 7.9662 9.5995 9.7345 10.0210 10.0588 10.3965 10.4631 10.9017 10.9416 11.3715 11.3911 k = 0.1667 0.2887-0.0000 ( 5570 PWs) bands (ev): -33.0883 -33.0883 -33.0834 -33.0834 -14.3771 -14.3760 -14.3543 -14.3531 -14.0204 -14.0192 -13.9833 -13.9828 -13.9710 -13.9710 -13.9702 -13.9694 -2.4708 -2.4694 -2.1334 -2.1307 3.0024 3.0121 3.0843 3.1159 3.1497 3.2308 3.2704 3.3310 3.3524 3.3670 3.3682 3.5358 3.7303 3.7400 3.8042 3.8150 3.8478 3.8753 4.1016 4.2104 4.5077 4.8179 5.4371 5.6080 5.6862 5.9661 6.5122 6.5453 7.1655 7.2187 8.0067 8.0310 9.5772 9.7139 9.9632 10.0178 10.3647 10.4389 10.8901 10.9432 11.3627 11.3681 k = 0.1591 0.2756-0.0000 ( 5566 PWs) bands (ev): -33.0883 -33.0883 -33.0834 -33.0834 -14.3770 -14.3759 -14.3540 -14.3528 -14.0204 -14.0192 -13.9828 -13.9823 -13.9707 -13.9707 -13.9701 -13.9693 -2.4960 -2.4947 -2.1394 -2.1367 2.9992 3.0081 3.0776 3.1054 3.1451 3.2250 3.2628 3.3147 3.3480 3.3644 3.3662 3.5343 3.7326 3.7402 3.8017 3.8111 3.8436 3.8722 4.1007 4.2128 4.5099 4.7813 5.5002 5.7000 5.7733 5.9977 6.6030 6.6374 7.2284 7.2875 8.0781 8.0964 9.5565 9.6957 9.9062 9.9778 10.3311 10.4122 10.8785 10.9471 11.3118 11.3644 k = 0.1515 0.2624-0.0000 ( 5566 PWs) bands (ev): -33.0883 -33.0883 -33.0835 -33.0835 -14.3769 -14.3758 -14.3537 -14.3525 -14.0204 -14.0192 -13.9822 -13.9817 -13.9703 -13.9703 -13.9700 -13.9692 -2.5210 -2.5199 -2.1456 -2.1430 2.9970 3.0052 3.0708 3.0952 3.1411 3.2191 3.2552 3.2981 3.3436 3.3613 3.3664 3.5332 3.7349 3.7406 3.7993 3.8074 3.8393 3.8696 4.0989 4.2145 4.5080 4.7397 5.5722 5.7940 5.8631 6.0389 6.6921 6.7291 7.2926 7.3570 8.1506 8.1624 9.5374 9.6798 9.8507 9.9394 10.2954 10.3825 10.8657 10.9527 11.2553 11.2975 k = 0.1439 0.2493-0.0000 ( 5572 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3769 -14.3757 -14.3534 -14.3522 -14.0204 -14.0192 -13.9817 -13.9812 -13.9701 -13.9699 -13.9698 -13.9691 -2.5458 -2.5447 -2.1518 -2.1493 2.9955 3.0030 3.0641 3.0854 3.1376 3.2130 3.2475 3.2819 3.3393 3.3585 3.3673 3.5325 3.7372 3.7412 3.7969 3.8042 3.8350 3.8675 4.0964 4.2158 4.5022 4.6951 5.6509 5.8893 5.9556 6.0900 6.7790 6.8195 7.3575 7.4272 8.2243 8.2292 9.5196 9.6659 9.7971 9.9032 10.2572 10.3495 10.8502 10.9590 11.1953 11.2255 k = 0.1364 0.2362-0.0000 ( 5560 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3768 -14.3756 -14.3531 -14.3519 -14.0204 -14.0191 -13.9811 -13.9807 -13.9699 -13.9695 -13.9694 -13.9690 -2.5701 -2.5691 -2.1580 -2.1556 2.9946 3.0014 3.0576 3.0761 3.1346 3.2070 3.2398 3.2662 3.3352 3.3557 3.3690 3.5322 3.7394 3.7421 3.7947 3.8013 3.8308 3.8658 4.0929 4.2163 4.4933 4.6494 5.7349 5.9848 6.0504 6.1514 6.8632 6.9078 7.4227 7.4981 8.2968 8.2993 9.5029 9.6532 9.7465 9.8699 10.2160 10.3126 10.8302 10.9647 11.1340 11.1503 k = 0.1288 0.2231-0.0000 ( 5558 PWs) bands (ev): -33.0884 -33.0884 -33.0835 -33.0835 -14.3767 -14.3756 -14.3528 -14.3517 -14.0204 -14.0192 -13.9805 -13.9801 -13.9699 -13.9692 -13.9691 -13.9689 -2.5939 -2.5929 -2.1643 -2.1619 2.9940 3.0000 3.0516 3.0673 3.1322 3.2010 3.2320 3.2512 3.3312 3.3528 3.3716 3.5324 3.7416 3.7431 3.7925 3.7987 3.8266 3.8647 4.0885 4.2161 4.4818 4.6037 5.8230 6.0791 6.1474 6.2235 6.9443 6.9932 7.4879 7.5695 8.3653 8.3758 9.4872 9.6395 9.7013 9.8400 10.1711 10.2711 10.8036 10.9672 11.0738 11.0743 k = 0.1212 0.2099-0.0000 ( 5556 PWs) bands (ev): -33.0884 -33.0884 -33.0836 -33.0836 -14.3766 -14.3755 -14.3525 -14.3514 -14.0204 -14.0192 -13.9800 -13.9796 -13.9698 -13.9690 -13.9687 -13.9687 -2.6170 -2.6160 -2.1705 -2.1682 2.9937 2.9987 3.0461 3.0593 3.1302 3.1953 3.2242 3.2369 3.3275 3.3498 3.3749 3.5330 3.7439 3.7443 3.7904 3.7965 3.8225 3.8640 4.0830 4.2150 4.4686 4.5588 5.9144 6.1708 6.2463 6.3067 7.0219 7.0748 7.5524 7.6415 8.4350 8.4537 9.4722 9.6181 9.6683 9.8141 10.1220 10.2244 10.7687 10.9554 11.0088 11.0171 k = 0.1136 0.1968-0.0000 ( 5560 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3765 -14.3755 -14.3523 -14.3512 -14.0203 -14.0192 -13.9794 -13.9791 -13.9698 -13.9689 -13.9684 -13.9683 -2.6392 -2.6384 -2.1765 -2.1744 2.9931 2.9972 3.0413 3.0520 3.1286 3.1898 3.2165 3.2234 3.3239 3.3467 3.3789 3.5339 3.7456 3.7463 3.7884 3.7947 3.8184 3.8637 4.0765 4.2125 4.4543 4.5156 6.0083 6.2597 6.3469 6.3998 7.0958 7.1521 7.6157 7.7140 8.5060 8.5330 9.4578 9.5842 9.6525 9.7923 10.0680 10.1715 10.7250 10.8982 10.9651 10.9849 k = 0.1061 0.1837-0.0000 ( 5564 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3765 -14.3754 -14.3520 -14.3509 -14.0203 -14.0192 -13.9789 -13.9786 -13.9697 -13.9689 -13.9680 -13.9680 -2.6606 -2.6598 -2.1825 -2.1804 2.9923 2.9952 3.0375 3.0457 3.1275 3.1846 3.2088 3.2107 3.3207 3.3436 3.3837 3.5352 3.7470 3.7488 3.7865 3.7932 3.8145 3.8640 4.0689 4.2083 4.4394 4.4750 6.1040 6.3466 6.4488 6.5009 7.1659 7.2246 7.6771 7.7870 8.5783 8.6138 9.4441 9.5461 9.6456 9.7749 10.0085 10.1117 10.6740 10.8241 10.9174 10.9742 k = 0.0985 0.1706-0.0000 ( 5570 PWs) bands (ev): -33.0885 -33.0885 -33.0836 -33.0836 -14.3764 -14.3754 -14.3517 -14.3507 -14.0203 -14.0192 -13.9784 -13.9781 -13.9696 -13.9688 -13.9677 -13.9677 -2.6810 -2.6803 -2.1882 -2.1863 2.9909 2.9927 3.0346 3.0405 3.1269 3.1798 3.1989 3.2012 3.3176 3.3404 3.3891 3.5366 3.7485 3.7515 3.7846 3.7920 3.8107 3.8647 4.0602 4.2017 4.4247 4.4378 6.2008 6.4323 6.5517 6.6074 7.2322 7.2920 7.7360 7.8600 8.6521 8.6960 9.4310 9.5093 9.6423 9.7619 9.9429 10.0445 10.6183 10.7503 10.8721 10.9591 k = 0.0909 0.1575-0.0000 ( 5569 PWs) bands (ev): -33.0885 -33.0885 -33.0837 -33.0837 -14.3763 -14.3754 -14.3514 -14.3505 -14.0203 -14.0193 -13.9779 -13.9776 -13.9696 -13.9688 -13.9674 -13.9674 -2.7003 -2.6996 -2.1936 -2.1918 2.9890 2.9897 3.0325 3.0363 3.1268 3.1754 3.1881 3.1940 3.3149 3.3372 3.3953 3.5380 3.7501 3.7544 3.7829 3.7914 3.8072 3.8659 4.0505 4.1920 4.4051 4.4104 6.2979 6.5173 6.6552 6.7175 7.2950 7.3542 7.7917 7.9325 8.7273 8.7791 9.4189 9.4757 9.6408 9.7530 9.8712 9.9697 10.5613 10.6795 10.8271 10.9361 k = 0.0833 0.1443-0.0000 ( 5573 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3762 -14.3754 -14.3512 -14.3503 -14.0202 -14.0193 -13.9774 -13.9772 -13.9695 -13.9687 -13.9671 -13.9670 -2.7183 -2.7177 -2.1988 -2.1971 2.9863 2.9864 3.0309 3.0332 3.1271 3.1712 3.1782 3.1870 3.3125 3.3341 3.4020 3.5392 3.7517 3.7575 3.7813 3.7912 3.8040 3.8675 4.0399 4.1784 4.3778 4.3970 6.3945 6.6009 6.7589 6.8297 7.3550 7.4117 7.8433 8.0036 8.8039 8.8630 9.4082 9.4466 9.6403 9.7479 9.7940 9.8880 10.5053 10.6126 10.7801 10.9019 k = 0.0758 0.1312-0.0000 ( 5573 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3762 -14.3754 -14.3509 -14.3501 -14.0202 -14.0193 -13.9769 -13.9768 -13.9694 -13.9687 -13.9668 -13.9668 -2.7351 -2.7345 -2.2036 -2.2021 2.9828 2.9832 3.0298 3.0310 3.1279 3.1672 3.1693 3.1806 3.3104 3.3310 3.4094 3.5400 3.7535 3.7606 3.7798 3.7915 3.8013 3.8696 4.0286 4.1605 4.3563 4.3845 6.4894 6.6823 6.8623 6.9428 7.4127 7.4649 7.8901 8.0718 8.8814 8.9470 9.3989 9.4229 9.6394 9.7124 9.7462 9.8011 10.4518 10.5495 10.7294 10.8521 k = 0.0682 0.1181-0.0000 ( 5565 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3761 -14.3753 -14.3507 -14.3499 -14.0201 -14.0193 -13.9765 -13.9764 -13.9694 -13.9687 -13.9665 -13.9665 -2.7505 -2.7500 -2.2081 -2.2067 2.9793 2.9799 3.0290 3.0295 3.1291 3.1614 3.1633 3.1749 3.3087 3.3280 3.4173 3.5403 3.7553 3.7636 3.7784 3.7921 3.8000 3.8722 4.0168 4.1387 4.3405 4.3733 6.5816 6.7600 6.9648 7.0557 7.4691 7.5147 7.9314 8.1352 8.9593 9.0305 9.3908 9.4058 9.6289 9.6324 9.7160 9.7473 10.4018 10.4895 10.6736 10.7837 k = 0.0606 0.1050-0.0000 ( 5569 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3760 -14.3753 -14.3505 -14.3498 -14.0201 -14.0194 -13.9762 -13.9761 -13.9693 -13.9686 -13.9663 -13.9663 -2.7644 -2.7640 -2.2122 -2.2109 2.9758 2.9764 3.0282 3.0283 3.1307 3.1544 3.1591 3.1701 3.3073 3.3252 3.4256 3.5397 3.7571 3.7661 3.7772 3.7913 3.8018 3.8751 4.0047 4.1138 4.3295 4.3632 6.6697 6.8324 7.0659 7.1672 7.5250 7.5618 7.9665 8.1916 9.0363 9.1121 9.3815 9.3966 9.5487 9.5842 9.6700 9.7508 10.3552 10.4320 10.6112 10.6987 k = 0.0530 0.0919-0.0000 ( 5571 PWs) bands (ev): -33.0886 -33.0886 -33.0837 -33.0837 -14.3759 -14.3753 -14.3503 -14.3497 -14.0201 -14.0194 -13.9758 -13.9757 -13.9692 -13.9686 -13.9661 -13.9661 -2.7769 -2.7765 -2.2159 -2.2148 2.9726 2.9731 3.0274 3.0275 3.1325 3.1485 3.1547 3.1663 3.3063 3.3225 3.4344 3.5382 3.7590 3.7679 3.7760 3.7894 3.8071 3.8785 3.9926 4.0870 4.3222 4.3542 6.7524 6.8979 7.1648 7.2761 7.5809 7.6072 7.9952 8.2385 9.1093 9.1904 9.3636 9.3963 9.4842 9.4950 9.6660 9.7563 10.3120 10.3763 10.5417 10.6034 k = 0.0455 0.0787-0.0000 ( 5575 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3759 -14.3753 -14.3501 -14.3496 -14.0200 -14.0195 -13.9755 -13.9755 -13.9692 -13.9686 -13.9659 -13.9659 -2.7878 -2.7875 -2.2191 -2.2182 2.9696 2.9700 3.0267 3.0269 3.1345 3.1437 3.1502 3.1632 3.3056 3.3199 3.4435 3.5358 3.7609 3.7691 3.7750 3.7871 3.8150 3.8824 3.9806 4.0596 4.3176 4.3464 6.8281 6.9547 7.2606 7.3804 7.6366 7.6515 8.0180 8.2733 9.1664 9.2610 9.3330 9.3896 9.4197 9.4534 9.6713 9.7634 10.2717 10.3219 10.4655 10.5039 k = 0.0379 0.0656-0.0000 ( 5575 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3758 -14.3753 -14.3500 -14.3495 -14.0200 -14.0195 -13.9753 -13.9753 -13.9691 -13.9687 -13.9657 -13.9657 -2.7971 -2.7968 -2.2219 -2.2211 2.9671 2.9673 3.0262 3.0263 3.1363 3.1402 3.1460 3.1606 3.3053 3.3175 3.4528 3.5322 3.7629 3.7698 3.7741 3.7848 3.8253 3.8867 3.9690 4.0321 4.3149 4.3395 6.8954 7.0018 7.3522 7.4778 7.6907 7.6948 8.0363 8.2938 9.1682 9.2787 9.3365 9.3517 9.4340 9.4502 9.6817 9.7718 10.2338 10.2691 10.3844 10.4051 k = 0.0303 0.0525-0.0000 ( 5577 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3757 -14.3754 -14.3498 -14.3495 -14.0199 -14.0195 -13.9751 -13.9751 -13.9691 -13.9687 -13.9655 -13.9655 -2.8048 -2.8046 -2.2241 -2.2235 2.9649 2.9650 3.0257 3.0258 3.1357 3.1402 3.1421 3.1583 3.3053 3.3153 3.4623 3.5275 3.7650 3.7702 3.7733 3.7825 3.8378 3.8915 3.9579 4.0054 4.3136 4.3337 6.9532 7.0384 7.4382 7.5646 7.7364 7.7401 8.0534 8.2987 9.1178 9.2004 9.3862 9.3993 9.4610 9.4639 9.6982 9.7810 10.1978 10.2188 10.3017 10.3107 k = 0.0227 0.0394-0.0000 ( 5587 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3757 -14.3754 -14.3498 -14.3495 -14.0199 -14.0196 -13.9750 -13.9750 -13.9690 -13.9687 -13.9654 -13.9654 -2.8108 -2.8106 -2.2259 -2.2254 2.9631 2.9632 3.0253 3.0253 3.1339 3.1388 3.1423 3.1560 3.3057 3.3133 3.4718 3.5217 3.7670 3.7704 3.7727 3.7802 3.8521 3.8968 3.9475 3.9797 4.3135 4.3286 7.0008 7.0644 7.5167 7.6353 7.7747 7.7807 8.0741 8.2883 9.0608 9.1219 9.4363 9.4445 9.4864 9.4990 9.7215 9.7899 10.1638 10.1727 10.2223 10.2252 k = 0.0152 0.0262-0.0000 ( 5591 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3754 -14.3497 -14.3495 -14.0198 -14.0196 -13.9749 -13.9749 -13.9690 -13.9688 -13.9654 -13.9654 -2.8151 -2.8150 -2.2272 -2.2268 2.9619 2.9619 3.0250 3.0250 3.1327 3.1361 3.1446 3.1538 3.3063 3.3115 3.4812 3.5150 3.7689 3.7706 3.7723 3.7780 3.8682 3.9022 3.9381 3.9557 4.3142 4.3243 7.0377 7.0798 7.5856 7.6819 7.8064 7.8098 8.1033 8.2638 9.0151 9.0566 9.4638 9.4741 9.5304 9.5370 9.7494 9.7968 10.1325 10.1328 10.1538 10.1552 k = 0.0076 0.0131-0.0000 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3755 -14.3496 -14.3495 -14.0198 -14.0197 -13.9748 -13.9748 -13.9689 -13.9688 -13.9654 -13.9654 -2.8177 -2.8176 -2.2279 -2.2277 2.9611 2.9611 3.0248 3.0248 3.1323 3.1341 3.1470 3.1516 3.3072 3.3098 3.4904 3.5074 3.7704 3.7707 3.7724 3.7759 3.8855 3.9065 3.9300 3.9349 4.3157 4.3208 7.0639 7.0848 7.6419 7.6970 7.8277 7.8283 8.1420 8.2282 8.9888 9.0100 9.4788 9.4866 9.5696 9.5706 9.7752 9.7987 10.0963 10.0986 10.1150 10.1158 k = 0.0000 0.0000 0.0000 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3756 -14.3495 -14.3495 -14.0198 -14.0198 -13.9748 -13.9748 -13.9689 -13.9689 -13.9653 -13.9653 -2.8185 -2.8185 -2.2281 -2.2281 2.9608 2.9608 3.0247 3.0247 3.1328 3.1328 3.1493 3.1493 3.3084 3.3084 3.4992 3.4992 3.7708 3.7708 3.7739 3.7739 3.9018 3.9018 3.9254 3.9254 4.3179 4.3179 7.0795 7.0795 7.6812 7.6812 7.8352 7.8352 8.1857 8.1857 8.9867 8.9867 9.4869 9.4869 9.5848 9.5848 9.7923 9.7923 10.0802 10.0802 10.1052 10.1052 k = 0.0000 0.0000 0.0000 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3756 -14.3756 -14.3495 -14.3495 -14.0198 -14.0198 -13.9748 -13.9748 -13.9689 -13.9689 -13.9653 -13.9653 -2.8185 -2.8185 -2.2281 -2.2281 2.9608 2.9608 3.0247 3.0247 3.1328 3.1328 3.1493 3.1493 3.3084 3.3084 3.4992 3.4992 3.7708 3.7708 3.7739 3.7739 3.9018 3.9018 3.9254 3.9254 4.3179 4.3179 7.0795 7.0795 7.6812 7.6812 7.8352 7.8352 8.1857 8.1857 8.9867 8.9867 9.4869 9.4869 9.5848 9.5848 9.7923 9.7923 10.0802 10.0802 10.1052 10.1052 k = 0.0000 0.0000 0.0146 ( 5599 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3755 -14.3755 -14.3495 -14.3495 -14.0197 -14.0197 -13.9748 -13.9748 -13.9689 -13.9689 -13.9654 -13.9654 -2.8178 -2.8178 -2.2290 -2.2290 2.9609 2.9609 3.0246 3.0246 3.1328 3.1328 3.1494 3.1494 3.3082 3.3082 3.4976 3.4976 3.7710 3.7710 3.7738 3.7738 3.8992 3.8992 3.9252 3.9252 4.3252 4.3252 7.0809 7.0809 7.6715 7.6715 7.8367 7.8367 8.1871 8.1871 8.9872 8.9872 9.4737 9.4737 9.5789 9.5789 9.8116 9.8116 10.0813 10.0813 10.1063 10.1063 k = 0.0000 0.0000 0.0293 ( 5600 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3754 -14.3754 -14.3496 -14.3496 -14.0195 -14.0195 -13.9747 -13.9747 -13.9692 -13.9692 -13.9654 -13.9654 -2.8156 -2.8156 -2.2318 -2.2318 2.9611 2.9611 3.0243 3.0243 3.1330 3.1330 3.1495 3.1495 3.3075 3.3075 3.4931 3.4931 3.7716 3.7716 3.7738 3.7738 3.8920 3.8920 3.9245 3.9245 4.3464 4.3464 7.0848 7.0848 7.6434 7.6434 7.8414 7.8414 8.1904 8.1904 8.9888 8.9888 9.4418 9.4418 9.5614 9.5614 9.8619 9.8619 10.0843 10.0843 10.1096 10.1096 k = 0.0000 0.0000 0.0439 ( 5576 PWs) bands (ev): -33.0887 -33.0887 -33.0838 -33.0838 -14.3751 -14.3751 -14.3497 -14.3497 -14.0192 -14.0192 -13.9746 -13.9746 -13.9695 -13.9695 -13.9654 -13.9654 -2.8119 -2.8119 -2.2364 -2.2364 2.9616 2.9616 3.0239 3.0239 3.1332 3.1332 3.1498 3.1498 3.3065 3.3065 3.4858 3.4858 3.7727 3.7727 3.7737 3.7737 3.8818 3.8818 3.9234 3.9234 4.3797 4.3797 7.0913 7.0913 7.5992 7.5992 7.8491 7.8491 8.1936 8.1936 8.9915 8.9915 9.4031 9.4031 9.5335 9.5335 9.9310 9.9310 10.0894 10.0894 10.1151 10.1151 k = 0.0000 0.0000 0.0585 ( 5576 PWs) bands (ev): -33.0886 -33.0886 -33.0839 -33.0839 -14.3748 -14.3748 -14.3499 -14.3499 -14.0188 -14.0188 -13.9745 -13.9745 -13.9700 -13.9700 -13.9655 -13.9655 -2.8068 -2.8068 -2.2429 -2.2429 2.9621 2.9621 3.0232 3.0232 3.1335 3.1335 3.1502 3.1502 3.3051 3.3051 3.4760 3.4760 3.7735 3.7735 3.7741 3.7741 3.8701 3.8701 3.9218 3.9218 4.4233 4.4233 7.1005 7.1005 7.5417 7.5417 7.8599 7.8599 8.1945 8.1945 8.9952 8.9952 9.3643 9.3643 9.4964 9.4964 10.0114 10.0114 10.0965 10.0965 10.1227 10.1227 k = 0.0000 0.0000 0.0732 ( 5576 PWs) bands (ev): -33.0885 -33.0885 -33.0840 -33.0840 -14.3745 -14.3745 -14.3502 -14.3502 -14.0182 -14.0182 -13.9744 -13.9744 -13.9707 -13.9707 -13.9656 -13.9656 -2.8002 -2.8002 -2.2511 -2.2511 2.9629 2.9629 3.0223 3.0223 3.1339 3.1339 3.1506 3.1506 3.3032 3.3032 3.4641 3.4641 3.7733 3.7733 3.7759 3.7759 3.8582 3.8582 3.9197 3.9197 4.4753 4.4753 7.1122 7.1122 7.4735 7.4735 7.8737 7.8737 8.1911 8.1911 8.9999 8.9999 9.3288 9.3288 9.4516 9.4516 10.0991 10.0991 10.1056 10.1056 10.1324 10.1324 k = 0.0000 0.0000 0.0878 ( 5576 PWs) bands (ev): -33.0885 -33.0885 -33.0840 -33.0840 -14.3740 -14.3740 -14.3505 -14.3505 -14.0176 -14.0176 -13.9743 -13.9743 -13.9716 -13.9716 -13.9658 -13.9658 -2.7923 -2.7923 -2.2610 -2.2610 2.9637 2.9637 3.0212 3.0212 3.1344 3.1344 3.1511 3.1511 3.3011 3.3011 3.4506 3.4506 3.7731 3.7731 3.7781 3.7781 3.8468 3.8468 3.9172 3.9172 4.5344 4.5344 7.1265 7.1265 7.3968 7.3968 7.8906 7.8906 8.1823 8.1823 9.0055 9.0055 9.2977 9.2977 9.4008 9.4008 10.1167 10.1167 10.1443 10.1443 10.1914 10.1914 k = 0.0000 0.0000 0.1024 ( 5558 PWs) bands (ev): -33.0884 -33.0884 -33.0841 -33.0841 -14.3734 -14.3734 -14.3508 -14.3508 -14.0167 -14.0167 -13.9741 -13.9741 -13.9726 -13.9726 -13.9659 -13.9659 -2.7830 -2.7830 -2.2725 -2.2725 2.9648 2.9648 3.0200 3.0200 3.1351 3.1351 3.1517 3.1517 3.2986 3.2986 3.4359 3.4359 3.7729 3.7729 3.7807 3.7807 3.8365 3.8365 3.9144 3.9144 4.5994 4.5994 7.1432 7.1432 7.3132 7.3132 7.9105 7.9105 8.1677 8.1677 9.0121 9.0121 9.2715 9.2715 9.3453 9.3453 10.1298 10.1298 10.1583 10.1583 10.2862 10.2862 k = 0.0000 0.0000 0.1171 ( 5558 PWs) bands (ev): -33.0883 -33.0883 -33.0842 -33.0842 -14.3728 -14.3728 -14.3513 -14.3513 -14.0158 -14.0158 -13.9739 -13.9739 -13.9737 -13.9737 -13.9661 -13.9661 -2.7723 -2.7723 -2.2856 -2.2856 2.9659 2.9659 3.0186 3.0186 3.1358 3.1358 3.1524 3.1524 3.2960 3.2960 3.4206 3.4206 3.7727 3.7727 3.7837 3.7837 3.8274 3.8274 3.9110 3.9110 4.6696 4.6696 7.1625 7.1625 7.2242 7.2242 7.9332 7.9332 8.1471 8.1471 9.0195 9.0195 9.2500 9.2500 9.2861 9.2861 10.1447 10.1447 10.1743 10.1743 10.3811 10.3811 k = 0.0000 0.0000 0.1317 ( 5558 PWs) bands (ev): -33.0882 -33.0882 -33.0843 -33.0843 -14.3721 -14.3721 -14.3518 -14.3518 -14.0148 -14.0148 -13.9749 -13.9749 -13.9737 -13.9737 -13.9663 -13.9663 -2.7604 -2.7604 -2.3000 -2.3000 2.9673 2.9673 3.0170 3.0170 3.1367 3.1367 3.1531 3.1531 3.2932 3.2932 3.4051 3.4051 3.7724 3.7724 3.7869 3.7869 3.8193 3.8193 3.9074 3.9074 4.7444 4.7444 7.1307 7.1307 7.1842 7.1842 7.9589 7.9589 8.1209 8.1209 9.0277 9.0277 9.2243 9.2243 9.2329 9.2329 10.1617 10.1617 10.1924 10.1924 10.4729 10.4729 k = 0.0000 0.0000 0.1464 ( 5558 PWs) bands (ev): -33.0880 -33.0880 -33.0844 -33.0844 -14.3714 -14.3714 -14.3523 -14.3523 -14.0137 -14.0137 -13.9763 -13.9763 -13.9734 -13.9734 -13.9665 -13.9665 -2.7473 -2.7473 -2.3158 -2.3158 2.9687 2.9687 3.0153 3.0153 3.1377 3.1377 3.1538 3.1538 3.2902 3.2902 3.3898 3.3898 3.7722 3.7722 3.7905 3.7905 3.8124 3.8124 3.9033 3.9033 4.8234 4.8234 7.0336 7.0336 7.2082 7.2082 7.9875 7.9875 8.0897 8.0897 9.0366 9.0366 9.1608 9.1608 9.2194 9.2194 10.1805 10.1805 10.2125 10.2125 10.5566 10.5566 k = 0.0000 0.0000 0.1610 ( 5552 PWs) bands (ev): -33.0879 -33.0879 -33.0846 -33.0846 -14.3706 -14.3706 -14.3529 -14.3529 -14.0124 -14.0124 -13.9777 -13.9777 -13.9732 -13.9732 -13.9668 -13.9668 -2.7330 -2.7330 -2.3328 -2.3328 2.9703 2.9703 3.0135 3.0135 3.1388 3.1388 3.1545 3.1545 3.2872 3.2872 3.3749 3.3749 3.7721 3.7721 3.7944 3.7944 3.8064 3.8064 3.8991 3.8991 4.9061 4.9061 6.9337 6.9337 7.2346 7.2346 8.0188 8.0188 8.0543 8.0543 9.0461 9.0461 9.0960 9.0960 9.2089 9.2089 10.2011 10.2011 10.2347 10.2347 10.6246 10.6246 k = 0.0000 0.0000 0.1756 ( 5552 PWs) bands (ev): -33.0878 -33.0878 -33.0847 -33.0847 -14.3697 -14.3697 -14.3535 -14.3535 -14.0111 -14.0111 -13.9793 -13.9793 -13.9729 -13.9729 -13.9670 -13.9670 -2.7175 -2.7175 -2.3509 -2.3509 2.9720 2.9720 3.0116 3.0116 3.1401 3.1401 3.1552 3.1552 3.2843 3.2843 3.3607 3.3607 3.7720 3.7720 3.7986 3.7986 3.8012 3.8012 3.8945 3.8945 4.9921 4.9921 6.8315 6.8315 7.2632 7.2632 8.0154 8.0154 8.0529 8.0529 9.0307 9.0307 9.0561 9.0561 9.2007 9.2007 10.2236 10.2236 10.2588 10.2588 10.6690 10.6690 k = 0.0000 0.0000 0.1903 ( 5546 PWs) bands (ev): -33.0876 -33.0876 -33.0848 -33.0848 -14.3688 -14.3688 -14.3542 -14.3542 -14.0096 -14.0096 -13.9810 -13.9810 -13.9726 -13.9726 -13.9673 -13.9673 -2.7011 -2.7011 -2.3699 -2.3699 2.9737 2.9737 3.0096 3.0096 3.1416 3.1416 3.1559 3.1559 3.2815 3.2815 3.3473 3.3473 3.7720 3.7720 3.7967 3.7967 3.8030 3.8030 3.8897 3.8897 5.0812 5.0812 6.7276 6.7276 7.2939 7.2939 7.9737 7.9737 8.0897 8.0897 8.9652 8.9652 9.0666 9.0666 9.1942 9.1942 10.2478 10.2478 10.2849 10.2849 10.6879 10.6879 k = 0.0000 0.0000 0.2049 ( 5546 PWs) bands (ev): -33.0875 -33.0875 -33.0850 -33.0850 -14.3679 -14.3679 -14.3549 -14.3549 -14.0081 -14.0081 -13.9827 -13.9827 -13.9723 -13.9723 -13.9676 -13.9676 -2.6836 -2.6836 -2.3898 -2.3898 2.9757 2.9757 3.0075 3.0075 3.1431 3.1431 3.1565 3.1565 3.2790 3.2790 3.3349 3.3349 3.7721 3.7721 3.7927 3.7927 3.8078 3.8078 3.8846 3.8846 5.1732 5.1732 6.6223 6.6223 7.3268 7.3268 7.9299 7.9299 8.1290 8.1290 8.8999 8.8999 9.0772 9.0772 9.1886 9.1886 10.2737 10.2737 10.3129 10.3129 10.6869 10.6869 k = 0.0000 0.0000 0.2195 ( 5534 PWs) bands (ev): -33.0873 -33.0873 -33.0852 -33.0852 -14.3669 -14.3669 -14.3557 -14.3557 -14.0065 -14.0065 -13.9845 -13.9845 -13.9720 -13.9720 -13.9679 -13.9679 -2.6652 -2.6652 -2.4103 -2.4103 2.9777 2.9777 3.0053 3.0053 3.1448 3.1448 3.1570 3.1570 3.2770 3.2770 3.3237 3.3237 3.7723 3.7723 3.7894 3.7894 3.8127 3.8127 3.8793 3.8793 5.2677 5.2677 6.5160 6.5160 7.3617 7.3617 7.8846 7.8846 8.1709 8.1709 8.8351 8.8351 9.0880 9.0880 9.1836 9.1836 10.3012 10.3012 10.3428 10.3428 10.6728 10.6728 k = 0.0000 0.0000 0.2342 ( 5546 PWs) bands (ev): -33.0871 -33.0871 -33.0853 -33.0853 -14.3660 -14.3660 -14.3566 -14.3566 -14.0049 -14.0049 -13.9864 -13.9864 -13.9717 -13.9717 -13.9682 -13.9682 -2.6460 -2.6460 -2.4315 -2.4315 2.9798 2.9798 3.0030 3.0030 3.1465 3.1465 3.1572 3.1572 3.2755 3.2755 3.3135 3.3135 3.7726 3.7726 3.7864 3.7864 3.8178 3.8178 3.8739 3.8739 5.3645 5.3645 6.4091 6.4091 7.3984 7.3984 7.8383 7.8383 8.2152 8.2152 8.7712 8.7712 9.0987 9.0987 9.1787 9.1787 10.3302 10.3302 10.3744 10.3744 10.6505 10.6505 k = 0.0000 0.0000 0.2488 ( 5540 PWs) bands (ev): -33.0870 -33.0870 -33.0855 -33.0855 -14.3650 -14.3650 -14.3574 -14.3574 -14.0031 -14.0031 -13.9882 -13.9882 -13.9713 -13.9713 -13.9685 -13.9685 -2.6261 -2.6261 -2.4531 -2.4531 2.9820 2.9820 3.0007 3.0007 3.1482 3.1482 3.1572 3.1572 3.2747 3.2747 3.3045 3.3045 3.7731 3.7731 3.7838 3.7838 3.8231 3.8231 3.8683 3.8683 5.4633 5.4633 6.3019 6.3019 7.4370 7.4370 7.7915 7.7915 8.2619 8.2619 8.7082 8.7082 9.1093 9.1093 9.1736 9.1736 10.3605 10.3605 10.4078 10.4078 10.6230 10.6230 k = 0.0000 0.0000 0.2634 ( 5546 PWs) bands (ev): -33.0868 -33.0868 -33.0857 -33.0857 -14.3640 -14.3640 -14.3583 -14.3583 -14.0014 -14.0014 -13.9901 -13.9901 -13.9710 -13.9710 -13.9689 -13.9689 -2.6055 -2.6055 -2.4750 -2.4750 2.9842 2.9842 2.9983 2.9983 3.1500 3.1500 3.1569 3.1569 3.2747 3.2747 3.2967 3.2967 3.7737 3.7737 3.7816 3.7816 3.8286 3.8286 3.8626 3.8626 5.5641 5.5641 6.1946 6.1946 7.4772 7.4772 7.7446 7.7446 8.3109 8.3109 8.6465 8.6465 9.1195 9.1195 9.1680 9.1680 10.3920 10.3920 10.4428 10.4428 10.5922 10.5922 k = 0.0000 0.0000 0.2781 ( 5522 PWs) bands (ev): -33.0866 -33.0866 -33.0858 -33.0858 -14.3630 -14.3630 -14.3592 -14.3592 -13.9995 -13.9995 -13.9920 -13.9920 -13.9706 -13.9706 -13.9692 -13.9692 -2.5844 -2.5844 -2.4969 -2.4969 2.9865 2.9865 2.9960 2.9960 3.1516 3.1516 3.1564 3.1564 3.2756 3.2756 3.2902 3.2902 3.7745 3.7745 3.7797 3.7797 3.8342 3.8342 3.8570 3.8570 5.6664 5.6664 6.0876 6.0876 7.5190 7.5190 7.6980 7.6980 8.3621 8.3621 8.5862 8.5862 9.1293 9.1293 9.1617 9.1617 10.4246 10.4246 10.4794 10.4794 10.5596 10.5596 k = 0.0000 0.0000 0.2927 ( 5510 PWs) bands (ev): -33.0864 -33.0864 -33.0860 -33.0860 -14.3620 -14.3620 -14.3601 -14.3601 -13.9976 -13.9976 -13.9939 -13.9939 -13.9703 -13.9703 -13.9695 -13.9695 -2.5629 -2.5629 -2.5190 -2.5190 2.9888 2.9888 2.9936 2.9936 3.1532 3.1532 3.1556 3.1556 3.2776 3.2776 3.2848 3.2848 3.7755 3.7755 3.7781 3.7781 3.8398 3.8398 3.8513 3.8513 5.7702 5.7702 5.9810 5.9810 7.5621 7.5621 7.6518 7.6518 8.4153 8.4153 8.5275 8.5275 9.1385 9.1385 9.1548 9.1548 10.4580 10.4580 10.5174 10.5174 10.5259 10.5259 k = 0.0000 0.0000 0.3073 ( 5504 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3610 -14.3610 -14.3610 -14.3610 -13.9958 -13.9958 -13.9958 -13.9958 -13.9699 -13.9699 -13.9699 -13.9699 -2.5410 -2.5410 -2.5410 -2.5410 2.9912 2.9912 2.9912 2.9912 3.1545 3.1545 3.1545 3.1545 3.2806 3.2806 3.2806 3.2806 3.7767 3.7767 3.7767 3.7767 3.8456 3.8456 3.8456 3.8456 5.8752 5.8752 5.8752 5.8752 7.6065 7.6065 7.6065 7.6065 8.4705 8.4705 8.4705 8.4705 9.1470 9.1470 9.1470 9.1470 10.4919 10.4919 10.4919 10.4919 10.5566 10.5566 k = 0.0000 0.0000 0.3073 ( 5504 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3610 -14.3610 -14.3610 -14.3610 -13.9958 -13.9958 -13.9958 -13.9958 -13.9699 -13.9699 -13.9699 -13.9699 -2.5410 -2.5410 -2.5410 -2.5410 2.9912 2.9912 2.9912 2.9912 3.1545 3.1545 3.1545 3.1545 3.2806 3.2806 3.2806 3.2806 3.7767 3.7767 3.7767 3.7767 3.8456 3.8456 3.8456 3.8456 5.8752 5.8752 5.8752 5.8752 7.6065 7.6065 7.6065 7.6065 8.4705 8.4705 8.4705 8.4705 9.1470 9.1470 9.1470 9.1470 10.4919 10.4919 10.4919 10.4919 10.5566 10.5566 k = 0.0132 0.0076 0.3073 ( 5512 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3611 -14.3611 -14.3610 -14.3610 -13.9958 -13.9958 -13.9957 -13.9957 -13.9699 -13.9699 -13.9699 -13.9699 -2.5404 -2.5404 -2.5404 -2.5404 2.9913 2.9913 2.9913 2.9913 3.1529 3.1529 3.1560 3.1560 3.2763 3.2763 3.2854 3.2854 3.7725 3.7725 3.7806 3.7806 3.8458 3.8458 3.8459 3.8459 5.8710 5.8710 5.8784 5.8784 7.5865 7.5865 7.6157 7.6157 8.4587 8.4587 8.4591 8.4591 9.1512 9.1512 9.1703 9.1703 10.4880 10.4880 10.4949 10.4949 10.5560 10.5561 k = 0.0263 0.0152 0.3073 ( 5526 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3612 -14.3612 -14.3610 -14.3610 -13.9959 -13.9959 -13.9957 -13.9957 -13.9700 -13.9700 -13.9700 -13.9700 -2.5386 -2.5386 -2.5386 -2.5386 2.9915 2.9915 2.9916 2.9916 3.1512 3.1512 3.1571 3.1571 3.2727 3.2727 3.2906 3.2906 3.7682 3.7682 3.7840 3.7840 3.8466 3.8466 3.8469 3.8469 5.8658 5.8658 5.8807 5.8807 7.5561 7.5561 7.6141 7.6141 8.4253 8.4253 8.4286 8.4286 9.1812 9.1812 9.2168 9.2168 10.4818 10.4818 10.4966 10.4966 10.5551 10.5552 k = 0.0395 0.0228 0.3073 ( 5530 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3613 -14.3613 -14.3610 -14.3610 -13.9960 -13.9960 -13.9957 -13.9957 -13.9701 -13.9701 -13.9701 -13.9701 -2.5356 -2.5356 -2.5355 -2.5355 2.9918 2.9918 2.9921 2.9921 3.1496 3.1496 3.1578 3.1578 3.2698 3.2698 3.2961 3.2961 3.7638 3.7638 3.7870 3.7870 3.8479 3.8479 3.8486 3.8486 5.8594 5.8594 5.8819 5.8819 7.5157 7.5157 7.6023 7.6023 8.3762 8.3762 8.3853 8.3853 9.2308 9.2308 9.2794 9.2794 10.4715 10.4715 10.4954 10.4954 10.5563 10.5563 k = 0.0526 0.0304 0.3073 ( 5552 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3614 -14.3614 -14.3610 -14.3610 -13.9961 -13.9961 -13.9957 -13.9957 -13.9703 -13.9703 -13.9703 -13.9703 -2.5313 -2.5313 -2.5312 -2.5312 2.9922 2.9922 2.9928 2.9928 3.1483 3.1483 3.1580 3.1580 3.2677 3.2677 3.3018 3.3018 3.7593 3.7593 3.7896 3.7896 3.8495 3.8495 3.8511 3.8511 5.8516 5.8516 5.8820 5.8820 7.4665 7.4665 7.5808 7.5808 8.3178 8.3178 8.3348 8.3348 9.2930 9.2930 9.3512 9.3512 10.4564 10.4564 10.4891 10.4891 10.5625 10.5625 k = 0.0658 0.0380 0.3073 ( 5556 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3615 -14.3615 -14.3611 -14.3611 -13.9961 -13.9961 -13.9957 -13.9957 -13.9704 -13.9704 -13.9704 -13.9704 -2.5259 -2.5259 -2.5257 -2.5257 2.9926 2.9926 2.9937 2.9937 3.1474 3.1474 3.1578 3.1578 3.2666 3.2666 3.3076 3.3076 3.7550 3.7550 3.7916 3.7916 3.8515 3.8515 3.8544 3.8544 5.8421 5.8421 5.8806 5.8806 7.4096 7.4096 7.5505 7.5505 8.2549 8.2549 8.2807 8.2807 9.3617 9.3617 9.4270 9.4270 10.4379 10.4379 10.4786 10.4786 10.5745 10.5745 k = 0.0789 0.0456 0.3073 ( 5564 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3617 -14.3617 -14.3611 -14.3611 -13.9962 -13.9962 -13.9956 -13.9956 -13.9706 -13.9706 -13.9706 -13.9706 -2.5192 -2.5192 -2.5191 -2.5191 2.9929 2.9929 2.9948 2.9948 3.1470 3.1470 3.1572 3.1572 3.2663 3.2663 3.3135 3.3135 3.7507 3.7507 3.7932 3.7932 3.8537 3.8537 3.8584 3.8584 5.8305 5.8305 5.8775 5.8775 7.3467 7.3467 7.5127 7.5127 8.1906 8.1906 8.2251 8.2251 9.4321 9.4321 9.5024 9.5024 10.4180 10.4180 10.4667 10.4667 10.5911 10.5911 k = 0.0921 0.0532 0.3073 ( 5572 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3618 -14.3618 -14.3612 -14.3612 -13.9963 -13.9963 -13.9956 -13.9956 -13.9709 -13.9709 -13.9709 -13.9709 -2.5115 -2.5115 -2.5113 -2.5113 2.9931 2.9931 2.9960 2.9960 3.1472 3.1472 3.1562 3.1562 3.2669 3.2669 3.3194 3.3194 3.7467 3.7467 3.7945 3.7945 3.8561 3.8561 3.8629 3.8629 5.8164 5.8164 5.8720 5.8720 7.2795 7.2795 7.4688 7.4688 8.1266 8.1266 8.1691 8.1691 9.5003 9.5003 9.5734 9.5734 10.3991 10.3991 10.4567 10.4567 10.6113 10.6113 k = 0.1053 0.0608 0.3073 ( 5578 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3620 -14.3620 -14.3612 -14.3612 -13.9964 -13.9964 -13.9956 -13.9956 -13.9712 -13.9712 -13.9711 -13.9711 -2.5027 -2.5027 -2.5024 -2.5024 2.9932 2.9932 2.9973 2.9973 3.1482 3.1482 3.1550 3.1550 3.2683 3.2683 3.3252 3.3252 3.7429 3.7429 3.7955 3.7955 3.8588 3.8588 3.8679 3.8679 5.7994 5.7994 5.8636 5.8636 7.2099 7.2099 7.4204 7.4204 8.0640 8.0640 8.1134 8.1134 9.5626 9.5626 9.6366 9.6366 10.3838 10.3838 10.4515 10.4515 10.6344 10.6345 k = 0.1184 0.0684 0.3073 ( 5570 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3621 -14.3621 -14.3613 -14.3613 -13.9965 -13.9965 -13.9956 -13.9956 -13.9714 -13.9714 -13.9714 -13.9714 -2.4928 -2.4928 -2.4925 -2.4925 2.9931 2.9931 2.9987 2.9987 3.1500 3.1500 3.1539 3.1539 3.2705 3.2705 3.3310 3.3310 3.7393 3.7393 3.7964 3.7964 3.8616 3.8616 3.8734 3.8734 5.7789 5.7789 5.8517 5.8517 7.1396 7.1396 7.3692 7.3692 8.0032 8.0032 8.0581 8.0581 9.6156 9.6156 9.6883 9.6883 10.3746 10.3746 10.4543 10.4543 10.6599 10.6600 k = 0.1316 0.0760 0.3073 ( 5578 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3623 -14.3623 -14.3614 -14.3614 -13.9966 -13.9966 -13.9956 -13.9956 -13.9718 -13.9718 -13.9717 -13.9717 -2.4819 -2.4819 -2.4817 -2.4817 2.9929 2.9929 3.0002 3.0002 3.1527 3.1527 3.1528 3.1528 3.2732 3.2732 3.3367 3.3367 3.7361 3.7361 3.7972 3.7972 3.8645 3.8645 3.8790 3.8790 5.7544 5.7544 5.8353 5.8353 7.0706 7.0706 7.3169 7.3169 7.9442 7.9442 8.0034 8.0034 9.6562 9.6562 9.7258 9.7258 10.3737 10.3737 10.4669 10.4669 10.6874 10.6874 k = 0.1447 0.0836 0.3073 ( 5586 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3624 -14.3624 -14.3615 -14.3615 -13.9967 -13.9967 -13.9957 -13.9957 -13.9721 -13.9721 -13.9721 -13.9721 -2.4702 -2.4702 -2.4699 -2.4699 2.9925 2.9925 3.0016 3.0016 3.1521 3.1521 3.1562 3.1562 3.2765 3.2765 3.3423 3.3423 3.7331 3.7331 3.7979 3.7979 3.8675 3.8675 3.8848 3.8848 5.7255 5.7255 5.8137 5.8137 7.0044 7.0044 7.2649 7.2649 7.8872 7.8872 7.9494 7.9494 9.6825 9.6825 9.7481 9.7481 10.3821 10.3821 10.4896 10.4896 10.7164 10.7164 k = 0.1579 0.0912 0.3073 ( 5592 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3626 -14.3626 -14.3617 -14.3617 -13.9968 -13.9968 -13.9957 -13.9957 -13.9725 -13.9725 -13.9724 -13.9724 -2.4575 -2.4575 -2.4572 -2.4572 2.9920 2.9920 3.0031 3.0031 3.1517 3.1517 3.1606 3.1606 3.2803 3.2803 3.3478 3.3478 3.7305 3.7305 3.7987 3.7987 3.8706 3.8706 3.8908 3.8908 5.6918 5.6918 5.7860 5.7860 6.9426 6.9426 7.2145 7.2145 7.8321 7.8321 7.8964 7.8964 9.6945 9.6945 9.7558 9.7558 10.3991 10.3991 10.5205 10.5205 10.7468 10.7468 k = 0.1711 0.0988 0.3073 ( 5586 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3628 -14.3628 -14.3618 -14.3618 -13.9968 -13.9968 -13.9957 -13.9957 -13.9729 -13.9729 -13.9728 -13.9728 -2.4441 -2.4441 -2.4438 -2.4438 2.9916 2.9916 3.0045 3.0045 3.1519 3.1519 3.1658 3.1658 3.2845 3.2845 3.3533 3.3533 3.7282 3.7282 3.7996 3.7996 3.8737 3.8737 3.8968 3.8968 5.6531 5.6531 5.7516 5.7516 6.8865 6.8865 7.1667 7.1667 7.7791 7.7791 7.8444 7.8444 9.6938 9.6938 9.7514 9.7514 10.4220 10.4220 10.5556 10.5556 10.7784 10.7784 k = 0.1842 0.1064 0.3073 ( 5590 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3630 -14.3630 -14.3619 -14.3619 -13.9969 -13.9969 -13.9957 -13.9957 -13.9733 -13.9733 -13.9732 -13.9732 -2.4300 -2.4300 -2.4297 -2.4297 2.9912 2.9912 3.0060 3.0060 3.1526 3.1526 3.1717 3.1717 3.2891 3.2891 3.3586 3.3586 3.7262 3.7262 3.8006 3.8006 3.8769 3.8769 3.9028 3.9028 5.6093 5.6093 5.7101 5.7101 6.8369 6.8369 7.1220 7.1220 7.7283 7.7283 7.7938 7.7938 9.6831 9.6831 9.7378 9.7378 10.4473 10.4473 10.5902 10.5902 10.8110 10.8110 k = 0.1974 0.1140 0.3073 ( 5592 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3632 -14.3632 -14.3621 -14.3621 -13.9970 -13.9970 -13.9958 -13.9958 -13.9737 -13.9737 -13.9736 -13.9736 -2.4153 -2.4153 -2.4149 -2.4149 2.9910 2.9910 3.0075 3.0075 3.1539 3.1539 3.1782 3.1782 3.2940 3.2940 3.3639 3.3639 3.7246 3.7246 3.8017 3.8017 3.8801 3.8801 3.9087 3.9087 5.5604 5.5604 5.6613 5.6613 6.7941 6.7941 7.0807 7.0807 7.6799 7.6799 7.7446 7.7446 9.6652 9.6652 9.7178 9.7178 10.4712 10.4712 10.6195 10.6195 10.8448 10.8448 k = 0.2105 0.1215 0.3073 ( 5588 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3633 -14.3633 -14.3622 -14.3622 -13.9971 -13.9971 -13.9958 -13.9958 -13.9741 -13.9741 -13.9739 -13.9739 -2.4000 -2.4000 -2.3996 -2.3996 2.9910 2.9910 3.0092 3.0092 3.1557 3.1557 3.1853 3.1853 3.2993 3.2993 3.3691 3.3691 3.7234 3.7234 3.8030 3.8030 3.8833 3.8833 3.9146 3.9146 5.5068 5.5068 5.6056 5.6056 6.7582 6.7582 7.0429 7.0429 7.6342 7.6342 7.6974 7.6974 9.6428 9.6428 9.6938 9.6938 10.4907 10.4907 10.6397 10.6397 10.8797 10.8797 k = 0.2237 0.1291 0.3073 ( 5584 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3635 -14.3635 -14.3624 -14.3624 -13.9972 -13.9972 -13.9959 -13.9959 -13.9745 -13.9745 -13.9743 -13.9743 -2.3843 -2.3843 -2.3839 -2.3839 2.9914 2.9914 3.0110 3.0110 3.1581 3.1581 3.1929 3.1929 3.3048 3.3048 3.3742 3.3742 3.7225 3.7225 3.8045 3.8045 3.8865 3.8865 3.9204 3.9204 5.4488 5.4488 5.5437 5.5437 6.7285 6.7285 7.0081 7.0081 7.5916 7.5916 7.6522 7.6522 9.6178 9.6178 9.6676 9.6676 10.5036 10.5036 10.6490 10.6490 10.9158 10.9159 k = 0.2368 0.1367 0.3073 ( 5594 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3637 -14.3637 -14.3626 -14.3626 -13.9973 -13.9973 -13.9959 -13.9959 -13.9749 -13.9749 -13.9747 -13.9747 -2.3683 -2.3683 -2.3679 -2.3679 2.9922 2.9922 3.0132 3.0132 3.1610 3.1610 3.2009 3.2009 3.3107 3.3107 3.3793 3.3793 3.7220 3.7220 3.8061 3.8061 3.8897 3.8897 3.9260 3.9260 5.3871 5.3871 5.4764 5.4764 6.7044 6.7044 6.9760 6.9760 7.5524 7.5524 7.6095 7.6095 9.5920 9.5920 9.6407 9.6407 10.5087 10.5087 10.6471 10.6471 10.9530 10.9531 k = 0.2500 0.1443 0.3073 ( 5594 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3639 -14.3639 -14.3627 -14.3627 -13.9974 -13.9974 -13.9960 -13.9960 -13.9753 -13.9753 -13.9751 -13.9751 -2.3520 -2.3520 -2.3516 -2.3516 2.9935 2.9935 3.0156 3.0156 3.1643 3.1643 3.2092 3.2092 3.3167 3.3167 3.3842 3.3842 3.7220 3.7220 3.8079 3.8079 3.8928 3.8928 3.9315 3.9315 5.3223 5.3223 5.4048 5.4048 6.6848 6.6848 6.9458 6.9458 7.5169 7.5169 7.5695 7.5695 9.5665 9.5665 9.6142 9.6142 10.5057 10.5057 10.6352 10.6352 10.9911 10.9912 k = 0.2632 0.1519 0.3073 ( 5606 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3641 -14.3641 -14.3629 -14.3629 -13.9975 -13.9975 -13.9961 -13.9961 -13.9758 -13.9758 -13.9756 -13.9756 -2.3357 -2.3357 -2.3353 -2.3353 2.9953 2.9953 3.0185 3.0185 3.1680 3.1680 3.2177 3.2177 3.3230 3.3230 3.3891 3.3891 3.7223 3.7223 3.8099 3.8099 3.8958 3.8958 3.9367 3.9367 5.2551 5.2551 5.3300 5.3300 6.6688 6.6688 6.9170 6.9170 7.4855 7.4855 7.5326 7.5326 9.5424 9.5424 9.5889 9.5889 10.4950 10.4950 10.6148 10.6148 11.0297 11.0297 k = 0.2763 0.1595 0.3073 ( 5602 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3643 -14.3643 -14.3631 -14.3631 -13.9976 -13.9976 -13.9962 -13.9962 -13.9762 -13.9762 -13.9760 -13.9760 -2.3193 -2.3193 -2.3189 -2.3189 2.9977 2.9977 3.0218 3.0218 3.1720 3.1720 3.2264 3.2264 3.3296 3.3296 3.3939 3.3939 3.7231 3.7231 3.8121 3.8121 3.8988 3.8988 3.9417 3.9417 5.1863 5.1863 5.2530 5.2530 6.6553 6.6553 6.8890 6.8890 7.4582 7.4582 7.4990 7.4990 9.5203 9.5203 9.5655 9.5655 10.4774 10.4774 10.5878 10.5878 11.0687 11.0690 k = 0.2895 0.1671 0.3073 ( 5604 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3644 -14.3644 -14.3633 -14.3633 -13.9977 -13.9977 -13.9963 -13.9963 -13.9766 -13.9766 -13.9763 -13.9763 -2.3030 -2.3030 -2.3026 -2.3026 3.0008 3.0008 3.0257 3.0257 3.1765 3.1765 3.2352 3.2352 3.3363 3.3363 3.3985 3.3985 3.7243 3.7243 3.8145 3.8145 3.9016 3.9016 3.9465 3.9465 5.1164 5.1164 5.1748 5.1748 6.6435 6.6435 6.8612 6.8612 7.4352 7.4352 7.4690 7.4690 9.5009 9.5009 9.5445 9.5445 10.4537 10.4537 10.5553 10.5553 11.1081 11.1082 k = 0.3026 0.1747 0.3073 ( 5594 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3646 -14.3646 -14.3635 -14.3635 -13.9978 -13.9978 -13.9964 -13.9964 -13.9769 -13.9769 -13.9767 -13.9767 -2.2869 -2.2869 -2.2865 -2.2865 3.0044 3.0044 3.0300 3.0300 3.1812 3.1812 3.2441 3.2441 3.3431 3.3431 3.4029 3.4029 3.7261 3.7261 3.8171 3.8171 3.9044 3.9044 3.9509 3.9509 5.0464 5.0464 5.0962 5.0962 6.6326 6.6326 6.8336 6.8336 7.4163 7.4163 7.4426 7.4426 9.4848 9.4848 9.5265 9.5265 10.4248 10.4248 10.5186 10.5186 11.1477 11.1481 k = 0.3158 0.1823 0.3073 ( 5594 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3647 -14.3647 -14.3637 -14.3637 -13.9979 -13.9979 -13.9965 -13.9965 -13.9773 -13.9773 -13.9770 -13.9770 -2.2712 -2.2712 -2.2708 -2.2708 3.0086 3.0086 3.0348 3.0348 3.1863 3.1863 3.2529 3.2529 3.3500 3.3500 3.4070 3.4070 3.7285 3.7285 3.8199 3.8199 3.9071 3.9071 3.9550 3.9550 4.9767 4.9767 5.0181 5.0181 6.6222 6.6222 6.8058 6.8058 7.4013 7.4013 7.4199 7.4199 9.4722 9.4722 9.5117 9.5117 10.3916 10.3916 10.4783 10.4783 11.1873 11.1879 k = 0.3289 0.1899 0.3073 ( 5594 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3649 -14.3649 -14.3639 -14.3639 -13.9979 -13.9979 -13.9966 -13.9966 -13.9776 -13.9776 -13.9774 -13.9774 -2.2559 -2.2559 -2.2555 -2.2555 3.0134 3.0134 3.0401 3.0401 3.1918 3.1918 3.2617 3.2617 3.3569 3.3569 3.4108 3.4108 3.7314 3.7314 3.8228 3.8228 3.9096 3.9096 3.9588 3.9588 4.9080 4.9080 4.9412 4.9412 6.6119 6.6119 6.7781 6.7781 7.3896 7.3896 7.4010 7.4010 9.4635 9.4635 9.5005 9.5005 10.3546 10.3546 10.4351 10.4351 11.2270 11.2278 k = 0.3421 0.1975 0.3073 ( 5586 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3650 -14.3650 -14.3640 -14.3640 -13.9980 -13.9980 -13.9967 -13.9967 -13.9779 -13.9779 -13.9777 -13.9777 -2.2411 -2.2411 -2.2408 -2.2408 3.0187 3.0187 3.0456 3.0456 3.1978 3.1978 3.2704 3.2704 3.3637 3.3637 3.4142 3.4142 3.7351 3.7351 3.8259 3.8259 3.9120 3.9120 3.9622 3.9622 4.8409 4.8409 4.8661 4.8661 6.6016 6.6016 6.7506 6.7506 7.3809 7.3809 7.3856 7.3856 9.4589 9.4589 9.4930 9.4930 10.3146 10.3146 10.3894 10.3894 11.2666 11.2671 k = 0.3553 0.2051 0.3073 ( 5586 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3651 -14.3651 -14.3642 -14.3642 -13.9980 -13.9980 -13.9968 -13.9968 -13.9782 -13.9782 -13.9780 -13.9780 -2.2271 -2.2271 -2.2267 -2.2267 3.0244 3.0244 3.0513 3.0513 3.2042 3.2042 3.2790 3.2790 3.3703 3.3703 3.4170 3.4170 3.7395 3.7395 3.8291 3.8291 3.9142 3.9142 3.9650 3.9650 4.7760 4.7760 4.7934 4.7934 6.5910 6.5910 6.7235 6.7235 7.3735 7.3735 7.3746 7.3746 9.4586 9.4586 9.4896 9.4896 10.2721 10.2721 10.3417 10.3417 11.3059 11.3070 k = 0.3684 0.2127 0.3073 ( 5594 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3652 -14.3652 -14.3644 -14.3644 -13.9981 -13.9981 -13.9970 -13.9970 -13.9785 -13.9785 -13.9783 -13.9783 -2.2139 -2.2139 -2.2135 -2.2135 3.0304 3.0304 3.0571 3.0571 3.2113 3.2113 3.2872 3.2872 3.3767 3.3767 3.4192 3.4192 3.7447 3.7447 3.8324 3.8324 3.9163 3.9163 3.9674 3.9674 4.7137 4.7137 4.7238 4.7238 6.5805 6.5805 6.6971 6.6971 7.3643 7.3643 7.3702 7.3702 9.4626 9.4626 9.4901 9.4901 10.2276 10.2276 10.2923 10.2923 11.3447 11.3456 k = 0.3816 0.2203 0.3073 ( 5590 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3653 -14.3653 -14.3645 -14.3645 -13.9981 -13.9981 -13.9971 -13.9971 -13.9788 -13.9788 -13.9785 -13.9785 -2.2015 -2.2015 -2.2012 -2.2012 3.0366 3.0366 3.0626 3.0626 3.2191 3.2191 3.2951 3.2951 3.3828 3.3828 3.4207 3.4207 3.7509 3.7509 3.8357 3.8357 3.9183 3.9183 3.9691 3.9691 4.6546 4.6546 4.6579 4.6579 6.5701 6.5701 6.6719 6.6719 7.3578 7.3578 7.3673 7.3673 9.4710 9.4710 9.4948 9.4948 10.1816 10.1816 10.2417 10.2417 11.3827 11.3836 k = 0.3947 0.2279 0.3073 ( 5592 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3654 -14.3654 -14.3647 -14.3647 -13.9982 -13.9982 -13.9972 -13.9972 -13.9790 -13.9790 -13.9788 -13.9788 -2.1901 -2.1901 -2.1899 -2.1899 3.0429 3.0429 3.0678 3.0678 3.2277 3.2277 3.3025 3.3025 3.3885 3.3885 3.4215 3.4215 3.7581 3.7581 3.8389 3.8389 3.9201 3.9201 3.9700 3.9700 4.5963 4.5963 4.5993 4.5993 6.5602 6.5602 6.6480 6.6480 7.3535 7.3535 7.3654 7.3654 9.4837 9.4837 9.5034 9.5034 10.1347 10.1347 10.1903 10.1903 11.4198 11.4202 k = 0.4079 0.2355 0.3073 ( 5590 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3655 -14.3655 -14.3648 -14.3648 -13.9982 -13.9982 -13.9973 -13.9973 -13.9792 -13.9792 -13.9790 -13.9790 -2.1799 -2.1799 -2.1796 -2.1796 3.0491 3.0491 3.0725 3.0725 3.2371 3.2371 3.3091 3.3091 3.3937 3.3937 3.4217 3.4217 3.7663 3.7663 3.8420 3.8420 3.9218 3.9218 3.9701 3.9701 4.5399 4.5399 4.5481 4.5481 6.5511 6.5511 6.6257 6.6257 7.3510 7.3510 7.3642 7.3642 9.5005 9.5005 9.5160 9.5160 10.0875 10.0875 10.1385 10.1385 11.4558 11.4566 k = 0.4211 0.2431 0.3073 ( 5586 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3655 -14.3655 -14.3650 -14.3650 -13.9982 -13.9982 -13.9974 -13.9974 -13.9794 -13.9794 -13.9792 -13.9792 -2.1708 -2.1708 -2.1706 -2.1706 3.0552 3.0552 3.0764 3.0764 3.2471 3.2471 3.3146 3.3146 3.3984 3.3984 3.4212 3.4212 3.7756 3.7756 3.8447 3.8447 3.9234 3.9234 3.9690 3.9690 4.4892 4.4892 4.5016 4.5016 6.5430 6.5430 6.6054 6.6054 7.3500 7.3500 7.3634 7.3634 9.5211 9.5211 9.5323 9.5323 10.0406 10.0406 10.0869 10.0869 11.4888 11.4893 k = 0.4342 0.2507 0.3073 ( 5590 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3651 -14.3651 -13.9982 -13.9982 -13.9976 -13.9976 -13.9795 -13.9795 -13.9794 -13.9794 -2.1630 -2.1630 -2.1628 -2.1628 3.0609 3.0609 3.0795 3.0795 3.2577 3.2577 3.3188 3.3188 3.4024 3.4024 3.4202 3.4202 3.7858 3.7858 3.8469 3.8469 3.9251 3.9251 3.9668 3.9668 4.4453 4.4453 4.4603 4.4603 6.5363 6.5363 6.5871 6.5871 7.3500 7.3500 7.3626 7.3626 9.5450 9.5450 9.5519 9.5519 9.9947 9.9947 10.0361 10.0361 11.5191 11.5192 k = 0.4474 0.2583 0.3073 ( 5600 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3652 -14.3652 -13.9982 -13.9982 -13.9977 -13.9977 -13.9796 -13.9796 -13.9795 -13.9795 -2.1565 -2.1565 -2.1563 -2.1563 3.0662 3.0662 3.0817 3.0817 3.2686 3.2686 3.3211 3.3211 3.4058 3.4058 3.4189 3.4189 3.7967 3.7967 3.8483 3.8483 3.9269 3.9269 3.9632 3.9632 4.4089 4.4089 4.4247 4.4247 6.5312 6.5312 6.5711 6.5711 7.3508 7.3508 7.3619 7.3619 9.5714 9.5714 9.5742 9.5742 9.9510 9.9510 9.9870 9.9870 11.5461 11.5466 k = 0.4605 0.2659 0.3073 ( 5596 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3653 -14.3653 -13.9982 -13.9982 -13.9978 -13.9978 -13.9797 -13.9797 -13.9796 -13.9796 -2.1513 -2.1513 -2.1512 -2.1512 3.0709 3.0709 3.0829 3.0829 3.2796 3.2796 3.3214 3.3214 3.4086 3.4086 3.4175 3.4175 3.8080 3.8080 3.8485 3.8485 3.9291 3.9291 3.9583 3.9583 4.3808 4.3808 4.3952 4.3952 6.5280 6.5280 6.5575 6.5575 7.3521 7.3521 7.3610 7.3610 9.5981 9.5981 9.5988 9.5988 9.9110 9.9110 9.9410 9.9410 11.5681 11.5688 k = 0.4737 0.2735 0.3073 ( 5604 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3654 -14.3654 -13.9982 -13.9982 -13.9979 -13.9979 -13.9798 -13.9798 -13.9797 -13.9797 -2.1477 -2.1477 -2.1476 -2.1476 3.0750 3.0750 3.0831 3.0831 3.2901 3.2901 3.3193 3.3193 3.4107 3.4107 3.4162 3.4162 3.8190 3.8190 3.8469 3.8469 3.9320 3.9320 3.9525 3.9525 4.3615 4.3615 4.3726 4.3726 6.5269 6.5269 6.5464 6.5464 7.3537 7.3537 7.3599 7.3599 9.6217 9.6217 9.6247 9.6247 9.8775 9.8775 9.9001 9.9001 11.5844 11.5845 k = 0.4868 0.2811 0.3073 ( 5600 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3655 -14.3655 -13.9981 -13.9981 -13.9980 -13.9980 -13.9798 -13.9798 -13.9798 -13.9798 -2.1454 -2.1454 -2.1454 -2.1454 3.0783 3.0783 3.0824 3.0824 3.2999 3.2999 3.3149 3.3149 3.4124 3.4124 3.4150 3.4150 3.8291 3.8291 3.8433 3.8433 3.9358 3.9358 3.9464 3.9464 4.3512 4.3512 4.3573 4.3573 6.5281 6.5281 6.5378 6.5378 7.3554 7.3554 7.3586 7.3586 9.6411 9.6411 9.6440 9.6440 9.8554 9.8554 9.8682 9.8682 11.5943 11.5946 k = 0.5000 0.2887 0.3073 ( 5608 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3656 -14.3656 -13.9981 -13.9981 -13.9981 -13.9981 -13.9798 -13.9798 -13.9798 -13.9798 -2.1447 -2.1447 -2.1447 -2.1447 3.0808 3.0808 3.0808 3.0808 3.3082 3.3082 3.3082 3.3082 3.4138 3.4138 3.4138 3.4138 3.8373 3.8373 3.8373 3.8373 3.9406 3.9406 3.9406 3.9406 4.3500 4.3500 4.3500 4.3500 6.5317 6.5317 6.5317 6.5317 7.3571 7.3571 7.3571 7.3571 9.6503 9.6503 9.6503 9.6503 9.8516 9.8516 9.8516 9.8516 11.5976 11.5976 k = 0.5000 0.2887 0.3073 ( 5608 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3656 -14.3656 -13.9981 -13.9981 -13.9981 -13.9981 -13.9798 -13.9798 -13.9798 -13.9798 -2.1447 -2.1447 -2.1447 -2.1447 3.0808 3.0808 3.0808 3.0808 3.3082 3.3082 3.3082 3.3082 3.4138 3.4138 3.4138 3.4138 3.8373 3.8373 3.8373 3.8373 3.9406 3.9406 3.9406 3.9406 4.3500 4.3500 4.3500 4.3500 6.5317 6.5317 6.5317 6.5317 7.3571 7.3571 7.3571 7.3571 9.6503 9.6503 9.6503 9.6503 9.8516 9.8516 9.8516 9.8516 11.5976 11.5976 k = 0.4924 0.3018 0.3073 ( 5600 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3655 -14.3655 -13.9981 -13.9981 -13.9980 -13.9980 -13.9799 -13.9799 -13.9797 -13.9797 -2.1445 -2.1445 -2.1443 -2.1443 3.0803 3.0803 3.0827 3.0827 3.3025 3.3025 3.3143 3.3143 3.4104 3.4104 3.4171 3.4171 3.8313 3.8313 3.8434 3.8434 3.9331 3.9331 3.9483 3.9483 4.3456 4.3456 4.3549 4.3549 6.4976 6.4976 6.5552 6.5552 7.3257 7.3257 7.3855 7.3855 9.6436 9.6436 9.6678 9.6678 9.8495 9.8495 9.8626 9.8626 11.5859 11.5869 k = 0.4848 0.3149 0.3073 ( 5592 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3657 -14.3657 -14.3654 -14.3654 -13.9981 -13.9981 -13.9979 -13.9979 -13.9800 -13.9800 -13.9796 -13.9796 -2.1439 -2.1439 -2.1436 -2.1436 3.0811 3.0811 3.0859 3.0859 3.2972 3.2972 3.3205 3.3205 3.4071 3.4071 3.4204 3.4204 3.8254 3.8254 3.8493 3.8493 3.9259 3.9259 3.9561 3.9561 4.3418 4.3418 4.3604 4.3604 6.4539 6.4539 6.5670 6.5670 7.2934 7.2934 7.4097 7.4097 9.6478 9.6478 9.6929 9.6929 9.8572 9.8572 9.8842 9.8842 11.5702 11.5706 k = 0.4773 0.3280 0.3073 ( 5590 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3658 -14.3658 -14.3653 -14.3653 -13.9981 -13.9981 -13.9979 -13.9979 -13.9802 -13.9802 -13.9796 -13.9796 -2.1430 -2.1430 -2.1425 -2.1425 3.0833 3.0833 3.0906 3.0906 3.2923 3.2923 3.3270 3.3270 3.4040 3.4040 3.4235 3.4235 3.8195 3.8195 3.8549 3.8549 3.9190 3.9190 3.9639 3.9639 4.3385 4.3385 4.3665 4.3665 6.4016 6.4016 6.5659 6.5659 7.2626 7.2626 7.4290 7.4290 9.6606 9.6606 9.7196 9.7196 9.8774 9.8774 9.9198 9.9198 11.5515 11.5517 k = 0.4697 0.3412 0.3073 ( 5594 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3659 -14.3659 -14.3653 -14.3653 -13.9981 -13.9981 -13.9978 -13.9978 -13.9804 -13.9804 -13.9796 -13.9796 -2.1416 -2.1416 -2.1410 -2.1410 3.0868 3.0868 3.0965 3.0965 3.2878 3.2878 3.3334 3.3334 3.4010 3.4010 3.4265 3.4265 3.8137 3.8137 3.8600 3.8600 3.9127 3.9127 3.9716 3.9716 4.3358 4.3358 4.3732 4.3732 6.3417 6.3417 6.5514 6.5514 7.2356 7.2356 7.4434 7.4434 9.6781 9.6781 9.7419 9.7419 9.9139 9.9139 9.9728 9.9728 11.5297 11.5297 k = 0.4621 0.3543 0.3073 ( 5602 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3660 -14.3660 -14.3652 -14.3652 -13.9981 -13.9981 -13.9977 -13.9977 -13.9806 -13.9806 -13.9796 -13.9796 -2.1399 -2.1399 -2.1391 -2.1391 3.0915 3.0915 3.1036 3.1036 3.2838 3.2838 3.3397 3.3397 3.3985 3.3985 3.4292 3.4292 3.8081 3.8081 3.8642 3.8642 3.9075 3.9075 3.9791 3.9791 4.3336 4.3336 4.3805 4.3805 6.2751 6.2751 6.5235 6.5235 7.2141 7.2141 7.4535 7.4535 9.6966 9.6966 9.7579 9.7579 9.9680 9.9680 10.0438 10.0438 11.5052 11.5052 k = 0.4545 0.3674 0.3073 ( 5594 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3660 -14.3660 -14.3652 -14.3652 -13.9981 -13.9981 -13.9976 -13.9976 -13.9808 -13.9808 -13.9796 -13.9796 -2.1378 -2.1378 -2.1368 -2.1368 3.0973 3.0973 3.1120 3.1120 3.2804 3.2804 3.3456 3.3456 3.3966 3.3966 3.4318 3.4318 3.8027 3.8027 3.8667 3.8667 3.9041 3.9041 3.9865 3.9865 4.3320 4.3320 4.3885 4.3885 6.2028 6.2028 6.4834 6.4834 7.1988 7.1988 7.4602 7.4602 9.7135 9.7135 9.7693 9.7693 10.0385 10.0385 10.1304 10.1304 11.4784 11.4785 k = 0.4470 0.3805 0.3073 ( 5598 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3661 -14.3661 -14.3651 -14.3651 -13.9981 -13.9981 -13.9975 -13.9975 -13.9811 -13.9811 -13.9796 -13.9796 -2.1354 -2.1354 -2.1343 -2.1343 3.1042 3.1042 3.1214 3.1214 3.2775 3.2775 3.3509 3.3509 3.3954 3.3954 3.4342 3.4342 3.7975 3.7975 3.8666 3.8666 3.9031 3.9031 3.9935 3.9935 4.3310 4.3310 4.3973 4.3973 6.1259 6.1259 6.4333 6.4333 7.1892 7.1892 7.4641 7.4641 9.7284 9.7284 9.7784 9.7784 10.1231 10.1231 10.2292 10.2292 11.4500 11.4500 k = 0.4394 0.3936 0.3073 ( 5602 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3662 -14.3662 -14.3651 -14.3651 -13.9981 -13.9981 -13.9974 -13.9974 -13.9813 -13.9813 -13.9797 -13.9797 -2.1327 -2.1327 -2.1314 -2.1314 3.1120 3.1120 3.1318 3.1318 3.2751 3.2751 3.3554 3.3554 3.3952 3.3952 3.4366 3.4366 3.7926 3.7926 3.8640 3.8640 3.9047 3.9047 4.0000 4.0000 4.3307 4.3307 4.4068 4.4068 6.0453 6.0453 6.3755 6.3755 7.1845 7.1845 7.4661 7.4661 9.7413 9.7413 9.7863 9.7863 10.2190 10.2190 10.3369 10.3369 11.4204 11.4204 k = 0.4318 0.4068 0.3073 ( 5586 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3663 -14.3663 -14.3651 -14.3651 -13.9981 -13.9981 -13.9973 -13.9973 -13.9815 -13.9815 -13.9797 -13.9797 -2.1297 -2.1297 -2.1283 -2.1283 3.1207 3.1207 3.1429 3.1429 3.2734 3.2734 3.3588 3.3588 3.3960 3.3960 3.4389 3.4389 3.7879 3.7879 3.8596 3.8596 3.9081 3.9081 4.0060 4.0060 4.3310 4.3310 4.4172 4.4172 5.9623 5.9623 6.3128 6.3128 7.1835 7.1835 7.4670 7.4670 9.7530 9.7530 9.7939 9.7939 10.3232 10.3232 10.4510 10.4510 11.3905 11.3905 k = 0.4242 0.4199 0.3073 ( 5594 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3664 -14.3664 -14.3650 -14.3650 -13.9980 -13.9980 -13.9972 -13.9972 -13.9818 -13.9818 -13.9798 -13.9798 -2.1266 -2.1266 -2.1251 -2.1251 3.1299 3.1299 3.1547 3.1547 3.2723 3.2723 3.3611 3.3611 3.3977 3.3977 3.4414 3.4414 3.7834 3.7834 3.8541 3.8541 3.9124 3.9124 4.0113 4.0113 4.3318 4.3318 4.4285 4.4285 5.8779 5.8779 6.2475 6.2475 7.1851 7.1851 7.4671 7.4671 9.7636 9.7636 9.8012 9.8012 10.4331 10.4331 10.5689 10.5689 11.3608 11.3609 k = 0.4167 0.4330 0.3073 ( 5590 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3665 -14.3665 -14.3650 -14.3650 -13.9980 -13.9980 -13.9971 -13.9971 -13.9821 -13.9821 -13.9799 -13.9799 -2.1234 -2.1234 -2.1217 -2.1217 3.1396 3.1396 3.1667 3.1667 3.2719 3.2719 3.3629 3.3629 3.3997 3.3997 3.4441 3.4441 3.7793 3.7793 3.8481 3.8481 3.9171 3.9171 4.0159 4.0159 4.3333 4.3333 4.4406 4.4406 5.7931 5.7931 6.1816 6.1816 7.1885 7.1885 7.4669 7.4669 9.7735 9.7735 9.8085 9.8085 10.5458 10.5458 10.6881 10.6881 11.3322 11.3322 k = 0.4091 0.4461 0.3073 ( 5582 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3665 -14.3665 -14.3650 -14.3650 -13.9980 -13.9980 -13.9969 -13.9969 -13.9823 -13.9823 -13.9800 -13.9800 -2.1200 -2.1200 -2.1182 -2.1182 3.1494 3.1494 3.1788 3.1788 3.2724 3.2724 3.3644 3.3644 3.4017 3.4017 3.4470 3.4470 3.7755 3.7755 3.8419 3.8419 3.9218 3.9218 4.0196 4.0196 4.3352 4.3352 4.4536 4.4536 5.7091 5.7091 6.1167 6.1167 7.1930 7.1930 7.4667 7.4667 9.7828 9.7828 9.8158 9.8158 10.6585 10.6585 10.8060 10.8060 11.3059 11.3059 k = 0.4015 0.4593 0.3073 ( 5572 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3666 -14.3666 -14.3650 -14.3650 -13.9979 -13.9979 -13.9968 -13.9968 -13.9825 -13.9825 -13.9801 -13.9801 -2.1166 -2.1166 -2.1147 -2.1147 3.1593 3.1593 3.1906 3.1906 3.2736 3.2736 3.3663 3.3663 3.4031 3.4031 3.4503 3.4503 3.7720 3.7720 3.8357 3.8357 3.9263 3.9263 4.0224 4.0224 4.3375 4.3375 4.4674 4.4674 5.6269 5.6269 6.0545 6.0545 7.1981 7.1981 7.4666 7.4666 9.7916 9.7916 9.8229 9.8229 10.7681 10.7681 10.9189 10.9189 11.2837 11.2837 k = 0.3939 0.4724 0.3073 ( 5576 PWs) bands (ev): -33.0856 -33.0856 -33.0855 -33.0855 -14.3667 -14.3667 -14.3650 -14.3650 -13.9979 -13.9979 -13.9967 -13.9967 -13.9828 -13.9828 -13.9802 -13.9802 -2.1133 -2.1133 -2.1113 -2.1113 3.1687 3.1687 3.2016 3.2016 3.2758 3.2758 3.3688 3.3688 3.4039 3.4039 3.4536 3.4536 3.7689 3.7689 3.8295 3.8295 3.9305 3.9305 4.0242 4.0242 4.3402 4.3402 4.4818 4.4818 5.5478 5.5478 5.9961 5.9961 7.2034 7.2034 7.4667 7.4667 9.7999 9.7999 9.8297 9.8297 10.8707 10.8707 11.0209 11.0209 11.2696 11.2696 k = 0.3864 0.4855 0.3073 ( 5582 PWs) bands (ev): -33.0856 -33.0856 -33.0855 -33.0855 -14.3668 -14.3668 -14.3650 -14.3650 -13.9978 -13.9978 -13.9966 -13.9966 -13.9830 -13.9830 -13.9803 -13.9803 -2.1102 -2.1102 -2.1081 -2.1081 3.1776 3.1776 3.2117 3.2117 3.2787 3.2787 3.3724 3.3724 3.4040 3.4040 3.4567 3.4567 3.7662 3.7662 3.8235 3.8235 3.9343 3.9343 4.0252 4.0252 4.3429 4.3429 4.4964 4.4964 5.4728 5.4728 5.9425 5.9425 7.2086 7.2086 7.4670 7.4670 9.8075 9.8075 9.8361 9.8361 10.9616 10.9616 11.0987 11.0987 11.2698 11.2698 k = 0.3788 0.4986 0.3073 ( 5580 PWs) bands (ev): -33.0856 -33.0856 -33.0855 -33.0855 -14.3668 -14.3668 -14.3650 -14.3650 -13.9978 -13.9978 -13.9965 -13.9965 -13.9833 -13.9833 -13.9804 -13.9804 -2.1072 -2.1072 -2.1050 -2.1050 3.1854 3.1854 3.2206 3.2206 3.2823 3.2823 3.3770 3.3770 3.4036 3.4036 3.4593 3.4593 3.7640 3.7640 3.8179 3.8179 3.9377 3.9377 4.0255 4.0255 4.3457 4.3457 4.5110 4.5110 5.4033 5.4033 5.8946 5.8946 7.2135 7.2135 7.4676 7.4676 9.8143 9.8143 9.8419 9.8419 11.0341 11.0341 11.1360 11.1360 11.2638 11.2638 k = 0.3712 0.5117 0.3073 ( 5584 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3650 -14.3650 -13.9978 -13.9978 -13.9964 -13.9964 -13.9835 -13.9835 -13.9805 -13.9805 -2.1044 -2.1044 -2.1022 -2.1022 3.1921 3.1921 3.2282 3.2282 3.2862 3.2862 3.3827 3.3827 3.4032 3.4032 3.4610 3.4610 3.7622 3.7622 3.8126 3.8126 3.9404 3.9404 4.0250 4.0250 4.3484 4.3484 4.5248 4.5248 5.3407 5.3407 5.8532 5.8532 7.2179 7.2179 7.4683 7.4683 9.8204 9.8204 9.8469 9.8469 11.0802 11.0802 11.1455 11.1455 11.2660 11.2660 k = 0.3636 0.5249 0.3073 ( 5580 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3650 -14.3650 -13.9978 -13.9978 -13.9964 -13.9964 -13.9836 -13.9836 -13.9806 -13.9806 -2.1020 -2.1020 -2.0997 -2.0997 3.1974 3.1974 3.2345 3.2345 3.2901 3.2901 3.3885 3.3885 3.4036 3.4036 3.4616 3.4616 3.7609 3.7609 3.8080 3.8080 3.9427 3.9427 4.0242 4.0242 4.3508 4.3508 4.5372 4.5372 5.2866 5.2866 5.8188 5.8188 7.2216 7.2216 7.4692 7.4692 9.8255 9.8255 9.8511 9.8511 11.0977 11.0977 11.1485 11.1485 11.2801 11.2801 k = 0.3561 0.5380 0.3073 ( 5572 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3650 -14.3650 -13.9977 -13.9977 -13.9963 -13.9963 -13.9837 -13.9837 -13.9806 -13.9806 -2.1000 -2.1000 -2.0977 -2.0977 3.2014 3.2014 3.2396 3.2396 3.2937 3.2937 3.3923 3.3923 3.4066 3.4066 3.4610 3.4610 3.7600 3.7600 3.8042 3.8042 3.9444 3.9444 4.0231 4.0231 4.3528 4.3528 4.5473 4.5473 5.2426 5.2426 5.7919 5.7919 7.2247 7.2247 7.4700 7.4700 9.8296 9.8296 9.8543 9.8543 11.0992 11.0992 11.1493 11.1493 11.2983 11.2983 k = 0.3485 0.5511 0.3073 ( 5568 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3650 -14.3650 -13.9977 -13.9977 -13.9963 -13.9963 -13.9838 -13.9838 -13.9807 -13.9807 -2.0985 -2.0985 -2.0961 -2.0961 3.2040 3.2040 3.2433 3.2433 3.2966 3.2966 3.3933 3.3933 3.4123 3.4123 3.4591 3.4591 3.7596 3.7596 3.8013 3.8013 3.9456 3.9456 4.0220 4.0220 4.3543 4.3543 4.5545 4.5545 5.2102 5.2102 5.7726 5.7726 7.2269 7.2269 7.4707 7.4707 9.8325 9.8325 9.8565 9.8565 11.0964 11.0964 11.1486 11.1486 11.3126 11.3126 k = 0.3409 0.5642 0.3073 ( 5568 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3670 -14.3670 -14.3650 -14.3650 -13.9977 -13.9977 -13.9963 -13.9963 -13.9838 -13.9838 -13.9807 -13.9807 -2.0976 -2.0976 -2.0951 -2.0951 3.2055 3.2055 3.2456 3.2456 3.2986 3.2986 3.3932 3.3932 3.4178 3.4178 3.4569 3.4569 3.7595 3.7595 3.7994 3.7994 3.9462 3.9462 4.0211 4.0211 4.3552 4.3552 4.5584 4.5584 5.1905 5.1905 5.7611 5.7611 7.2283 7.2283 7.4713 7.4713 9.8343 9.8343 9.8577 9.8577 11.0939 11.0939 11.1479 11.1479 11.3204 11.3204 k = 0.3333 0.5774 0.3073 ( 5556 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3649 -14.3649 -13.9977 -13.9977 -13.9962 -13.9962 -13.9838 -13.9838 -13.9807 -13.9807 -2.0972 -2.0972 -2.0948 -2.0948 3.2060 3.2060 3.2464 3.2464 3.2994 3.2994 3.3932 3.3932 3.4202 3.4202 3.4558 3.4558 3.7595 3.7595 3.7988 3.7988 3.9465 3.9465 4.0208 4.0208 4.3555 4.3555 4.5595 4.5595 5.1841 5.1841 5.7573 5.7573 7.2288 7.2288 7.4715 7.4715 9.8349 9.8349 9.8581 9.8581 11.0929 11.0929 11.1478 11.1478 11.3226 11.3226 k = 0.3333 0.5774 0.3073 ( 5556 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3649 -14.3649 -13.9977 -13.9977 -13.9962 -13.9962 -13.9838 -13.9838 -13.9807 -13.9807 -2.0972 -2.0972 -2.0948 -2.0948 3.2060 3.2060 3.2464 3.2464 3.2994 3.2994 3.3932 3.3932 3.4202 3.4202 3.4558 3.4558 3.7595 3.7595 3.7988 3.7988 3.9465 3.9465 4.0208 4.0208 4.3555 4.3555 4.5595 4.5595 5.1841 5.1841 5.7573 5.7573 7.2288 7.2288 7.4715 7.4715 9.8349 9.8349 9.8581 9.8581 11.0929 11.0929 11.1478 11.1478 11.3226 11.3226 k = 0.3258 0.5642 0.3073 ( 5570 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3670 -14.3670 -14.3650 -14.3650 -13.9977 -13.9977 -13.9963 -13.9963 -13.9839 -13.9839 -13.9807 -13.9807 -2.0976 -2.0976 -2.0952 -2.0952 3.2055 3.2055 3.2456 3.2456 3.2985 3.2985 3.3932 3.3932 3.4178 3.4178 3.4570 3.4570 3.7594 3.7594 3.7994 3.7994 3.9462 3.9462 4.0212 4.0212 4.3552 4.3552 4.5589 4.5589 5.1903 5.1903 5.7610 5.7610 7.2283 7.2283 7.4712 7.4712 9.8343 9.8343 9.8578 9.8578 11.0938 11.0938 11.1475 11.1475 11.3213 11.3213 k = 0.3182 0.5511 0.3073 ( 5562 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3650 -14.3650 -13.9977 -13.9977 -13.9963 -13.9963 -13.9838 -13.9838 -13.9806 -13.9806 -2.0987 -2.0987 -2.0963 -2.0963 3.2043 3.2043 3.2434 3.2434 3.2959 3.2959 3.3925 3.3925 3.4121 3.4121 3.4597 3.4597 3.7591 3.7591 3.8013 3.8013 3.9456 3.9456 4.0224 4.0224 4.3548 4.3548 4.5584 4.5584 5.2081 5.2081 5.7720 5.7720 7.2269 7.2269 7.4704 7.4704 9.8327 9.8327 9.8571 9.8571 11.0958 11.0958 11.1454 11.1454 11.3197 11.3197 k = 0.3106 0.5380 0.3073 ( 5554 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3649 -14.3649 -13.9977 -13.9977 -13.9963 -13.9963 -13.9837 -13.9837 -13.9806 -13.9806 -2.1006 -2.1006 -2.0982 -2.0982 3.2022 3.2022 3.2397 3.2397 3.2914 3.2914 3.3883 3.3883 3.4079 3.4079 3.4621 3.4621 3.7585 3.7585 3.8042 3.8042 3.9446 3.9446 4.0243 4.0243 4.3547 4.3547 4.5597 4.5597 5.2361 5.2361 5.7899 5.7899 7.2245 7.2245 7.4689 7.4689 9.8302 9.8302 9.8563 9.8563 11.0980 11.0980 11.1392 11.1392 11.3209 11.3209 k = 0.3030 0.5249 0.3073 ( 5572 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3649 -14.3649 -13.9977 -13.9977 -13.9963 -13.9963 -13.9836 -13.9836 -13.9805 -13.9805 -2.1034 -2.1034 -2.1010 -2.1010 3.1992 3.1992 3.2347 3.2347 3.2848 3.2848 3.3790 3.3790 3.4078 3.4078 3.4633 3.4633 3.7574 3.7574 3.8079 3.8079 3.9431 3.9431 4.0267 4.0267 4.3560 4.3560 4.5641 4.5641 5.2728 5.2728 5.8142 5.8142 7.2212 7.2212 7.4667 7.4667 9.8272 9.8272 9.8555 9.8555 11.0985 11.0985 11.1271 11.1271 11.3272 11.3272 k = 0.2955 0.5117 0.3073 ( 5568 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3668 -14.3668 -14.3649 -14.3649 -13.9978 -13.9978 -13.9964 -13.9964 -13.9834 -13.9834 -13.9804 -13.9804 -2.1070 -2.1070 -2.1047 -2.1047 3.1952 3.1952 3.2285 3.2285 3.2762 3.2762 3.3675 3.3675 3.4097 3.4097 3.4630 3.4630 3.7559 3.7559 3.8121 3.8121 3.9411 3.9411 4.0291 4.0291 4.3601 4.3601 4.5725 4.5725 5.3168 5.3168 5.8446 5.8446 7.2169 7.2169 7.4635 7.4635 9.8238 9.8238 9.8552 9.8552 11.0938 11.0938 11.1104 11.1104 11.3391 11.3391 k = 0.2879 0.4986 0.3073 ( 5574 PWs) bands (ev): -33.0856 -33.0856 -33.0855 -33.0855 -14.3668 -14.3668 -14.3649 -14.3649 -13.9978 -13.9978 -13.9964 -13.9964 -13.9832 -13.9832 -13.9803 -13.9803 -2.1116 -2.1116 -2.1094 -2.1094 3.1897 3.1897 3.2217 3.2217 3.2656 3.2656 3.3560 3.3560 3.4121 3.4121 3.4611 3.4611 3.7539 3.7539 3.8166 3.8166 3.9386 3.9386 4.0310 4.0310 4.3684 4.3684 4.5854 4.5854 5.3669 5.3669 5.8805 5.8805 7.2118 7.2118 7.4594 7.4594 9.8206 9.8206 9.8556 9.8556 11.0756 11.0756 11.0961 11.0961 11.3549 11.3549 k = 0.2803 0.4855 0.3073 ( 5570 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3667 -14.3667 -14.3649 -14.3649 -13.9978 -13.9978 -13.9964 -13.9964 -13.9830 -13.9830 -13.9802 -13.9802 -2.1172 -2.1172 -2.1150 -2.1150 3.1825 3.1825 3.2147 3.2147 3.2530 3.2530 3.3454 3.3454 3.4142 3.4142 3.4580 3.4580 3.7516 3.7516 3.8209 3.8209 3.9356 3.9356 4.0319 4.0319 4.3822 4.3822 4.6027 4.6027 5.4223 5.4223 5.9215 5.9215 7.2060 7.2060 7.4543 7.4543 9.8178 9.8178 9.8569 9.8569 11.0462 11.0462 11.0818 11.0818 11.3701 11.3701 k = 0.2727 0.4724 0.3073 ( 5570 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3666 -14.3666 -14.3648 -14.3648 -13.9978 -13.9978 -13.9965 -13.9965 -13.9827 -13.9827 -13.9800 -13.9800 -2.1237 -2.1237 -2.1217 -2.1217 3.1730 3.1730 3.2081 3.2081 3.2387 3.2387 3.3362 3.3362 3.4153 3.4153 3.4542 3.4542 3.7489 3.7489 3.8250 3.8250 3.9323 3.9323 4.0314 4.0314 4.4021 4.4021 4.6243 4.6243 5.4822 5.4822 5.9670 5.9670 7.1995 7.1995 7.4483 7.4483 9.8157 9.8157 9.8595 9.8595 11.0114 11.0114 11.0620 11.0620 11.3758 11.3758 k = 0.2652 0.4593 0.3073 ( 5582 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3665 -14.3665 -14.3648 -14.3648 -13.9979 -13.9979 -13.9965 -13.9965 -13.9824 -13.9824 -13.9799 -13.9799 -2.1312 -2.1312 -2.1293 -2.1293 3.1614 3.1614 3.2019 3.2019 3.2232 3.2232 3.3283 3.3283 3.4148 3.4148 3.4503 3.4503 3.7460 3.7460 3.8284 3.8284 3.9287 3.9287 4.0295 4.0295 4.4283 4.4283 4.6502 4.6502 5.5459 5.5459 6.0167 6.0167 7.1924 7.1924 7.4412 7.4412 9.8148 9.8148 9.8635 9.8635 10.9730 10.9730 11.0361 11.0361 11.3597 11.3597 k = 0.2576 0.4461 0.3073 ( 5586 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3664 -14.3664 -14.3647 -14.3647 -13.9979 -13.9979 -13.9965 -13.9965 -13.9821 -13.9821 -13.9797 -13.9797 -2.1397 -2.1397 -2.1379 -2.1379 3.1482 3.1482 3.1957 3.1957 3.2076 3.2076 3.3217 3.3217 3.4120 3.4120 3.4472 3.4472 3.7431 3.7431 3.8313 3.8313 3.9249 3.9249 4.0264 4.0264 4.4607 4.4607 4.6801 4.6801 5.6131 5.6131 6.0699 6.0699 7.1851 7.1851 7.4332 7.4332 9.8153 9.8153 9.8693 9.8693 10.9319 10.9319 11.0049 11.0049 11.3230 11.3230 k = 0.2500 0.4330 0.3073 ( 5570 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3663 -14.3663 -14.3646 -14.3646 -13.9979 -13.9979 -13.9965 -13.9965 -13.9818 -13.9818 -13.9794 -13.9794 -2.1491 -2.1491 -2.1474 -2.1474 3.1339 3.1339 3.1863 3.1863 3.1955 3.1955 3.3161 3.3161 3.4069 3.4069 3.4450 3.4450 3.7401 3.7401 3.8333 3.8333 3.9212 3.9212 4.0223 4.0223 4.4989 4.4989 4.7139 4.7139 5.6831 5.6831 6.1263 6.1263 7.1777 7.1777 7.4243 7.4243 9.8174 9.8174 9.8771 9.8771 10.8885 10.8885 10.9692 10.9692 11.2760 11.2760 k = 0.2424 0.4199 0.3073 ( 5562 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3661 -14.3661 -14.3645 -14.3645 -13.9979 -13.9979 -13.9965 -13.9965 -13.9814 -13.9814 -13.9792 -13.9792 -2.1595 -2.1595 -2.1578 -2.1578 3.1191 3.1191 3.1714 3.1714 3.1891 3.1891 3.3113 3.3113 3.3998 3.3998 3.4435 3.4435 3.7371 3.7371 3.8346 3.8346 3.9175 3.9175 4.0175 4.0175 4.5421 4.5421 4.7514 4.7514 5.7556 5.7556 6.1852 6.1852 7.1706 7.1706 7.4147 7.4147 9.8212 9.8212 9.8869 9.8869 10.8434 10.8434 10.9301 10.9301 11.2252 11.2252 k = 0.2348 0.4068 0.3073 ( 5570 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3660 -14.3660 -14.3644 -14.3644 -13.9979 -13.9979 -13.9965 -13.9965 -13.9810 -13.9810 -13.9789 -13.9789 -2.1708 -2.1708 -2.1692 -2.1692 3.1041 3.1041 3.1555 3.1555 3.1841 3.1841 3.3068 3.3068 3.3914 3.3914 3.4421 3.4421 3.7342 3.7342 3.8350 3.8350 3.9141 3.9141 4.0122 4.0122 4.5900 4.5900 4.7923 4.7923 5.8302 5.8302 6.2461 6.2461 7.1641 7.1641 7.4046 7.4046 9.8269 9.8269 9.8989 9.8989 10.7969 10.7969 10.8882 10.8882 11.1736 11.1736 k = 0.2273 0.3936 0.3073 ( 5570 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3659 -14.3659 -14.3643 -14.3643 -13.9979 -13.9979 -13.9965 -13.9965 -13.9806 -13.9806 -13.9787 -13.9787 -2.1830 -2.1830 -2.1815 -2.1815 3.0894 3.0894 3.1401 3.1401 3.1795 3.1795 3.3027 3.3027 3.3822 3.3822 3.4405 3.4405 3.7316 3.7316 3.8346 3.8346 3.9110 3.9110 4.0065 4.0065 4.6419 4.6419 4.8365 4.8365 5.9064 5.9064 6.3084 6.3084 7.1589 7.1589 7.3942 7.3942 9.8346 9.8346 9.9131 9.9131 10.7495 10.7495 10.8441 10.8441 11.1230 11.1230 k = 0.2197 0.3805 0.3073 ( 5562 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3657 -14.3657 -14.3642 -14.3642 -13.9979 -13.9979 -13.9964 -13.9964 -13.9802 -13.9802 -13.9784 -13.9784 -2.1959 -2.1959 -2.1945 -2.1945 3.0754 3.0754 3.1253 3.1253 3.1751 3.1751 3.2987 3.2987 3.3726 3.3726 3.4385 3.4385 3.7291 3.7291 3.8335 3.8335 3.9081 3.9081 4.0007 4.0007 4.6973 4.6973 4.8839 4.8839 5.9837 5.9837 6.3714 6.3714 7.1555 7.1555 7.3838 7.3838 9.8442 9.8442 9.9297 9.9297 10.7014 10.7014 10.7982 10.7982 11.0744 11.0744 k = 0.2121 0.3674 0.3073 ( 5564 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3655 -14.3655 -14.3641 -14.3641 -13.9979 -13.9979 -13.9964 -13.9964 -13.9798 -13.9798 -13.9781 -13.9781 -2.2096 -2.2096 -2.2083 -2.2083 3.0621 3.0621 3.1115 3.1115 3.1707 3.1707 3.2947 3.2947 3.3629 3.3629 3.4358 3.4358 3.7269 3.7269 3.8318 3.8318 3.9056 3.9056 3.9947 3.9947 4.7558 4.7558 4.9340 4.9340 6.0617 6.0617 6.4342 6.4342 7.1549 7.1549 7.3737 7.3737 9.8556 9.8556 9.9486 9.9486 10.6531 10.6531 10.7509 10.7509 11.0286 11.0286 k = 0.2045 0.3543 0.3073 ( 5564 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3654 -14.3654 -14.3639 -14.3639 -13.9978 -13.9978 -13.9963 -13.9963 -13.9794 -13.9794 -13.9778 -13.9778 -2.2239 -2.2239 -2.2228 -2.2228 3.0498 3.0498 3.0986 3.0986 3.1665 3.1665 3.2903 3.2903 3.3533 3.3533 3.4326 3.4326 3.7250 3.7250 3.8296 3.8296 3.9033 3.9033 3.9887 3.9887 4.8170 4.8170 4.9868 4.9868 6.1397 6.1397 6.4961 6.4961 7.1581 7.1581 7.3645 7.3645 9.8688 9.8688 9.9695 9.9695 10.6048 10.6048 10.7025 10.7025 10.9860 10.9860 k = 0.1970 0.3412 0.3073 ( 5576 PWs) bands (ev): -33.0857 -33.0857 -33.0857 -33.0857 -14.3652 -14.3652 -14.3638 -14.3638 -13.9978 -13.9978 -13.9963 -13.9963 -13.9789 -13.9789 -13.9775 -13.9775 -2.2389 -2.2389 -2.2378 -2.2378 3.0385 3.0385 3.0868 3.0868 3.1624 3.1624 3.2855 3.2855 3.3441 3.3441 3.4288 3.4288 3.7233 3.7233 3.8270 3.8270 3.9012 3.9012 3.9825 3.9825 4.8803 4.8803 5.0419 5.0419 6.2171 6.2171 6.5560 6.5560 7.1662 7.1662 7.3565 7.3565 9.8836 9.8836 9.9925 9.9925 10.5570 10.5570 10.6533 10.6533 10.9470 10.9470 k = 0.1894 0.3280 0.3073 ( 5576 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3650 -14.3650 -14.3636 -14.3636 -13.9978 -13.9978 -13.9963 -13.9963 -13.9785 -13.9785 -13.9771 -13.9771 -2.2543 -2.2543 -2.2533 -2.2533 3.0285 3.0285 3.0761 3.0761 3.1584 3.1584 3.2800 3.2800 3.3356 3.3356 3.4245 3.4245 3.7220 3.7220 3.8243 3.8243 3.8992 3.8992 3.9763 3.9763 4.9454 4.9454 5.0991 5.0991 6.2928 6.2928 6.6130 6.6130 7.1806 7.1806 7.3506 7.3506 9.8996 9.8996 10.0172 10.0172 10.5100 10.5100 10.6035 10.6035 10.9117 10.9117 k = 0.1818 0.3149 0.3073 ( 5584 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3649 -14.3649 -14.3635 -14.3635 -13.9977 -13.9977 -13.9962 -13.9962 -13.9780 -13.9780 -13.9768 -13.9768 -2.2702 -2.2702 -2.2693 -2.2693 3.0196 3.0196 3.0665 3.0665 3.1546 3.1546 3.2737 3.2737 3.3279 3.3279 3.4197 3.4197 3.7210 3.7210 3.8215 3.8215 3.8972 3.8972 3.9700 3.9700 5.0118 5.0118 5.1580 5.1580 6.3659 6.3659 6.6667 6.6667 7.2024 7.2024 7.3475 7.3475 9.9166 9.9166 10.0433 10.0433 10.4641 10.4641 10.5535 10.5535 10.8802 10.8802 k = 0.1742 0.3018 0.3073 ( 5586 PWs) bands (ev): -33.0858 -33.0858 -33.0858 -33.0858 -14.3647 -14.3647 -14.3633 -14.3633 -13.9977 -13.9977 -13.9962 -13.9962 -13.9775 -13.9775 -13.9764 -13.9764 -2.2864 -2.2864 -2.2856 -2.2856 3.0119 3.0119 3.0579 3.0579 3.1510 3.1510 3.2665 3.2665 3.3211 3.3211 3.4144 3.4144 3.7203 3.7203 3.8186 3.8186 3.8953 3.8953 3.9637 3.9637 5.0789 5.0789 5.2184 5.2184 6.4349 6.4349 6.7171 6.7171 7.2322 7.2322 7.3482 7.3482 9.9341 9.9341 10.0703 10.0703 10.4196 10.4196 10.5037 10.5037 10.8525 10.8525 k = 0.1667 0.2887 0.3073 ( 5598 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3645 -14.3645 -14.3632 -14.3632 -13.9976 -13.9976 -13.9961 -13.9961 -13.9771 -13.9771 -13.9761 -13.9761 -2.3028 -2.3028 -2.3021 -2.3021 3.0055 3.0055 3.0503 3.0503 3.1476 3.1476 3.2585 3.2585 3.3153 3.3153 3.4089 3.4089 3.7198 3.7198 3.8159 3.8159 3.8933 3.8933 3.9573 3.9573 5.1462 5.1462 5.2796 5.2796 6.4984 6.4984 6.7649 6.7649 7.2697 7.2697 7.3540 7.3540 9.9516 9.9516 10.0977 10.0977 10.3768 10.3768 10.4543 10.4543 10.8286 10.8286 k = 0.1591 0.2756 0.3073 ( 5586 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3643 -14.3643 -14.3630 -14.3630 -13.9975 -13.9975 -13.9960 -13.9960 -13.9766 -13.9766 -13.9757 -13.9757 -2.3194 -2.3194 -2.3187 -2.3187 3.0001 3.0001 3.0436 3.0436 3.1446 3.1446 3.2498 3.2498 3.3102 3.3102 3.4031 3.4031 3.7196 3.7196 3.8133 3.8133 3.8913 3.8913 3.9509 3.9509 5.2130 5.2130 5.3414 5.3414 6.5552 6.5552 6.8115 6.8115 7.3127 7.3127 7.3677 7.3677 9.9681 9.9681 10.1245 10.1245 10.3365 10.3365 10.4060 10.4060 10.8083 10.8083 k = 0.1515 0.2624 0.3073 ( 5582 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3641 -14.3641 -14.3628 -14.3628 -13.9974 -13.9974 -13.9960 -13.9960 -13.9761 -13.9761 -13.9753 -13.9753 -2.3359 -2.3359 -2.3353 -2.3353 2.9959 2.9959 3.0377 3.0377 3.1419 3.1419 3.2407 3.2407 3.3057 3.3057 3.3971 3.3971 3.7198 3.7198 3.8109 3.8109 3.8892 3.8892 3.9444 3.9444 5.2788 5.2788 5.4029 5.4029 6.6047 6.6047 6.8581 6.8581 7.3546 7.3546 7.3957 7.3957 9.9827 9.9827 10.1492 10.1492 10.2994 10.2994 10.3598 10.3598 10.7914 10.7914 k = 0.1439 0.2493 0.3073 ( 5578 PWs) bands (ev): -33.0859 -33.0859 -33.0859 -33.0859 -14.3639 -14.3639 -14.3627 -14.3627 -13.9974 -13.9974 -13.9959 -13.9959 -13.9756 -13.9756 -13.9749 -13.9749 -2.3524 -2.3524 -2.3518 -2.3518 2.9926 2.9926 3.0326 3.0326 3.1396 3.1396 3.2313 3.2313 3.3016 3.3016 3.3911 3.3911 3.7201 3.7201 3.8086 3.8086 3.8870 3.8870 3.9379 3.9379 5.3429 5.3429 5.4636 5.4636 6.6477 6.6477 6.9051 6.9051 7.3894 7.3894 7.4436 7.4436 9.9937 9.9937 10.1683 10.1683 10.2672 10.2672 10.3182 10.3182 10.7777 10.7777 k = 0.1364 0.2362 0.3073 ( 5578 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3637 -14.3637 -14.3625 -14.3625 -13.9973 -13.9973 -13.9959 -13.9959 -13.9751 -13.9751 -13.9745 -13.9745 -2.3687 -2.3687 -2.3682 -2.3682 2.9903 2.9903 3.0281 3.0281 3.1378 3.1378 3.2219 3.2219 3.2978 3.2978 3.3850 3.3850 3.7208 3.7208 3.8066 3.8066 3.8847 3.8847 3.9313 3.9313 5.4046 5.4046 5.5225 5.5225 6.6864 6.6864 6.9520 6.9520 7.4252 7.4252 7.5022 7.5022 9.9987 9.9987 10.1731 10.1731 10.2422 10.2422 10.2889 10.2889 10.7666 10.7666 k = 0.1288 0.2231 0.3073 ( 5582 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3635 -14.3635 -14.3623 -14.3623 -13.9972 -13.9972 -13.9958 -13.9958 -13.9747 -13.9747 -13.9742 -13.9742 -2.3848 -2.3848 -2.3843 -2.3843 2.9887 2.9887 3.0240 3.0240 3.1365 3.1365 3.2127 3.2127 3.2941 3.2941 3.3789 3.3789 3.7217 3.7217 3.8048 3.8048 3.8822 3.8822 3.9247 3.9247 5.4632 5.4632 5.5788 5.5788 6.7233 6.7233 6.9982 6.9982 7.4672 7.4672 7.5652 7.5652 9.9947 9.9947 10.1543 10.1543 10.2243 10.2243 10.2834 10.2834 10.7573 10.7573 k = 0.1212 0.2099 0.3073 ( 5586 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3633 -14.3633 -14.3622 -14.3622 -13.9971 -13.9971 -13.9958 -13.9958 -13.9742 -13.9742 -13.9738 -13.9738 -2.4005 -2.4005 -2.4001 -2.4001 2.9878 2.9878 3.0204 3.0204 3.1358 3.1358 3.2037 3.2037 3.2906 3.2906 3.3728 3.3728 3.7229 3.7229 3.8032 3.8032 3.8797 3.8797 3.9181 3.9181 5.5183 5.5183 5.6315 5.6315 6.7609 6.7609 7.0436 7.0436 7.5164 7.5164 7.6300 7.6300 9.9796 9.9796 10.1177 10.1177 10.2154 10.2154 10.2953 10.2953 10.7489 10.7489 k = 0.1136 0.1968 0.3073 ( 5584 PWs) bands (ev): -33.0860 -33.0860 -33.0860 -33.0860 -14.3632 -14.3632 -14.3620 -14.3620 -13.9970 -13.9970 -13.9957 -13.9957 -13.9738 -13.9738 -13.9734 -13.9734 -2.4158 -2.4158 -2.4154 -2.4154 2.9876 2.9876 3.0170 3.0170 3.1356 3.1356 3.1953 3.1953 3.2872 3.2872 3.3667 3.3667 3.7243 3.7243 3.8018 3.8018 3.8772 3.8772 3.9115 3.9115 5.5694 5.5694 5.6797 5.6797 6.8013 6.8013 7.0885 7.0885 7.5718 7.5718 7.6953 7.6953 9.9535 9.9535 10.0727 10.0727 10.2166 10.2166 10.3127 10.3127 10.7404 10.7404 k = 0.1061 0.1837 0.3073 ( 5568 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3629 -14.3629 -14.3619 -14.3619 -13.9969 -13.9969 -13.9957 -13.9957 -13.9733 -13.9733 -13.9730 -13.9730 -2.4304 -2.4304 -2.4301 -2.4301 2.9878 2.9878 3.0140 3.0140 3.1359 3.1359 3.1874 3.1874 3.2838 3.2838 3.3608 3.3608 3.7261 3.7261 3.8007 3.8007 3.8746 3.8746 3.9050 3.9050 5.6160 5.6160 5.7227 5.7227 6.8460 6.8460 7.1337 7.1337 7.6325 7.6325 7.7603 7.7603 9.9181 9.9181 10.0235 10.0235 10.2257 10.2257 10.3313 10.3313 10.7306 10.7306 k = 0.0985 0.1706 0.3073 ( 5580 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3628 -14.3628 -14.3617 -14.3617 -13.9968 -13.9968 -13.9957 -13.9957 -13.9729 -13.9729 -13.9727 -13.9727 -2.4445 -2.4445 -2.4442 -2.4442 2.9883 2.9883 3.0111 3.0111 3.1368 3.1368 3.1802 3.1802 3.2806 3.2806 3.3548 3.3548 3.7282 3.7282 3.7996 3.7996 3.8718 3.8718 3.8984 3.8984 5.6580 5.6580 5.7599 5.7599 6.8960 6.8960 7.1797 7.1797 7.6968 7.6968 7.8242 7.8242 9.8752 9.8752 9.9713 9.9713 10.2403 10.2403 10.3498 10.3498 10.7183 10.7183 k = 0.0909 0.1575 0.3073 ( 5574 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3626 -14.3626 -14.3616 -14.3616 -13.9967 -13.9967 -13.9957 -13.9957 -13.9725 -13.9725 -13.9723 -13.9723 -2.4579 -2.4579 -2.4576 -2.4576 2.9890 2.9890 3.0084 3.0084 3.1381 3.1381 3.1739 3.1739 3.2774 3.2774 3.3489 3.3489 3.7305 3.7305 3.7987 3.7987 3.8691 3.8691 3.8920 3.8920 5.6953 5.6953 5.7912 5.7912 6.9513 6.9513 7.2271 7.2271 7.7638 7.7638 7.8868 7.8868 9.8259 9.8259 9.9161 9.9161 10.2587 10.2587 10.3680 10.3680 10.7028 10.7028 k = 0.0833 0.1443 0.3073 ( 5570 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3624 -14.3624 -14.3615 -14.3615 -13.9966 -13.9966 -13.9956 -13.9956 -13.9721 -13.9721 -13.9720 -13.9720 -2.4705 -2.4705 -2.4702 -2.4702 2.9898 2.9898 3.0058 3.0058 3.1396 3.1396 3.1685 3.1685 3.2745 3.2745 3.3430 3.3430 3.7332 3.7332 3.7979 3.7979 3.8664 3.8664 3.8857 3.8857 5.7279 5.7279 5.8168 5.8168 7.0117 7.0117 7.2760 7.2760 7.8324 7.8324 7.9478 7.9478 9.7710 9.7710 9.8576 9.8576 10.2800 10.2800 10.3859 10.3859 10.6838 10.6838 k = 0.0758 0.1312 0.3073 ( 5574 PWs) bands (ev): -33.0861 -33.0861 -33.0861 -33.0861 -14.3622 -14.3622 -14.3614 -14.3614 -13.9966 -13.9966 -13.9956 -13.9956 -13.9718 -13.9718 -13.9717 -13.9717 -2.4822 -2.4822 -2.4820 -2.4820 2.9906 2.9906 3.0033 3.0033 3.1413 3.1413 3.1642 3.1642 3.2719 3.2719 3.3371 3.3371 3.7362 3.7362 3.7971 3.7971 3.8636 3.8636 3.8796 3.8796 5.7559 5.7559 5.8371 5.8371 7.0763 7.0763 7.3259 7.3259 7.9019 7.9019 8.0071 8.0071 9.7110 9.7110 9.7952 9.7952 10.3034 10.3034 10.4037 10.4037 10.6619 10.6619 k = 0.0682 0.1181 0.3073 ( 5574 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3621 -14.3621 -14.3613 -14.3613 -13.9965 -13.9965 -13.9956 -13.9956 -13.9715 -13.9715 -13.9714 -13.9714 -2.4930 -2.4930 -2.4928 -2.4928 2.9913 2.9913 3.0010 3.0010 3.1429 3.1429 3.1610 3.1610 3.2696 3.2696 3.3312 3.3312 3.7394 3.7394 3.7964 3.7964 3.8610 3.8610 3.8738 3.8738 5.7799 5.7799 5.8527 5.8527 7.1439 7.1439 7.3759 7.3759 7.9719 7.9719 8.0649 8.0649 9.6465 9.6465 9.7286 9.7286 10.3284 10.3284 10.4216 10.4216 10.6382 10.6382 k = 0.0606 0.1050 0.3073 ( 5574 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3619 -14.3619 -14.3612 -14.3612 -13.9964 -13.9964 -13.9956 -13.9956 -13.9712 -13.9712 -13.9711 -13.9711 -2.5029 -2.5029 -2.5026 -2.5026 2.9918 2.9918 2.9990 2.9990 3.1443 3.1443 3.1590 3.1590 3.2678 3.2678 3.3253 3.3253 3.7430 3.7430 3.7955 3.7955 3.8583 3.8583 3.8682 3.8682 5.8000 5.8000 5.8641 5.8641 7.2129 7.2129 7.4251 7.4251 8.0421 8.0421 8.1214 8.1214 9.5781 9.5781 9.6579 9.6579 10.3545 10.3545 10.4394 10.4394 10.6144 10.6144 k = 0.0530 0.0919 0.3073 ( 5572 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3618 -14.3618 -14.3612 -14.3612 -13.9963 -13.9963 -13.9956 -13.9956 -13.9709 -13.9709 -13.9709 -13.9709 -2.5117 -2.5117 -2.5115 -2.5115 2.9921 2.9921 2.9971 2.9971 3.1453 3.1453 3.1581 3.1581 3.2666 3.2666 3.3194 3.3194 3.7468 3.7468 3.7945 3.7945 3.8558 3.8558 3.8631 3.8631 5.8168 5.8168 5.8722 5.8722 7.2816 7.2816 7.4718 7.4718 8.1122 8.1122 8.1768 8.1768 9.5068 9.5068 9.5834 9.5834 10.3810 10.3810 10.4567 10.4567 10.5922 10.5922 k = 0.0455 0.0787 0.3073 ( 5564 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3617 -14.3617 -14.3611 -14.3611 -13.9962 -13.9962 -13.9956 -13.9956 -13.9706 -13.9706 -13.9706 -13.9706 -2.5194 -2.5194 -2.5192 -2.5192 2.9923 2.9923 2.9955 2.9955 3.1462 3.1462 3.1580 3.1580 3.2662 3.2662 3.3134 3.3134 3.7508 3.7508 3.7932 3.7932 3.8535 3.8535 3.8585 3.8585 5.8308 5.8308 5.8776 5.8776 7.3481 7.3481 7.5145 7.5145 8.1818 8.1818 8.2315 8.2315 9.4340 9.4340 9.5062 9.5062 10.4070 10.4070 10.4727 10.4727 10.5733 10.5733 k = 0.0379 0.0656 0.3073 ( 5556 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3615 -14.3615 -14.3611 -14.3611 -13.9961 -13.9961 -13.9957 -13.9957 -13.9704 -13.9704 -13.9704 -13.9704 -2.5259 -2.5259 -2.5258 -2.5258 2.9922 2.9922 2.9941 2.9941 3.1471 3.1471 3.1581 3.1581 3.2665 3.2665 3.3076 3.3076 3.7550 3.7550 3.7916 3.7916 3.8514 3.8514 3.8545 3.8545 5.8423 5.8423 5.8807 5.8807 7.4105 7.4105 7.5515 7.5515 8.2501 8.2501 8.2854 8.2854 9.3617 9.3617 9.4279 9.4279 10.4315 10.4315 10.4860 10.4860 10.5594 10.5594 k = 0.0303 0.0525 0.3073 ( 5544 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3614 -14.3614 -14.3610 -14.3610 -13.9961 -13.9961 -13.9957 -13.9957 -13.9702 -13.9702 -13.9702 -13.9702 -2.5314 -2.5314 -2.5312 -2.5312 2.9920 2.9920 2.9930 2.9930 3.1482 3.1482 3.1581 3.1581 3.2677 3.2677 3.3018 3.3018 3.7594 3.7594 3.7895 3.7895 3.8495 3.8495 3.8512 3.8512 5.8517 5.8517 5.8820 5.8820 7.4671 7.4671 7.5812 7.5812 8.3156 8.3156 8.3378 8.3378 9.2924 9.2924 9.3510 9.3510 10.4531 10.4531 10.4946 10.4946 10.5520 10.5520 k = 0.0227 0.0394 0.3073 ( 5532 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3613 -14.3613 -14.3610 -14.3610 -13.9960 -13.9960 -13.9957 -13.9957 -13.9701 -13.9701 -13.9701 -13.9701 -2.5356 -2.5356 -2.5355 -2.5355 2.9918 2.9918 2.9922 2.9922 3.1496 3.1496 3.1578 3.1578 3.2698 3.2698 3.2961 3.2961 3.7638 3.7638 3.7870 3.7870 3.8479 3.8479 3.8486 3.8486 5.8595 5.8595 5.8819 5.8819 7.5161 7.5161 7.6025 7.6025 8.3754 8.3754 8.3869 8.3869 9.2304 9.2304 9.2790 9.2790 10.4701 10.4701 10.4977 10.4977 10.5510 10.5510 k = 0.0152 0.0262 0.3073 ( 5528 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3612 -14.3612 -14.3610 -14.3610 -13.9959 -13.9959 -13.9957 -13.9957 -13.9700 -13.9700 -13.9700 -13.9700 -2.5386 -2.5386 -2.5386 -2.5386 2.9915 2.9915 2.9916 2.9916 3.1512 3.1512 3.1571 3.1571 3.2727 3.2727 3.2906 3.2906 3.7682 3.7682 3.7840 3.7840 3.8466 3.8466 3.8469 3.8469 5.8658 5.8658 5.8807 5.8807 7.5563 7.5563 7.6142 7.6142 8.4251 8.4251 8.4292 8.4292 9.1810 9.1810 9.2165 9.2165 10.4816 10.4816 10.4971 10.4971 10.5535 10.5535 k = 0.0076 0.0131 0.3073 ( 5516 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3611 -14.3611 -14.3610 -14.3610 -13.9958 -13.9958 -13.9957 -13.9957 -13.9699 -13.9699 -13.9699 -13.9699 -2.5405 -2.5405 -2.5404 -2.5404 2.9913 2.9913 2.9913 2.9913 3.1529 3.1529 3.1559 3.1559 3.2763 3.2763 3.2854 3.2854 3.7725 3.7725 3.7805 3.7805 3.8458 3.8458 3.8459 3.8459 5.8710 5.8710 5.8784 5.8784 7.5866 7.5866 7.6156 7.6156 8.4587 8.4587 8.4593 8.4593 9.1511 9.1511 9.1702 9.1702 10.4880 10.4880 10.4949 10.4949 10.5559 10.5559 k = 0.0000 0.0000 0.3073 ( 5504 PWs) bands (ev): -33.0862 -33.0862 -33.0862 -33.0862 -14.3610 -14.3610 -14.3610 -14.3610 -13.9958 -13.9958 -13.9958 -13.9958 -13.9699 -13.9699 -13.9699 -13.9699 -2.5410 -2.5410 -2.5410 -2.5410 2.9912 2.9912 2.9912 2.9912 3.1545 3.1545 3.1545 3.1545 3.2806 3.2806 3.2806 3.2806 3.7767 3.7767 3.7767 3.7767 3.8456 3.8456 3.8456 3.8456 5.8752 5.8752 5.8752 5.8752 7.6065 7.6065 7.6065 7.6065 8.4705 8.4705 8.4705 8.4705 9.1470 9.1470 9.1470 9.1470 10.4919 10.4919 10.4919 10.4919 10.5566 10.5566 k = 0.5000 0.2887 0.3073 ( 5608 PWs) bands (ev): -33.0856 -33.0856 -33.0856 -33.0856 -14.3656 -14.3656 -14.3656 -14.3656 -13.9981 -13.9981 -13.9981 -13.9981 -13.9798 -13.9798 -13.9798 -13.9798 -2.1447 -2.1447 -2.1447 -2.1447 3.0808 3.0808 3.0808 3.0808 3.3082 3.3082 3.3082 3.3082 3.4138 3.4138 3.4138 3.4138 3.8373 3.8373 3.8373 3.8373 3.9406 3.9406 3.9406 3.9406 4.3500 4.3500 4.3500 4.3500 6.5317 6.5317 6.5317 6.5317 7.3571 7.3571 7.3571 7.3571 9.6503 9.6503 9.6503 9.6503 9.8516 9.8516 9.8516 9.8516 11.5976 11.5976 k = 0.5000 0.2887 0.2927 ( 5598 PWs) bands (ev): -33.0858 -33.0858 -33.0854 -33.0854 -14.3663 -14.3663 -14.3648 -14.3648 -13.9997 -13.9997 -13.9964 -13.9964 -13.9801 -13.9801 -13.9794 -13.9794 -2.1467 -2.1467 -2.1426 -2.1426 3.0786 3.0786 3.0833 3.0833 3.3072 3.3072 3.3094 3.3094 3.4083 3.4083 3.4197 3.4197 3.8362 3.8362 3.8387 3.8387 3.9365 3.9365 3.9446 3.9446 4.3392 4.3392 4.3626 4.3626 6.5094 6.5094 6.5514 6.5514 7.3055 7.3056 7.4053 7.4053 9.5869 9.5869 9.6999 9.6999 9.7783 9.7783 9.9487 9.9487 11.5841 11.5846 k = 0.5000 0.2887 0.2781 ( 5588 PWs) bands (ev): -33.0860 -33.0860 -33.0853 -33.0853 -14.3671 -14.3671 -14.3640 -14.3640 -14.0014 -14.0014 -13.9948 -13.9948 -13.9803 -13.9803 -13.9791 -13.9791 -2.1488 -2.1488 -2.1407 -2.1407 3.0768 3.0768 3.0861 3.0861 3.3062 3.3062 3.3106 3.3106 3.4032 3.4032 3.4261 3.4261 3.8351 3.8351 3.8401 3.8401 3.9322 3.9322 3.9482 3.9482 4.3302 4.3302 4.3769 4.3769 6.4842 6.4842 6.5687 6.5687 7.2522 7.2522 7.4485 7.4485 9.5236 9.5236 9.6601 9.6601 9.8062 9.8062 10.0543 10.0543 11.5696 11.5697 k = 0.5000 0.2887 0.2634 ( 5586 PWs) bands (ev): -33.0862 -33.0862 -33.0851 -33.0851 -14.3679 -14.3679 -14.3633 -14.3633 -14.0030 -14.0030 -13.9933 -13.9933 -13.9805 -13.9805 -13.9787 -13.9787 -2.1510 -2.1510 -2.1388 -2.1388 3.0754 3.0754 3.0891 3.0891 3.3053 3.3053 3.3118 3.3118 3.3985 3.3985 3.4328 3.4328 3.8343 3.8343 3.8416 3.8416 3.9279 3.9279 3.9515 3.9515 4.3230 4.3230 4.3929 4.3929 6.4559 6.4559 6.5836 6.5836 7.1985 7.1986 7.4851 7.4851 9.4618 9.4618 9.5946 9.5946 9.8730 9.8730 10.1653 10.1653 11.5544 11.5545 k = 0.5000 0.2887 0.2488 ( 5586 PWs) bands (ev): -33.0863 -33.0863 -33.0849 -33.0849 -14.3687 -14.3687 -14.3626 -14.3626 -14.0046 -14.0046 -13.9918 -13.9918 -13.9806 -13.9806 -13.9783 -13.9783 -2.1532 -2.1532 -2.1371 -2.1371 3.0743 3.0743 3.0924 3.0924 3.3046 3.3046 3.3131 3.3131 3.3942 3.3942 3.4399 3.4399 3.8335 3.8335 3.8431 3.8431 3.9235 3.9235 3.9544 3.9544 4.3176 4.3176 4.4105 4.4105 6.4244 6.4244 6.5963 6.5963 7.1459 7.1459 7.5136 7.5136 9.4020 9.4020 9.5386 9.5386 9.9444 9.9444 10.2798 10.2798 11.5389 11.5389 k = 0.5000 0.2887 0.2342 ( 5578 PWs) bands (ev): -33.0865 -33.0865 -33.0847 -33.0847 -14.3695 -14.3695 -14.3619 -14.3619 -14.0062 -14.0062 -13.9906 -13.9906 -13.9805 -13.9805 -13.9779 -13.9779 -2.1554 -2.1554 -2.1354 -2.1354 3.0735 3.0735 3.0957 3.0957 3.3040 3.3040 3.3143 3.3143 3.3904 3.3904 3.4472 3.4472 3.8330 3.8330 3.8447 3.8447 3.9192 3.9192 3.9570 3.9570 4.3140 4.3140 4.4296 4.4296 6.3894 6.3894 6.6069 6.6069 7.0955 7.0955 7.5331 7.5331 9.3447 9.3447 9.4956 9.4956 10.0173 10.0173 10.3959 10.3959 11.5237 11.5238 k = 0.5000 0.2887 0.2195 ( 5580 PWs) bands (ev): -33.0867 -33.0867 -33.0846 -33.0846 -14.3703 -14.3703 -14.3612 -14.3612 -14.0078 -14.0078 -13.9895 -13.9895 -13.9802 -13.9802 -13.9775 -13.9775 -2.1576 -2.1576 -2.1339 -2.1339 3.0730 3.0730 3.0992 3.0992 3.3036 3.3036 3.3155 3.3155 3.3869 3.3869 3.4548 3.4548 3.8326 3.8326 3.8462 3.8462 3.9151 3.9151 3.9591 3.9591 4.3122 4.3122 4.4501 4.4501 6.3509 6.3509 6.6154 6.6154 7.0481 7.0481 7.5427 7.5427 9.2905 9.2905 9.4664 9.4664 10.0909 10.0909 10.5118 10.5118 11.5098 11.5098 k = 0.5000 0.2887 0.2049 ( 5580 PWs) bands (ev): -33.0868 -33.0868 -33.0844 -33.0844 -14.3710 -14.3710 -14.3606 -14.3606 -14.0092 -14.0092 -13.9887 -13.9887 -13.9797 -13.9797 -13.9771 -13.9771 -2.1597 -2.1597 -2.1325 -2.1325 3.0729 3.0729 3.1026 3.1026 3.3035 3.3035 3.3166 3.3166 3.3837 3.3837 3.4626 3.4626 3.8323 3.8323 3.8477 3.8477 3.9114 3.9114 3.9607 3.9607 4.3120 4.3120 4.4717 4.4717 6.3093 6.3093 6.6219 6.6219 7.0045 7.0045 7.5426 7.5426 9.2399 9.2399 9.4509 9.4509 10.1642 10.1642 10.6252 10.6252 11.4979 11.4979 k = 0.5000 0.2887 0.1903 ( 5580 PWs) bands (ev): -33.0870 -33.0870 -33.0843 -33.0843 -14.3718 -14.3718 -14.3600 -14.3600 -14.0106 -14.0106 -13.9882 -13.9882 -13.9790 -13.9790 -13.9768 -13.9768 -2.1619 -2.1619 -2.1312 -2.1312 3.0730 3.0730 3.1060 3.1060 3.3035 3.3035 3.3177 3.3177 3.3809 3.3809 3.4704 3.4704 3.8321 3.8321 3.8492 3.8492 3.9080 3.9080 3.9620 3.9620 4.3135 4.3135 4.4943 4.4943 6.2647 6.2647 6.6264 6.6264 6.9649 6.9649 7.5333 7.5333 9.1928 9.1928 9.4486 9.4486 10.2367 10.2367 10.7337 10.7337 11.4888 11.4888 k = 0.5000 0.2887 0.1756 ( 5598 PWs) bands (ev): -33.0871 -33.0871 -33.0841 -33.0841 -14.3725 -14.3725 -14.3596 -14.3596 -14.0119 -14.0119 -13.9880 -13.9880 -13.9782 -13.9782 -13.9764 -13.9764 -2.1640 -2.1640 -2.1300 -2.1300 3.0733 3.0733 3.1092 3.1092 3.3036 3.3036 3.3187 3.3187 3.3784 3.3784 3.4782 3.4782 3.8319 3.8319 3.8505 3.8505 3.9052 3.9052 3.9628 3.9628 4.3165 4.3165 4.5177 4.5177 6.2179 6.2179 6.6292 6.6292 6.9294 6.9294 7.5160 7.5160 9.1492 9.1492 9.4583 9.4583 10.3076 10.3076 10.8339 10.8339 11.4830 11.4830 k = 0.5000 0.2887 0.1610 ( 5588 PWs) bands (ev): -33.0873 -33.0873 -33.0840 -33.0840 -14.3732 -14.3732 -14.3590 -14.3590 -14.0132 -14.0132 -13.9878 -13.9878 -13.9772 -13.9772 -13.9760 -13.9760 -2.1659 -2.1659 -2.1289 -2.1289 3.0738 3.0738 3.1123 3.1123 3.3040 3.3040 3.3197 3.3197 3.3762 3.3762 3.4859 3.4859 3.8317 3.8317 3.8517 3.8517 3.9030 3.9030 3.9632 3.9632 4.3209 4.3209 4.5416 4.5416 6.1697 6.1697 6.6302 6.6302 6.8978 6.8978 7.4925 7.4925 9.1092 9.1092 9.4784 9.4784 10.3761 10.3761 10.9225 10.9225 11.4800 11.4800 k = 0.5000 0.2887 0.1464 ( 5580 PWs) bands (ev): -33.0874 -33.0874 -33.0838 -33.0838 -14.3739 -14.3739 -14.3585 -14.3585 -14.0143 -14.0143 -13.9877 -13.9877 -13.9763 -13.9763 -13.9756 -13.9756 -2.1678 -2.1678 -2.1279 -2.1279 3.0744 3.0744 3.1152 3.1152 3.3046 3.3046 3.3206 3.3206 3.3743 3.3743 3.4933 3.4933 3.8315 3.8315 3.8528 3.8528 3.9014 3.9014 3.9632 3.9632 4.3265 4.3265 4.5656 4.5656 6.1209 6.1209 6.6298 6.6298 6.8696 6.8696 7.4648 7.4648 9.0728 9.0728 9.5069 9.5069 10.4414 10.4414 10.9960 10.9960 11.4782 11.4782 k = 0.5000 0.2887 0.1317 ( 5580 PWs) bands (ev): -33.0875 -33.0875 -33.0837 -33.0837 -14.3745 -14.3745 -14.3581 -14.3581 -14.0154 -14.0154 -13.9877 -13.9877 -13.9757 -13.9757 -13.9748 -13.9748 -2.1695 -2.1695 -2.1271 -2.1271 3.0751 3.0751 3.1177 3.1177 3.3053 3.3053 3.3214 3.3214 3.3727 3.3727 3.5005 3.5005 3.8312 3.8312 3.8537 3.8537 3.9005 3.9005 3.9629 3.9629 4.3331 4.3331 4.5894 4.5894 6.0725 6.0725 6.6282 6.6282 6.8444 6.8444 7.4348 7.4348 9.0398 9.0398 9.5418 9.5418 10.5028 10.5028 11.0523 11.0523 11.4758 11.4758 k = 0.5000 0.2887 0.1171 ( 5580 PWs) bands (ev): -33.0876 -33.0876 -33.0836 -33.0836 -14.3750 -14.3750 -14.3577 -14.3577 -14.0164 -14.0164 -13.9878 -13.9878 -13.9754 -13.9754 -13.9739 -13.9739 -2.1712 -2.1712 -2.1263 -2.1263 3.0758 3.0758 3.1201 3.1201 3.3061 3.3061 3.3221 3.3221 3.3712 3.3712 3.5071 3.5071 3.8307 3.8307 3.8546 3.8546 3.9003 3.9003 3.9623 3.9623 4.3405 4.3405 4.6127 4.6127 6.0257 6.0257 6.6257 6.6257 6.8216 6.8216 7.4042 7.4042 9.0103 9.0103 9.5808 9.5808 10.5594 10.5594 11.0920 11.0920 11.4725 11.4725 k = 0.5000 0.2887 0.1024 ( 5586 PWs) bands (ev): -33.0877 -33.0877 -33.0835 -33.0835 -14.3755 -14.3755 -14.3574 -14.3574 -14.0172 -14.0172 -13.9879 -13.9879 -13.9751 -13.9751 -13.9731 -13.9731 -2.1727 -2.1727 -2.1256 -2.1256 3.0766 3.0766 3.1221 3.1221 3.3070 3.3070 3.3227 3.3227 3.3700 3.3700 3.5133 3.5133 3.8301 3.8301 3.8554 3.8554 3.9006 3.9006 3.9614 3.9614 4.3483 4.3483 4.6348 4.6348 5.9813 5.9813 6.6226 6.6226 6.8010 6.8010 7.3748 7.3748 8.9843 8.9843 9.6218 9.6218 10.6105 10.6105 11.1181 11.1181 11.4687 11.4687 k = 0.5000 0.2887 0.0878 ( 5582 PWs) bands (ev): -33.0878 -33.0878 -33.0834 -33.0834 -14.3760 -14.3760 -14.3571 -14.3571 -14.0180 -14.0180 -13.9880 -13.9880 -13.9749 -13.9749 -13.9722 -13.9722 -2.1740 -2.1740 -2.1251 -2.1251 3.0773 3.0773 3.1238 3.1238 3.3079 3.3079 3.3233 3.3233 3.3690 3.3690 3.5188 3.5188 3.8294 3.8294 3.8561 3.8561 3.9015 3.9015 3.9604 3.9604 4.3562 4.3562 4.6554 4.6554 5.9404 5.9404 6.6193 6.6193 6.7823 6.7823 7.3477 7.3477 8.9617 8.9617 9.6628 9.6628 10.6554 10.6554 11.1343 11.1343 11.4648 11.4648 k = 0.5000 0.2887 0.0732 ( 5590 PWs) bands (ev): -33.0878 -33.0878 -33.0834 -33.0834 -14.3764 -14.3764 -14.3569 -14.3569 -14.0186 -14.0186 -13.9881 -13.9881 -13.9748 -13.9748 -13.9715 -13.9715 -2.1751 -2.1751 -2.1246 -2.1246 3.0779 3.0779 3.1252 3.1252 3.3087 3.3087 3.3237 3.3237 3.3682 3.3682 3.5235 3.5235 3.8287 3.8287 3.8566 3.8566 3.9026 3.9026 3.9592 3.9592 4.3639 4.3639 4.6740 4.6740 5.9040 5.9040 6.6159 6.6159 6.7655 6.7655 7.3239 7.3239 8.9426 8.9426 9.7018 9.7018 10.6936 10.6936 11.1440 11.1440 11.4612 11.4612 k = 0.5000 0.2887 0.0585 ( 5588 PWs) bands (ev): -33.0879 -33.0879 -33.0833 -33.0833 -14.3767 -14.3767 -14.3567 -14.3567 -14.0191 -14.0191 -13.9882 -13.9882 -13.9746 -13.9746 -13.9709 -13.9709 -2.1761 -2.1761 -2.1243 -2.1243 3.0785 3.0785 3.1263 3.1263 3.3095 3.3095 3.3241 3.3241 3.3675 3.3675 3.5276 3.5276 3.8280 3.8280 3.8572 3.8572 3.9038 3.9038 3.9580 3.9580 4.3709 4.3709 4.6901 4.6901 5.8728 5.8728 6.6129 6.6129 6.7510 6.7510 7.3040 7.3040 8.9270 8.9270 9.7369 9.7369 10.7248 10.7248 11.1497 11.1497 11.4580 11.4580 k = 0.5000 0.2887 0.0439 ( 5592 PWs) bands (ev): -33.0880 -33.0880 -33.0833 -33.0833 -14.3770 -14.3770 -14.3565 -14.3565 -14.0195 -14.0195 -13.9883 -13.9883 -13.9745 -13.9745 -13.9705 -13.9705 -2.1768 -2.1768 -2.1239 -2.1239 3.0790 3.0790 3.1272 3.1272 3.3101 3.3101 3.3244 3.3244 3.3670 3.3670 3.5307 3.5307 3.8274 3.8274 3.8576 3.8576 3.9051 3.9051 3.9569 3.9569 4.3768 4.3768 4.7031 4.7031 5.8476 5.8476 6.6103 6.6103 6.7391 6.7391 7.2883 7.2883 8.9148 8.9148 9.7664 9.7664 10.7489 10.7489 11.1529 11.1529 11.4554 11.4554 k = 0.5000 0.2887 0.0293 ( 5590 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3771 -14.3771 -14.3564 -14.3564 -14.0198 -14.0198 -13.9884 -13.9884 -13.9744 -13.9744 -13.9701 -13.9701 -2.1774 -2.1774 -2.1237 -2.1237 3.0794 3.0794 3.1278 3.1278 3.3106 3.3106 3.3246 3.3246 3.3667 3.3667 3.5330 3.5330 3.8269 3.8269 3.8579 3.8579 3.9061 3.9061 3.9560 3.9560 4.3814 4.3814 4.7128 4.7128 5.8291 5.8291 6.6084 6.6084 6.7301 6.7301 7.2771 7.2771 8.9062 8.9062 9.7887 9.7887 10.7659 10.7659 11.1546 11.1546 11.4536 11.4536 k = 0.5000 0.2887 0.0146 ( 5582 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3772 -14.3772 -14.3563 -14.3563 -14.0200 -14.0200 -13.9884 -13.9884 -13.9743 -13.9743 -13.9699 -13.9699 -2.1776 -2.1776 -2.1236 -2.1236 3.0796 3.0796 3.1282 3.1282 3.3109 3.3109 3.3247 3.3247 3.3665 3.3665 3.5344 3.5344 3.8267 3.8267 3.8581 3.8581 3.9068 3.9068 3.9555 3.9555 4.3842 4.3842 4.7187 4.7187 5.8179 5.8179 6.6071 6.6071 6.7246 6.7246 7.2704 7.2704 8.9010 8.9010 9.8026 9.8026 10.7761 10.7761 11.1555 11.1555 11.4524 11.4524 k = 0.5000 0.2887-0.0000 ( 5578 PWs) bands (ev): -33.0880 -33.0880 -33.0832 -33.0832 -14.3773 -14.3773 -14.3563 -14.3563 -14.0201 -14.0201 -13.9884 -13.9884 -13.9743 -13.9743 -13.9698 -13.9698 -2.1777 -2.1777 -2.1236 -2.1236 3.0797 3.0797 3.1283 3.1283 3.3111 3.3111 3.3248 3.3248 3.3664 3.3664 3.5349 3.5349 3.8266 3.8266 3.8582 3.8582 3.9071 3.9071 3.9553 3.9553 4.3852 4.3852 4.7207 4.7207 5.8141 5.8141 6.6067 6.6067 6.7227 6.7227 7.2681 7.2681 8.8992 8.8992 9.8073 9.8073 10.7794 10.7794 11.1558 11.1558 11.4521 11.4521 k = 0.3333 0.5774-0.0000 ( 5556 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3774 -14.3774 -14.3569 -14.3569 -14.0196 -14.0196 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9714 -2.1049 -2.1005 -2.1003 -2.1003 3.1704 3.1704 3.2696 3.2859 3.2859 3.3477 3.4262 3.4420 3.4420 3.4952 3.4952 3.6643 3.7722 3.7722 3.8611 3.8611 3.9176 3.9176 3.9613 4.0106 4.2776 4.6072 4.6369 4.6369 4.8000 4.8000 6.2200 6.2200 6.4204 6.8276 6.8938 6.8938 10.2067 10.5776 10.5776 10.5982 10.6881 10.6881 10.7310 10.7310 11.0788 11.2364 k = 0.3333 0.5774 0.0146 ( 5547 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3774 -14.3774 -14.3570 -14.3570 -14.0195 -14.0195 -13.9890 -13.9889 -13.9756 -13.9755 -13.9714 -13.9714 -2.1049 -2.1005 -2.1002 -2.1002 3.1705 3.1705 3.2696 3.2858 3.2858 3.3477 3.4258 3.4417 3.4417 3.4950 3.4950 3.6628 3.7722 3.7722 3.8604 3.8604 3.9181 3.9181 3.9620 4.0106 4.2777 4.6058 4.6372 4.6372 4.8005 4.8005 6.2193 6.2193 6.4242 6.8301 6.8955 6.8955 10.2046 10.5771 10.5771 10.5943 10.6860 10.6860 10.7340 10.7340 11.0805 11.2386 k = 0.3333 0.5774 0.0293 ( 5538 PWs) bands (ev): -33.0879 -33.0879 -33.0831 -33.0831 -14.3773 -14.3773 -14.3570 -14.3570 -14.0193 -14.0193 -13.9890 -13.9888 -13.9757 -13.9755 -13.9716 -13.9716 -2.1048 -2.1004 -2.1001 -2.1001 3.1709 3.1709 3.2698 3.2855 3.2855 3.3476 3.4247 3.4408 3.4408 3.4944 3.4944 3.6585 3.7721 3.7721 3.8581 3.8581 3.9194 3.9194 3.9638 4.0108 4.2780 4.6017 4.6379 4.6379 4.8020 4.8020 6.2168 6.2168 6.4354 6.8376 6.9006 6.9006 10.1983 10.5745 10.5745 10.5830 10.6807 10.6807 10.7430 10.7430 11.0853 11.2451 k = 0.3333 0.5774 0.0439 ( 5556 PWs) bands (ev): -33.0879 -33.0879 -33.0832 -33.0832 -14.3771 -14.3771 -14.3571 -14.3571 -14.0191 -14.0191 -13.9889 -13.9887 -13.9758 -13.9757 -13.9720 -13.9720 -2.1046 -2.1003 -2.1000 -2.1000 3.1715 3.1715 3.2700 3.2849 3.2849 3.3474 3.4228 3.4393 3.4393 3.4934 3.4934 3.6516 3.7720 3.7720 3.8546 3.8546 3.9214 3.9214 3.9666 4.0110 4.2785 4.5951 4.6387 4.6387 4.8051 4.8051 6.2123 6.2123 6.4539 6.8499 6.9096 6.9096 10.1880 10.5645 10.5667 10.5667 10.6756 10.6756 10.7580 10.7580 11.0929 11.2553 k = 0.3333 0.5774 0.0585 ( 5574 PWs) bands (ev): -33.0878 -33.0878 -33.0832 -33.0832 -14.3769 -14.3769 -14.3574 -14.3574 -14.0187 -14.0187 -13.9888 -13.9887 -13.9759 -13.9758 -13.9726 -13.9726 -2.1044 -2.1002 -2.0999 -2.0999 3.1723 3.1723 3.2703 3.2841 3.2841 3.3472 3.4203 3.4372 3.4372 3.4921 3.4921 3.6423 3.7717 3.7717 3.8503 3.8503 3.9237 3.9237 3.9703 4.0113 4.2792 4.5861 4.6390 4.6390 4.8103 4.8103 6.2052 6.2052 6.4792 6.8668 6.9228 6.9228 10.1737 10.5396 10.5499 10.5499 10.6751 10.6751 10.7789 10.7789 11.1028 11.2686 k = 0.3333 0.5774 0.0732 ( 5574 PWs) bands (ev): -33.0878 -33.0878 -33.0833 -33.0833 -14.3766 -14.3766 -14.3576 -14.3576 -14.0182 -14.0182 -13.9887 -13.9885 -13.9761 -13.9759 -13.9733 -13.9733 -2.1041 -2.1000 -2.0996 -2.0996 3.1734 3.1734 3.2707 3.2831 3.2831 3.3468 3.4172 3.4346 3.4346 3.4904 3.4904 3.6311 3.7715 3.7715 3.8454 3.8454 3.9263 3.9263 3.9746 4.0118 4.2802 4.5751 4.6384 4.6384 4.8184 4.8184 6.1947 6.1947 6.5109 6.8880 6.9408 6.9408 10.1557 10.5089 10.5228 10.5228 10.6811 10.6811 10.8055 10.8055 11.1146 11.2731 k = 0.3333 0.5774 0.0878 ( 5586 PWs) bands (ev): -33.0877 -33.0877 -33.0834 -33.0834 -14.3762 -14.3762 -14.3578 -14.3578 -14.0175 -14.0175 -13.9885 -13.9883 -13.9763 -13.9761 -13.9741 -13.9741 -2.1038 -2.0998 -2.0993 -2.0993 3.1747 3.1747 3.2712 3.2818 3.2818 3.3463 3.4137 3.4317 3.4317 3.4884 3.4884 3.6182 3.7711 3.7711 3.8401 3.8401 3.9288 3.9288 3.9792 4.0123 4.2814 4.5625 4.6363 4.6363 4.8298 4.8298 6.1804 6.1804 6.5482 6.9130 6.9637 6.9637 10.1341 10.4731 10.4867 10.4867 10.6930 10.6930 10.8370 10.8370 11.1277 11.2761 k = 0.3333 0.5774 0.1024 ( 5574 PWs) bands (ev): -33.0876 -33.0876 -33.0834 -33.0834 -14.3758 -14.3758 -14.3580 -14.3580 -14.0168 -14.0168 -13.9882 -13.9881 -13.9765 -13.9763 -13.9750 -13.9750 -2.1033 -2.0995 -2.0990 -2.0990 3.1763 3.1763 3.2719 3.2802 3.2802 3.3457 3.4100 3.4284 3.4284 3.4861 3.4861 3.6042 3.7707 3.7707 3.8349 3.8349 3.9313 3.9313 3.9841 4.0129 4.2830 4.5486 4.6327 4.6327 4.8449 4.8449 6.1620 6.1620 6.5906 6.9413 6.9919 6.9919 10.1094 10.4330 10.4438 10.4438 10.7095 10.7095 10.8728 10.8728 11.1419 11.2797 k = 0.3333 0.5774 0.1171 ( 5577 PWs) bands (ev): -33.0875 -33.0875 -33.0835 -33.0835 -14.3753 -14.3753 -14.3584 -14.3584 -14.0159 -14.0159 -13.9880 -13.9878 -13.9768 -13.9766 -13.9761 -13.9761 -2.1029 -2.0992 -2.0986 -2.0986 3.1781 3.1781 3.2726 3.2784 3.2784 3.3448 3.4061 3.4249 3.4249 3.4835 3.4835 3.5892 3.7701 3.7701 3.8297 3.8297 3.9336 3.9336 3.9889 4.0136 4.2849 4.5337 4.6276 4.6276 4.8635 4.8635 6.1393 6.1393 6.6372 6.9723 7.0249 7.0249 10.0820 10.3892 10.3959 10.3959 10.7294 10.7294 10.9117 10.9117 11.1567 11.2839 k = 0.3333 0.5774 0.1317 ( 5577 PWs) bands (ev): -33.0874 -33.0874 -33.0836 -33.0836 -14.3748 -14.3748 -14.3587 -14.3587 -14.0150 -14.0150 -13.9877 -13.9876 -13.9772 -13.9772 -13.9770 -13.9769 -2.1024 -2.0989 -2.0982 -2.0982 3.1801 3.1801 3.2735 3.2764 3.2764 3.3435 3.4023 3.4212 3.4212 3.4808 3.4808 3.5737 3.7695 3.7695 3.8247 3.8247 3.9357 3.9357 3.9935 4.0143 4.2872 4.5182 4.6213 4.6213 4.8856 4.8856 6.1125 6.1125 6.6873 7.0054 7.0624 7.0624 10.0523 10.3423 10.3442 10.3442 10.7522 10.7522 10.9525 10.9525 11.1720 11.2886 k = 0.3333 0.5774 0.1464 ( 5583 PWs) bands (ev): -33.0873 -33.0873 -33.0838 -33.0838 -14.3742 -14.3742 -14.3591 -14.3591 -14.0140 -14.0140 -13.9874 -13.9873 -13.9785 -13.9785 -13.9773 -13.9772 -2.1019 -2.0986 -2.0978 -2.0978 3.1822 3.1822 3.2740 3.2740 3.2745 3.3418 3.3988 3.4175 3.4175 3.4779 3.4779 3.5579 3.7687 3.7687 3.8201 3.8201 3.9376 3.9376 3.9979 4.0151 4.2899 4.5024 4.6142 4.6142 4.9106 4.9106 6.0821 6.0821 6.7400 7.0396 7.1037 7.1037 10.0211 10.2899 10.2899 10.2930 10.7775 10.7775 10.9939 10.9939 11.1875 11.2938 k = 0.3333 0.5774 0.1610 ( 5565 PWs) bands (ev): -33.0872 -33.0872 -33.0839 -33.0839 -14.3735 -14.3735 -14.3596 -14.3596 -14.0127 -14.0127 -13.9871 -13.9869 -13.9799 -13.9799 -13.9776 -13.9775 -2.1013 -2.0983 -2.0973 -2.0973 3.1846 3.1846 3.2715 3.2715 3.2757 3.3397 3.3959 3.4138 3.4138 3.4750 3.4750 3.5422 3.7678 3.7678 3.8160 3.8160 3.9393 3.9393 4.0019 4.0159 4.2930 4.4866 4.6067 4.6067 4.9382 4.9382 6.0485 6.0485 6.7944 7.0743 7.1477 7.1477 9.9890 10.2342 10.2342 10.2421 10.8050 10.8050 11.0344 11.0344 11.2031 11.2993 k = 0.3333 0.5774 0.1756 ( 5556 PWs) bands (ev): -33.0870 -33.0870 -33.0840 -33.0840 -14.3728 -14.3728 -14.3600 -14.3600 -14.0114 -14.0114 -13.9867 -13.9866 -13.9813 -13.9813 -13.9779 -13.9778 -2.1007 -2.0980 -2.0969 -2.0969 3.1871 3.1871 3.2687 3.2687 3.2771 3.3369 3.3939 3.4103 3.4103 3.4720 3.4720 3.5266 3.7668 3.7668 3.8123 3.8123 3.9408 3.9408 4.0056 4.0167 4.2966 4.4709 4.5990 4.5990 4.9678 4.9678 6.0126 6.0126 6.8498 7.1083 7.1935 7.1935 9.9570 10.1781 10.1781 10.1904 10.8344 10.8344 11.0724 11.0724 11.2186 11.3049 k = 0.3333 0.5774 0.1903 ( 5556 PWs) bands (ev): -33.0869 -33.0869 -33.0842 -33.0842 -14.3721 -14.3721 -14.3606 -14.3606 -14.0101 -14.0101 -13.9864 -13.9862 -13.9829 -13.9829 -13.9783 -13.9781 -2.1002 -2.0977 -2.0965 -2.0965 3.1897 3.1897 3.2657 3.2657 3.2786 3.3336 3.3927 3.4069 3.4069 3.4691 3.4691 3.5115 3.7657 3.7657 3.8091 3.8091 3.9421 3.9421 4.0088 4.0175 4.3007 4.4556 4.5916 4.5916 4.9988 4.9988 5.9750 5.9750 6.9050 7.1409 7.2397 7.2397 9.9261 10.1228 10.1228 10.1386 10.8653 10.8653 11.1061 11.1061 11.2338 11.3106 k = 0.3333 0.5774 0.2049 ( 5556 PWs) bands (ev): -33.0867 -33.0867 -33.0843 -33.0843 -14.3714 -14.3714 -14.3611 -14.3611 -14.0087 -14.0087 -13.9860 -13.9858 -13.9845 -13.9845 -13.9787 -13.9785 -2.0997 -2.0975 -2.0961 -2.0961 3.1923 3.1923 3.2625 3.2625 3.2803 3.3297 3.3926 3.4039 3.4039 3.4663 3.4663 3.4970 3.7646 3.7646 3.8064 3.8064 3.9431 3.9431 4.0116 4.0183 4.3054 4.4407 4.5847 4.5847 5.0305 5.0305 5.9368 5.9368 6.9593 7.1708 7.2852 7.2852 9.8972 10.0695 10.0695 10.0876 10.8974 10.8974 11.1343 11.1343 11.2486 11.3159 k = 0.3333 0.5774 0.2195 ( 5556 PWs) bands (ev): -33.0866 -33.0866 -33.0845 -33.0845 -14.3707 -14.3707 -14.3617 -14.3617 -14.0072 -14.0072 -13.9862 -13.9862 -13.9856 -13.9854 -13.9791 -13.9789 -2.0992 -2.0973 -2.0958 -2.0958 3.1950 3.1950 3.2593 3.2593 3.2822 3.3254 3.3935 3.4011 3.4011 3.4638 3.4638 3.4832 3.7634 3.7634 3.8042 3.8042 3.9441 3.9441 4.0140 4.0190 4.3106 4.4264 4.5783 4.5783 5.0623 5.0623 5.8988 5.8988 7.0115 7.1972 7.3285 7.3285 9.8714 10.0194 10.0194 10.0385 10.9304 10.9304 11.1557 11.1557 11.2628 11.3207 k = 0.3333 0.5774 0.2342 ( 5553 PWs) bands (ev): -33.0864 -33.0864 -33.0846 -33.0846 -14.3699 -14.3699 -14.3623 -14.3623 -14.0056 -14.0056 -13.9879 -13.9879 -13.9852 -13.9851 -13.9794 -13.9793 -2.0987 -2.0971 -2.0955 -2.0955 3.1977 3.1977 3.2561 3.2561 3.2844 3.3209 3.3955 3.3987 3.3987 3.4615 3.4615 3.4703 3.7624 3.7624 3.8024 3.8024 3.9448 3.9448 4.0160 4.0196 4.3165 4.4127 4.5728 4.5728 5.0931 5.0931 5.8624 5.8624 7.0607 7.2188 7.3683 7.3683 9.8498 9.9740 9.9740 9.9921 10.9636 10.9636 11.1695 11.1695 11.2761 11.3247 k = 0.3333 0.5774 0.2488 ( 5547 PWs) bands (ev): -33.0862 -33.0862 -33.0848 -33.0848 -14.3692 -14.3692 -14.3629 -14.3629 -14.0040 -14.0040 -13.9897 -13.9897 -13.9848 -13.9847 -13.9798 -13.9797 -2.0983 -2.0970 -2.0952 -2.0952 3.2002 3.2002 3.2531 3.2531 3.2868 3.3164 3.3968 3.3968 3.3984 3.4583 3.4595 3.4595 3.7614 3.7614 3.8011 3.8011 3.9454 3.9454 4.0177 4.0202 4.3229 4.3998 4.5681 4.5681 5.1218 5.1218 5.8288 5.8288 7.1059 7.2349 7.4033 7.4033 9.8334 9.9344 9.9344 9.9495 10.9966 10.9966 11.1754 11.1754 11.2884 11.3275 k = 0.3333 0.5774 0.2634 ( 5553 PWs) bands (ev): -33.0861 -33.0861 -33.0850 -33.0850 -14.3685 -14.3685 -14.3635 -14.3635 -14.0023 -14.0023 -13.9914 -13.9914 -13.9845 -13.9843 -13.9802 -13.9801 -2.0979 -2.0970 -2.0950 -2.0950 3.2025 3.2025 3.2505 3.2505 3.2895 3.3118 3.3952 3.3952 3.4024 3.4472 3.4579 3.4579 3.7606 3.7606 3.8001 3.8001 3.9459 3.9459 4.0189 4.0206 4.3300 4.3876 4.5644 4.5644 5.1469 5.1469 5.7997 5.7997 7.1462 7.2444 7.4322 7.4322 9.8231 9.9020 9.9020 9.9116 11.0284 11.0284 11.1738 11.1738 11.2994 11.3289 k = 0.3333 0.5774 0.2781 ( 5565 PWs) bands (ev): -33.0859 -33.0859 -33.0852 -33.0852 -14.3678 -14.3678 -14.3642 -14.3642 -14.0006 -14.0006 -13.9933 -13.9933 -13.9842 -13.9841 -13.9805 -13.9804 -2.0977 -2.0970 -2.0949 -2.0949 3.2043 3.2043 3.2483 3.2483 3.2924 3.3074 3.3940 3.3940 3.4073 3.4372 3.4567 3.4567 3.7600 3.7600 3.7993 3.7993 3.9462 3.9462 4.0198 4.0208 4.3378 4.3761 4.5617 4.5617 5.1668 5.1668 5.7769 5.7769 7.1805 7.2468 7.4537 7.4537 9.8197 9.8780 9.8780 9.8794 11.0577 11.0577 11.1660 11.1660 11.3088 11.3287 k = 0.3333 0.5774 0.2927 ( 5577 PWs) bands (ev): -33.0857 -33.0857 -33.0854 -33.0854 -14.3673 -14.3673 -14.3647 -14.3647 -13.9990 -13.9990 -13.9950 -13.9950 -13.9840 -13.9839 -13.9807 -13.9806 -2.0974 -2.0971 -2.0948 -2.0948 3.2055 3.2055 3.2468 3.2468 3.2957 3.3032 3.3933 3.3933 3.4133 3.4282 3.4560 3.4560 3.7596 3.7596 3.7989 3.7989 3.9464 3.9464 4.0204 4.0209 4.3463 4.3654 4.5600 4.5600 5.1796 5.1796 5.7623 5.7623 7.2083 7.2416 7.4670 7.4670 9.8235 9.8536 9.8631 9.8631 11.0819 11.0819 11.1546 11.1546 11.3166 11.3266 k = 0.3333 0.5774 0.3073 ( 5556 PWs) bands (ev): -33.0855 -33.0855 -33.0855 -33.0855 -14.3669 -14.3669 -14.3649 -14.3649 -13.9977 -13.9977 -13.9962 -13.9962 -13.9838 -13.9838 -13.9807 -13.9807 -2.0972 -2.0972 -2.0948 -2.0948 3.2060 3.2060 3.2464 3.2464 3.2994 3.2994 3.3932 3.3932 3.4202 3.4202 3.4558 3.4558 3.7595 3.7595 3.7988 3.7988 3.9465 3.9465 4.0208 4.0208 4.3555 4.3555 4.5595 4.5595 5.1841 5.1841 5.7573 5.7573 7.2288 7.2288 7.4715 7.4715 9.8349 9.8349 9.8581 9.8581 11.0929 11.0929 11.1478 11.1478 11.3226 11.3226 Writing output data file CaAgBi.save init_run : 4.09s CPU 13.66s WALL ( 1 calls) electrons : 1722.61s CPU 1734.96s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.57s CPU 1.54s WALL ( 1 calls) Called by electrons: c_bands : 1722.53s CPU 1734.21s WALL ( 1 calls) v_of_rho : 0.28s CPU 0.90s WALL ( 1 calls) v_h : 0.00s CPU 0.02s WALL ( 1 calls) v_xc : 0.27s CPU 0.57s WALL ( 1 calls) newd : 0.40s CPU 0.72s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.09s WALL ( 280 calls) cegterg : 1654.39s CPU 1663.17s WALL ( 1454 calls) Called by sum_band: Called by *egterg: h_psi : 621.99s CPU 637.54s WALL ( 29010 calls) s_psi : 69.57s CPU 70.61s WALL ( 29010 calls) g_psi : 1.49s CPU 1.58s WALL ( 27276 calls) cdiaghg : 700.63s CPU 694.70s WALL ( 27556 calls) cegterg:over : 133.95s CPU 127.82s WALL ( 27276 calls) cegterg:upda : 34.91s CPU 42.78s WALL ( 27276 calls) cegterg:last : 25.42s CPU 26.53s WALL ( 3134 calls) Called by h_psi: h_psi:vloc : 472.51s CPU 486.02s WALL ( 29010 calls) h_psi:vnl : 148.72s CPU 149.62s WALL ( 29010 calls) add_vuspsi : 52.35s CPU 61.30s WALL ( 29010 calls) General routines calbec : 96.29s CPU 88.11s WALL ( 29010 calls) fft : 0.62s CPU 1.28s WALL ( 19 calls) ffts : 0.01s CPU 0.02s WALL ( 4 calls) fftw : 452.96s CPU 459.91s WALL ( 2240920 calls) interpolate : 0.10s CPU 0.13s WALL ( 4 calls) davcio : 0.02s CPU 1.57s WALL ( 560 calls) Parallel routines fft_scatter : 287.13s CPU 295.95s WALL ( 2240943 calls) PWSCF : 29m54.70s CPU 32m39.49s WALL This run was terminated on: 23:32:59 17Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=