Program PWSCF v.5.1.1 starts on 9Oct2015 at 13:49:31 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: ./NbInS2.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D 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 15 10 3 795 474 77 Max 16 11 4 804 501 86 Sum 733 511 163 38287 23353 3883 bravais-lattice index = 14 lattice parameter (alat) = 6.2739 a.u. unit-cell volume = 519.2044 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 38.00 number of Kohn-Sham states= 46 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 267.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.273890 celldm(2)= 1.000000 celldm(3)= 2.427711 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 2.427711 ) 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 0.411911 ) PseudoPot. # 1 for S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 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 In read from file: /home/autes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1241 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 S 6.00 32.06500 S( 1.00) Nb 13.00 92.90640 Nb( 1.00) In 13.00 114.81800 In( 1.00) 12 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,1,0] cryst. s( 2) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [2,1,0] cryst. s( 6) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 7) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 7) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3h (-62m) there are 9 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3C2' s_h 2S3 -2S3 3s_v -3C2' -s_h' -3s_v G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 1.73 -1.73 0.00 G_8 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.73 1.73 0.00 G_9 2.00 -2.00 -2.00 2.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2'-3C2' 2 -6 -5 -2 5 6 2C3 3 4 3s_v-3s_v 7 -7 3s_v-3s_v 8 -8 11 -12 -11 12 2S3 9 10 -E -1 -2C3 -3 -4 -2S3 -9 -10 Cartesian axes number of k points= 371 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 2) = ( 0.0090909 0.0052486 -0.0000000), wk = 0.0026954 k( 3) = ( 0.0181818 0.0104973 -0.0000000), wk = 0.0026954 k( 4) = ( 0.0272727 0.0157459 -0.0000000), wk = 0.0026954 k( 5) = ( 0.0363636 0.0209946 -0.0000000), wk = 0.0026954 k( 6) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0026954 k( 7) = ( 0.0545455 0.0314918 -0.0000000), wk = 0.0026954 k( 8) = ( 0.0636364 0.0367405 -0.0000000), wk = 0.0026954 k( 9) = ( 0.0727273 0.0419891 -0.0000000), wk = 0.0026954 k( 10) = ( 0.0818182 0.0472377 -0.0000000), wk = 0.0026954 k( 11) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0026954 k( 12) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0026954 k( 13) = ( 0.1090909 0.0629837 -0.0000000), wk = 0.0026954 k( 14) = ( 0.1181818 0.0682323 -0.0000000), wk = 0.0026954 k( 15) = ( 0.1272727 0.0734809 -0.0000000), wk = 0.0026954 k( 16) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0026954 k( 17) = ( 0.1454545 0.0839782 -0.0000000), wk = 0.0026954 k( 18) = ( 0.1545455 0.0892269 -0.0000000), wk = 0.0026954 k( 19) = ( 0.1636364 0.0944755 -0.0000000), wk = 0.0026954 k( 20) = ( 0.1727273 0.0997241 -0.0000000), wk = 0.0026954 k( 21) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0026954 k( 22) = ( 0.1909091 0.1102214 -0.0000000), wk = 0.0026954 k( 23) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0026954 k( 24) = ( 0.2090909 0.1207187 -0.0000000), wk = 0.0026954 k( 25) = ( 0.2181818 0.1259673 -0.0000000), wk = 0.0026954 k( 26) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0026954 k( 27) = ( 0.2363636 0.1364646 -0.0000000), wk = 0.0026954 k( 28) = ( 0.2454545 0.1417133 -0.0000000), wk = 0.0026954 k( 29) = ( 0.2545455 0.1469619 -0.0000000), wk = 0.0026954 k( 30) = ( 0.2636364 0.1522105 -0.0000000), wk = 0.0026954 k( 31) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0026954 k( 32) = ( 0.2818182 0.1627078 -0.0000000), wk = 0.0026954 k( 33) = ( 0.2909091 0.1679564 -0.0000000), wk = 0.0026954 k( 34) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0026954 k( 35) = ( 0.3090909 0.1784537 -0.0000000), wk = 0.0026954 k( 36) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0026954 k( 37) = ( 0.3272727 0.1889510 -0.0000000), wk = 0.0026954 k( 38) = ( 0.3363636 0.1941996 -0.0000000), wk = 0.0026954 k( 39) = ( 0.3454546 0.1994483 -0.0000000), wk = 0.0026954 k( 40) = ( 0.3545454 0.2046969 -0.0000000), wk = 0.0026954 k( 41) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0026954 k( 42) = ( 0.3727273 0.2151942 -0.0000000), wk = 0.0026954 k( 43) = ( 0.3818182 0.2204428 -0.0000000), wk = 0.0026954 k( 44) = ( 0.3909091 0.2256915 -0.0000000), wk = 0.0026954 k( 45) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0026954 k( 46) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0026954 k( 47) = ( 0.4181818 0.2414374 -0.0000000), wk = 0.0026954 k( 48) = ( 0.4272727 0.2466860 -0.0000000), wk = 0.0026954 k( 49) = ( 0.4363636 0.2519347 -0.0000000), wk = 0.0026954 k( 50) = ( 0.4454546 0.2571833 -0.0000000), wk = 0.0026954 k( 51) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0026954 k( 52) = ( 0.4636364 0.2676806 -0.0000000), wk = 0.0026954 k( 53) = ( 0.4727273 0.2729292 -0.0000000), wk = 0.0026954 k( 54) = ( 0.4818182 0.2781779 -0.0000000), wk = 0.0026954 k( 55) = ( 0.4909091 0.2834265 -0.0000000), wk = 0.0026954 k( 56) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026954 k( 57) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026954 k( 58) = ( 0.4947917 0.2976962 -0.0000000), wk = 0.0026954 k( 59) = ( 0.4895833 0.3067173 -0.0000000), wk = 0.0026954 k( 60) = ( 0.4843750 0.3157384 -0.0000000), wk = 0.0026954 k( 61) = ( 0.4791667 0.3247595 -0.0000000), wk = 0.0026954 k( 62) = ( 0.4739583 0.3337806 -0.0000000), wk = 0.0026954 k( 63) = ( 0.4687500 0.3428017 -0.0000000), wk = 0.0026954 k( 64) = ( 0.4635417 0.3518228 -0.0000000), wk = 0.0026954 k( 65) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0026954 k( 66) = ( 0.4531250 0.3698650 -0.0000000), wk = 0.0026954 k( 67) = ( 0.4479167 0.3788861 -0.0000000), wk = 0.0026954 k( 68) = ( 0.4427083 0.3879072 -0.0000000), wk = 0.0026954 k( 69) = ( 0.4375000 0.3969283 -0.0000000), wk = 0.0026954 k( 70) = ( 0.4322917 0.4059494 -0.0000000), wk = 0.0026954 k( 71) = ( 0.4270833 0.4149705 -0.0000000), wk = 0.0026954 k( 72) = ( 0.4218750 0.4239916 -0.0000000), wk = 0.0026954 k( 73) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0026954 k( 74) = ( 0.4114583 0.4420338 -0.0000000), wk = 0.0026954 k( 75) = ( 0.4062500 0.4510549 -0.0000000), wk = 0.0026954 k( 76) = ( 0.4010417 0.4600760 -0.0000000), wk = 0.0026954 k( 77) = ( 0.3958333 0.4690971 -0.0000000), wk = 0.0026954 k( 78) = ( 0.3906250 0.4781182 -0.0000000), wk = 0.0026954 k( 79) = ( 0.3854167 0.4871393 -0.0000000), wk = 0.0026954 k( 80) = ( 0.3802083 0.4961604 -0.0000000), wk = 0.0026954 k( 81) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0026954 k( 82) = ( 0.3697917 0.5142026 -0.0000000), wk = 0.0026954 k( 83) = ( 0.3645833 0.5232237 -0.0000000), wk = 0.0026954 k( 84) = ( 0.3593750 0.5322448 -0.0000000), wk = 0.0026954 k( 85) = ( 0.3541667 0.5412659 -0.0000000), wk = 0.0026954 k( 86) = ( 0.3489583 0.5502870 -0.0000000), wk = 0.0026954 k( 87) = ( 0.3437500 0.5593081 -0.0000000), wk = 0.0026954 k( 88) = ( 0.3385417 0.5683292 -0.0000000), wk = 0.0026954 k( 89) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026954 k( 90) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026954 k( 91) = ( 0.3281250 0.5683292 -0.0000000), wk = 0.0026954 k( 92) = ( 0.3229167 0.5593081 -0.0000000), wk = 0.0026954 k( 93) = ( 0.3177083 0.5502870 -0.0000000), wk = 0.0026954 k( 94) = ( 0.3125000 0.5412659 -0.0000000), wk = 0.0026954 k( 95) = ( 0.3072917 0.5322448 -0.0000000), wk = 0.0026954 k( 96) = ( 0.3020833 0.5232237 -0.0000000), wk = 0.0026954 k( 97) = ( 0.2968750 0.5142026 -0.0000000), wk = 0.0026954 k( 98) = ( 0.2916667 0.5051815 -0.0000000), wk = 0.0026954 k( 99) = ( 0.2864583 0.4961604 -0.0000000), wk = 0.0026954 k( 100) = ( 0.2812500 0.4871393 -0.0000000), wk = 0.0026954 k( 101) = ( 0.2760417 0.4781182 -0.0000000), wk = 0.0026954 k( 102) = ( 0.2708333 0.4690971 -0.0000000), wk = 0.0026954 k( 103) = ( 0.2656250 0.4600760 -0.0000000), wk = 0.0026954 k( 104) = ( 0.2604167 0.4510549 -0.0000000), wk = 0.0026954 k( 105) = ( 0.2552083 0.4420338 -0.0000000), wk = 0.0026954 k( 106) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0026954 k( 107) = ( 0.2447917 0.4239916 -0.0000000), wk = 0.0026954 k( 108) = ( 0.2395833 0.4149705 -0.0000000), wk = 0.0026954 k( 109) = ( 0.2343750 0.4059494 -0.0000000), wk = 0.0026954 k( 110) = ( 0.2291667 0.3969283 -0.0000000), wk = 0.0026954 k( 111) = ( 0.2239583 0.3879072 -0.0000000), wk = 0.0026954 k( 112) = ( 0.2187500 0.3788861 -0.0000000), wk = 0.0026954 k( 113) = ( 0.2135417 0.3698650 -0.0000000), wk = 0.0026954 k( 114) = ( 0.2083333 0.3608439 -0.0000000), wk = 0.0026954 k( 115) = ( 0.2031250 0.3518228 -0.0000000), wk = 0.0026954 k( 116) = ( 0.1979167 0.3428017 -0.0000000), wk = 0.0026954 k( 117) = ( 0.1927083 0.3337806 -0.0000000), wk = 0.0026954 k( 118) = ( 0.1875000 0.3247595 -0.0000000), wk = 0.0026954 k( 119) = ( 0.1822917 0.3157384 -0.0000000), wk = 0.0026954 k( 120) = ( 0.1770833 0.3067173 -0.0000000), wk = 0.0026954 k( 121) = ( 0.1718750 0.2976962 -0.0000000), wk = 0.0026954 k( 122) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0026954 k( 123) = ( 0.1614583 0.2796540 -0.0000000), wk = 0.0026954 k( 124) = ( 0.1562500 0.2706329 -0.0000000), wk = 0.0026954 k( 125) = ( 0.1510417 0.2616118 -0.0000000), wk = 0.0026954 k( 126) = ( 0.1458333 0.2525907 -0.0000000), wk = 0.0026954 k( 127) = ( 0.1406250 0.2435696 -0.0000000), wk = 0.0026954 k( 128) = ( 0.1354167 0.2345486 -0.0000000), wk = 0.0026954 k( 129) = ( 0.1302083 0.2255274 -0.0000000), wk = 0.0026954 k( 130) = ( 0.1250000 0.2165064 -0.0000000), wk = 0.0026954 k( 131) = ( 0.1197917 0.2074853 -0.0000000), wk = 0.0026954 k( 132) = ( 0.1145833 0.1984641 -0.0000000), wk = 0.0026954 k( 133) = ( 0.1093750 0.1894431 -0.0000000), wk = 0.0026954 k( 134) = ( 0.1041667 0.1804220 -0.0000000), wk = 0.0026954 k( 135) = ( 0.0989583 0.1714009 -0.0000000), wk = 0.0026954 k( 136) = ( 0.0937500 0.1623798 -0.0000000), wk = 0.0026954 k( 137) = ( 0.0885417 0.1533587 -0.0000000), wk = 0.0026954 k( 138) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0026954 k( 139) = ( 0.0781250 0.1353165 -0.0000000), wk = 0.0026954 k( 140) = ( 0.0729167 0.1262954 -0.0000000), wk = 0.0026954 k( 141) = ( 0.0677083 0.1172743 -0.0000000), wk = 0.0026954 k( 142) = ( 0.0625000 0.1082532 -0.0000000), wk = 0.0026954 k( 143) = ( 0.0572917 0.0992321 -0.0000000), wk = 0.0026954 k( 144) = ( 0.0520833 0.0902110 -0.0000000), wk = 0.0026954 k( 145) = ( 0.0468750 0.0811899 -0.0000000), wk = 0.0026954 k( 146) = ( 0.0416667 0.0721688 -0.0000000), wk = 0.0026954 k( 147) = ( 0.0364583 0.0631477 -0.0000000), wk = 0.0026954 k( 148) = ( 0.0312500 0.0541266 -0.0000000), wk = 0.0026954 k( 149) = ( 0.0260417 0.0451055 -0.0000000), wk = 0.0026954 k( 150) = ( 0.0208333 0.0360844 -0.0000000), wk = 0.0026954 k( 151) = ( 0.0156250 0.0270633 -0.0000000), wk = 0.0026954 k( 152) = ( 0.0104167 0.0180422 -0.0000000), wk = 0.0026954 k( 153) = ( 0.0052083 0.0090211 -0.0000000), wk = 0.0026954 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 156) = ( 0.0000000 0.0000000 0.0102978), wk = 0.0026954 k( 157) = ( 0.0000000 0.0000000 0.0205955), wk = 0.0026954 k( 158) = ( 0.0000000 0.0000000 0.0308933), wk = 0.0026954 k( 159) = ( 0.0000000 0.0000000 0.0411911), wk = 0.0026954 k( 160) = ( 0.0000000 0.0000000 0.0514888), wk = 0.0026954 k( 161) = ( 0.0000000 0.0000000 0.0617866), wk = 0.0026954 k( 162) = ( 0.0000000 0.0000000 0.0720844), wk = 0.0026954 k( 163) = ( 0.0000000 0.0000000 0.0823821), wk = 0.0026954 k( 164) = ( 0.0000000 0.0000000 0.0926799), wk = 0.0026954 k( 165) = ( 0.0000000 0.0000000 0.1029777), wk = 0.0026954 k( 166) = ( 0.0000000 0.0000000 0.1132754), wk = 0.0026954 k( 167) = ( 0.0000000 0.0000000 0.1235732), wk = 0.0026954 k( 168) = ( 0.0000000 0.0000000 0.1338710), wk = 0.0026954 k( 169) = ( 0.0000000 0.0000000 0.1441687), wk = 0.0026954 k( 170) = ( 0.0000000 0.0000000 0.1544665), wk = 0.0026954 k( 171) = ( 0.0000000 0.0000000 0.1647643), wk = 0.0026954 k( 172) = ( 0.0000000 0.0000000 0.1750620), wk = 0.0026954 k( 173) = ( 0.0000000 0.0000000 0.1853598), wk = 0.0026954 k( 174) = ( 0.0000000 0.0000000 0.1956576), wk = 0.0026954 k( 175) = ( 0.0000000 0.0000000 0.2059553), wk = 0.0026954 k( 176) = ( 0.0000000 0.0000000 0.2059553), wk = 0.0026954 k( 177) = ( 0.0090909 0.0052486 0.2059553), wk = 0.0026954 k( 178) = ( 0.0181818 0.0104973 0.2059553), wk = 0.0026954 k( 179) = ( 0.0272727 0.0157459 0.2059553), wk = 0.0026954 k( 180) = ( 0.0363636 0.0209946 0.2059553), wk = 0.0026954 k( 181) = ( 0.0454546 0.0262432 0.2059553), wk = 0.0026954 k( 182) = ( 0.0545455 0.0314918 0.2059553), wk = 0.0026954 k( 183) = ( 0.0636364 0.0367405 0.2059553), wk = 0.0026954 k( 184) = ( 0.0727273 0.0419891 0.2059553), wk = 0.0026954 k( 185) = ( 0.0818182 0.0472377 0.2059553), wk = 0.0026954 k( 186) = ( 0.0909091 0.0524864 0.2059553), wk = 0.0026954 k( 187) = ( 0.1000000 0.0577350 0.2059553), wk = 0.0026954 k( 188) = ( 0.1090909 0.0629837 0.2059553), wk = 0.0026954 k( 189) = ( 0.1181818 0.0682323 0.2059553), wk = 0.0026954 k( 190) = ( 0.1272727 0.0734809 0.2059553), wk = 0.0026954 k( 191) = ( 0.1363636 0.0787296 0.2059553), wk = 0.0026954 k( 192) = ( 0.1454545 0.0839782 0.2059553), wk = 0.0026954 k( 193) = ( 0.1545455 0.0892269 0.2059553), wk = 0.0026954 k( 194) = ( 0.1636364 0.0944755 0.2059553), wk = 0.0026954 k( 195) = ( 0.1727273 0.0997241 0.2059553), wk = 0.0026954 k( 196) = ( 0.1818182 0.1049728 0.2059553), wk = 0.0026954 k( 197) = ( 0.1909091 0.1102214 0.2059553), wk = 0.0026954 k( 198) = ( 0.2000000 0.1154701 0.2059553), wk = 0.0026954 k( 199) = ( 0.2090909 0.1207187 0.2059553), wk = 0.0026954 k( 200) = ( 0.2181818 0.1259673 0.2059553), wk = 0.0026954 k( 201) = ( 0.2272727 0.1312160 0.2059553), wk = 0.0026954 k( 202) = ( 0.2363636 0.1364646 0.2059553), wk = 0.0026954 k( 203) = ( 0.2454545 0.1417133 0.2059553), wk = 0.0026954 k( 204) = ( 0.2545455 0.1469619 0.2059553), wk = 0.0026954 k( 205) = ( 0.2636364 0.1522105 0.2059553), wk = 0.0026954 k( 206) = ( 0.2727273 0.1574592 0.2059553), wk = 0.0026954 k( 207) = ( 0.2818182 0.1627078 0.2059553), wk = 0.0026954 k( 208) = ( 0.2909091 0.1679564 0.2059553), wk = 0.0026954 k( 209) = ( 0.3000000 0.1732051 0.2059553), wk = 0.0026954 k( 210) = ( 0.3090909 0.1784537 0.2059553), wk = 0.0026954 k( 211) = ( 0.3181818 0.1837024 0.2059553), wk = 0.0026954 k( 212) = ( 0.3272727 0.1889510 0.2059553), wk = 0.0026954 k( 213) = ( 0.3363636 0.1941996 0.2059553), wk = 0.0026954 k( 214) = ( 0.3454546 0.1994483 0.2059553), wk = 0.0026954 k( 215) = ( 0.3545454 0.2046969 0.2059553), wk = 0.0026954 k( 216) = ( 0.3636364 0.2099456 0.2059553), wk = 0.0026954 k( 217) = ( 0.3727273 0.2151942 0.2059553), wk = 0.0026954 k( 218) = ( 0.3818182 0.2204428 0.2059553), wk = 0.0026954 k( 219) = ( 0.3909091 0.2256915 0.2059553), wk = 0.0026954 k( 220) = ( 0.4000000 0.2309401 0.2059553), wk = 0.0026954 k( 221) = ( 0.4090909 0.2361887 0.2059553), wk = 0.0026954 k( 222) = ( 0.4181818 0.2414374 0.2059553), wk = 0.0026954 k( 223) = ( 0.4272727 0.2466860 0.2059553), wk = 0.0026954 k( 224) = ( 0.4363636 0.2519347 0.2059553), wk = 0.0026954 k( 225) = ( 0.4454546 0.2571833 0.2059553), wk = 0.0026954 k( 226) = ( 0.4545455 0.2624319 0.2059553), wk = 0.0026954 k( 227) = ( 0.4636364 0.2676806 0.2059553), wk = 0.0026954 k( 228) = ( 0.4727273 0.2729292 0.2059553), wk = 0.0026954 k( 229) = ( 0.4818182 0.2781779 0.2059553), wk = 0.0026954 k( 230) = ( 0.4909091 0.2834265 0.2059553), wk = 0.0026954 k( 231) = ( 0.5000000 0.2886751 0.2059553), wk = 0.0026954 k( 232) = ( 0.5000000 0.2886751 0.2059553), wk = 0.0026954 k( 233) = ( 0.4947917 0.2976962 0.2059553), wk = 0.0026954 k( 234) = ( 0.4895833 0.3067173 0.2059553), wk = 0.0026954 k( 235) = ( 0.4843750 0.3157384 0.2059553), wk = 0.0026954 k( 236) = ( 0.4791667 0.3247595 0.2059553), wk = 0.0026954 k( 237) = ( 0.4739583 0.3337806 0.2059553), wk = 0.0026954 k( 238) = ( 0.4687500 0.3428017 0.2059553), wk = 0.0026954 k( 239) = ( 0.4635417 0.3518228 0.2059553), wk = 0.0026954 k( 240) = ( 0.4583333 0.3608439 0.2059553), wk = 0.0026954 k( 241) = ( 0.4531250 0.3698650 0.2059553), wk = 0.0026954 k( 242) = ( 0.4479167 0.3788861 0.2059553), wk = 0.0026954 k( 243) = ( 0.4427083 0.3879072 0.2059553), wk = 0.0026954 k( 244) = ( 0.4375000 0.3969283 0.2059553), wk = 0.0026954 k( 245) = ( 0.4322917 0.4059494 0.2059553), wk = 0.0026954 k( 246) = ( 0.4270833 0.4149705 0.2059553), wk = 0.0026954 k( 247) = ( 0.4218750 0.4239916 0.2059553), wk = 0.0026954 k( 248) = ( 0.4166667 0.4330127 0.2059553), wk = 0.0026954 k( 249) = ( 0.4114583 0.4420338 0.2059553), wk = 0.0026954 k( 250) = ( 0.4062500 0.4510549 0.2059553), wk = 0.0026954 k( 251) = ( 0.4010417 0.4600760 0.2059553), wk = 0.0026954 k( 252) = ( 0.3958333 0.4690971 0.2059553), wk = 0.0026954 k( 253) = ( 0.3906250 0.4781182 0.2059553), wk = 0.0026954 k( 254) = ( 0.3854167 0.4871393 0.2059553), wk = 0.0026954 k( 255) = ( 0.3802083 0.4961604 0.2059553), wk = 0.0026954 k( 256) = ( 0.3750000 0.5051815 0.2059553), wk = 0.0026954 k( 257) = ( 0.3697917 0.5142026 0.2059553), wk = 0.0026954 k( 258) = ( 0.3645833 0.5232237 0.2059553), wk = 0.0026954 k( 259) = ( 0.3593750 0.5322448 0.2059553), wk = 0.0026954 k( 260) = ( 0.3541667 0.5412659 0.2059553), wk = 0.0026954 k( 261) = ( 0.3489583 0.5502870 0.2059553), wk = 0.0026954 k( 262) = ( 0.3437500 0.5593081 0.2059553), wk = 0.0026954 k( 263) = ( 0.3385417 0.5683292 0.2059553), wk = 0.0026954 k( 264) = ( 0.3333333 0.5773503 0.2059553), wk = 0.0026954 k( 265) = ( 0.3333333 0.5773503 0.2059553), wk = 0.0026954 k( 266) = ( 0.3281250 0.5683292 0.2059553), wk = 0.0026954 k( 267) = ( 0.3229167 0.5593081 0.2059553), wk = 0.0026954 k( 268) = ( 0.3177083 0.5502870 0.2059553), wk = 0.0026954 k( 269) = ( 0.3125000 0.5412659 0.2059553), wk = 0.0026954 k( 270) = ( 0.3072917 0.5322448 0.2059553), wk = 0.0026954 k( 271) = ( 0.3020833 0.5232237 0.2059553), wk = 0.0026954 k( 272) = ( 0.2968750 0.5142026 0.2059553), wk = 0.0026954 k( 273) = ( 0.2916667 0.5051815 0.2059553), wk = 0.0026954 k( 274) = ( 0.2864583 0.4961604 0.2059553), wk = 0.0026954 k( 275) = ( 0.2812500 0.4871393 0.2059553), wk = 0.0026954 k( 276) = ( 0.2760417 0.4781182 0.2059553), wk = 0.0026954 k( 277) = ( 0.2708333 0.4690971 0.2059553), wk = 0.0026954 k( 278) = ( 0.2656250 0.4600760 0.2059553), wk = 0.0026954 k( 279) = ( 0.2604167 0.4510549 0.2059553), wk = 0.0026954 k( 280) = ( 0.2552083 0.4420338 0.2059553), wk = 0.0026954 k( 281) = ( 0.2500000 0.4330127 0.2059553), wk = 0.0026954 k( 282) = ( 0.2447917 0.4239916 0.2059553), wk = 0.0026954 k( 283) = ( 0.2395833 0.4149705 0.2059553), wk = 0.0026954 k( 284) = ( 0.2343750 0.4059494 0.2059553), wk = 0.0026954 k( 285) = ( 0.2291667 0.3969283 0.2059553), wk = 0.0026954 k( 286) = ( 0.2239583 0.3879072 0.2059553), wk = 0.0026954 k( 287) = ( 0.2187500 0.3788861 0.2059553), wk = 0.0026954 k( 288) = ( 0.2135417 0.3698650 0.2059553), wk = 0.0026954 k( 289) = ( 0.2083333 0.3608439 0.2059553), wk = 0.0026954 k( 290) = ( 0.2031250 0.3518228 0.2059553), wk = 0.0026954 k( 291) = ( 0.1979167 0.3428017 0.2059553), wk = 0.0026954 k( 292) = ( 0.1927083 0.3337806 0.2059553), wk = 0.0026954 k( 293) = ( 0.1875000 0.3247595 0.2059553), wk = 0.0026954 k( 294) = ( 0.1822917 0.3157384 0.2059553), wk = 0.0026954 k( 295) = ( 0.1770833 0.3067173 0.2059553), wk = 0.0026954 k( 296) = ( 0.1718750 0.2976962 0.2059553), wk = 0.0026954 k( 297) = ( 0.1666667 0.2886751 0.2059553), wk = 0.0026954 k( 298) = ( 0.1614583 0.2796540 0.2059553), wk = 0.0026954 k( 299) = ( 0.1562500 0.2706329 0.2059553), wk = 0.0026954 k( 300) = ( 0.1510417 0.2616118 0.2059553), wk = 0.0026954 k( 301) = ( 0.1458333 0.2525907 0.2059553), wk = 0.0026954 k( 302) = ( 0.1406250 0.2435696 0.2059553), wk = 0.0026954 k( 303) = ( 0.1354167 0.2345486 0.2059553), wk = 0.0026954 k( 304) = ( 0.1302083 0.2255274 0.2059553), wk = 0.0026954 k( 305) = ( 0.1250000 0.2165064 0.2059553), wk = 0.0026954 k( 306) = ( 0.1197917 0.2074853 0.2059553), wk = 0.0026954 k( 307) = ( 0.1145833 0.1984641 0.2059553), wk = 0.0026954 k( 308) = ( 0.1093750 0.1894431 0.2059553), wk = 0.0026954 k( 309) = ( 0.1041667 0.1804220 0.2059553), wk = 0.0026954 k( 310) = ( 0.0989583 0.1714009 0.2059553), wk = 0.0026954 k( 311) = ( 0.0937500 0.1623798 0.2059553), wk = 0.0026954 k( 312) = ( 0.0885417 0.1533587 0.2059553), wk = 0.0026954 k( 313) = ( 0.0833333 0.1443376 0.2059553), wk = 0.0026954 k( 314) = ( 0.0781250 0.1353165 0.2059553), wk = 0.0026954 k( 315) = ( 0.0729167 0.1262954 0.2059553), wk = 0.0026954 k( 316) = ( 0.0677083 0.1172743 0.2059553), wk = 0.0026954 k( 317) = ( 0.0625000 0.1082532 0.2059553), wk = 0.0026954 k( 318) = ( 0.0572917 0.0992321 0.2059553), wk = 0.0026954 k( 319) = ( 0.0520833 0.0902110 0.2059553), wk = 0.0026954 k( 320) = ( 0.0468750 0.0811899 0.2059553), wk = 0.0026954 k( 321) = ( 0.0416667 0.0721688 0.2059553), wk = 0.0026954 k( 322) = ( 0.0364583 0.0631477 0.2059553), wk = 0.0026954 k( 323) = ( 0.0312500 0.0541266 0.2059553), wk = 0.0026954 k( 324) = ( 0.0260417 0.0451055 0.2059553), wk = 0.0026954 k( 325) = ( 0.0208333 0.0360844 0.2059553), wk = 0.0026954 k( 326) = ( 0.0156250 0.0270633 0.2059553), wk = 0.0026954 k( 327) = ( 0.0104167 0.0180422 0.2059553), wk = 0.0026954 k( 328) = ( 0.0052083 0.0090211 0.2059553), wk = 0.0026954 k( 329) = ( 0.0000000 0.0000000 0.2059553), wk = 0.0026954 k( 330) = ( 0.5000000 0.2886751 0.2059553), wk = 0.0026954 k( 331) = ( 0.5000000 0.2886751 0.1956576), wk = 0.0026954 k( 332) = ( 0.5000000 0.2886751 0.1853598), wk = 0.0026954 k( 333) = ( 0.5000000 0.2886751 0.1750620), wk = 0.0026954 k( 334) = ( 0.5000000 0.2886751 0.1647643), wk = 0.0026954 k( 335) = ( 0.5000000 0.2886751 0.1544665), wk = 0.0026954 k( 336) = ( 0.5000000 0.2886751 0.1441687), wk = 0.0026954 k( 337) = ( 0.5000000 0.2886751 0.1338710), wk = 0.0026954 k( 338) = ( 0.5000000 0.2886751 0.1235732), wk = 0.0026954 k( 339) = ( 0.5000000 0.2886751 0.1132754), wk = 0.0026954 k( 340) = ( 0.5000000 0.2886751 0.1029777), wk = 0.0026954 k( 341) = ( 0.5000000 0.2886751 0.0926799), wk = 0.0026954 k( 342) = ( 0.5000000 0.2886751 0.0823821), wk = 0.0026954 k( 343) = ( 0.5000000 0.2886751 0.0720844), wk = 0.0026954 k( 344) = ( 0.5000000 0.2886751 0.0617866), wk = 0.0026954 k( 345) = ( 0.5000000 0.2886751 0.0514888), wk = 0.0026954 k( 346) = ( 0.5000000 0.2886751 0.0411911), wk = 0.0026954 k( 347) = ( 0.5000000 0.2886751 0.0308933), wk = 0.0026954 k( 348) = ( 0.5000000 0.2886751 0.0205955), wk = 0.0026954 k( 349) = ( 0.5000000 0.2886751 0.0102978), wk = 0.0026954 k( 350) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0026954 k( 351) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0026954 k( 352) = ( 0.3333333 0.5773503 0.0102978), wk = 0.0026954 k( 353) = ( 0.3333333 0.5773503 0.0205955), wk = 0.0026954 k( 354) = ( 0.3333333 0.5773503 0.0308933), wk = 0.0026954 k( 355) = ( 0.3333333 0.5773503 0.0411911), wk = 0.0026954 k( 356) = ( 0.3333333 0.5773503 0.0514888), wk = 0.0026954 k( 357) = ( 0.3333333 0.5773503 0.0617866), wk = 0.0026954 k( 358) = ( 0.3333333 0.5773503 0.0720844), wk = 0.0026954 k( 359) = ( 0.3333333 0.5773503 0.0823821), wk = 0.0026954 k( 360) = ( 0.3333333 0.5773503 0.0926799), wk = 0.0026954 k( 361) = ( 0.3333333 0.5773503 0.1029777), wk = 0.0026954 k( 362) = ( 0.3333333 0.5773503 0.1132754), wk = 0.0026954 k( 363) = ( 0.3333333 0.5773503 0.1235732), wk = 0.0026954 k( 364) = ( 0.3333333 0.5773503 0.1338710), wk = 0.0026954 k( 365) = ( 0.3333333 0.5773503 0.1441687), wk = 0.0026954 k( 366) = ( 0.3333333 0.5773503 0.1544665), wk = 0.0026954 k( 367) = ( 0.3333333 0.5773503 0.1647643), wk = 0.0026954 k( 368) = ( 0.3333333 0.5773503 0.1750620), wk = 0.0026954 k( 369) = ( 0.3333333 0.5773503 0.1853598), wk = 0.0026954 k( 370) = ( 0.3333333 0.5773503 0.1956576), wk = 0.0026954 k( 371) = ( 0.3333333 0.5773503 0.2059553), wk = 0.0026954 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 2) = ( 0.0090909 0.0000000 0.0000000), wk = 0.0026954 k( 3) = ( 0.0181818 0.0000000 0.0000000), wk = 0.0026954 k( 4) = ( 0.0272727 -0.0000000 -0.0000000), wk = 0.0026954 k( 5) = ( 0.0363636 0.0000000 0.0000000), wk = 0.0026954 k( 6) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0026954 k( 7) = ( 0.0545455 0.0000000 0.0000000), wk = 0.0026954 k( 8) = ( 0.0636364 0.0000000 0.0000000), wk = 0.0026954 k( 9) = ( 0.0727273 0.0000000 0.0000000), wk = 0.0026954 k( 10) = ( 0.0818182 0.0000000 0.0000000), wk = 0.0026954 k( 11) = ( 0.0909091 0.0000000 -0.0000000), wk = 0.0026954 k( 12) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0026954 k( 13) = ( 0.1090909 0.0000000 0.0000000), wk = 0.0026954 k( 14) = ( 0.1181818 0.0000000 0.0000000), wk = 0.0026954 k( 15) = ( 0.1272727 0.0000000 0.0000000), wk = 0.0026954 k( 16) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0026954 k( 17) = ( 0.1454545 0.0000000 -0.0000000), wk = 0.0026954 k( 18) = ( 0.1545455 0.0000000 0.0000000), wk = 0.0026954 k( 19) = ( 0.1636364 0.0000000 0.0000000), wk = 0.0026954 k( 20) = ( 0.1727273 0.0000000 0.0000000), wk = 0.0026954 k( 21) = ( 0.1818182 0.0000000 -0.0000000), wk = 0.0026954 k( 22) = ( 0.1909091 -0.0000000 -0.0000000), wk = 0.0026954 k( 23) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0026954 k( 24) = ( 0.2090909 0.0000000 0.0000000), wk = 0.0026954 k( 25) = ( 0.2181818 0.0000000 0.0000000), wk = 0.0026954 k( 26) = ( 0.2272727 -0.0000000 -0.0000000), wk = 0.0026954 k( 27) = ( 0.2363636 0.0000000 0.0000000), wk = 0.0026954 k( 28) = ( 0.2454545 0.0000000 0.0000000), wk = 0.0026954 k( 29) = ( 0.2545455 0.0000000 -0.0000000), wk = 0.0026954 k( 30) = ( 0.2636364 0.0000000 0.0000000), wk = 0.0026954 k( 31) = ( 0.2727273 0.0000000 -0.0000000), wk = 0.0026954 k( 32) = ( 0.2818182 0.0000000 -0.0000000), wk = 0.0026954 k( 33) = ( 0.2909091 0.0000000 0.0000000), wk = 0.0026954 k( 34) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0026954 k( 35) = ( 0.3090909 0.0000000 -0.0000000), wk = 0.0026954 k( 36) = ( 0.3181818 -0.0000000 0.0000000), wk = 0.0026954 k( 37) = ( 0.3272727 -0.0000000 0.0000000), wk = 0.0026954 k( 38) = ( 0.3363636 0.0000000 0.0000000), wk = 0.0026954 k( 39) = ( 0.3454546 -0.0000000 0.0000000), wk = 0.0026954 k( 40) = ( 0.3545454 -0.0000000 -0.0000000), wk = 0.0026954 k( 41) = ( 0.3636364 0.0000000 -0.0000000), wk = 0.0026954 k( 42) = ( 0.3727273 0.0000000 0.0000000), wk = 0.0026954 k( 43) = ( 0.3818182 -0.0000000 -0.0000000), wk = 0.0026954 k( 44) = ( 0.3909091 0.0000000 0.0000000), wk = 0.0026954 k( 45) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0026954 k( 46) = ( 0.4090909 0.0000000 -0.0000000), wk = 0.0026954 k( 47) = ( 0.4181818 0.0000000 0.0000000), wk = 0.0026954 k( 48) = ( 0.4272727 0.0000000 -0.0000000), wk = 0.0026954 k( 49) = ( 0.4363636 0.0000000 0.0000000), wk = 0.0026954 k( 50) = ( 0.4454546 -0.0000000 -0.0000000), wk = 0.0026954 k( 51) = ( 0.4545455 -0.0000000 0.0000000), wk = 0.0026954 k( 52) = ( 0.4636364 -0.0000000 -0.0000000), wk = 0.0026954 k( 53) = ( 0.4727273 -0.0000000 0.0000000), wk = 0.0026954 k( 54) = ( 0.4818182 -0.0000000 0.0000000), wk = 0.0026954 k( 55) = ( 0.4909091 0.0000000 -0.0000000), wk = 0.0026954 k( 56) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0026954 k( 57) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0026954 k( 58) = ( 0.4947917 0.0104167 0.0000000), wk = 0.0026954 k( 59) = ( 0.4895833 0.0208333 0.0000000), wk = 0.0026954 k( 60) = ( 0.4843750 0.0312500 0.0000000), wk = 0.0026954 k( 61) = ( 0.4791667 0.0416667 0.0000000), wk = 0.0026954 k( 62) = ( 0.4739583 0.0520833 0.0000000), wk = 0.0026954 k( 63) = ( 0.4687500 0.0625000 0.0000000), wk = 0.0026954 k( 64) = ( 0.4635417 0.0729167 0.0000000), wk = 0.0026954 k( 65) = ( 0.4583333 0.0833333 0.0000000), wk = 0.0026954 k( 66) = ( 0.4531250 0.0937500 0.0000000), wk = 0.0026954 k( 67) = ( 0.4479167 0.1041667 0.0000000), wk = 0.0026954 k( 68) = ( 0.4427083 0.1145833 0.0000000), wk = 0.0026954 k( 69) = ( 0.4375000 0.1250000 -0.0000000), wk = 0.0026954 k( 70) = ( 0.4322917 0.1354167 -0.0000000), wk = 0.0026954 k( 71) = ( 0.4270833 0.1458333 -0.0000000), wk = 0.0026954 k( 72) = ( 0.4218750 0.1562500 0.0000000), wk = 0.0026954 k( 73) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0026954 k( 74) = ( 0.4114583 0.1770833 0.0000000), wk = 0.0026954 k( 75) = ( 0.4062500 0.1875000 0.0000000), wk = 0.0026954 k( 76) = ( 0.4010417 0.1979167 0.0000000), wk = 0.0026954 k( 77) = ( 0.3958333 0.2083333 0.0000000), wk = 0.0026954 k( 78) = ( 0.3906250 0.2187500 0.0000000), wk = 0.0026954 k( 79) = ( 0.3854167 0.2291667 0.0000000), wk = 0.0026954 k( 80) = ( 0.3802083 0.2395833 0.0000000), wk = 0.0026954 k( 81) = ( 0.3750000 0.2500000 0.0000000), wk = 0.0026954 k( 82) = ( 0.3697917 0.2604167 0.0000000), wk = 0.0026954 k( 83) = ( 0.3645833 0.2708333 0.0000000), wk = 0.0026954 k( 84) = ( 0.3593750 0.2812500 -0.0000000), wk = 0.0026954 k( 85) = ( 0.3541667 0.2916667 -0.0000000), wk = 0.0026954 k( 86) = ( 0.3489583 0.3020833 0.0000000), wk = 0.0026954 k( 87) = ( 0.3437500 0.3125000 0.0000000), wk = 0.0026954 k( 88) = ( 0.3385417 0.3229167 -0.0000000), wk = 0.0026954 k( 89) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0026954 k( 90) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0026954 k( 91) = ( 0.3281250 0.3281250 0.0000000), wk = 0.0026954 k( 92) = ( 0.3229167 0.3229167 -0.0000000), wk = 0.0026954 k( 93) = ( 0.3177083 0.3177083 0.0000000), wk = 0.0026954 k( 94) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0026954 k( 95) = ( 0.3072917 0.3072917 -0.0000000), wk = 0.0026954 k( 96) = ( 0.3020833 0.3020833 0.0000000), wk = 0.0026954 k( 97) = ( 0.2968750 0.2968750 0.0000000), wk = 0.0026954 k( 98) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0026954 k( 99) = ( 0.2864583 0.2864583 0.0000000), wk = 0.0026954 k( 100) = ( 0.2812500 0.2812500 0.0000000), wk = 0.0026954 k( 101) = ( 0.2760417 0.2760417 0.0000000), wk = 0.0026954 k( 102) = ( 0.2708333 0.2708333 0.0000000), wk = 0.0026954 k( 103) = ( 0.2656250 0.2656250 0.0000000), wk = 0.0026954 k( 104) = ( 0.2604167 0.2604167 0.0000000), wk = 0.0026954 k( 105) = ( 0.2552083 0.2552083 0.0000000), wk = 0.0026954 k( 106) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0026954 k( 107) = ( 0.2447917 0.2447917 0.0000000), wk = 0.0026954 k( 108) = ( 0.2395833 0.2395833 -0.0000000), wk = 0.0026954 k( 109) = ( 0.2343750 0.2343750 0.0000000), wk = 0.0026954 k( 110) = ( 0.2291667 0.2291667 0.0000000), wk = 0.0026954 k( 111) = ( 0.2239583 0.2239583 0.0000000), wk = 0.0026954 k( 112) = ( 0.2187500 0.2187500 0.0000000), wk = 0.0026954 k( 113) = ( 0.2135417 0.2135417 0.0000000), wk = 0.0026954 k( 114) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0026954 k( 115) = ( 0.2031250 0.2031250 0.0000000), wk = 0.0026954 k( 116) = ( 0.1979167 0.1979167 0.0000000), wk = 0.0026954 k( 117) = ( 0.1927083 0.1927083 -0.0000000), wk = 0.0026954 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0026954 k( 119) = ( 0.1822917 0.1822917 0.0000000), wk = 0.0026954 k( 120) = ( 0.1770833 0.1770833 0.0000000), wk = 0.0026954 k( 121) = ( 0.1718750 0.1718750 0.0000000), wk = 0.0026954 k( 122) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0026954 k( 123) = ( 0.1614583 0.1614583 0.0000000), wk = 0.0026954 k( 124) = ( 0.1562500 0.1562500 0.0000000), wk = 0.0026954 k( 125) = ( 0.1510417 0.1510417 0.0000000), wk = 0.0026954 k( 126) = ( 0.1458333 0.1458333 0.0000000), wk = 0.0026954 k( 127) = ( 0.1406250 0.1406250 0.0000000), wk = 0.0026954 k( 128) = ( 0.1354167 0.1354167 0.0000000), wk = 0.0026954 k( 129) = ( 0.1302083 0.1302083 0.0000000), wk = 0.0026954 k( 130) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0026954 k( 131) = ( 0.1197917 0.1197917 0.0000000), wk = 0.0026954 k( 132) = ( 0.1145833 0.1145833 0.0000000), wk = 0.0026954 k( 133) = ( 0.1093750 0.1093750 0.0000000), wk = 0.0026954 k( 134) = ( 0.1041667 0.1041667 0.0000000), wk = 0.0026954 k( 135) = ( 0.0989583 0.0989583 0.0000000), wk = 0.0026954 k( 136) = ( 0.0937500 0.0937500 -0.0000000), wk = 0.0026954 k( 137) = ( 0.0885417 0.0885417 0.0000000), wk = 0.0026954 k( 138) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0026954 k( 139) = ( 0.0781250 0.0781250 0.0000000), wk = 0.0026954 k( 140) = ( 0.0729167 0.0729167 0.0000000), wk = 0.0026954 k( 141) = ( 0.0677083 0.0677083 0.0000000), wk = 0.0026954 k( 142) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0026954 k( 143) = ( 0.0572917 0.0572917 -0.0000000), wk = 0.0026954 k( 144) = ( 0.0520833 0.0520833 0.0000000), wk = 0.0026954 k( 145) = ( 0.0468750 0.0468750 -0.0000000), wk = 0.0026954 k( 146) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0026954 k( 147) = ( 0.0364583 0.0364583 0.0000000), wk = 0.0026954 k( 148) = ( 0.0312500 0.0312500 0.0000000), wk = 0.0026954 k( 149) = ( 0.0260417 0.0260417 0.0000000), wk = 0.0026954 k( 150) = ( 0.0208333 0.0208333 -0.0000000), wk = 0.0026954 k( 151) = ( 0.0156250 0.0156250 0.0000000), wk = 0.0026954 k( 152) = ( 0.0104167 0.0104167 0.0000000), wk = 0.0026954 k( 153) = ( 0.0052083 0.0052083 -0.0000000), wk = 0.0026954 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026954 k( 156) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0026954 k( 157) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0026954 k( 158) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0026954 k( 159) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0026954 k( 160) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0026954 k( 161) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0026954 k( 162) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0026954 k( 163) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0026954 k( 164) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0026954 k( 165) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0026954 k( 166) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0026954 k( 167) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0026954 k( 168) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0026954 k( 169) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0026954 k( 170) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0026954 k( 171) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0026954 k( 172) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0026954 k( 173) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0026954 k( 174) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0026954 k( 175) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026954 k( 176) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026954 k( 177) = ( 0.0090909 0.0000000 0.5000000), wk = 0.0026954 k( 178) = ( 0.0181818 0.0000000 0.5000000), wk = 0.0026954 k( 179) = ( 0.0272727 -0.0000000 0.5000000), wk = 0.0026954 k( 180) = ( 0.0363636 0.0000000 0.5000000), wk = 0.0026954 k( 181) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0026954 k( 182) = ( 0.0545455 0.0000000 0.5000000), wk = 0.0026954 k( 183) = ( 0.0636364 0.0000000 0.5000000), wk = 0.0026954 k( 184) = ( 0.0727273 0.0000000 0.5000000), wk = 0.0026954 k( 185) = ( 0.0818182 0.0000000 0.5000000), wk = 0.0026954 k( 186) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0026954 k( 187) = ( 0.1000000 0.0000000 0.5000000), wk = 0.0026954 k( 188) = ( 0.1090909 0.0000000 0.5000000), wk = 0.0026954 k( 189) = ( 0.1181818 0.0000000 0.5000000), wk = 0.0026954 k( 190) = ( 0.1272727 0.0000000 0.5000000), wk = 0.0026954 k( 191) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0026954 k( 192) = ( 0.1454545 0.0000000 0.5000000), wk = 0.0026954 k( 193) = ( 0.1545455 0.0000000 0.5000000), wk = 0.0026954 k( 194) = ( 0.1636364 0.0000000 0.5000000), wk = 0.0026954 k( 195) = ( 0.1727273 0.0000000 0.5000000), wk = 0.0026954 k( 196) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0026954 k( 197) = ( 0.1909091 -0.0000000 0.5000000), wk = 0.0026954 k( 198) = ( 0.2000000 0.0000000 0.5000000), wk = 0.0026954 k( 199) = ( 0.2090909 0.0000000 0.5000000), wk = 0.0026954 k( 200) = ( 0.2181818 0.0000000 0.5000000), wk = 0.0026954 k( 201) = ( 0.2272727 -0.0000000 0.5000000), wk = 0.0026954 k( 202) = ( 0.2363636 0.0000000 0.5000000), wk = 0.0026954 k( 203) = ( 0.2454545 0.0000000 0.5000000), wk = 0.0026954 k( 204) = ( 0.2545455 0.0000000 0.5000000), wk = 0.0026954 k( 205) = ( 0.2636364 0.0000000 0.5000000), wk = 0.0026954 k( 206) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0026954 k( 207) = ( 0.2818182 0.0000000 0.5000000), wk = 0.0026954 k( 208) = ( 0.2909091 0.0000000 0.5000000), wk = 0.0026954 k( 209) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0026954 k( 210) = ( 0.3090909 0.0000000 0.5000000), wk = 0.0026954 k( 211) = ( 0.3181818 -0.0000000 0.5000000), wk = 0.0026954 k( 212) = ( 0.3272727 -0.0000000 0.5000000), wk = 0.0026954 k( 213) = ( 0.3363636 0.0000000 0.5000000), wk = 0.0026954 k( 214) = ( 0.3454546 -0.0000000 0.5000000), wk = 0.0026954 k( 215) = ( 0.3545454 -0.0000000 0.5000000), wk = 0.0026954 k( 216) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0026954 k( 217) = ( 0.3727273 0.0000000 0.5000000), wk = 0.0026954 k( 218) = ( 0.3818182 -0.0000000 0.5000000), wk = 0.0026954 k( 219) = ( 0.3909091 0.0000000 0.5000000), wk = 0.0026954 k( 220) = ( 0.4000000 0.0000000 0.5000000), wk = 0.0026954 k( 221) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0026954 k( 222) = ( 0.4181818 0.0000000 0.5000000), wk = 0.0026954 k( 223) = ( 0.4272727 0.0000000 0.5000000), wk = 0.0026954 k( 224) = ( 0.4363636 0.0000000 0.5000000), wk = 0.0026954 k( 225) = ( 0.4454546 -0.0000000 0.5000000), wk = 0.0026954 k( 226) = ( 0.4545455 -0.0000000 0.5000000), wk = 0.0026954 k( 227) = ( 0.4636364 -0.0000000 0.5000000), wk = 0.0026954 k( 228) = ( 0.4727273 -0.0000000 0.5000000), wk = 0.0026954 k( 229) = ( 0.4818182 -0.0000000 0.5000000), wk = 0.0026954 k( 230) = ( 0.4909091 0.0000000 0.5000000), wk = 0.0026954 k( 231) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026954 k( 232) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026954 k( 233) = ( 0.4947917 0.0104167 0.5000000), wk = 0.0026954 k( 234) = ( 0.4895833 0.0208333 0.5000000), wk = 0.0026954 k( 235) = ( 0.4843750 0.0312500 0.5000000), wk = 0.0026954 k( 236) = ( 0.4791667 0.0416667 0.5000000), wk = 0.0026954 k( 237) = ( 0.4739583 0.0520833 0.5000000), wk = 0.0026954 k( 238) = ( 0.4687500 0.0625000 0.5000000), wk = 0.0026954 k( 239) = ( 0.4635417 0.0729167 0.5000000), wk = 0.0026954 k( 240) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0026954 k( 241) = ( 0.4531250 0.0937500 0.5000000), wk = 0.0026954 k( 242) = ( 0.4479167 0.1041667 0.5000000), wk = 0.0026954 k( 243) = ( 0.4427083 0.1145833 0.5000000), wk = 0.0026954 k( 244) = ( 0.4375000 0.1250000 0.5000000), wk = 0.0026954 k( 245) = ( 0.4322917 0.1354167 0.5000000), wk = 0.0026954 k( 246) = ( 0.4270833 0.1458333 0.5000000), wk = 0.0026954 k( 247) = ( 0.4218750 0.1562500 0.5000000), wk = 0.0026954 k( 248) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0026954 k( 249) = ( 0.4114583 0.1770833 0.5000000), wk = 0.0026954 k( 250) = ( 0.4062500 0.1875000 0.5000000), wk = 0.0026954 k( 251) = ( 0.4010417 0.1979167 0.5000000), wk = 0.0026954 k( 252) = ( 0.3958333 0.2083333 0.5000000), wk = 0.0026954 k( 253) = ( 0.3906250 0.2187500 0.5000000), wk = 0.0026954 k( 254) = ( 0.3854167 0.2291667 0.5000000), wk = 0.0026954 k( 255) = ( 0.3802083 0.2395833 0.5000000), wk = 0.0026954 k( 256) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0026954 k( 257) = ( 0.3697917 0.2604167 0.5000000), wk = 0.0026954 k( 258) = ( 0.3645833 0.2708333 0.5000000), wk = 0.0026954 k( 259) = ( 0.3593750 0.2812500 0.5000000), wk = 0.0026954 k( 260) = ( 0.3541667 0.2916667 0.5000000), wk = 0.0026954 k( 261) = ( 0.3489583 0.3020833 0.5000000), wk = 0.0026954 k( 262) = ( 0.3437500 0.3125000 0.5000000), wk = 0.0026954 k( 263) = ( 0.3385417 0.3229167 0.5000000), wk = 0.0026954 k( 264) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026954 k( 265) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026954 k( 266) = ( 0.3281250 0.3281250 0.5000000), wk = 0.0026954 k( 267) = ( 0.3229167 0.3229167 0.5000000), wk = 0.0026954 k( 268) = ( 0.3177083 0.3177083 0.5000000), wk = 0.0026954 k( 269) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0026954 k( 270) = ( 0.3072917 0.3072917 0.5000000), wk = 0.0026954 k( 271) = ( 0.3020833 0.3020833 0.5000000), wk = 0.0026954 k( 272) = ( 0.2968750 0.2968750 0.5000000), wk = 0.0026954 k( 273) = ( 0.2916667 0.2916667 0.5000000), wk = 0.0026954 k( 274) = ( 0.2864583 0.2864583 0.5000000), wk = 0.0026954 k( 275) = ( 0.2812500 0.2812500 0.5000000), wk = 0.0026954 k( 276) = ( 0.2760417 0.2760417 0.5000000), wk = 0.0026954 k( 277) = ( 0.2708333 0.2708333 0.5000000), wk = 0.0026954 k( 278) = ( 0.2656250 0.2656250 0.5000000), wk = 0.0026954 k( 279) = ( 0.2604167 0.2604167 0.5000000), wk = 0.0026954 k( 280) = ( 0.2552083 0.2552083 0.5000000), wk = 0.0026954 k( 281) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0026954 k( 282) = ( 0.2447917 0.2447917 0.5000000), wk = 0.0026954 k( 283) = ( 0.2395833 0.2395833 0.5000000), wk = 0.0026954 k( 284) = ( 0.2343750 0.2343750 0.5000000), wk = 0.0026954 k( 285) = ( 0.2291667 0.2291667 0.5000000), wk = 0.0026954 k( 286) = ( 0.2239583 0.2239583 0.5000000), wk = 0.0026954 k( 287) = ( 0.2187500 0.2187500 0.5000000), wk = 0.0026954 k( 288) = ( 0.2135417 0.2135417 0.5000000), wk = 0.0026954 k( 289) = ( 0.2083333 0.2083333 0.5000000), wk = 0.0026954 k( 290) = ( 0.2031250 0.2031250 0.5000000), wk = 0.0026954 k( 291) = ( 0.1979167 0.1979167 0.5000000), wk = 0.0026954 k( 292) = ( 0.1927083 0.1927083 0.5000000), wk = 0.0026954 k( 293) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0026954 k( 294) = ( 0.1822917 0.1822917 0.5000000), wk = 0.0026954 k( 295) = ( 0.1770833 0.1770833 0.5000000), wk = 0.0026954 k( 296) = ( 0.1718750 0.1718750 0.5000000), wk = 0.0026954 k( 297) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0026954 k( 298) = ( 0.1614583 0.1614583 0.5000000), wk = 0.0026954 k( 299) = ( 0.1562500 0.1562500 0.5000000), wk = 0.0026954 k( 300) = ( 0.1510417 0.1510417 0.5000000), wk = 0.0026954 k( 301) = ( 0.1458333 0.1458333 0.5000000), wk = 0.0026954 k( 302) = ( 0.1406250 0.1406250 0.5000000), wk = 0.0026954 k( 303) = ( 0.1354167 0.1354167 0.5000000), wk = 0.0026954 k( 304) = ( 0.1302083 0.1302083 0.5000000), wk = 0.0026954 k( 305) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0026954 k( 306) = ( 0.1197917 0.1197917 0.5000000), wk = 0.0026954 k( 307) = ( 0.1145833 0.1145833 0.5000000), wk = 0.0026954 k( 308) = ( 0.1093750 0.1093750 0.5000000), wk = 0.0026954 k( 309) = ( 0.1041667 0.1041667 0.5000000), wk = 0.0026954 k( 310) = ( 0.0989583 0.0989583 0.5000000), wk = 0.0026954 k( 311) = ( 0.0937500 0.0937500 0.5000000), wk = 0.0026954 k( 312) = ( 0.0885417 0.0885417 0.5000000), wk = 0.0026954 k( 313) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0026954 k( 314) = ( 0.0781250 0.0781250 0.5000000), wk = 0.0026954 k( 315) = ( 0.0729167 0.0729167 0.5000000), wk = 0.0026954 k( 316) = ( 0.0677083 0.0677083 0.5000000), wk = 0.0026954 k( 317) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0026954 k( 318) = ( 0.0572917 0.0572917 0.5000000), wk = 0.0026954 k( 319) = ( 0.0520833 0.0520833 0.5000000), wk = 0.0026954 k( 320) = ( 0.0468750 0.0468750 0.5000000), wk = 0.0026954 k( 321) = ( 0.0416667 0.0416667 0.5000000), wk = 0.0026954 k( 322) = ( 0.0364583 0.0364583 0.5000000), wk = 0.0026954 k( 323) = ( 0.0312500 0.0312500 0.5000000), wk = 0.0026954 k( 324) = ( 0.0260417 0.0260417 0.5000000), wk = 0.0026954 k( 325) = ( 0.0208333 0.0208333 0.5000000), wk = 0.0026954 k( 326) = ( 0.0156250 0.0156250 0.5000000), wk = 0.0026954 k( 327) = ( 0.0104167 0.0104167 0.5000000), wk = 0.0026954 k( 328) = ( 0.0052083 0.0052083 0.5000000), wk = 0.0026954 k( 329) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026954 k( 330) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0026954 k( 331) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0026954 k( 332) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0026954 k( 333) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0026954 k( 334) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0026954 k( 335) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0026954 k( 336) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0026954 k( 337) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0026954 k( 338) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0026954 k( 339) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0026954 k( 340) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0026954 k( 341) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0026954 k( 342) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0026954 k( 343) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0026954 k( 344) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0026954 k( 345) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0026954 k( 346) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0026954 k( 347) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0026954 k( 348) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0026954 k( 349) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0026954 k( 350) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0026954 k( 351) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0026954 k( 352) = ( 0.3333333 0.3333333 0.0250000), wk = 0.0026954 k( 353) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0026954 k( 354) = ( 0.3333333 0.3333333 0.0750000), wk = 0.0026954 k( 355) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0026954 k( 356) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0026954 k( 357) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0026954 k( 358) = ( 0.3333333 0.3333333 0.1750000), wk = 0.0026954 k( 359) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0026954 k( 360) = ( 0.3333333 0.3333333 0.2250000), wk = 0.0026954 k( 361) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0026954 k( 362) = ( 0.3333333 0.3333333 0.2750000), wk = 0.0026954 k( 363) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0026954 k( 364) = ( 0.3333333 0.3333333 0.3250000), wk = 0.0026954 k( 365) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0026954 k( 366) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0026954 k( 367) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0026954 k( 368) = ( 0.3333333 0.3333333 0.4250000), wk = 0.0026954 k( 369) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0026954 k( 370) = ( 0.3333333 0.3333333 0.4750000), wk = 0.0026954 k( 371) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0026954 Dense grid: 38287 G-vectors FFT dimensions: ( 36, 36, 80) Smooth grid: 23353 G-vectors FFT dimensions: ( 27, 27, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 140, 46) NL pseudopotentials 0.15 Mb ( 70, 136) Each V/rho on FFT grid 0.04 Mb ( 2592) Each G-vector array 0.01 Mb ( 800) G-vector shells 0.00 Mb ( 408) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.39 Mb ( 140, 184) Each subspace H/S matrix 0.52 Mb ( 184, 184) Each matrix 0.19 Mb ( 136, 2, 46) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./NbInS2.save/charge-density.dat Starting wfc are 60 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.7 secs Computing kpt #: 2 total cpu time spent up to now is 46.3 secs Computing kpt #: 3 total cpu time spent up to now is 47.7 secs Computing kpt #: 4 total cpu time spent up to now is 48.8 secs Computing kpt #: 5 total cpu time spent up to now is 49.7 secs Computing kpt #: 6 total cpu time spent up to now is 50.7 secs Computing kpt #: 7 total cpu time spent up to now is 51.6 secs Computing kpt #: 8 total cpu time spent up to now is 52.6 secs Computing kpt #: 9 total cpu time spent up to now is 53.5 secs Computing kpt #: 10 total cpu time spent up to now is 54.4 secs Computing kpt #: 11 total cpu time spent up to now is 55.4 secs Computing kpt #: 12 total cpu time spent up to now is 56.5 secs Computing kpt #: 13 total cpu time spent up to now is 57.5 secs Computing kpt #: 14 total cpu time spent up to now is 58.5 secs Computing kpt #: 15 total cpu time spent up to now is 59.4 secs Computing kpt #: 16 total cpu time spent up to now is 60.4 secs Computing kpt #: 17 total cpu time spent up to now is 61.3 secs Computing kpt #: 18 total cpu time spent up to now is 62.7 secs Computing kpt #: 19 total cpu time spent up to now is 63.9 secs Computing kpt #: 20 total cpu time spent up to now is 64.8 secs Computing kpt #: 21 total cpu time spent up to now is 65.7 secs Computing kpt #: 22 total cpu time spent up to now is 66.6 secs Computing kpt #: 23 total cpu time spent up to now is 67.6 secs Computing kpt #: 24 total cpu time spent up to now is 68.6 secs Computing kpt #: 25 total cpu time spent up to now is 69.6 secs Computing kpt #: 26 total cpu time spent up to now is 70.7 secs Computing kpt #: 27 total cpu time spent up to now is 71.6 secs Computing kpt #: 28 total cpu time spent up to now is 72.8 secs Computing kpt #: 29 total cpu time spent up to now is 73.8 secs Computing kpt #: 30 total cpu time spent up to now is 74.9 secs Computing kpt #: 31 total cpu time spent up to now is 76.1 secs Computing kpt #: 32 total cpu time spent up to now is 77.2 secs Computing kpt #: 33 total cpu time spent up to now is 78.3 secs Computing kpt #: 34 total cpu time spent up to now is 79.4 secs Computing kpt #: 35 total cpu time spent up to now is 80.4 secs Computing kpt #: 36 total cpu time spent up to now is 81.5 secs Computing kpt #: 37 total cpu time spent up to now is 82.6 secs Computing kpt #: 38 total cpu time spent up to now is 83.6 secs Computing kpt #: 39 total cpu time spent up to now is 84.7 secs Computing kpt #: 40 total cpu time spent up to now is 85.8 secs Computing kpt #: 41 total cpu time spent up to now is 86.9 secs Computing kpt #: 42 total cpu time spent up to now is 88.3 secs Computing kpt #: 43 total cpu time spent up to now is 89.4 secs Computing kpt #: 44 total cpu time spent up to now is 90.6 secs Computing kpt #: 45 total cpu time spent up to now is 91.6 secs Computing kpt #: 46 total cpu time spent up to now is 92.7 secs Computing kpt #: 47 total cpu time spent up to now is 93.8 secs Computing kpt #: 48 total cpu time spent up to now is 94.9 secs Computing kpt #: 49 total cpu time spent up to now is 96.2 secs Computing kpt #: 50 total cpu time spent up to now is 97.5 secs Computing kpt #: 51 total cpu time spent up to now is 98.7 secs Computing kpt #: 52 total cpu time spent up to now is 99.9 secs Computing kpt #: 53 total cpu time spent up to now is 101.0 secs Computing kpt #: 54 total cpu time spent up to now is 102.1 secs Computing kpt #: 55 total cpu time spent up to now is 103.3 secs Computing kpt #: 56 total cpu time spent up to now is 104.4 secs Computing kpt #: 57 total cpu time spent up to now is 105.7 secs Computing kpt #: 58 total cpu time spent up to now is 106.8 secs Computing kpt #: 59 total cpu time spent up to now is 107.9 secs Computing kpt #: 60 total cpu time spent up to now is 109.0 secs Computing kpt #: 61 total cpu time spent up to now is 110.2 secs Computing kpt #: 62 total cpu time spent up to now is 111.4 secs Computing kpt #: 63 total cpu time spent up to now is 112.6 secs Computing kpt #: 64 total cpu time spent up to now is 113.8 secs Computing kpt #: 65 total cpu time spent up to now is 115.0 secs Computing kpt #: 66 total cpu time spent up to now is 116.2 secs Computing kpt #: 67 total cpu time spent up to now is 117.5 secs Computing kpt #: 68 total cpu time spent up to now is 118.8 secs Computing kpt #: 69 total cpu time spent up to now is 120.0 secs Computing kpt #: 70 total cpu time spent up to now is 121.3 secs Computing kpt #: 71 total cpu time spent up to now is 122.5 secs Computing kpt #: 72 total cpu time spent up to now is 123.8 secs Computing kpt #: 73 total cpu time spent up to now is 125.0 secs Computing kpt #: 74 total cpu time spent up to now is 126.3 secs Computing kpt #: 75 total cpu time spent up to now is 127.6 secs Computing kpt #: 76 total cpu time spent up to now is 128.8 secs Computing kpt #: 77 total cpu time spent up to now is 129.9 secs Computing kpt #: 78 total cpu time spent up to now is 131.3 secs Computing kpt #: 79 total cpu time spent up to now is 132.6 secs Computing kpt #: 80 total cpu time spent up to now is 133.8 secs Computing kpt #: 81 total cpu time spent up to now is 135.0 secs Computing kpt #: 82 total cpu time spent up to now is 136.3 secs Computing kpt #: 83 total cpu time spent up to now is 137.5 secs Computing kpt #: 84 total cpu time spent up to now is 138.7 secs Computing kpt #: 85 total cpu time spent up to now is 139.9 secs Computing kpt #: 86 total cpu time spent up to now is 141.2 secs Computing kpt #: 87 total cpu time spent up to now is 142.4 secs Computing kpt #: 88 total cpu time spent up to now is 143.6 secs Computing kpt #: 89 total cpu time spent up to now is 144.8 secs Computing kpt #: 90 total cpu time spent up to now is 145.9 secs Computing kpt #: 91 total cpu time spent up to now is 147.3 secs Computing kpt #: 92 total cpu time spent up to now is 148.4 secs Computing kpt #: 93 total cpu time spent up to now is 149.6 secs Computing kpt #: 94 total cpu time spent up to now is 150.8 secs Computing kpt #: 95 total cpu time spent up to now is 152.2 secs Computing kpt #: 96 total cpu time spent up to now is 153.5 secs Computing kpt #: 97 total cpu time spent up to now is 154.6 secs Computing kpt #: 98 total cpu time spent up to now is 155.8 secs Computing kpt #: 99 total cpu time spent up to now is 157.0 secs Computing kpt #: 100 total cpu time spent up to now is 158.4 secs Computing kpt #: 101 total cpu time spent up to now is 159.6 secs Computing kpt #: 102 total cpu time spent up to now is 160.8 secs Computing kpt #: 103 total cpu time spent up to now is 161.9 secs Computing kpt #: 104 total cpu time spent up to now is 163.1 secs Computing kpt #: 105 total cpu time spent up to now is 164.4 secs Computing kpt #: 106 total cpu time spent up to now is 165.7 secs Computing kpt #: 107 total cpu time spent up to now is 167.1 secs Computing kpt #: 108 total cpu time spent up to now is 168.3 secs Computing kpt #: 109 total cpu time spent up to now is 169.5 secs Computing kpt #: 110 total cpu time spent up to now is 170.9 secs Computing kpt #: 111 total cpu time spent up to now is 172.1 secs Computing kpt #: 112 total cpu time spent up to now is 173.1 secs Computing kpt #: 113 total cpu time spent up to now is 174.1 secs Computing kpt #: 114 total cpu time spent up to now is 175.2 secs Computing kpt #: 115 total cpu time spent up to now is 176.3 secs Computing kpt #: 116 total cpu time spent up to now is 177.4 secs Computing kpt #: 117 total cpu time spent up to now is 178.5 secs Computing kpt #: 118 total cpu time spent up to now is 179.5 secs Computing kpt #: 119 total cpu time spent up to now is 180.5 secs Computing kpt #: 120 total cpu time spent up to now is 181.7 secs Computing kpt #: 121 total cpu time spent up to now is 182.9 secs Computing kpt #: 122 total cpu time spent up to now is 184.1 secs Computing kpt #: 123 total cpu time spent up to now is 185.3 secs Computing kpt #: 124 total cpu time spent up to now is 186.4 secs Computing kpt #: 125 total cpu time spent up to now is 187.4 secs Computing kpt #: 126 total cpu time spent up to now is 188.4 secs Computing kpt #: 127 total cpu time spent up to now is 189.5 secs Computing kpt #: 128 total cpu time spent up to now is 190.5 secs Computing kpt #: 129 total cpu time spent up to now is 191.4 secs Computing kpt #: 130 total cpu time spent up to now is 192.3 secs Computing kpt #: 131 total cpu time spent up to now is 193.3 secs Computing kpt #: 132 total cpu time spent up to now is 194.4 secs Computing kpt #: 133 total cpu time spent up to now is 195.3 secs Computing kpt #: 134 total cpu time spent up to now is 196.4 secs Computing kpt #: 135 total cpu time spent up to now is 197.3 secs Computing kpt #: 136 total cpu time spent up to now is 198.2 secs Computing kpt #: 137 total cpu time spent up to now is 199.2 secs Computing kpt #: 138 total cpu time spent up to now is 200.1 secs Computing kpt #: 139 total cpu time spent up to now is 201.1 secs Computing kpt #: 140 total cpu time spent up to now is 202.0 secs Computing kpt #: 141 total cpu time spent up to now is 203.1 secs Computing kpt #: 142 total cpu time spent up to now is 204.1 secs Computing kpt #: 143 total cpu time spent up to now is 205.0 secs Computing kpt #: 144 total cpu time spent up to now is 206.0 secs Computing kpt #: 145 total cpu time spent up to now is 207.1 secs Computing kpt #: 146 total cpu time spent up to now is 208.0 secs Computing kpt #: 147 total cpu time spent up to now is 209.0 secs Computing kpt #: 148 total cpu time spent up to now is 210.1 secs Computing kpt #: 149 total cpu time spent up to now is 211.0 secs Computing kpt #: 150 total cpu time spent up to now is 212.1 secs Computing kpt #: 151 total cpu time spent up to now is 213.2 secs Computing kpt #: 152 total cpu time spent up to now is 214.1 secs Computing kpt #: 153 total cpu time spent up to now is 215.1 secs Computing kpt #: 154 total cpu time spent up to now is 216.3 secs Computing kpt #: 155 total cpu time spent up to now is 217.2 secs Computing kpt #: 156 total cpu time spent up to now is 218.0 secs Computing kpt #: 157 total cpu time spent up to now is 219.0 secs Computing kpt #: 158 total cpu time spent up to now is 220.0 secs Computing kpt #: 159 total cpu time spent up to now is 221.1 secs Computing kpt #: 160 total cpu time spent up to now is 222.0 secs Computing kpt #: 161 total cpu time spent up to now is 222.9 secs Computing kpt #: 162 total cpu time spent up to now is 223.9 secs Computing kpt #: 163 total cpu time spent up to now is 225.0 secs Computing kpt #: 164 total cpu time spent up to now is 226.0 secs Computing kpt #: 165 total cpu time spent up to now is 226.9 secs Computing kpt #: 166 total cpu time spent up to now is 227.8 secs Computing kpt #: 167 total cpu time spent up to now is 228.7 secs Computing kpt #: 168 total cpu time spent up to now is 229.6 secs Computing kpt #: 169 total cpu time spent up to now is 230.6 secs Computing kpt #: 170 total cpu time spent up to now is 231.6 secs Computing kpt #: 171 total cpu time spent up to now is 232.5 secs Computing kpt #: 172 total cpu time spent up to now is 233.4 secs Computing kpt #: 173 total cpu time spent up to now is 234.3 secs Computing kpt #: 174 total cpu time spent up to now is 235.3 secs Computing kpt #: 175 total cpu time spent up to now is 236.3 secs Computing kpt #: 176 total cpu time spent up to now is 237.2 secs Computing kpt #: 177 total cpu time spent up to now is 238.2 secs Computing kpt #: 178 total cpu time spent up to now is 239.1 secs Computing kpt #: 179 total cpu time spent up to now is 240.1 secs Computing kpt #: 180 total cpu time spent up to now is 241.0 secs Computing kpt #: 181 total cpu time spent up to now is 242.0 secs Computing kpt #: 182 total cpu time spent up to now is 242.9 secs Computing kpt #: 183 total cpu time spent up to now is 243.8 secs Computing kpt #: 184 total cpu time spent up to now is 244.8 secs Computing kpt #: 185 total cpu time spent up to now is 245.7 secs Computing kpt #: 186 total cpu time spent up to now is 246.6 secs Computing kpt #: 187 total cpu time spent up to now is 247.6 secs Computing kpt #: 188 total cpu time spent up to now is 248.5 secs Computing kpt #: 189 total cpu time spent up to now is 249.5 secs Computing kpt #: 190 total cpu time spent up to now is 250.6 secs Computing kpt #: 191 total cpu time spent up to now is 251.6 secs Computing kpt #: 192 total cpu time spent up to now is 252.5 secs Computing kpt #: 193 total cpu time spent up to now is 253.5 secs Computing kpt #: 194 total cpu time spent up to now is 254.7 secs Computing kpt #: 195 total cpu time spent up to now is 255.6 secs Computing kpt #: 196 total cpu time spent up to now is 256.7 secs Computing kpt #: 197 total cpu time spent up to now is 257.6 secs Computing kpt #: 198 total cpu time spent up to now is 258.5 secs Computing kpt #: 199 total cpu time spent up to now is 259.4 secs Computing kpt #: 200 total cpu time spent up to now is 260.5 secs Computing kpt #: 201 total cpu time spent up to now is 261.5 secs Computing kpt #: 202 total cpu time spent up to now is 262.5 secs Computing kpt #: 203 total cpu time spent up to now is 263.5 secs Computing kpt #: 204 total cpu time spent up to now is 264.6 secs Computing kpt #: 205 total cpu time spent up to now is 265.5 secs Computing kpt #: 206 total cpu time spent up to now is 266.5 secs Computing kpt #: 207 total cpu time spent up to now is 267.6 secs Computing kpt #: 208 total cpu time spent up to now is 268.8 secs Computing kpt #: 209 total cpu time spent up to now is 269.9 secs Computing kpt #: 210 total cpu time spent up to now is 271.0 secs Computing kpt #: 211 total cpu time spent up to now is 272.3 secs Computing kpt #: 212 total cpu time spent up to now is 273.4 secs Computing kpt #: 213 total cpu time spent up to now is 274.5 secs Computing kpt #: 214 total cpu time spent up to now is 275.7 secs Computing kpt #: 215 total cpu time spent up to now is 277.0 secs Computing kpt #: 216 total cpu time spent up to now is 278.3 secs Computing kpt #: 217 total cpu time spent up to now is 279.5 secs Computing kpt #: 218 total cpu time spent up to now is 280.6 secs Computing kpt #: 219 total cpu time spent up to now is 281.8 secs Computing kpt #: 220 total cpu time spent up to now is 283.1 secs Computing kpt #: 221 total cpu time spent up to now is 284.2 secs Computing kpt #: 222 total cpu time spent up to now is 285.4 secs Computing kpt #: 223 total cpu time spent up to now is 286.5 secs Computing kpt #: 224 total cpu time spent up to now is 287.6 secs Computing kpt #: 225 total cpu time spent up to now is 288.9 secs Computing kpt #: 226 total cpu time spent up to now is 290.0 secs Computing kpt #: 227 total cpu time spent up to now is 291.2 secs Computing kpt #: 228 total cpu time spent up to now is 292.4 secs Computing kpt #: 229 total cpu time spent up to now is 293.6 secs Computing kpt #: 230 total cpu time spent up to now is 294.7 secs Computing kpt #: 231 total cpu time spent up to now is 295.8 secs Computing kpt #: 232 total cpu time spent up to now is 297.0 secs Computing kpt #: 233 total cpu time spent up to now is 298.2 secs Computing kpt #: 234 total cpu time spent up to now is 299.3 secs Computing kpt #: 235 total cpu time spent up to now is 300.5 secs Computing kpt #: 236 total cpu time spent up to now is 301.6 secs Computing kpt #: 237 total cpu time spent up to now is 302.8 secs Computing kpt #: 238 total cpu time spent up to now is 304.0 secs Computing kpt #: 239 total cpu time spent up to now is 305.1 secs Computing kpt #: 240 total cpu time spent up to now is 306.2 secs Computing kpt #: 241 total cpu time spent up to now is 307.4 secs Computing kpt #: 242 total cpu time spent up to now is 308.5 secs Computing kpt #: 243 total cpu time spent up to now is 309.9 secs Computing kpt #: 244 total cpu time spent up to now is 311.1 secs Computing kpt #: 245 total cpu time spent up to now is 312.0 secs Computing kpt #: 246 total cpu time spent up to now is 313.1 secs Computing kpt #: 247 total cpu time spent up to now is 314.1 secs Computing kpt #: 248 total cpu time spent up to now is 315.3 secs Computing kpt #: 249 total cpu time spent up to now is 316.3 secs Computing kpt #: 250 total cpu time spent up to now is 317.3 secs Computing kpt #: 251 total cpu time spent up to now is 318.3 secs Computing kpt #: 252 total cpu time spent up to now is 319.3 secs Computing kpt #: 253 total cpu time spent up to now is 320.5 secs Computing kpt #: 254 total cpu time spent up to now is 321.7 secs Computing kpt #: 255 total cpu time spent up to now is 322.7 secs Computing kpt #: 256 total cpu time spent up to now is 323.8 secs Computing kpt #: 257 total cpu time spent up to now is 324.9 secs Computing kpt #: 258 total cpu time spent up to now is 326.0 secs Computing kpt #: 259 total cpu time spent up to now is 327.0 secs Computing kpt #: 260 total cpu time spent up to now is 328.2 secs Computing kpt #: 261 total cpu time spent up to now is 329.5 secs Computing kpt #: 262 total cpu time spent up to now is 330.5 secs Computing kpt #: 263 total cpu time spent up to now is 331.4 secs Computing kpt #: 264 total cpu time spent up to now is 332.6 secs Computing kpt #: 265 total cpu time spent up to now is 333.7 secs Computing kpt #: 266 total cpu time spent up to now is 334.7 secs Computing kpt #: 267 total cpu time spent up to now is 335.7 secs Computing kpt #: 268 total cpu time spent up to now is 336.8 secs Computing kpt #: 269 total cpu time spent up to now is 337.9 secs Computing kpt #: 270 total cpu time spent up to now is 339.1 secs Computing kpt #: 271 total cpu time spent up to now is 340.1 secs Computing kpt #: 272 total cpu time spent up to now is 341.2 secs Computing kpt #: 273 total cpu time spent up to now is 343.0 secs Computing kpt #: 274 total cpu time spent up to now is 344.5 secs Computing kpt #: 275 total cpu time spent up to now is 346.1 secs Computing kpt #: 276 total cpu time spent up to now is 347.7 secs Computing kpt #: 277 total cpu time spent up to now is 348.7 secs Computing kpt #: 278 total cpu time spent up to now is 349.8 secs Computing kpt #: 279 total cpu time spent up to now is 350.8 secs Computing kpt #: 280 total cpu time spent up to now is 351.8 secs Computing kpt #: 281 total cpu time spent up to now is 352.8 secs Computing kpt #: 282 total cpu time spent up to now is 353.8 secs Computing kpt #: 283 total cpu time spent up to now is 354.9 secs Computing kpt #: 284 total cpu time spent up to now is 355.9 secs Computing kpt #: 285 total cpu time spent up to now is 357.3 secs Computing kpt #: 286 total cpu time spent up to now is 358.3 secs Computing kpt #: 287 total cpu time spent up to now is 359.3 secs Computing kpt #: 288 total cpu time spent up to now is 360.3 secs Computing kpt #: 289 total cpu time spent up to now is 361.6 secs Computing kpt #: 290 total cpu time spent up to now is 363.0 secs Computing kpt #: 291 total cpu time spent up to now is 364.2 secs Computing kpt #: 292 total cpu time spent up to now is 365.3 secs Computing kpt #: 293 total cpu time spent up to now is 366.4 secs Computing kpt #: 294 total cpu time spent up to now is 367.6 secs Computing kpt #: 295 total cpu time spent up to now is 368.9 secs Computing kpt #: 296 total cpu time spent up to now is 370.3 secs Computing kpt #: 297 total cpu time spent up to now is 371.4 secs Computing kpt #: 298 total cpu time spent up to now is 372.4 secs Computing kpt #: 299 total cpu time spent up to now is 373.4 secs Computing kpt #: 300 total cpu time spent up to now is 374.5 secs Computing kpt #: 301 total cpu time spent up to now is 375.5 secs Computing kpt #: 302 total cpu time spent up to now is 376.5 secs Computing kpt #: 303 total cpu time spent up to now is 377.6 secs Computing kpt #: 304 total cpu time spent up to now is 378.5 secs Computing kpt #: 305 total cpu time spent up to now is 379.4 secs Computing kpt #: 306 total cpu time spent up to now is 380.5 secs Computing kpt #: 307 total cpu time spent up to now is 381.5 secs Computing kpt #: 308 total cpu time spent up to now is 382.4 secs Computing kpt #: 309 total cpu time spent up to now is 383.3 secs Computing kpt #: 310 total cpu time spent up to now is 384.2 secs Computing kpt #: 311 total cpu time spent up to now is 385.1 secs Computing kpt #: 312 total cpu time spent up to now is 386.0 secs Computing kpt #: 313 total cpu time spent up to now is 387.1 secs Computing kpt #: 314 total cpu time spent up to now is 388.1 secs Computing kpt #: 315 total cpu time spent up to now is 389.0 secs Computing kpt #: 316 total cpu time spent up to now is 389.9 secs Computing kpt #: 317 total cpu time spent up to now is 390.8 secs Computing kpt #: 318 total cpu time spent up to now is 391.8 secs Computing kpt #: 319 total cpu time spent up to now is 392.8 secs Computing kpt #: 320 total cpu time spent up to now is 393.7 secs Computing kpt #: 321 total cpu time spent up to now is 394.6 secs Computing kpt #: 322 total cpu time spent up to now is 395.5 secs Computing kpt #: 323 total cpu time spent up to now is 396.4 secs Computing kpt #: 324 total cpu time spent up to now is 397.4 secs Computing kpt #: 325 total cpu time spent up to now is 398.4 secs Computing kpt #: 326 total cpu time spent up to now is 399.5 secs Computing kpt #: 327 total cpu time spent up to now is 400.4 secs Computing kpt #: 328 total cpu time spent up to now is 401.4 secs Computing kpt #: 329 total cpu time spent up to now is 402.2 secs Computing kpt #: 330 total cpu time spent up to now is 403.4 secs Computing kpt #: 331 total cpu time spent up to now is 404.8 secs Computing kpt #: 332 total cpu time spent up to now is 405.9 secs Computing kpt #: 333 total cpu time spent up to now is 407.1 secs Computing kpt #: 334 total cpu time spent up to now is 408.3 secs Computing kpt #: 335 total cpu time spent up to now is 409.6 secs Computing kpt #: 336 total cpu time spent up to now is 410.9 secs Computing kpt #: 337 total cpu time spent up to now is 412.1 secs Computing kpt #: 338 total cpu time spent up to now is 413.3 secs Computing kpt #: 339 total cpu time spent up to now is 414.4 secs Computing kpt #: 340 total cpu time spent up to now is 415.8 secs Computing kpt #: 341 total cpu time spent up to now is 417.1 secs Computing kpt #: 342 total cpu time spent up to now is 418.3 secs Computing kpt #: 343 total cpu time spent up to now is 419.5 secs Computing kpt #: 344 total cpu time spent up to now is 420.6 secs Computing kpt #: 345 total cpu time spent up to now is 421.7 secs Computing kpt #: 346 total cpu time spent up to now is 423.1 secs Computing kpt #: 347 total cpu time spent up to now is 424.1 secs Computing kpt #: 348 total cpu time spent up to now is 425.2 secs Computing kpt #: 349 total cpu time spent up to now is 426.3 secs Computing kpt #: 350 total cpu time spent up to now is 427.4 secs Computing kpt #: 351 total cpu time spent up to now is 428.6 secs Computing kpt #: 352 total cpu time spent up to now is 429.8 secs Computing kpt #: 353 total cpu time spent up to now is 431.0 secs Computing kpt #: 354 total cpu time spent up to now is 432.1 secs Computing kpt #: 355 total cpu time spent up to now is 433.3 secs Computing kpt #: 356 total cpu time spent up to now is 434.5 secs Computing kpt #: 357 total cpu time spent up to now is 435.7 secs Computing kpt #: 358 total cpu time spent up to now is 436.9 secs Computing kpt #: 359 total cpu time spent up to now is 438.0 secs Computing kpt #: 360 total cpu time spent up to now is 439.3 secs Computing kpt #: 361 total cpu time spent up to now is 440.6 secs Computing kpt #: 362 total cpu time spent up to now is 441.9 secs Computing kpt #: 363 total cpu time spent up to now is 443.2 secs Computing kpt #: 364 total cpu time spent up to now is 444.2 secs Computing kpt #: 365 total cpu time spent up to now is 445.2 secs Computing kpt #: 366 total cpu time spent up to now is 446.3 secs Computing kpt #: 367 total cpu time spent up to now is 447.5 secs Computing kpt #: 368 total cpu time spent up to now is 448.5 secs Computing kpt #: 369 total cpu time spent up to now is 449.5 secs Computing kpt #: 370 total cpu time spent up to now is 450.5 secs Computing kpt #: 371 total cpu time spent up to now is 451.5 secs ethr = 2.63E-11, avg # of iterations = 20.2 total cpu time spent up to now is 451.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9505 -3.9505 -3.5435 -3.5435 -3.2491 -3.2491 -2.7216 -2.7216 -2.5932 -2.5932 -2.5792 -2.5792 -1.9779 -1.9779 2.9533 2.9533 7.0328 7.0328 7.6983 7.6983 7.9380 7.9380 7.9466 7.9466 9.0754 9.0754 9.1445 9.1445 12.7549 12.7549 13.8418 13.8418 13.9043 13.9043 14.1506 14.1506 14.1550 14.1550 k = 0.0091 0.0052-0.0000 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9576 -20.9576 -18.9390 -18.9390 -18.7794 -18.7794 -3.9500 -3.9500 -3.5434 -3.5434 -3.2487 -3.2487 -2.7216 -2.7216 -2.5930 -2.5930 -2.5793 -2.5793 -1.9776 -1.9776 2.9547 2.9547 7.0339 7.0339 7.6969 7.6969 7.9367 7.9367 7.9461 7.9461 9.0744 9.0744 9.1433 9.1433 12.7501 12.7501 13.8421 13.8421 13.9048 13.9048 14.1504 14.1504 14.1559 14.1559 k = 0.0182 0.0105-0.0000 ( 2880 PWs) bands (ev): -43.4053 -43.4053 -20.9579 -20.9579 -18.9391 -18.9391 -18.7802 -18.7802 -3.9484 -3.9484 -3.5433 -3.5433 -3.2475 -3.2475 -2.7213 -2.7213 -2.5922 -2.5922 -2.5795 -2.5795 -1.9766 -1.9766 2.9590 2.9590 7.0375 7.0375 7.6927 7.6927 7.9300 7.9300 7.9476 7.9476 9.0710 9.0710 9.1398 9.1398 12.7359 12.7359 13.8422 13.8422 13.9072 13.9072 14.1479 14.1479 14.1605 14.1605 k = 0.0273 0.0157-0.0000 ( 2886 PWs) bands (ev): -43.4052 -43.4052 -20.9584 -20.9584 -18.9393 -18.9393 -18.7814 -18.7814 -3.9458 -3.9458 -3.5430 -3.5430 -3.2456 -3.2456 -2.7209 -2.7209 -2.5910 -2.5910 -2.5800 -2.5800 -1.9750 -1.9750 2.9661 2.9661 7.0434 7.0434 7.6856 7.6856 7.9170 7.9170 7.9522 7.9522 9.0650 9.0650 9.1344 9.1344 12.7126 12.7126 13.8400 13.8400 13.9137 13.9137 14.1427 14.1427 14.1689 14.1689 k = 0.0364 0.0210-0.0000 ( 2886 PWs) bands (ev): -43.4050 -43.4050 -20.9591 -20.9591 -18.9396 -18.9396 -18.7832 -18.7832 -3.9422 -3.9422 -3.5426 -3.5426 -3.2429 -3.2429 -2.7203 -2.7203 -2.5892 -2.5892 -2.5806 -2.5806 -1.9728 -1.9728 2.9759 2.9759 7.0515 7.0515 7.6759 7.6759 7.8984 7.8984 7.9591 7.9591 9.0560 9.0560 9.1274 9.1274 12.6805 12.6805 13.8337 13.8337 13.9264 13.9264 14.1354 14.1354 14.1804 14.1804 k = 0.0455 0.0262-0.0000 ( 2886 PWs) bands (ev): -43.4046 -43.4046 -20.9599 -20.9599 -18.9399 -18.9399 -18.7854 -18.7854 -3.9376 -3.9376 -3.5421 -3.5421 -3.2394 -3.2394 -2.7195 -2.7195 -2.5868 -2.5868 -2.5813 -2.5813 -1.9700 -1.9700 2.9886 2.9886 7.0618 7.0618 7.6634 7.6634 7.8748 7.8748 7.9683 7.9683 9.0436 9.0436 9.1194 9.1194 12.6404 12.6404 13.8234 13.8234 13.9456 13.9456 14.1262 14.1262 14.1944 14.1944 k = 0.0545 0.0315-0.0000 ( 2884 PWs) bands (ev): -43.4043 -43.4043 -20.9609 -20.9609 -18.9404 -18.9404 -18.7880 -18.7880 -3.9320 -3.9320 -3.5415 -3.5415 -3.2351 -3.2351 -2.7186 -2.7186 -2.5840 -2.5840 -2.5820 -2.5820 -1.9666 -1.9666 3.0041 3.0041 7.0741 7.0741 7.6485 7.6485 7.8466 7.8466 7.9795 7.9795 9.0274 9.0274 9.1106 9.1106 12.5928 12.5928 13.8101 13.8101 13.9704 13.9704 14.1155 14.1155 14.2105 14.2105 k = 0.0636 0.0367-0.0000 ( 2886 PWs) bands (ev): -43.4039 -43.4039 -20.9621 -20.9621 -18.9409 -18.9409 -18.7911 -18.7911 -3.9256 -3.9256 -3.5408 -3.5408 -3.2300 -3.2300 -2.7175 -2.7175 -2.5833 -2.5833 -2.5801 -2.5801 -1.9626 -1.9626 3.0223 3.0223 7.0882 7.0882 7.6310 7.6310 7.8144 7.8144 7.9928 7.9928 9.0073 9.0073 9.1011 9.1011 12.5384 12.5384 13.7948 13.7948 13.9996 13.9996 14.1038 14.1038 14.2283 14.2283 k = 0.0727 0.0420-0.0000 ( 2882 PWs) bands (ev): -43.4033 -43.4033 -20.9635 -20.9635 -18.9415 -18.9415 -18.7947 -18.7947 -3.9183 -3.9183 -3.5400 -3.5400 -3.2242 -3.2242 -2.7162 -2.7162 -2.5843 -2.5843 -2.5759 -2.5759 -1.9580 -1.9580 3.0432 3.0432 7.1039 7.1039 7.6114 7.6114 7.7786 7.7786 8.0080 8.0080 8.9837 8.9837 9.0907 9.0907 12.4779 12.4779 13.7786 13.7786 14.0306 14.0306 14.0935 14.0935 14.2471 14.2471 k = 0.0818 0.0472-0.0000 ( 2878 PWs) bands (ev): -43.4027 -43.4027 -20.9651 -20.9651 -18.9422 -18.9422 -18.7986 -18.7986 -3.9103 -3.9103 -3.5391 -3.5391 -3.2176 -3.2176 -2.7148 -2.7148 -2.5855 -2.5855 -2.5710 -2.5710 -1.9528 -1.9528 3.0669 3.0669 7.1205 7.1205 7.5895 7.5895 7.7402 7.7402 8.0252 8.0252 8.9567 8.9567 9.0793 9.0793 12.4120 12.4120 13.7623 13.7623 14.0502 14.0502 14.0974 14.0974 14.2668 14.2668 k = 0.0909 0.0525-0.0000 ( 2878 PWs) bands (ev): -43.4021 -43.4021 -20.9669 -20.9669 -18.9431 -18.9431 -18.8028 -18.8028 -3.9017 -3.9017 -3.5381 -3.5381 -3.2103 -3.2103 -2.7132 -2.7132 -2.5868 -2.5868 -2.5654 -2.5654 -1.9471 -1.9471 3.0932 3.0932 7.1376 7.1376 7.5658 7.5658 7.6999 7.6999 8.0442 8.0442 8.9267 8.9267 9.0666 9.0666 12.3413 12.3413 13.7468 13.7468 14.0435 14.0435 14.1300 14.1300 14.2870 14.2870 k = 0.1000 0.0577-0.0000 ( 2878 PWs) bands (ev): -43.4014 -43.4014 -20.9688 -20.9688 -18.9440 -18.9440 -18.8074 -18.8074 -3.8924 -3.8924 -3.5371 -3.5371 -3.2023 -3.2023 -2.7116 -2.7116 -2.5882 -2.5882 -2.5589 -2.5589 -1.9409 -1.9409 3.1222 3.1222 7.1540 7.1540 7.5402 7.5402 7.6592 7.6592 8.0651 8.0651 8.8940 8.8940 9.0523 9.0523 12.2664 12.2664 13.7326 13.7326 14.0279 14.0279 14.1740 14.1740 14.3076 14.3076 k = 0.1091 0.0630-0.0000 ( 2882 PWs) bands (ev): -43.4008 -43.4008 -20.9709 -20.9709 -18.9452 -18.9452 -18.8123 -18.8123 -3.8827 -3.8827 -3.5361 -3.5361 -3.1937 -3.1937 -2.7100 -2.7100 -2.5896 -2.5896 -2.5516 -2.5516 -1.9342 -1.9342 3.1538 3.1538 7.1681 7.1681 7.5131 7.5131 7.6198 7.6198 8.0877 8.0877 8.8591 8.8591 9.0363 9.0363 12.1880 12.1880 13.7204 13.7204 14.0097 14.0097 14.2223 14.2223 14.3283 14.3283 k = 0.1182 0.0682-0.0000 ( 2884 PWs) bands (ev): -43.4000 -43.4000 -20.9731 -20.9731 -18.9465 -18.9465 -18.8174 -18.8174 -3.8725 -3.8725 -3.5350 -3.5350 -3.1843 -3.1843 -2.7082 -2.7082 -2.5911 -2.5911 -2.5433 -2.5433 -1.9270 -1.9270 3.1879 3.1879 7.1775 7.1775 7.4847 7.4847 7.5846 7.5846 8.1119 8.1119 8.8221 8.8221 9.0184 9.0184 12.1066 12.1066 13.7106 13.7106 13.9904 13.9904 14.2731 14.2731 14.3497 14.3497 k = 0.1273 0.0735-0.0000 ( 2892 PWs) bands (ev): -43.3993 -43.3993 -20.9756 -20.9756 -18.9480 -18.9480 -18.8227 -18.8227 -3.8621 -3.8621 -3.5339 -3.5339 -3.1744 -3.1744 -2.7064 -2.7064 -2.5926 -2.5926 -2.5341 -2.5341 -1.9194 -1.9194 3.2245 3.2245 7.1789 7.1789 7.4550 7.4550 7.5571 7.5571 8.1377 8.1377 8.7833 8.7833 8.9986 8.9986 12.0228 12.0228 13.7038 13.7038 13.9704 13.9704 14.3234 14.3234 14.3737 14.3737 k = 0.1364 0.0787-0.0000 ( 2896 PWs) bands (ev): -43.3985 -43.3985 -20.9781 -20.9781 -18.9497 -18.9497 -18.8281 -18.8281 -3.8514 -3.8514 -3.5327 -3.5327 -3.1639 -3.1639 -2.7045 -2.7045 -2.5940 -2.5940 -2.5238 -2.5238 -1.9114 -1.9114 3.2635 3.2635 7.1687 7.1687 7.4238 7.4238 7.5414 7.5414 8.1650 8.1650 8.7431 8.7431 8.9769 8.9769 11.9371 11.9371 13.7003 13.7003 13.9503 13.9503 14.3650 14.3650 14.4080 14.4080 k = 0.1455 0.0840-0.0000 ( 2896 PWs) bands (ev): -43.3975 -43.3975 -20.9809 -20.9809 -18.9516 -18.9516 -18.8336 -18.8336 -3.8405 -3.8405 -3.5315 -3.5315 -3.1529 -3.1529 -2.7026 -2.7026 -2.5954 -2.5954 -2.5124 -2.5124 -1.9029 -1.9029 3.3048 3.3048 7.1454 7.1454 7.3909 7.3909 7.5397 7.5397 8.1936 8.1936 8.7016 8.7016 8.9532 8.9532 11.8500 11.8500 13.7002 13.7002 13.9301 13.9301 14.3916 14.3916 14.4584 14.4584 k = 0.1545 0.0892-0.0000 ( 2896 PWs) bands (ev): -43.3966 -43.3966 -20.9837 -20.9837 -18.9539 -18.9539 -18.8391 -18.8391 -3.8296 -3.8296 -3.5302 -3.5302 -3.1415 -3.1415 -2.7006 -2.7006 -2.5967 -2.5967 -2.4998 -2.4998 -1.8941 -1.8941 3.3485 3.3485 7.1099 7.1099 7.3567 7.3567 7.5512 7.5512 8.2236 8.2236 8.6592 8.6592 8.9277 8.9277 11.7622 11.7622 13.7038 13.7038 13.9101 13.9101 14.4115 14.4115 14.5161 14.5161 k = 0.1636 0.0945-0.0000 ( 2896 PWs) bands (ev): -43.3956 -43.3956 -20.9867 -20.9867 -18.9564 -18.9564 -18.8446 -18.8446 -3.8186 -3.8186 -3.5290 -3.5290 -3.1298 -3.1298 -2.6986 -2.6986 -2.5978 -2.5978 -2.4859 -2.4859 -1.8849 -1.8849 3.3943 3.3943 7.0648 7.0648 7.3213 7.3213 7.5732 7.5732 8.2546 8.2546 8.6160 8.6160 8.9005 8.9005 11.6740 11.6740 13.7112 13.7112 13.8907 13.8907 14.4288 14.4288 14.5766 14.5766 k = 0.1727 0.0997-0.0000 ( 2900 PWs) bands (ev): -43.3946 -43.3946 -20.9898 -20.9898 -18.9593 -18.9593 -18.8499 -18.8499 -3.8078 -3.8078 -3.5278 -3.5278 -3.1177 -3.1177 -2.6968 -2.6968 -2.5988 -2.5988 -2.4708 -2.4708 -1.8754 -1.8754 3.4422 3.4422 7.0131 7.0131 7.2849 7.2849 7.6027 7.6027 8.2867 8.2867 8.5722 8.5722 8.8717 8.8717 11.5860 11.5860 13.7223 13.7223 13.8720 13.8720 14.4447 14.4447 14.6384 14.6384 k = 0.1818 0.1050-0.0000 ( 2912 PWs) bands (ev): -43.3937 -43.3937 -20.9931 -20.9931 -18.9626 -18.9626 -18.8551 -18.8551 -3.7973 -3.7973 -3.5266 -3.5266 -3.1056 -3.1056 -2.6950 -2.6950 -2.5997 -2.5997 -2.4543 -2.4543 -1.8657 -1.8657 3.4921 3.4921 6.9569 6.9569 7.2477 7.2477 7.6378 7.6378 8.3197 8.3197 8.5280 8.5280 8.8415 8.8415 11.4987 11.4987 13.7370 13.7370 13.8545 13.8545 14.4592 14.4592 14.7009 14.7009 k = 0.1909 0.1102-0.0000 ( 2914 PWs) bands (ev): -43.3926 -43.3926 -20.9964 -20.9964 -18.9663 -18.9663 -18.8600 -18.8600 -3.7868 -3.7868 -3.5254 -3.5254 -3.0933 -3.0933 -2.6933 -2.6933 -2.6003 -2.6003 -2.4363 -2.4363 -1.8556 -1.8556 3.5439 3.5439 6.8979 6.8979 7.2098 7.2098 7.6768 7.6768 8.3533 8.3533 8.4838 8.4838 8.8103 8.8103 11.4126 11.4126 13.7547 13.7547 13.8388 13.8388 14.4724 14.4724 14.7637 14.7637 k = 0.2000 0.1155-0.0000 ( 2912 PWs) bands (ev): -43.3915 -43.3915 -20.9999 -20.9999 -18.9704 -18.9704 -18.8646 -18.8646 -3.7767 -3.7767 -3.5242 -3.5242 -3.0810 -3.0810 -2.6918 -2.6918 -2.6005 -2.6005 -2.4169 -2.4169 -1.8454 -1.8454 3.5974 3.5974 6.8372 6.8372 7.1712 7.1712 7.7188 7.7188 8.3869 8.3869 8.4401 8.4401 8.7782 8.7782 11.3284 11.3284 13.7739 13.7739 13.8265 13.8265 14.4843 14.4843 14.8264 14.8264 k = 0.2091 0.1207-0.0000 ( 2910 PWs) bands (ev): -43.3903 -43.3903 -21.0034 -21.0034 -18.9749 -18.9749 -18.8689 -18.8689 -3.7669 -3.7669 -3.5231 -3.5231 -3.0688 -3.0688 -2.6904 -2.6904 -2.6003 -2.6003 -2.3960 -2.3960 -1.8349 -1.8349 3.6525 3.6525 6.7756 6.7756 7.1320 7.1320 7.7629 7.7629 8.3921 8.3921 8.4252 8.4252 8.7455 8.7455 11.2464 11.2464 13.7866 13.7866 13.8254 13.8254 14.4948 14.4948 14.8888 14.8888 k = 0.2182 0.1260-0.0000 ( 2914 PWs) bands (ev): -43.3892 -43.3892 -21.0071 -21.0071 -18.9799 -18.9799 -18.8728 -18.8728 -3.7574 -3.7574 -3.5220 -3.5220 -3.0567 -3.0567 -2.6893 -2.6893 -2.5999 -2.5999 -2.3736 -2.3736 -1.8243 -1.8243 3.7091 3.7091 6.7136 6.7136 7.0923 7.0923 7.8086 7.8086 8.3496 8.3496 8.4585 8.4585 8.7126 8.7126 11.1673 11.1673 13.7836 13.7836 13.8448 13.8448 14.5036 14.5036 14.9506 14.9506 k = 0.2273 0.1312-0.0000 ( 2914 PWs) bands (ev): -43.3880 -43.3880 -21.0108 -21.0108 -18.9853 -18.9853 -18.8764 -18.8764 -3.7483 -3.7483 -3.5209 -3.5209 -3.0449 -3.0449 -2.6884 -2.6884 -2.5991 -2.5991 -2.3498 -2.3498 -1.8136 -1.8136 3.7669 3.7669 6.6518 6.6518 7.0521 7.0521 7.8553 7.8553 8.3061 8.3061 8.4927 8.4927 8.6803 8.6803 11.0916 11.0916 13.7751 13.7751 13.8744 13.8744 14.5105 14.5105 15.0115 15.0115 k = 0.2364 0.1365-0.0000 ( 2914 PWs) bands (ev): -43.3868 -43.3868 -21.0145 -21.0145 -18.9911 -18.9911 -18.8795 -18.8795 -3.7397 -3.7397 -3.5199 -3.5199 -3.0334 -3.0334 -2.6878 -2.6878 -2.5978 -2.5978 -2.3246 -2.3246 -1.8027 -1.8027 3.8259 3.8259 6.5904 6.5904 7.0115 7.0115 7.9026 7.9026 8.2630 8.2630 8.5253 8.5253 8.6497 8.6497 11.0199 11.0199 13.7666 13.7666 13.9084 13.9084 14.5150 14.5150 15.0713 15.0713 k = 0.2455 0.1417-0.0000 ( 2910 PWs) bands (ev): -43.3856 -43.3856 -21.0183 -21.0183 -18.9972 -18.9972 -18.8823 -18.8823 -3.7314 -3.7314 -3.5189 -3.5189 -3.0223 -3.0223 -2.6874 -2.6874 -2.5961 -2.5961 -2.2981 -2.2981 -1.7918 -1.7918 3.8857 3.8857 6.5299 6.5299 6.9707 6.9707 7.9500 7.9500 8.2205 8.2205 8.5513 8.5513 8.6262 8.6262 10.9526 10.9526 13.7596 13.7596 13.9454 13.9454 14.5162 14.5162 15.1298 15.1298 k = 0.2545 0.1470-0.0000 ( 2910 PWs) bands (ev): -43.3844 -43.3844 -21.0222 -21.0222 -19.0036 -19.0036 -18.8848 -18.8848 -3.7236 -3.7236 -3.5179 -3.5179 -3.0116 -3.0116 -2.6873 -2.6873 -2.5941 -2.5941 -2.2703 -2.2703 -1.7808 -1.7808 3.9462 3.9462 6.4705 6.4705 6.9297 6.9297 7.9974 7.9974 8.1787 8.1787 8.5531 8.5531 8.6272 8.6272 10.8903 10.8903 13.7543 13.7543 13.9846 13.9846 14.5127 14.5127 15.1868 15.1868 k = 0.2636 0.1522-0.0000 ( 2910 PWs) bands (ev): -43.3832 -43.3832 -21.0261 -21.0261 -19.0103 -19.0103 -18.8869 -18.8869 -3.7163 -3.7163 -3.5170 -3.5170 -3.0013 -3.0013 -2.6875 -2.6875 -2.5916 -2.5916 -2.2413 -2.2413 -1.7699 -1.7699 4.0072 4.0072 6.4123 6.4123 6.8885 6.8885 8.0441 8.0441 8.1378 8.1378 8.5308 8.5308 8.6527 8.6527 10.8334 10.8334 13.7509 13.7509 14.0255 14.0255 14.5019 14.5019 15.2419 15.2419 k = 0.2727 0.1575-0.0000 ( 2906 PWs) bands (ev): -43.3820 -43.3820 -21.0299 -21.0299 -19.0171 -19.0171 -18.8888 -18.8888 -3.7094 -3.7094 -3.5162 -3.5162 -2.9914 -2.9914 -2.6879 -2.6879 -2.5888 -2.5888 -2.2113 -2.2113 -1.7589 -1.7589 4.0683 4.0683 6.3557 6.3557 6.8474 6.8474 8.0882 8.0882 8.0997 8.0997 8.5025 8.5025 8.6846 8.6846 10.7825 10.7825 13.7496 13.7496 14.0677 14.0677 14.4782 14.4782 15.1707 15.1707 k = 0.2818 0.1627-0.0000 ( 2912 PWs) bands (ev): -43.3809 -43.3809 -21.0338 -21.0338 -19.0241 -19.0241 -18.8904 -18.8904 -3.7030 -3.7030 -3.5155 -3.5155 -2.9821 -2.9821 -2.6886 -2.6886 -2.5857 -2.5857 -2.1804 -2.1804 -1.7480 -1.7480 4.1293 4.1293 6.3007 6.3007 6.8063 6.8063 8.0582 8.0582 8.1357 8.1357 8.4734 8.4734 8.7179 8.7179 10.7378 10.7378 13.7504 13.7504 14.1104 14.1104 14.4317 14.4317 15.0011 15.0011 k = 0.2909 0.1680-0.0000 ( 2908 PWs) bands (ev): -43.3797 -43.3797 -21.0377 -21.0377 -19.0311 -19.0311 -18.8918 -18.8918 -3.6969 -3.6969 -3.5148 -3.5148 -2.9732 -2.9732 -2.6894 -2.6894 -2.5823 -2.5823 -2.1488 -2.1488 -1.7372 -1.7372 4.1900 4.1900 6.2476 6.2476 6.7655 6.7655 8.0204 8.0204 8.1793 8.1793 8.4450 8.4450 8.7512 8.7512 10.6998 10.6998 13.7532 13.7532 14.1518 14.1518 14.3487 14.3487 14.8720 14.8720 k = 0.3000 0.1732-0.0000 ( 2912 PWs) bands (ev): -43.3786 -43.3786 -21.0415 -21.0415 -19.0381 -19.0381 -18.8930 -18.8930 -3.6913 -3.6913 -3.5142 -3.5142 -2.9648 -2.9648 -2.6904 -2.6904 -2.5788 -2.5788 -2.1165 -2.1165 -1.7266 -1.7266 4.2500 4.2500 6.1964 6.1964 6.7250 6.7250 7.9836 7.9836 8.2214 8.2214 8.4178 8.4178 8.7841 8.7841 10.6684 10.6684 13.7579 13.7579 14.1702 14.1702 14.2443 14.2443 14.7903 14.7903 k = 0.3091 0.1785-0.0000 ( 2922 PWs) bands (ev): -43.3776 -43.3776 -21.0454 -21.0454 -19.0451 -19.0451 -18.8940 -18.8940 -3.6862 -3.6862 -3.5136 -3.5136 -2.9570 -2.9570 -2.6916 -2.6916 -2.5750 -2.5750 -2.0839 -2.0839 -1.7161 -1.7161 4.3090 4.3090 6.1473 6.1473 6.6850 6.6850 7.9481 7.9481 8.2613 8.2613 8.3928 8.3928 8.8163 8.8163 10.6438 10.6438 13.7641 13.7641 14.0412 14.0412 14.2545 14.2545 14.7448 14.7448 k = 0.3182 0.1837-0.0000 ( 2928 PWs) bands (ev): -43.3766 -43.3766 -21.0491 -21.0491 -19.0520 -19.0520 -18.8948 -18.8948 -3.6814 -3.6814 -3.5132 -3.5132 -2.9495 -2.9495 -2.6929 -2.6929 -2.5712 -2.5712 -2.0510 -2.0510 -1.7058 -1.7058 4.3667 4.3667 6.1004 6.1004 6.6457 6.6457 7.9138 7.9138 8.2964 8.2964 8.3730 8.3730 8.8476 8.8476 10.6258 10.6258 13.7675 13.7675 13.8692 13.8692 14.2950 14.2950 14.7196 14.7196 k = 0.3273 0.1890-0.0000 ( 2928 PWs) bands (ev): -43.3755 -43.3755 -21.0528 -21.0528 -19.0588 -19.0588 -18.8955 -18.8955 -3.6770 -3.6770 -3.5127 -3.5127 -2.9425 -2.9425 -2.6942 -2.6942 -2.5673 -2.5673 -2.0181 -2.0181 -1.6957 -1.6957 4.4227 4.4227 6.0558 6.0558 6.6071 6.6071 7.8809 7.8809 8.3135 8.3135 8.3719 8.3719 8.8778 8.8778 10.6141 10.6141 13.6659 13.6659 13.7949 13.7949 14.3370 14.3370 14.7050 14.7050 k = 0.3364 0.1942-0.0000 ( 2924 PWs) bands (ev): -43.3744 -43.3744 -21.0563 -21.0563 -19.0655 -19.0655 -18.8962 -18.8962 -3.6729 -3.6729 -3.5122 -3.5122 -2.9359 -2.9359 -2.6955 -2.6955 -2.5633 -2.5633 -1.9853 -1.9853 -1.6859 -1.6859 4.4767 4.4767 6.0136 6.0136 6.5693 6.5693 7.8494 7.8494 8.3032 8.3032 8.3992 8.3992 8.9069 8.9069 10.6080 10.6080 13.4811 13.4811 13.8040 13.8040 14.3782 14.3782 14.6961 14.6961 k = 0.3455 0.1994-0.0000 ( 2920 PWs) bands (ev): -43.3734 -43.3734 -21.0598 -21.0598 -19.0719 -19.0719 -18.8967 -18.8967 -3.6692 -3.6692 -3.5118 -3.5118 -2.9297 -2.9297 -2.6968 -2.6968 -2.5592 -2.5592 -1.9529 -1.9529 -1.6764 -1.6764 4.5284 4.5284 5.9738 5.9738 6.5327 6.5327 7.8194 7.8194 8.2851 8.2851 8.4359 8.4359 8.9348 8.9348 10.6068 10.6068 13.2946 13.2946 13.8180 13.8180 14.4179 14.4179 14.6905 14.6905 k = 0.3545 0.2047-0.0000 ( 2920 PWs) bands (ev): -43.3724 -43.3724 -21.0632 -21.0632 -19.0781 -19.0781 -18.8971 -18.8971 -3.6658 -3.6658 -3.5114 -3.5114 -2.9240 -2.9240 -2.6982 -2.6982 -2.5552 -2.5552 -1.9210 -1.9210 -1.6672 -1.6672 4.5775 4.5775 5.9366 5.9366 6.4972 6.4972 7.7909 7.7909 8.2663 8.2663 8.4756 8.4756 8.9613 8.9613 10.6095 10.6095 13.1113 13.1113 13.8340 13.8340 14.4556 14.4556 14.6869 14.6869 k = 0.3636 0.2099-0.0000 ( 2918 PWs) bands (ev): -43.3715 -43.3715 -21.0664 -21.0664 -19.0841 -19.0841 -18.8974 -18.8974 -3.6627 -3.6627 -3.5111 -3.5111 -2.9187 -2.9187 -2.6995 -2.6995 -2.5513 -2.5513 -1.8898 -1.8898 -1.6584 -1.6584 4.6238 4.6238 5.9018 5.9018 6.4631 6.4631 7.7639 7.7639 8.2483 8.2483 8.5173 8.5173 8.9864 8.9864 10.6148 10.6148 12.9331 12.9331 13.8516 13.8516 14.4908 14.4908 14.6848 14.6848 k = 0.3727 0.2152-0.0000 ( 2926 PWs) bands (ev): -43.3707 -43.3707 -21.0695 -21.0695 -19.0898 -19.0898 -18.8977 -18.8977 -3.6599 -3.6599 -3.5110 -3.5110 -2.9137 -2.9137 -2.7009 -2.7009 -2.5475 -2.5475 -1.8596 -1.8596 -1.6499 -1.6499 4.6669 4.6669 5.8696 5.8696 6.4304 6.4304 7.7384 7.7384 8.2313 8.2313 8.5614 8.5614 9.0101 9.0101 10.6210 10.6210 12.7617 12.7617 13.8704 13.8704 14.5231 14.5231 14.6839 14.6839 k = 0.3818 0.2204-0.0000 ( 2930 PWs) bands (ev): -43.3699 -43.3699 -21.0725 -21.0725 -19.0952 -19.0952 -18.8979 -18.8979 -3.6574 -3.6574 -3.5108 -3.5108 -2.9092 -2.9092 -2.7022 -2.7022 -2.5440 -2.5440 -1.8305 -1.8305 -1.6419 -1.6419 4.7068 4.7068 5.8399 5.8399 6.3993 6.3993 7.7146 7.7146 8.2156 8.2156 8.6082 8.6082 9.0323 9.0323 10.6264 10.6264 12.5988 12.5988 13.8900 13.8900 14.5517 14.5517 14.6846 14.6846 k = 0.3909 0.2257-0.0000 ( 2918 PWs) bands (ev): -43.3690 -43.3690 -21.0753 -21.0753 -19.1003 -19.1003 -18.8981 -18.8981 -3.6551 -3.6551 -3.5105 -3.5105 -2.9049 -2.9049 -2.7034 -2.7034 -2.5403 -2.5403 -1.8027 -1.8027 -1.6343 -1.6343 4.7432 4.7432 5.8128 5.8128 6.3700 6.3700 7.6925 7.6925 8.2011 8.2011 8.6581 8.6581 9.0529 9.0529 10.6287 10.6287 12.4461 12.4461 13.9102 13.9102 14.5762 14.5762 14.6872 14.6872 k = 0.4000 0.2309-0.0000 ( 2922 PWs) bands (ev): -43.3683 -43.3683 -21.0779 -21.0779 -19.1050 -19.1050 -18.8982 -18.8982 -3.6531 -3.6531 -3.5104 -3.5104 -2.9011 -2.9011 -2.7046 -2.7046 -2.5369 -2.5369 -1.7764 -1.7764 -1.6272 -1.6272 4.7761 4.7761 5.7882 5.7882 6.3425 6.3425 7.6720 7.6720 8.1879 8.1879 8.7116 8.7116 9.0720 9.0720 10.6257 10.6257 12.3055 12.3055 13.9305 13.9305 14.5955 14.5955 14.6923 14.6923 k = 0.4091 0.2362-0.0000 ( 2928 PWs) bands (ev): -43.3677 -43.3677 -21.0803 -21.0803 -19.1094 -19.1094 -18.8984 -18.8984 -3.6513 -3.6513 -3.5103 -3.5103 -2.8977 -2.8977 -2.7057 -2.7057 -2.5339 -2.5339 -1.7518 -1.7518 -1.6206 -1.6206 4.8055 4.8055 5.7660 5.7660 6.3169 6.3169 7.6532 7.6532 8.1760 8.1760 8.7689 8.7689 9.0896 9.0896 10.6147 10.6147 12.1791 12.1791 13.9507 13.9507 14.6093 14.6093 14.7002 14.7002 k = 0.4182 0.2414-0.0000 ( 2924 PWs) bands (ev): -43.3670 -43.3670 -21.0825 -21.0825 -19.1134 -19.1134 -18.8984 -18.8984 -3.6497 -3.6497 -3.5102 -3.5102 -2.8945 -2.8945 -2.7067 -2.7067 -2.5310 -2.5310 -1.7290 -1.7290 -1.6145 -1.6145 4.8315 4.8315 5.7462 5.7462 6.2935 6.2935 7.6362 7.6362 8.1654 8.1654 8.8299 8.8299 9.1056 9.1056 10.5935 10.5935 12.0688 12.0688 13.9705 13.9705 14.6181 14.6181 14.7107 14.7107 k = 0.4273 0.2467-0.0000 ( 2928 PWs) bands (ev): -43.3665 -43.3665 -21.0845 -21.0845 -19.1170 -19.1170 -18.8985 -18.8985 -3.6483 -3.6483 -3.5101 -3.5101 -2.8917 -2.8917 -2.7077 -2.7077 -2.5284 -2.5284 -1.7082 -1.7082 -1.6090 -1.6090 4.8540 4.8540 5.7287 5.7287 6.2722 6.2722 7.6209 7.6209 8.1560 8.1560 8.8945 8.8945 9.1202 9.1202 10.5605 10.5605 11.9760 11.9760 13.9893 13.9893 14.6230 14.6230 14.7223 14.7223 k = 0.4364 0.2519-0.0000 ( 2926 PWs) bands (ev): -43.3660 -43.3660 -21.0863 -21.0863 -19.1203 -19.1203 -18.8985 -18.8985 -3.6471 -3.6471 -3.5100 -3.5100 -2.8892 -2.8892 -2.7085 -2.7085 -2.5260 -2.5260 -1.6896 -1.6896 -1.6040 -1.6040 4.8734 4.8734 5.7135 5.7135 6.2533 6.2533 7.6073 7.6073 8.1477 8.1477 8.9621 8.9621 9.1335 9.1335 10.5150 10.5150 11.9012 11.9012 14.0070 14.0070 14.6255 14.6255 14.7340 14.7340 k = 0.4455 0.2572-0.0000 ( 2934 PWs) bands (ev): -43.3656 -43.3656 -21.0879 -21.0879 -19.1231 -19.1231 -18.8986 -18.8986 -3.6462 -3.6462 -3.5101 -3.5101 -2.8872 -2.8872 -2.7093 -2.7093 -2.5240 -2.5240 -1.6732 -1.6732 -1.5995 -1.5995 4.8896 4.8896 5.7005 5.7005 6.2366 6.2366 7.5955 7.5955 8.1407 8.1407 9.0309 9.0309 9.1464 9.1464 10.4581 10.4581 11.8436 11.8436 14.0231 14.0231 14.6264 14.6264 14.7448 14.7448 k = 0.4545 0.2624-0.0000 ( 2940 PWs) bands (ev): -43.3653 -43.3653 -21.0893 -21.0893 -19.1255 -19.1255 -18.8986 -18.8986 -3.6454 -3.6454 -3.5100 -3.5100 -2.8854 -2.8854 -2.7099 -2.7099 -2.5223 -2.5223 -1.6592 -1.6592 -1.5957 -1.5957 4.9030 4.9030 5.6896 5.6896 6.2224 6.2224 7.5855 7.5855 8.1347 8.1347 9.0964 9.0964 9.1620 9.1620 10.3927 10.3927 11.8015 11.8015 14.0374 14.0374 14.6265 14.6265 14.7543 14.7543 k = 0.4636 0.2677-0.0000 ( 2940 PWs) bands (ev): -43.3650 -43.3650 -21.0904 -21.0904 -19.1274 -19.1274 -18.8986 -18.8986 -3.6447 -3.6447 -3.5100 -3.5100 -2.8840 -2.8840 -2.7105 -2.7105 -2.5207 -2.5207 -1.6477 -1.6477 -1.5924 -1.5924 4.9136 4.9136 5.6808 5.6808 6.2107 6.2107 7.5773 7.5773 8.1299 8.1299 9.1399 9.1399 9.1968 9.1968 10.3231 10.3231 11.7721 11.7721 14.0495 14.0495 14.6263 14.6263 14.7622 14.7622 k = 0.4727 0.2729-0.0000 ( 2940 PWs) bands (ev): -43.3648 -43.3648 -21.0912 -21.0912 -19.1290 -19.1290 -18.8986 -18.8986 -3.6442 -3.6442 -3.5099 -3.5099 -2.8828 -2.8828 -2.7109 -2.7109 -2.5196 -2.5196 -1.6387 -1.6387 -1.5898 -1.5898 4.9217 4.9217 5.6740 5.6740 6.2016 6.2016 7.5710 7.5710 8.1262 8.1262 9.1550 9.1550 9.2536 9.2536 10.2550 10.2550 11.7526 11.7526 14.0592 14.0592 14.6258 14.6258 14.7683 14.7683 k = 0.4818 0.2782-0.0000 ( 2942 PWs) bands (ev): -43.3646 -43.3646 -21.0919 -21.0919 -19.1301 -19.1301 -18.8986 -18.8986 -3.6438 -3.6438 -3.5100 -3.5100 -2.8820 -2.8820 -2.7112 -2.7112 -2.5188 -2.5188 -1.6323 -1.6323 -1.5879 -1.5879 4.9273 4.9273 5.6692 5.6692 6.1950 6.1950 7.5664 7.5664 8.1236 8.1236 9.1617 9.1617 9.3071 9.3071 10.1961 10.1961 11.7406 11.7406 14.0663 14.0663 14.6254 14.6254 14.7727 14.7727 k = 0.4909 0.2834-0.0000 ( 2938 PWs) bands (ev): -43.3645 -43.3645 -21.0922 -21.0922 -19.1307 -19.1307 -18.8986 -18.8986 -3.6436 -3.6436 -3.5099 -3.5099 -2.8815 -2.8815 -2.7113 -2.7113 -2.5182 -2.5182 -1.6285 -1.6285 -1.5867 -1.5867 4.9307 4.9307 5.6663 5.6663 6.1911 6.1911 7.5637 7.5637 8.1220 8.1220 9.1651 9.1651 9.3449 9.3449 10.1550 10.1550 11.7342 11.7342 14.0706 14.0706 14.6251 14.6251 14.7754 14.7754 k = 0.5000 0.2887-0.0000 ( 2926 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6435 -3.6435 -3.5098 -3.5098 -2.8813 -2.8813 -2.7113 -2.7113 -2.5179 -2.5179 -1.6272 -1.6272 -1.5863 -1.5863 4.9318 4.9318 5.6653 5.6653 6.1898 6.1898 7.5628 7.5628 8.1215 8.1215 9.1662 9.1662 9.3587 9.3587 10.1400 10.1400 11.7322 11.7322 14.0721 14.0721 14.6250 14.6250 14.7763 14.7763 k = 0.5000 0.2887-0.0000 ( 2926 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6435 -3.6435 -3.5098 -3.5098 -2.8813 -2.8813 -2.7113 -2.7113 -2.5179 -2.5179 -1.6272 -1.6272 -1.5863 -1.5863 4.9318 4.9318 5.6653 5.6653 6.1898 6.1898 7.5628 7.5628 8.1215 8.1215 9.1662 9.1662 9.3587 9.3587 10.1400 10.1400 11.7322 11.7322 14.0721 14.0721 14.6250 14.6250 14.7763 14.7763 k = 0.4948 0.2977-0.0000 ( 2934 PWs) bands (ev): -43.3644 -43.3644 -21.0936 -21.0911 -19.1325 -19.1293 -18.8989 -18.8987 -3.6435 -3.6434 -3.5098 -3.5098 -2.8815 -2.8810 -2.7113 -2.7113 -2.5182 -2.5182 -1.6284 -1.6253 -1.5861 -1.5861 4.9330 4.9338 5.6653 5.6662 6.1876 6.1893 7.5609 7.5613 8.1219 8.1252 9.1462 9.1681 9.3544 9.3743 10.1407 10.1443 11.7270 11.7343 14.0688 14.0784 14.6177 14.6339 14.7778 14.7796 k = 0.4896 0.3067-0.0000 ( 2934 PWs) bands (ev): -43.3644 -43.3644 -21.0949 -21.0899 -19.1340 -19.1275 -18.8994 -18.8991 -3.6433 -3.6431 -3.5095 -3.5095 -2.8815 -2.8807 -2.7111 -2.7111 -2.5187 -2.5187 -1.6289 -1.6226 -1.5855 -1.5854 4.9374 4.9390 5.6660 5.6678 6.1828 6.1863 7.5558 7.5565 8.1264 8.1328 9.1130 9.1503 9.3632 9.3964 10.1463 10.1535 11.7190 11.7334 14.0681 14.0876 14.6120 14.6444 14.7843 14.7880 k = 0.4844 0.3157-0.0000 ( 2930 PWs) bands (ev): -43.3643 -43.3643 -21.0962 -21.0888 -19.1355 -19.1257 -18.9003 -18.8998 -3.6430 -3.6426 -3.5091 -3.5091 -2.8814 -2.8802 -2.7108 -2.7107 -2.5195 -2.5194 -1.6286 -1.6193 -1.5844 -1.5844 4.9450 4.9473 5.6676 5.6702 6.1754 6.1806 7.5481 7.5489 8.1346 8.1439 9.0705 9.1165 9.3815 9.4216 10.1565 10.1674 11.7083 11.7296 14.0692 14.0988 14.6084 14.6571 14.7958 14.8016 k = 0.4792 0.3248-0.0000 ( 2930 PWs) bands (ev): -43.3642 -43.3642 -21.0975 -21.0877 -19.1369 -19.1238 -18.9014 -18.9008 -3.6425 -3.6421 -3.5086 -3.5085 -2.8813 -2.8797 -2.7105 -2.7103 -2.5207 -2.5206 -1.6277 -1.6152 -1.5830 -1.5829 4.9557 4.9589 5.6699 5.6734 6.1654 6.1722 7.5384 7.5392 8.1458 8.1576 9.0204 9.0714 9.4053 9.4487 10.1711 10.1854 11.6954 11.7234 14.0708 14.1105 14.6077 14.6724 14.8124 14.8205 k = 0.4740 0.3338-0.0000 ( 2922 PWs) bands (ev): -43.3640 -43.3640 -21.0989 -21.0866 -19.1382 -19.1218 -18.9028 -18.9021 -3.6419 -3.6414 -3.5078 -3.5077 -2.8810 -2.8790 -2.7099 -2.7097 -2.5221 -2.5219 -1.6260 -1.6106 -1.5811 -1.5810 4.9697 4.9735 5.6731 5.6774 6.1529 6.1613 7.5277 7.5281 8.1592 8.1732 8.9636 9.0178 9.4325 9.4774 10.1895 10.2074 11.6807 11.7150 14.0713 14.1208 14.6114 14.6912 14.8342 14.8450 k = 0.4688 0.3428-0.0000 ( 2918 PWs) bands (ev): -43.3638 -43.3638 -21.1003 -21.0855 -19.1394 -19.1197 -18.9044 -18.9038 -3.6412 -3.6406 -3.5069 -3.5068 -2.8807 -2.8782 -2.7092 -2.7089 -2.5238 -2.5236 -1.6236 -1.6053 -1.5789 -1.5786 4.9867 4.9913 5.6770 5.6821 6.1378 6.1478 7.5164 7.5166 8.1740 8.1899 8.9009 8.9570 9.4623 9.5077 10.2114 10.2327 11.6648 11.7051 14.0690 14.1271 14.6211 14.7145 14.8610 14.8749 k = 0.4635 0.3518-0.0000 ( 2914 PWs) bands (ev): -43.3637 -43.3637 -21.1016 -21.0846 -19.1406 -19.1175 -18.9062 -18.9058 -3.6404 -3.6396 -3.5058 -3.5057 -2.8803 -2.8775 -2.7084 -2.7081 -2.5258 -2.5256 -1.6206 -1.5995 -1.5763 -1.5758 5.0068 5.0121 5.6818 5.6875 6.1203 6.1317 7.5050 7.5059 8.1895 8.2068 8.8327 8.8899 9.4944 9.5401 10.2363 10.2611 11.6482 11.6942 14.0623 14.1270 14.6385 14.7430 14.8927 14.9100 k = 0.4583 0.3608-0.0000 ( 2911 PWs) bands (ev): -43.3635 -43.3635 -21.1030 -21.0836 -19.1418 -19.1153 -18.9083 -18.9080 -3.6395 -3.6387 -3.5046 -3.5045 -2.8798 -2.8766 -2.7075 -2.7072 -2.5281 -2.5278 -1.6169 -1.5933 -1.5734 -1.5724 5.0300 5.0359 5.6873 5.6937 6.1004 6.1132 7.4945 7.4961 8.2050 8.2233 8.7594 8.8173 9.5289 9.5747 10.2639 10.2921 11.6316 11.6828 14.0502 14.1188 14.6647 14.7774 14.9289 14.9501 k = 0.4531 0.3699-0.0000 ( 2903 PWs) bands (ev): -43.3632 -43.3632 -21.1044 -21.0827 -19.1429 -19.1129 -18.9106 -18.9105 -3.6385 -3.6376 -3.5032 -3.5031 -2.8792 -2.8757 -2.7064 -2.7061 -2.5306 -2.5303 -1.6126 -1.5867 -1.5702 -1.5685 5.0561 5.0626 5.6937 5.7006 6.0782 6.0924 7.4855 7.4880 8.2198 8.2386 8.6816 8.7396 9.5660 9.6119 10.2939 10.3254 11.6155 11.6715 14.0317 14.1016 14.6996 14.8175 14.9689 14.9947 k = 0.4479 0.3789-0.0000 ( 2905 PWs) bands (ev): -43.3630 -43.3630 -21.1058 -21.0819 -19.1440 -19.1105 -18.9134 -18.9128 -3.6375 -3.6364 -3.5019 -3.5018 -2.8785 -2.8747 -2.7052 -2.7049 -2.5334 -2.5331 -1.6077 -1.5801 -1.5667 -1.5638 5.0851 5.0921 5.7008 5.7081 6.0541 6.0694 7.4785 7.4817 8.2334 8.2520 8.6001 8.6574 9.6059 9.6519 10.3260 10.3609 11.6004 11.6609 14.0066 14.0755 14.7421 14.8628 15.0120 15.0430 k = 0.4427 0.3879-0.0000 ( 2907 PWs) bands (ev): -43.3629 -43.3629 -21.1072 -21.0812 -19.1451 -19.1080 -18.9164 -18.9153 -3.6364 -3.6353 -3.5004 -3.5002 -2.8779 -2.8738 -2.7039 -2.7035 -2.5365 -2.5362 -1.6024 -1.5737 -1.5630 -1.5582 5.1170 5.1244 5.7088 5.7164 6.0280 6.0444 7.4736 7.4778 8.2453 8.2623 8.5159 8.5711 9.6486 9.6949 10.3599 10.3983 11.5869 11.6514 13.9749 14.0411 14.7901 14.9118 15.0563 15.0935 k = 0.4375 0.3969-0.0000 ( 2919 PWs) bands (ev): -43.3628 -43.3628 -21.1086 -21.0805 -19.1461 -19.1055 -18.9197 -18.9179 -3.6354 -3.6341 -3.4989 -3.4987 -2.8772 -2.8728 -2.7025 -2.7022 -2.5400 -2.5396 -1.5965 -1.5678 -1.5590 -1.5515 5.1516 5.1593 5.7175 5.7254 6.0004 6.0177 7.4713 7.4762 8.2550 8.2668 8.4320 8.4815 9.6942 9.7410 10.3956 10.4375 11.5753 11.6435 13.9368 13.9993 14.8404 14.9617 15.0979 15.1414 k = 0.4323 0.4059-0.0000 ( 2917 PWs) bands (ev): -43.3625 -43.3625 -21.1100 -21.0798 -19.1472 -19.1029 -18.9232 -18.9205 -3.6342 -3.6329 -3.4972 -3.4970 -2.8764 -2.8718 -2.7009 -2.7005 -2.5434 -2.5430 -1.5902 -1.5623 -1.5548 -1.5438 5.1888 5.1967 5.7272 5.7350 5.9714 5.9895 7.4716 7.4772 8.2546 8.2613 8.3595 8.3898 9.7429 9.7903 10.4328 10.4781 11.5660 11.6377 13.8927 13.9509 14.8862 15.0048 15.1254 15.1611 k = 0.4271 0.4150-0.0000 ( 2917 PWs) bands (ev): -43.3623 -43.3623 -21.1113 -21.0792 -19.1482 -19.1002 -18.9269 -18.9232 -3.6330 -3.6316 -3.4955 -3.4953 -2.8756 -2.8707 -2.6992 -2.6988 -2.5470 -2.5466 -1.5835 -1.5571 -1.5505 -1.5353 5.2285 5.2364 5.7378 5.7454 5.9414 5.9602 7.4747 7.4809 8.1993 8.2556 8.3049 8.3248 9.7948 9.8428 10.4714 10.5202 11.5595 11.6343 13.8430 13.8964 14.9090 15.0152 15.1184 15.1222 k = 0.4219 0.4240-0.0000 ( 2915 PWs) bands (ev): -43.3620 -43.3620 -21.1127 -21.0787 -19.1493 -19.0975 -18.9307 -18.9258 -3.6318 -3.6303 -3.4937 -3.4935 -2.8747 -2.8696 -2.6973 -2.6968 -2.5508 -2.5504 -1.5765 -1.5522 -1.5460 -1.5262 5.2705 5.2782 5.7493 5.7565 5.9107 5.9301 7.4804 7.4871 8.1129 8.1847 8.2802 8.3164 9.8497 9.8987 10.5114 10.5636 11.5559 11.6335 13.7879 13.8363 14.8622 14.9325 15.0669 15.0748 k = 0.4167 0.4330-0.0000 ( 2917 PWs) bands (ev): -43.3618 -43.3618 -21.1140 -21.0782 -19.1503 -19.0948 -18.9347 -18.9284 -3.6306 -3.6290 -3.4919 -3.4917 -2.8739 -2.8686 -2.6952 -2.6948 -2.5548 -2.5543 -1.5693 -1.5474 -1.5414 -1.5167 5.3147 5.3220 5.7619 5.7683 5.8796 5.8995 7.4889 7.4960 8.0174 8.0872 8.2775 8.3126 9.9078 9.9578 10.5525 10.6081 11.5557 11.6358 13.7276 13.7708 14.7284 14.7712 15.0118 15.0203 k = 0.4115 0.4420-0.0000 ( 2921 PWs) bands (ev): -43.3616 -43.3616 -21.1153 -21.0778 -19.1514 -19.0921 -18.9387 -18.9310 -3.6295 -3.6278 -3.4902 -3.4899 -2.8730 -2.8675 -2.6931 -2.6927 -2.5589 -2.5583 -1.5619 -1.5427 -1.5367 -1.5070 5.3608 5.3672 5.7757 5.7810 5.8484 5.8688 7.5000 7.5072 7.9184 7.9862 8.2741 8.3082 9.9690 10.0202 10.5947 10.6535 11.5590 11.6411 13.6622 13.7000 14.5563 14.5861 14.9583 14.9689 k = 0.4062 0.4511-0.0000 ( 2927 PWs) bands (ev): -43.3614 -43.3614 -21.1165 -21.0774 -19.1524 -19.0894 -18.9428 -18.9335 -3.6284 -3.6266 -3.4885 -3.4882 -2.8722 -2.8665 -2.6908 -2.6904 -2.5630 -2.5625 -1.5544 -1.5381 -1.5320 -1.4972 5.4085 5.4137 5.7906 5.7945 5.8176 5.8387 7.5137 7.5207 7.8179 7.8838 8.2683 8.3018 10.0332 10.0859 10.6380 10.6998 11.5659 11.6497 13.5914 13.6233 14.3744 14.3961 14.9077 14.9204 k = 0.4010 0.4601-0.0000 ( 2937 PWs) bands (ev): -43.3613 -43.3613 -21.1177 -21.0772 -19.1535 -19.0866 -18.9470 -18.9359 -3.6273 -3.6256 -3.4869 -3.4865 -2.8713 -2.8655 -2.6885 -2.6881 -2.5673 -2.5667 -1.5470 -1.5336 -1.5273 -1.4874 5.4574 5.4607 5.7870 5.8011 5.8097 5.8153 7.5297 7.5357 7.7173 7.7806 8.2597 8.2929 10.1004 10.1547 10.6822 10.7467 11.5767 11.6615 13.5146 13.5400 14.1930 14.2080 14.8607 14.8752 k = 0.3958 0.4691-0.0000 ( 2933 PWs) bands (ev): -43.3610 -43.3610 -21.1189 -21.0769 -19.1545 -19.0839 -18.9511 -18.9381 -3.6262 -3.6244 -3.4851 -3.4848 -2.8704 -2.8645 -2.6860 -2.6856 -2.5714 -2.5708 -1.5396 -1.5292 -1.5225 -1.4776 5.5069 5.5076 5.7577 5.7771 5.8260 5.8296 7.5481 7.5482 7.6212 7.6773 8.2484 8.2814 10.1704 10.2265 10.7272 10.7941 11.5912 11.6764 13.4303 13.4487 14.0175 14.0259 14.8175 14.8335 k = 0.3906 0.4781-0.0000 ( 2929 PWs) bands (ev): -43.3607 -43.3607 -21.1200 -21.0767 -19.1556 -19.0813 -18.9551 -18.9403 -3.6252 -3.6234 -3.4835 -3.4831 -2.8695 -2.8635 -2.6834 -2.6830 -2.5755 -2.5748 -1.5326 -1.5249 -1.5177 -1.4681 5.5535 5.5563 5.7297 5.7494 5.8444 5.8518 7.5021 7.5674 7.5754 7.5861 8.2343 8.2672 10.2431 10.3013 10.7732 10.8418 11.6096 11.6942 13.3363 13.3471 13.8525 13.8541 14.7783 14.7956 k = 0.3854 0.4871-0.0000 ( 2935 PWs) bands (ev): -43.3605 -43.3605 -21.1210 -21.0766 -19.1566 -19.0788 -18.9590 -18.9422 -3.6243 -3.6224 -3.4820 -3.4816 -2.8687 -2.8626 -2.6808 -2.6804 -2.5796 -2.5789 -1.5261 -1.5209 -1.5127 -1.4589 5.5972 5.6040 5.7034 5.7228 5.8655 5.8782 7.4058 7.4719 7.5914 7.6038 8.2175 8.2504 10.3182 10.3788 10.8199 10.8897 11.6315 11.7143 13.2293 13.2331 13.6973 13.7023 14.7432 14.7616 k = 0.3802 0.4962-0.0000 ( 2931 PWs) bands (ev): -43.3603 -43.3603 -21.1220 -21.0764 -19.1576 -19.0763 -18.9628 -18.9440 -3.6234 -3.6215 -3.4806 -3.4802 -2.8679 -2.8617 -2.6781 -2.6778 -2.5835 -2.5828 -1.5202 -1.5171 -1.5077 -1.4501 5.6373 5.6464 5.6817 5.6980 5.8905 5.9094 7.3073 7.3710 7.6158 7.6269 8.1980 8.2311 10.3956 10.4588 10.8675 10.9375 11.6566 11.7358 13.1057 13.1070 13.5596 13.5696 14.7121 14.7316 k = 0.3750 0.5052-0.0000 ( 2927 PWs) bands (ev): -43.3600 -43.3600 -21.1229 -21.0764 -19.1586 -19.0740 -18.9663 -18.9456 -3.6226 -3.6206 -3.4793 -3.4788 -2.8671 -2.8608 -2.6755 -2.6752 -2.5872 -2.5865 -1.5150 -1.5136 -1.5024 -1.4418 5.6496 5.6673 5.6808 5.6971 5.9205 5.9458 7.2100 7.2721 7.6419 7.6522 8.1762 8.2095 10.4748 10.5409 10.9159 10.9851 11.6845 11.7574 12.9675 12.9697 13.4423 13.4546 14.6851 14.7055 k = 0.3698 0.5142-0.0000 ( 2923 PWs) bands (ev): -43.3598 -43.3598 -21.1238 -21.0763 -19.1595 -19.0719 -18.9696 -18.9470 -3.6219 -3.6199 -3.4781 -3.4776 -2.8664 -2.8600 -2.6730 -2.6727 -2.5908 -2.5900 -1.5106 -1.5103 -1.4972 -1.4341 5.6304 5.6519 5.7063 5.7315 5.9564 5.9875 7.1151 7.1758 7.6696 7.6791 8.1521 8.1859 10.5552 10.6246 10.9652 11.0319 11.7144 11.7770 12.8218 12.8236 13.3434 13.3550 14.6620 14.6832 k = 0.3646 0.5232-0.0000 ( 2919 PWs) bands (ev): -43.3596 -43.3596 -21.1245 -21.0763 -19.1604 -19.0700 -18.9726 -18.9482 -3.6212 -3.6192 -3.4770 -3.4765 -2.8657 -2.8593 -2.6705 -2.6702 -2.5940 -2.5933 -1.5074 -1.5069 -1.4921 -1.4271 5.6121 5.6334 5.7322 5.7612 5.9979 6.0337 7.0236 7.0830 7.6986 7.7070 8.1259 8.1605 10.6364 10.7095 11.0152 11.0775 11.7452 11.7913 12.6694 12.6815 13.2595 13.2683 14.6427 14.6647 k = 0.3594 0.5322-0.0000 ( 2921 PWs) bands (ev): -43.3594 -43.3594 -21.1251 -21.0763 -19.1612 -19.0683 -18.9752 -18.9492 -3.6207 -3.6187 -3.4761 -3.4756 -2.8651 -2.8586 -2.6683 -2.6681 -2.5970 -2.5962 -1.5049 -1.5039 -1.4875 -1.4209 5.5959 5.6171 5.7539 5.7853 6.0438 6.0828 6.9365 6.9948 7.7286 7.7357 8.0981 8.1338 10.7174 10.7945 11.0656 11.1207 11.7755 11.7951 12.5188 12.5492 13.1880 13.1928 14.6271 14.6498 k = 0.3542 0.5413-0.0000 ( 2919 PWs) bands (ev): -43.3593 -43.3593 -21.1257 -21.0764 -19.1619 -19.0669 -18.9774 -18.9500 -3.6202 -3.6182 -3.4754 -3.4749 -2.8646 -2.8581 -2.6664 -2.6662 -2.5995 -2.5987 -1.5027 -1.5014 -1.4834 -1.4156 5.5824 5.6035 5.7718 5.8045 6.0916 6.1326 6.8557 6.9132 7.7593 7.7644 8.0690 8.1066 10.7971 10.8787 11.1155 11.1595 11.7813 11.8032 12.3766 12.4368 13.1281 13.1283 14.6149 14.6382 k = 0.3490 0.5503-0.0000 ( 2931 PWs) bands (ev): -43.3593 -43.3593 -21.1261 -21.0764 -19.1625 -19.0658 -18.9792 -18.9507 -3.6199 -3.6179 -3.4749 -3.4744 -2.8642 -2.8577 -2.6649 -2.6648 -2.6017 -2.6008 -1.5010 -1.4994 -1.4800 -1.4113 5.5716 5.5926 5.7859 5.8194 6.1380 6.1801 6.7838 6.8406 7.7899 7.7921 8.0395 8.0798 10.8735 10.9607 11.1624 11.1907 11.7442 11.8256 12.2509 12.3533 13.0755 13.0798 14.6060 14.6297 k = 0.3438 0.5593-0.0000 ( 2939 PWs) bands (ev): -43.3593 -43.3593 -21.1265 -21.0765 -19.1629 -19.0651 -18.9805 -18.9511 -3.6198 -3.6177 -3.4746 -3.4741 -2.8640 -2.8575 -2.6639 -2.6637 -2.6032 -2.6023 -1.4998 -1.4980 -1.4774 -1.4082 5.5638 5.5847 5.7966 5.8303 6.1782 6.2209 6.7250 6.7815 7.8170 7.8189 8.0111 8.0554 10.9437 11.0386 11.2001 11.2094 11.6872 11.8389 12.1528 12.3022 13.0359 13.0440 14.6000 14.6241 k = 0.3385 0.5683-0.0000 ( 2943 PWs) bands (ev): -43.3593 -43.3593 -21.1267 -21.0765 -19.1632 -19.0646 -18.9812 -18.9514 -3.6196 -3.6176 -3.4744 -3.4739 -2.8639 -2.8573 -2.6632 -2.6631 -2.6041 -2.6032 -1.4990 -1.4972 -1.4759 -1.4062 5.5590 5.5799 5.8034 5.8373 6.2063 6.2491 6.6855 6.7418 7.8357 7.8427 7.9876 8.0370 11.0009 11.1104 11.2118 11.2140 11.6314 11.8410 12.0940 12.2775 13.0112 13.0219 14.5966 14.6210 k = 0.3333 0.5774-0.0000 ( 2943 PWs) bands (ev): -43.3593 -43.3593 -21.1267 -21.0765 -19.1633 -19.0645 -18.9815 -18.9514 -3.6196 -3.6175 -3.4743 -3.4738 -2.8638 -2.8572 -2.6630 -2.6628 -2.6044 -2.6035 -1.4988 -1.4969 -1.4753 -1.4055 5.5574 5.5783 5.8059 5.8399 6.2163 6.2591 6.6715 6.7278 7.8430 7.8530 7.9774 8.0298 11.0269 11.1623 11.1938 11.2067 11.6084 11.8387 12.0764 12.2707 13.0028 13.0145 14.5956 14.6201 k = 0.3333 0.5774-0.0000 ( 2943 PWs) bands (ev): -43.3593 -43.3593 -21.1267 -21.0765 -19.1633 -19.0645 -18.9815 -18.9514 -3.6196 -3.6175 -3.4743 -3.4738 -2.8638 -2.8572 -2.6630 -2.6628 -2.6044 -2.6035 -1.4988 -1.4969 -1.4753 -1.4055 5.5574 5.5783 5.8059 5.8399 6.2163 6.2591 6.6715 6.7278 7.8430 7.8530 7.9774 8.0298 11.0269 11.1623 11.1938 11.2067 11.6084 11.8387 12.0764 12.2707 13.0028 13.0145 14.5956 14.6201 k = 0.3281 0.5683-0.0000 ( 2939 PWs) bands (ev): -43.3593 -43.3593 -21.1267 -21.0765 -19.1632 -19.0646 -18.9812 -18.9514 -3.6196 -3.6176 -3.4743 -3.4738 -2.8638 -2.8573 -2.6632 -2.6630 -2.6041 -2.6032 -1.4990 -1.4972 -1.4759 -1.4062 5.5590 5.5800 5.8031 5.8369 6.2073 6.2501 6.6849 6.7412 7.8354 7.8423 7.9881 8.0374 10.9947 11.0924 11.2187 11.2358 11.6285 11.8440 12.0903 12.2766 13.0111 13.0219 14.5965 14.6209 k = 0.3229 0.5593-0.0000 ( 2939 PWs) bands (ev): -43.3593 -43.3593 -21.1265 -21.0764 -19.1628 -19.0650 -18.9805 -18.9511 -3.6198 -3.6177 -3.4746 -3.4741 -2.8640 -2.8575 -2.6638 -2.6636 -2.6033 -2.6024 -1.4998 -1.4981 -1.4777 -1.4084 5.5640 5.5850 5.7937 5.8272 6.1854 6.2277 6.7207 6.7772 7.8150 7.8164 8.0139 8.0577 10.9119 10.9787 11.2448 11.2798 11.6757 11.8609 12.1278 12.2947 13.0353 13.0438 14.5989 14.6230 k = 0.3177 0.5503-0.0000 ( 2935 PWs) bands (ev): -43.3594 -43.3594 -21.1261 -21.0763 -19.1623 -19.0655 -18.9794 -18.9507 -3.6200 -3.6180 -3.4749 -3.4744 -2.8644 -2.8579 -2.6647 -2.6645 -2.6021 -2.6012 -1.5012 -1.4996 -1.4807 -1.4121 5.5723 5.5934 5.7767 5.8092 6.1593 6.2004 6.7717 6.8285 7.7836 7.7867 8.0467 8.0862 10.8028 10.8503 11.2673 11.3111 11.7351 11.8875 12.1855 12.3273 13.0736 13.0788 14.6023 14.6259 k = 0.3125 0.5413-0.0000 ( 2927 PWs) bands (ev): -43.3594 -43.3594 -21.1255 -21.0762 -19.1615 -19.0661 -18.9779 -18.9502 -3.6203 -3.6183 -3.4753 -3.4748 -2.8649 -2.8584 -2.6658 -2.6655 -2.6005 -2.5997 -1.5031 -1.5018 -1.4850 -1.4174 5.5840 5.6052 5.7513 5.7821 6.1352 6.1743 6.8322 6.8896 7.7477 7.7539 8.0827 8.1193 10.6814 10.7162 11.2773 11.3270 11.8000 11.9230 12.2607 12.3767 13.1238 13.1254 14.6063 14.6290 k = 0.3073 0.5322-0.0000 ( 2929 PWs) bands (ev): -43.3596 -43.3596 -21.1249 -21.0760 -19.1604 -19.0669 -18.9762 -18.9496 -3.6208 -3.6188 -3.4760 -3.4755 -2.8656 -2.8591 -2.6671 -2.6668 -2.5989 -2.5980 -1.5056 -1.5048 -1.4906 -1.4243 5.5991 5.6205 5.7173 5.7463 6.1164 6.1529 6.8986 6.9567 7.7104 7.7187 8.1204 8.1551 10.5545 10.5810 11.2723 11.3266 11.8687 11.9682 12.3501 12.4435 13.1816 13.1836 14.6103 14.6318 k = 0.3021 0.5232-0.0000 ( 2931 PWs) bands (ev): -43.3598 -43.3598 -21.1240 -21.0757 -19.1591 -19.0676 -18.9741 -18.9489 -3.6214 -3.6194 -3.4768 -3.4763 -2.8665 -2.8600 -2.6685 -2.6682 -2.5971 -2.5962 -1.5090 -1.5086 -1.4971 -1.4330 5.6173 5.6392 5.6762 5.7035 6.1031 6.1371 6.9686 7.0277 7.6725 7.6823 8.1591 8.1925 10.4261 10.4468 11.2528 11.3108 11.9416 12.0234 12.4508 12.5261 13.2456 13.2508 14.6137 14.6337 k = 0.2969 0.5142-0.0000 ( 2931 PWs) bands (ev): -43.3601 -43.3601 -21.1230 -21.0753 -19.1575 -19.0683 -18.9719 -18.9480 -3.6222 -3.6201 -3.4777 -3.4772 -2.8676 -2.8612 -2.6699 -2.6696 -2.5951 -2.5944 -1.5149 -1.5122 -1.5040 -1.4434 5.6288 5.6351 5.6593 5.6618 6.0945 6.1264 7.0410 7.1012 7.6345 7.6454 8.1983 8.2310 10.2984 10.3152 11.2212 11.2820 12.0193 12.0882 12.5601 12.6217 13.3158 13.3239 14.6160 14.6341 k = 0.2917 0.5052-0.0000 ( 2935 PWs) bands (ev): -43.3604 -43.3604 -21.1218 -21.0749 -19.1556 -19.0689 -18.9695 -18.9471 -3.6230 -3.6210 -3.4787 -3.4782 -2.8689 -2.8625 -2.6713 -2.6710 -2.5933 -2.5925 -1.5236 -1.5163 -1.5104 -1.4555 5.5780 5.6002 5.6680 5.6875 6.0892 6.1196 7.1148 7.1762 7.5967 7.6086 8.2378 8.2700 10.1729 10.1869 11.1804 11.2430 12.1022 12.1614 12.6761 12.7273 13.3907 13.4012 14.6165 14.6323 k = 0.2865 0.4962-0.0000 ( 2939 PWs) bands (ev): -43.3608 -43.3608 -21.1204 -21.0744 -19.1533 -19.0693 -18.9669 -18.9461 -3.6240 -3.6220 -3.4797 -3.4793 -2.8705 -2.8641 -2.6727 -2.6724 -2.5915 -2.5907 -1.5349 -1.5210 -1.5162 -1.4695 5.5246 5.5474 5.6962 5.7168 6.0862 6.1156 7.1892 7.2520 7.5595 7.5722 8.2773 8.3094 10.0506 10.0626 11.1330 11.1967 12.1903 12.2418 12.7971 12.8402 13.4691 13.4817 14.6147 14.6278 k = 0.2812 0.4871-0.0000 ( 2927 PWs) bands (ev): -43.3611 -43.3611 -21.1188 -21.0737 -19.1508 -19.0696 -18.9642 -18.9450 -3.6250 -3.6231 -3.4807 -3.4803 -2.8721 -2.8657 -2.6739 -2.6736 -2.5896 -2.5889 -1.5484 -1.5262 -1.5221 -1.4852 5.4699 5.4930 5.7285 5.7495 6.0846 6.1136 7.2637 7.3281 7.5232 7.5367 8.3168 8.3488 9.9321 9.9427 11.0813 11.1456 12.2834 12.3286 12.9218 12.9583 13.5499 13.5643 14.6102 14.6202 k = 0.2760 0.4781-0.0000 ( 2927 PWs) bands (ev): -43.3615 -43.3615 -21.1171 -21.0729 -19.1479 -19.0697 -18.9614 -18.9438 -3.6263 -3.6243 -3.4819 -3.4815 -2.8740 -2.8676 -2.6751 -2.6747 -2.5881 -2.5874 -1.5638 -1.5319 -1.5282 -1.5028 5.4145 5.4382 5.7642 5.7856 6.0839 6.1127 7.3372 7.4032 7.4888 7.5031 8.3560 8.3881 9.8179 9.8275 11.0270 11.0916 12.3814 12.4210 13.0492 13.0795 13.6322 13.6483 14.6025 14.6090 k = 0.2708 0.4691-0.0000 ( 2923 PWs) bands (ev): -43.3619 -43.3619 -21.1151 -21.0720 -19.1447 -19.0695 -18.9586 -18.9426 -3.6276 -3.6256 -3.4831 -3.4827 -2.8761 -2.8698 -2.6761 -2.6757 -2.5866 -2.5859 -1.5809 -1.5382 -1.5348 -1.5220 5.3589 5.3835 5.8034 5.8250 6.0837 6.1127 7.4046 7.4465 7.4763 7.4870 8.3949 8.4272 9.7082 9.7172 10.9716 11.0362 12.4840 12.5183 13.1780 13.2021 13.7153 13.7330 14.5912 14.5940 k = 0.2656 0.4601-0.0000 ( 2923 PWs) bands (ev): -43.3625 -43.3625 -21.1130 -21.0710 -19.1412 -19.0692 -18.9557 -18.9414 -3.6291 -3.6271 -3.4844 -3.4840 -2.8784 -2.8722 -2.6770 -2.6766 -2.5854 -2.5847 -1.5998 -1.5454 -1.5426 -1.5417 5.3035 5.3290 5.8458 5.8677 6.0840 6.1131 7.4173 7.4213 7.5008 7.5584 8.4333 8.4658 9.6032 9.6117 10.9162 10.9806 12.5912 12.6203 13.3069 13.3241 13.7985 13.8182 14.5751 14.5761 k = 0.2604 0.4511-0.0000 ( 2929 PWs) bands (ev): -43.3631 -43.3631 -21.1107 -21.0699 -19.1374 -19.0685 -18.9528 -18.9401 -3.6308 -3.6288 -3.4858 -3.4854 -2.8810 -2.8748 -2.6779 -2.6775 -2.5845 -2.5838 -1.6203 -1.5659 -1.5520 -1.5491 5.2483 5.2747 5.8913 5.9136 6.0846 6.1140 7.3861 7.3956 7.5681 7.6322 8.4710 8.5039 9.5030 9.5112 10.8618 10.9259 12.7027 12.7264 13.4343 13.4431 13.8814 13.9035 14.5523 14.5571 k = 0.2552 0.4420-0.0000 ( 2933 PWs) bands (ev): -43.3638 -43.3638 -21.1082 -21.0687 -19.1333 -19.0677 -18.9499 -18.9388 -3.6326 -3.6307 -3.4872 -3.4869 -2.8838 -2.8776 -2.6787 -2.6782 -2.5838 -2.5831 -1.6423 -1.5902 -1.5597 -1.5569 5.1933 5.2206 5.9400 5.9626 6.0856 6.1152 7.3561 7.3672 7.6386 7.7052 8.5080 8.5412 9.4075 9.4156 10.8091 10.8730 12.8185 12.8363 13.5560 13.5580 13.9640 13.9893 14.5259 14.5344 k = 0.2500 0.4330-0.0000 ( 2933 PWs) bands (ev): -43.3644 -43.3644 -21.1055 -21.0673 -19.1288 -19.0665 -18.9470 -18.9374 -3.6346 -3.6326 -3.4886 -3.4882 -2.8869 -2.8807 -2.6792 -2.6788 -2.5834 -2.5827 -1.6659 -1.6161 -1.5678 -1.5651 5.1384 5.1665 5.9916 6.0146 6.0873 6.1168 7.3278 7.3397 7.7085 7.7768 8.5441 8.5778 9.3168 9.3248 10.7591 10.8225 12.9383 12.9495 13.6592 13.6749 14.0464 14.0757 14.4964 14.5080 k = 0.2448 0.4240-0.0000 ( 2933 PWs) bands (ev): -43.3651 -43.3651 -21.1027 -21.0657 -19.1241 -19.0650 -18.9440 -18.9360 -3.6367 -3.6348 -3.4900 -3.4897 -2.8901 -2.8839 -2.6797 -2.6793 -2.5831 -2.5825 -1.6909 -1.6435 -1.5763 -1.5737 5.0836 5.1122 6.0461 6.0694 6.0897 6.1190 7.3015 7.3139 7.7768 7.8465 8.5793 8.6134 9.2306 9.2386 10.7121 10.7751 13.0621 13.0657 13.7482 13.7812 14.1291 14.1624 14.4646 14.4784 k = 0.2396 0.4150-0.0000 ( 2929 PWs) bands (ev): -43.3658 -43.3658 -21.0997 -21.0641 -19.1190 -19.0633 -18.9411 -18.9346 -3.6390 -3.6370 -3.4913 -3.4910 -2.8936 -2.8874 -2.6801 -2.6796 -2.5831 -2.5824 -1.7172 -1.6722 -1.5851 -1.5827 5.0287 5.0576 6.0931 6.1034 6.1215 6.1275 7.2772 7.2899 7.8432 7.9141 8.6133 8.6478 9.1488 9.1567 10.6689 10.7314 13.1840 13.1895 13.8190 13.8724 14.2121 14.2467 14.4328 14.4460 k = 0.2344 0.4059-0.0000 ( 2937 PWs) bands (ev): -43.3667 -43.3667 -21.0965 -21.0623 -19.1136 -19.0612 -18.9382 -18.9331 -3.6415 -3.6396 -3.4928 -3.4926 -2.8973 -2.8912 -2.6804 -2.6800 -2.5834 -2.5827 -1.7448 -1.7023 -1.5943 -1.5921 4.9735 5.0025 6.0979 6.1259 6.1630 6.1873 7.2551 7.2682 7.9072 7.9791 8.6461 8.6810 9.0711 9.0791 10.6299 10.6918 13.3033 13.3203 13.8692 13.9453 14.2944 14.3154 14.4111 14.4115 k = 0.2292 0.3969-0.0000 ( 2939 PWs) bands (ev): -43.3676 -43.3676 -21.0932 -21.0604 -19.1080 -19.0589 -18.9353 -18.9317 -3.6443 -3.6423 -3.4943 -3.4940 -2.9014 -2.8953 -2.6806 -2.6802 -2.5839 -2.5832 -1.7735 -1.7335 -1.6039 -1.6017 4.9177 4.9466 6.1043 6.1312 6.2251 6.2499 7.2355 7.2488 7.9685 8.0412 8.6774 8.7126 8.9975 9.0056 10.5956 10.6569 13.4217 13.4541 13.8986 13.9992 14.3240 14.3710 14.3762 14.4416 k = 0.2240 0.3879-0.0000 ( 2935 PWs) bands (ev): -43.3684 -43.3684 -21.0897 -21.0583 -19.1021 -19.0563 -18.9324 -18.9302 -3.6472 -3.6452 -3.4956 -3.4953 -2.9057 -2.8996 -2.6807 -2.6803 -2.5845 -2.5839 -1.8032 -1.7656 -1.6137 -1.6117 4.8613 4.8898 6.1126 6.1382 6.2893 6.3146 7.2184 7.2320 8.0266 8.0999 8.7069 8.7418 8.9279 8.9367 10.5665 10.6270 13.5357 13.5896 13.9097 14.0379 14.2927 14.3360 14.4447 14.5002 k = 0.2188 0.3789-0.0000 ( 2933 PWs) bands (ev): -43.3693 -43.3693 -21.0860 -21.0561 -19.0959 -19.0534 -18.9296 -18.9287 -3.6503 -3.6483 -3.4970 -3.4967 -2.9102 -2.9042 -2.6808 -2.6803 -2.5854 -2.5848 -1.8339 -1.7987 -1.6239 -1.6219 4.8042 4.8320 6.1231 6.1470 6.3553 6.3812 7.2043 7.2181 8.0811 8.1547 8.7333 8.7659 8.8633 8.8747 10.5429 10.6024 13.6386 13.7227 13.9096 14.0701 14.2540 14.2969 14.5085 14.5550 k = 0.2135 0.3699-0.0000 ( 2927 PWs) bands (ev): -43.3702 -43.3702 -21.0823 -21.0538 -19.0895 -19.0503 -18.9271 -18.9267 -3.6536 -3.6517 -3.4983 -3.4981 -2.9151 -2.9091 -2.6808 -2.6803 -2.5864 -2.5858 -1.8654 -1.8326 -1.6343 -1.6324 4.7462 4.7731 6.1360 6.1580 6.4229 6.4493 7.1932 7.2072 8.1314 8.2050 8.7487 8.7676 8.8116 8.8368 10.5252 10.5837 13.7192 13.8226 13.9327 14.1103 14.2135 14.2574 14.5664 14.6034 k = 0.2083 0.3608-0.0000 ( 2915 PWs) bands (ev): -43.3710 -43.3710 -21.0784 -21.0513 -19.0828 -19.0468 -18.9255 -18.9239 -3.6572 -3.6552 -3.4995 -3.4993 -2.9203 -2.9143 -2.6807 -2.6802 -2.5875 -2.5869 -1.8974 -1.8670 -1.6449 -1.6431 4.6873 4.7132 6.1515 6.1715 6.4915 6.5186 7.1856 7.1998 8.1769 8.2500 8.7197 8.7249 8.8060 8.8447 10.5137 10.5709 13.7664 13.8288 14.0423 14.1708 14.1729 14.2195 14.6215 14.6476 k = 0.2031 0.3518-0.0000 ( 2915 PWs) bands (ev): -43.3720 -43.3720 -21.0744 -21.0488 -19.0760 -19.0432 -18.9239 -18.9210 -3.6610 -3.6591 -3.5009 -3.5007 -2.9258 -2.9199 -2.6807 -2.6802 -2.5888 -2.5882 -1.9300 -1.9019 -1.6557 -1.6541 4.6274 4.6521 6.1699 6.1876 6.5607 6.5882 7.1821 7.1962 8.2167 8.2884 8.6683 8.6709 8.8254 8.8659 10.5086 10.5644 13.7811 13.8035 14.1262 14.1744 14.1840 14.2608 14.6785 14.6908 k = 0.1979 0.3428-0.0000 ( 2919 PWs) bands (ev): -43.3731 -43.3731 -21.0703 -21.0461 -19.0690 -19.0393 -18.9222 -18.9182 -3.6652 -3.6632 -3.5023 -3.5021 -2.9318 -2.9259 -2.6807 -2.6803 -2.5903 -2.5897 -1.9629 -1.9371 -1.6667 -1.6651 4.5667 4.5900 6.1912 6.2065 6.6297 6.6576 7.1832 7.1971 8.2495 8.3183 8.6181 8.6182 8.8470 8.8882 10.5102 10.5643 13.7724 13.7747 14.0879 14.1357 14.3171 14.3532 14.7378 14.7436 k = 0.1927 0.3338-0.0000 ( 2911 PWs) bands (ev): -43.3741 -43.3741 -21.0661 -21.0433 -19.0619 -19.0352 -18.9205 -18.9153 -3.6696 -3.6676 -3.5036 -3.5034 -2.9381 -2.9323 -2.6806 -2.6802 -2.5918 -2.5912 -1.9961 -1.9724 -1.6778 -1.6764 4.5051 4.5271 6.2156 6.2284 6.6976 6.7254 7.1901 7.2035 8.2733 8.3363 8.5699 8.5753 8.8681 8.9098 10.5185 10.5709 13.7407 13.7578 14.0478 14.0967 14.4393 14.4404 14.7971 14.8247 k = 0.1875 0.3248-0.0000 ( 2905 PWs) bands (ev): -43.3752 -43.3752 -21.0619 -21.0405 -19.0546 -19.0309 -18.9186 -18.9124 -3.6743 -3.6723 -3.5048 -3.5047 -2.9448 -2.9391 -2.6806 -2.6802 -2.5933 -2.5928 -2.0292 -2.0077 -1.6891 -1.6878 4.4428 4.4633 6.2430 6.2533 6.7629 6.7901 7.2041 7.2163 8.2848 8.3374 8.5297 8.5447 8.8880 8.9302 10.5337 10.5840 13.7106 13.7369 14.0083 14.0583 14.5079 14.5383 14.8814 14.9277 k = 0.1823 0.3157-0.0000 ( 2905 PWs) bands (ev): -43.3763 -43.3763 -21.0575 -21.0375 -19.0473 -19.0265 -18.9167 -18.9095 -3.6794 -3.6774 -3.5062 -3.5060 -2.9519 -2.9463 -2.6807 -2.6803 -2.5948 -2.5943 -2.0623 -2.0428 -1.7005 -1.6992 4.3799 4.3990 6.2735 6.2813 6.8240 6.8498 7.2271 7.2372 8.2803 8.3187 8.5012 8.5291 8.9066 8.9492 10.5557 10.6038 13.6835 13.7156 13.9700 14.0209 14.5570 14.6032 14.9979 15.0521 k = 0.1771 0.3067-0.0000 ( 2905 PWs) bands (ev): -43.3774 -43.3774 -21.0532 -21.0345 -19.0399 -19.0219 -18.9147 -18.9065 -3.6847 -3.6827 -3.5075 -3.5074 -2.9594 -2.9539 -2.6808 -2.6805 -2.5964 -2.5959 -2.0952 -2.0775 -1.7119 -1.7108 4.3166 4.3342 6.3071 6.3124 6.8793 6.9025 7.2608 7.2676 8.2585 8.2840 8.4854 8.5248 8.9237 8.9667 10.5843 10.6301 13.6601 13.6960 13.9330 13.9848 14.5902 14.6417 15.1395 15.1923 k = 0.1719 0.2977-0.0000 ( 2909 PWs) bands (ev): -43.3786 -43.3786 -21.0488 -21.0314 -19.0326 -19.0172 -18.9126 -18.9035 -3.6905 -3.6885 -3.5089 -3.5088 -2.9675 -2.9621 -2.6811 -2.6808 -2.5978 -2.5973 -2.1276 -2.1118 -1.7234 -1.7223 4.2530 4.2692 6.3436 6.3465 6.9275 6.9470 7.3062 7.3086 8.2232 8.2399 8.4786 8.5251 8.9394 8.9828 10.6196 10.6629 13.6411 13.6795 13.8975 13.9500 14.6119 14.6639 15.2950 15.3408 k = 0.1667 0.2887-0.0000 ( 2905 PWs) bands (ev): -43.3798 -43.3798 -21.0444 -21.0283 -19.0252 -19.0124 -18.9103 -18.9004 -3.6966 -3.6946 -3.5102 -3.5101 -2.9760 -2.9707 -2.6814 -2.6811 -2.5992 -2.5987 -2.1594 -2.1453 -1.7350 -1.7340 4.1893 4.2041 6.3830 6.3835 6.9683 6.9837 7.3602 7.3626 8.1797 8.1912 8.4754 8.5252 8.9537 8.9973 10.6611 10.7019 13.6266 13.6666 13.8637 13.9167 14.6253 14.6758 15.4484 15.4659 k = 0.1615 0.2797-0.0000 ( 2901 PWs) bands (ev): -43.3809 -43.3809 -21.0400 -21.0251 -19.0180 -19.0076 -18.9078 -18.8972 -3.7030 -3.7011 -3.5114 -3.5114 -2.9849 -2.9798 -2.6818 -2.6816 -2.6003 -2.5999 -2.1905 -2.1781 -1.7465 -1.7456 4.1258 4.1392 6.4235 6.4251 7.0027 7.0143 7.4211 7.4282 8.1320 8.1404 8.4723 8.5232 8.9666 9.0104 10.7086 10.7469 13.6170 13.6578 13.8318 13.8852 14.6322 14.6808 15.4569 15.4917 k = 0.1562 0.2706-0.0000 ( 2901 PWs) bands (ev): -43.3821 -43.3821 -21.0356 -21.0219 -19.0109 -19.0027 -18.9050 -18.8939 -3.7099 -3.7079 -3.5128 -3.5127 -2.9944 -2.9894 -2.6824 -2.6822 -2.6014 -2.6009 -2.2208 -2.2099 -1.7580 -1.7572 4.0625 4.0747 6.4661 6.4698 7.0325 7.0409 7.4894 7.5006 8.0821 8.0886 8.4673 8.5178 8.9782 9.0222 10.7619 10.7975 13.6120 13.6533 13.8018 13.8555 14.6341 14.6806 15.4053 15.4443 k = 0.1510 0.2616-0.0000 ( 2899 PWs) bands (ev): -43.3833 -43.3833 -21.0312 -21.0186 -19.0041 -18.9979 -18.9021 -18.8905 -3.7171 -3.7152 -3.5141 -3.5140 -3.0043 -2.9995 -2.6832 -2.6829 -2.6022 -2.6018 -2.2501 -2.2406 -1.7695 -1.7687 3.9997 4.0107 6.5113 6.5169 7.0593 7.0651 7.5631 7.5778 8.0314 8.0366 8.4595 8.5090 8.9885 9.0326 10.8203 10.8535 13.6117 13.6530 13.7739 13.8279 14.6319 14.6763 15.3466 15.3863 k = 0.1458 0.2526-0.0000 ( 2903 PWs) bands (ev): -43.3845 -43.3845 -21.0268 -21.0154 -18.9975 -18.9932 -18.8988 -18.8869 -3.7248 -3.7229 -3.5154 -3.5154 -3.0147 -3.0101 -2.6840 -2.6838 -2.6029 -2.6025 -2.2784 -2.2701 -1.7809 -1.7802 3.9376 3.9474 6.5588 6.5662 7.0845 7.0883 7.6405 7.6582 7.9805 7.9850 8.4487 8.4966 8.9976 9.0418 10.8836 10.9143 13.6157 13.6568 13.7483 13.8024 14.6260 14.6685 15.2842 15.3240 k = 0.1406 0.2436-0.0000 ( 2901 PWs) bands (ev): -43.3857 -43.3857 -21.0225 -21.0121 -18.9913 -18.9886 -18.8952 -18.8831 -3.7328 -3.7310 -3.5167 -3.5167 -3.0255 -3.0212 -2.6850 -2.6848 -2.6033 -2.6029 -2.3055 -2.2984 -1.7922 -1.7916 3.8763 3.8851 6.6085 6.6174 7.1090 7.1113 7.7203 7.7405 7.9300 7.9339 8.4348 8.4810 9.0055 9.0499 10.9514 10.9797 13.6239 13.6644 13.7250 13.7792 14.6172 14.6579 15.2191 15.2589 k = 0.1354 0.2345-0.0000 ( 2893 PWs) bands (ev): -43.3868 -43.3868 -21.0183 -21.0089 -18.9854 -18.9841 -18.8912 -18.8792 -3.7412 -3.7394 -3.5180 -3.5180 -3.0366 -3.0325 -2.6861 -2.6859 -2.6035 -2.6031 -2.3313 -2.3252 -1.8034 -1.8028 3.8160 3.8238 6.6600 6.6704 7.1335 7.1346 7.8016 7.8238 7.8803 7.8840 8.4182 8.4623 9.0124 9.0569 11.0231 11.0491 13.6358 13.6755 13.7042 13.7585 14.6059 14.6449 15.1520 15.1916 k = 0.1302 0.2255-0.0000 ( 2897 PWs) bands (ev): -43.3880 -43.3880 -21.0141 -21.0057 -18.9800 -18.9798 -18.8869 -18.8750 -3.7500 -3.7483 -3.5194 -3.5194 -3.0481 -3.0443 -2.6874 -2.6873 -2.6035 -2.6031 -2.3558 -2.3507 -1.8145 -1.8140 3.7569 3.7638 6.7131 6.7247 7.1584 7.1585 7.8314 7.8344 7.8837 7.9083 8.3991 8.4411 9.0184 9.0630 11.0983 11.1222 13.6510 13.6860 13.6890 13.7410 14.5923 14.6297 15.0832 15.1226 k = 0.1250 0.2165-0.0000 ( 2895 PWs) bands (ev): -43.3892 -43.3892 -21.0100 -21.0025 -18.9757 -18.9750 -18.8822 -18.8707 -3.7592 -3.7576 -3.5207 -3.5207 -3.0599 -3.0563 -2.6888 -2.6887 -2.6033 -2.6029 -2.3790 -2.3746 -1.8254 -1.8249 3.6991 3.7052 6.7674 6.7801 7.1833 7.1838 7.7841 7.7870 7.9657 7.9919 8.3777 8.4176 9.0236 9.0682 11.1766 11.1984 13.6658 13.6740 13.7017 13.7296 14.5768 14.6128 15.0134 15.0524 k = 0.1198 0.2075-0.0000 ( 2887 PWs) bands (ev): -43.3902 -43.3902 -21.0060 -20.9993 -18.9718 -18.9704 -18.8772 -18.8662 -3.7687 -3.7671 -3.5220 -3.5220 -3.0718 -3.0686 -2.6903 -2.6902 -2.6028 -2.6025 -2.4006 -2.3970 -1.8361 -1.8357 3.6428 3.6481 6.8225 6.8361 7.2090 7.2100 7.7385 7.7412 8.0472 8.0751 8.3546 8.3923 9.0281 9.0727 11.2575 11.2773 13.6563 13.6916 13.7017 13.7361 14.5597 14.5944 14.9428 14.9813 k = 0.1146 0.1985-0.0000 ( 2887 PWs) bands (ev): -43.3913 -43.3913 -21.0022 -20.9962 -18.9682 -18.9664 -18.8718 -18.8615 -3.7786 -3.7771 -3.5234 -3.5234 -3.0839 -3.0810 -2.6919 -2.6919 -2.6021 -2.6018 -2.4209 -2.4180 -1.8466 -1.8463 3.5881 3.5927 6.8778 6.8921 7.2355 7.2369 7.6949 7.6975 8.1277 8.1571 8.3300 8.3656 9.0319 9.0766 11.3405 11.3586 13.6462 13.6934 13.7146 13.7556 14.5412 14.5746 14.8718 14.9098 k = 0.1094 0.1894-0.0000 ( 2895 PWs) bands (ev): -43.3925 -43.3925 -20.9984 -20.9932 -18.9648 -18.9627 -18.8662 -18.8566 -3.7888 -3.7874 -3.5248 -3.5248 -3.0961 -3.0935 -2.6937 -2.6937 -2.6014 -2.6011 -2.4399 -2.4375 -1.8569 -1.8566 3.5350 3.5390 6.9328 6.9476 7.2629 7.2645 7.6541 7.6565 8.2068 8.2376 8.3043 8.3378 9.0352 9.0799 11.4253 11.4417 13.6387 13.6857 13.7397 13.7787 14.5214 14.5537 14.8009 14.8382 k = 0.1042 0.1804-0.0000 ( 2887 PWs) bands (ev): -43.3935 -43.3935 -20.9948 -20.9902 -18.9617 -18.9595 -18.8603 -18.8516 -3.7991 -3.7978 -3.5261 -3.5261 -3.1083 -3.1059 -2.6954 -2.6954 -2.6004 -2.6001 -2.4573 -2.4554 -1.8669 -1.8666 3.4838 3.4872 6.9865 7.0016 7.2910 7.2928 7.6166 7.6188 8.2775 8.2847 8.3085 8.3172 9.0381 9.0828 11.5114 11.5262 13.6341 13.6802 13.7661 13.8037 14.5007 14.5319 14.7306 14.7669 k = 0.0990 0.1714-0.0000 ( 2887 PWs) bands (ev): -43.3946 -43.3946 -20.9913 -20.9874 -18.9589 -18.9567 -18.8543 -18.8465 -3.8098 -3.8086 -3.5274 -3.5274 -3.1203 -3.1183 -2.6973 -2.6972 -2.5993 -2.5990 -2.4735 -2.4719 -1.8767 -1.8764 3.4345 3.4374 7.0377 7.0528 7.3198 7.3216 7.5837 7.5854 8.2511 8.2805 8.3594 8.3928 9.0408 9.0854 11.5984 11.6116 13.6323 13.6772 13.7936 13.8297 14.4789 14.5093 14.6611 14.6964 k = 0.0938 0.1624-0.0000 ( 2893 PWs) bands (ev): -43.3957 -43.3957 -20.9879 -20.9846 -18.9563 -18.9542 -18.8482 -18.8413 -3.8206 -3.8195 -3.5288 -3.5288 -3.1322 -3.1304 -2.6992 -2.6991 -2.5981 -2.5979 -2.4883 -2.4871 -1.8861 -1.8859 3.3872 3.3897 7.0847 7.0994 7.3490 7.3506 7.5570 7.5578 8.2242 8.2517 8.4321 8.4666 9.0433 9.0878 11.6858 11.6976 13.6334 13.6767 13.8216 13.8564 14.4562 14.4858 14.5931 14.6270 k = 0.0885 0.1534-0.0000 ( 2895 PWs) bands (ev): -43.3967 -43.3967 -20.9847 -20.9819 -18.9539 -18.9521 -18.8421 -18.8360 -3.8314 -3.8304 -3.5302 -3.5301 -3.1437 -3.1422 -2.7011 -2.7011 -2.5968 -2.5966 -2.5019 -2.5009 -1.8952 -1.8950 3.3421 3.3441 7.1251 7.1388 7.3786 7.3798 7.5383 7.5390 8.1975 8.2231 8.5020 8.5374 9.0457 9.0900 11.7733 11.7837 13.6372 13.6788 13.8499 13.8833 14.4321 14.4615 14.5274 14.5595 k = 0.0833 0.1443-0.0000 ( 2895 PWs) bands (ev): -43.3976 -43.3976 -20.9817 -20.9793 -18.9518 -18.9501 -18.8360 -18.8308 -3.8422 -3.8413 -3.5315 -3.5314 -3.1549 -3.1536 -2.7030 -2.7030 -2.5954 -2.5952 -2.5142 -2.5134 -1.9039 -1.9038 3.2991 3.3008 7.1561 7.1681 7.4080 7.4087 7.5296 7.5324 8.1713 8.1950 8.5687 8.6050 9.0482 9.0922 11.8603 11.8694 13.6438 13.6835 13.8781 13.9101 14.4053 14.4357 14.4660 14.4949 k = 0.0781 0.1353-0.0000 ( 2901 PWs) bands (ev): -43.3986 -43.3986 -20.9788 -20.9768 -18.9499 -18.9485 -18.8300 -18.8256 -3.8530 -3.8522 -3.5328 -3.5327 -3.1657 -3.1646 -2.7050 -2.7049 -2.5940 -2.5939 -2.5254 -2.5248 -1.9123 -1.9122 3.2584 3.2598 7.1751 7.1848 7.4370 7.4370 7.5342 7.5397 8.1458 8.1677 8.6320 8.6689 9.0509 9.0944 11.9463 11.9543 13.6529 13.6905 13.9058 13.9364 14.3700 14.4039 14.4150 14.4379 k = 0.0729 0.1263-0.0000 ( 2893 PWs) bands (ev): -43.3994 -43.3994 -20.9761 -20.9745 -18.9482 -18.9470 -18.8241 -18.8205 -3.8635 -3.8629 -3.5339 -3.5339 -3.1759 -3.1751 -2.7067 -2.7067 -2.5925 -2.5924 -2.5354 -2.5350 -1.9203 -1.9201 3.2200 3.2211 7.1817 7.1890 7.4647 7.4651 7.5524 7.5602 8.1211 8.1413 8.6917 8.7289 9.0538 9.0967 12.0310 12.0379 13.6645 13.6999 13.9327 13.9620 14.3210 14.3556 14.3801 14.4000 k = 0.0677 0.1173-0.0000 ( 2889 PWs) bands (ev): -43.4002 -43.4002 -20.9736 -20.9723 -18.9467 -18.9457 -18.8185 -18.8155 -3.8738 -3.8733 -3.5350 -3.5350 -3.1857 -3.1850 -2.7085 -2.7085 -2.5910 -2.5909 -2.5444 -2.5441 -1.9278 -1.9277 3.1840 3.1849 7.1780 7.1832 7.4919 7.4923 7.5815 7.5909 8.0976 8.1161 8.7475 8.7848 9.0571 9.0991 12.1139 12.1197 13.6783 13.7112 13.9585 13.9866 14.2668 14.2996 14.3533 14.3726 k = 0.0625 0.1083-0.0000 ( 2889 PWs) bands (ev): -43.4009 -43.4009 -20.9712 -20.9702 -18.9454 -18.9446 -18.8131 -18.8107 -3.8838 -3.8834 -3.5362 -3.5362 -3.1948 -3.1942 -2.7103 -2.7103 -2.5895 -2.5895 -2.5525 -2.5522 -1.9349 -1.9348 3.1505 3.1512 7.1673 7.1709 7.5186 7.5187 7.6176 7.6278 8.0753 8.0921 8.7993 8.8363 9.0608 9.1017 12.1943 12.1992 13.6940 13.7243 13.9829 14.0099 14.2136 14.2448 14.3290 14.3475 k = 0.0573 0.0992-0.0000 ( 2885 PWs) bands (ev): -43.4016 -43.4016 -20.9690 -20.9682 -18.9442 -18.9436 -18.8080 -18.8062 -3.8934 -3.8931 -3.5372 -3.5372 -3.2033 -3.2029 -2.7119 -2.7119 -2.5881 -2.5881 -2.5596 -2.5594 -1.9415 -1.9414 3.1194 3.1200 7.1526 7.1550 7.5443 7.5443 7.6573 7.6676 8.0544 8.0697 8.8468 8.8830 9.0652 9.1045 12.2719 12.2758 13.7113 13.7389 14.0051 14.0316 14.1631 14.1933 14.3059 14.3233 k = 0.0521 0.0902-0.0000 ( 2883 PWs) bands (ev): -43.4022 -43.4022 -20.9670 -20.9664 -18.9432 -18.9427 -18.8032 -18.8018 -3.9025 -3.9022 -3.5382 -3.5382 -3.2111 -3.2108 -2.7135 -2.7135 -2.5867 -2.5867 -2.5659 -2.5658 -1.9476 -1.9476 3.0909 3.0914 7.1361 7.1377 7.5687 7.5688 7.6981 7.7082 8.0350 8.0487 8.8900 8.9248 9.0703 9.1075 12.3459 12.3491 13.7298 13.7544 14.0241 14.0509 14.1168 14.1470 14.2836 14.2998 k = 0.0469 0.0812-0.0000 ( 2885 PWs) bands (ev): -43.4028 -43.4028 -20.9652 -20.9648 -18.9423 -18.9420 -18.7988 -18.7978 -3.9110 -3.9108 -3.5392 -3.5392 -3.2183 -3.2180 -2.7150 -2.7149 -2.5855 -2.5854 -2.5715 -2.5714 -1.9532 -1.9532 3.0650 3.0653 7.1191 7.1202 7.5916 7.5918 7.7383 7.7479 8.0173 8.0295 8.9288 8.9614 9.0763 9.1107 12.4158 12.4183 13.7489 13.7705 14.0355 14.0592 14.0837 14.1104 14.2623 14.2770 k = 0.0417 0.0722-0.0000 ( 2881 PWs) bands (ev): -43.4033 -43.4033 -20.9636 -20.9633 -18.9416 -18.9413 -18.7948 -18.7941 -3.9189 -3.9187 -3.5400 -3.5400 -3.2247 -3.2245 -2.7163 -2.7163 -2.5842 -2.5842 -2.5763 -2.5762 -1.9583 -1.9583 3.0418 3.0420 7.1026 7.1033 7.6129 7.6130 7.7767 7.7856 8.0013 8.0120 8.9630 8.9923 9.0836 9.1142 12.4811 12.4829 13.7681 13.7867 14.0274 14.0289 14.0916 14.0956 14.2420 14.2552 k = 0.0365 0.0631-0.0000 ( 2887 PWs) bands (ev): -43.4039 -43.4039 -20.9622 -20.9620 -18.9409 -18.9408 -18.7912 -18.7907 -3.9260 -3.9259 -3.5409 -3.5409 -3.2304 -3.2303 -2.7176 -2.7176 -2.5832 -2.5832 -2.5804 -2.5803 -1.9628 -1.9628 3.0212 3.0213 7.0873 7.0877 7.6321 7.6323 7.8123 7.8205 7.9871 7.9964 8.9926 9.0172 9.0924 9.1179 12.5409 12.5422 13.7868 13.8021 13.9952 14.0013 14.1014 14.1056 14.2231 14.2345 k = 0.0312 0.0541-0.0000 ( 2879 PWs) bands (ev): -43.4042 -43.4042 -20.9609 -20.9608 -18.9404 -18.9403 -18.7881 -18.7877 -3.9323 -3.9322 -3.5415 -3.5415 -3.2353 -3.2352 -2.7186 -2.7186 -2.5841 -2.5840 -2.5820 -2.5820 -1.9668 -1.9667 3.0032 3.0033 7.0734 7.0737 7.6492 7.6493 7.8446 7.8518 7.9748 7.9827 9.0174 9.0362 9.1027 9.1221 12.5948 12.5956 13.8041 13.8163 13.9659 13.9729 14.1125 14.1184 14.2057 14.2154 k = 0.0260 0.0451-0.0000 ( 2883 PWs) bands (ev): -43.4046 -43.4046 -20.9599 -20.9598 -18.9399 -18.9399 -18.7854 -18.7852 -3.9378 -3.9377 -3.5421 -3.5421 -3.2395 -3.2395 -2.7195 -2.7195 -2.5869 -2.5869 -2.5812 -2.5812 -1.9701 -1.9701 2.9880 2.9881 7.0613 7.0614 7.6639 7.6640 7.8729 7.8790 7.9645 7.9710 9.0374 9.0500 9.1137 9.1266 12.6418 12.6423 13.8192 13.8282 13.9418 13.9479 14.1235 14.1293 14.1902 14.1981 k = 0.0208 0.0361-0.0000 ( 2879 PWs) bands (ev): -43.4049 -43.4049 -20.9590 -20.9590 -18.9396 -18.9396 -18.7831 -18.7830 -3.9423 -3.9423 -3.5426 -3.5426 -3.2430 -3.2430 -2.7203 -2.7203 -2.5892 -2.5892 -2.5805 -2.5805 -1.9729 -1.9729 2.9756 2.9756 7.0512 7.0513 7.6762 7.6762 7.8967 7.9017 7.9562 7.9614 9.0527 9.0598 9.1241 9.1314 12.6815 12.6818 13.8311 13.8369 13.9238 13.9281 14.1332 14.1381 14.1770 14.1830 k = 0.0156 0.0271-0.0000 ( 2887 PWs) bands (ev): -43.4052 -43.4052 -20.9584 -20.9584 -18.9393 -18.9393 -18.7814 -18.7814 -3.9459 -3.9459 -3.5431 -3.5431 -3.2457 -3.2457 -2.7210 -2.7210 -2.5910 -2.5910 -2.5800 -2.5800 -1.9751 -1.9751 2.9659 2.9659 7.0432 7.0432 7.6858 7.6858 7.9156 7.9193 7.9500 7.9538 9.0636 9.0667 9.1329 9.1361 12.7132 12.7133 13.8386 13.8416 13.9124 13.9146 14.1411 14.1448 14.1664 14.1707 k = 0.0104 0.0180-0.0000 ( 2879 PWs) bands (ev): -43.4053 -43.4053 -20.9579 -20.9579 -18.9391 -18.9391 -18.7802 -18.7802 -3.9484 -3.9484 -3.5432 -3.5432 -3.2476 -3.2476 -2.7213 -2.7213 -2.5922 -2.5922 -2.5795 -2.5795 -1.9766 -1.9766 2.9589 2.9589 7.0374 7.0374 7.6927 7.6928 7.9292 7.9314 7.9464 7.9486 9.0706 9.0715 9.1394 9.1404 12.7362 12.7362 13.8418 13.8427 13.9067 13.9075 14.1468 14.1493 14.1590 14.1616 k = 0.0052 0.0090-0.0000 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9576 -20.9576 -18.9390 -18.9390 -18.7794 -18.7794 -3.9500 -3.9500 -3.5434 -3.5434 -3.2487 -3.2487 -2.7216 -2.7216 -2.5930 -2.5930 -2.5793 -2.5793 -1.9776 -1.9776 2.9547 2.9547 7.0339 7.0339 7.6969 7.6969 7.9364 7.9370 7.9459 7.9464 9.0743 9.0744 9.1432 9.1433 12.7502 12.7502 13.8420 13.8422 13.9047 13.9048 14.1501 14.1508 14.1555 14.1562 k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9505 -3.9505 -3.5435 -3.5435 -3.2491 -3.2491 -2.7216 -2.7216 -2.5932 -2.5932 -2.5792 -2.5792 -1.9779 -1.9779 2.9533 2.9533 7.0328 7.0328 7.6983 7.6983 7.9380 7.9380 7.9466 7.9466 9.0754 9.0754 9.1445 9.1445 12.7549 12.7549 13.8418 13.8418 13.9043 13.9043 14.1506 14.1506 14.1550 14.1550 k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9505 -3.9505 -3.5435 -3.5435 -3.2491 -3.2491 -2.7216 -2.7216 -2.5932 -2.5932 -2.5792 -2.5792 -1.9779 -1.9779 2.9533 2.9533 7.0328 7.0328 7.6983 7.6983 7.9380 7.9380 7.9466 7.9466 9.0754 9.0754 9.1445 9.1445 12.7549 12.7549 13.8418 13.8418 13.9043 13.9043 14.1506 14.1506 14.1550 14.1550 k = 0.0000 0.0000 0.0103 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9495 -3.9495 -3.5435 -3.5435 -3.2497 -3.2497 -2.7216 -2.7216 -2.5956 -2.5956 -2.5792 -2.5792 -1.9761 -1.9761 2.9568 2.9568 6.9889 6.9889 7.7428 7.7428 7.9380 7.9381 7.9475 7.9475 9.0753 9.0753 9.1442 9.1444 12.7504 12.7504 13.8413 13.8413 13.9021 13.9057 14.1495 14.1532 14.1558 14.1558 k = 0.0000 0.0000 0.0206 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9467 -3.9467 -3.5435 -3.5435 -3.2514 -3.2514 -2.7216 -2.7216 -2.6028 -2.6028 -2.5792 -2.5792 -1.9707 -1.9707 2.9673 2.9673 6.8813 6.8813 7.8492 7.8492 7.9382 7.9383 7.9535 7.9535 9.0749 9.0749 9.1437 9.1440 12.7370 12.7370 13.8400 13.8400 13.8992 13.9062 14.1499 14.1571 14.1582 14.1582 k = 0.0000 0.0000 0.0309 ( 2865 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9418 -3.9418 -3.5434 -3.5434 -3.2543 -3.2543 -2.7216 -2.7216 -2.6141 -2.6141 -2.5791 -2.5791 -1.9622 -1.9622 2.9847 2.9847 6.7435 6.7435 7.9295 7.9295 7.9385 7.9387 8.0190 8.0190 9.0742 9.0742 9.1430 9.1434 12.7146 12.7146 13.8378 13.8378 13.8957 13.9058 14.1518 14.1621 14.1621 14.1623 k = 0.0000 0.0000 0.0412 ( 2859 PWs) bands (ev): -43.4052 -43.4052 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9352 -3.9352 -3.5434 -3.5434 -3.2584 -3.2584 -2.7216 -2.7216 -2.6292 -2.6292 -2.5791 -2.5791 -1.9510 -1.9510 3.0090 3.0090 6.5926 6.5926 7.9388 7.9388 7.9390 7.9392 8.1716 8.1716 9.0732 9.0732 9.1420 9.1425 12.6831 12.6831 13.8350 13.8350 13.8918 13.9045 14.1552 14.1674 14.1674 14.1684 k = 0.0000 0.0000 0.0515 ( 2871 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9267 -3.9267 -3.5435 -3.5435 -3.2639 -3.2639 -2.7217 -2.7217 -2.6473 -2.6473 -2.5792 -2.5792 -1.9379 -1.9379 3.0401 3.0401 6.4363 6.4363 7.9395 7.9398 7.9412 7.9412 8.3396 8.3396 9.0720 9.0720 9.1407 9.1414 12.6424 12.6424 13.8315 13.8315 13.8876 13.9024 14.1599 14.1738 14.1738 14.1753 k = 0.0000 0.0000 0.0618 ( 2871 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9165 -3.9165 -3.5435 -3.5435 -3.2708 -3.2708 -2.7217 -2.7217 -2.6675 -2.6675 -2.5792 -2.5792 -1.9233 -1.9233 3.0779 3.0779 6.2780 6.2780 7.9402 7.9405 7.9427 7.9427 8.5135 8.5135 9.0707 9.0707 9.1393 9.1400 12.5925 12.5925 13.8276 13.8276 13.8834 13.8996 14.1658 14.1811 14.1811 14.1828 k = 0.0000 0.0000 0.0721 ( 2877 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.9047 -3.9047 -3.5436 -3.5435 -3.2792 -3.2792 -2.7218 -2.7218 -2.6890 -2.6890 -2.5792 -2.5792 -1.9079 -1.9079 3.1224 3.1224 6.1195 6.1195 7.9409 7.9414 7.9439 7.9439 8.6909 8.6909 9.0692 9.0692 9.1377 9.1385 12.5332 12.5332 13.8235 13.8235 13.8791 13.8963 14.1726 14.1892 14.1892 14.1906 k = 0.0000 0.0000 0.0824 ( 2889 PWs) bands (ev): -43.4055 -43.4055 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8912 -3.8912 -3.5436 -3.5436 -3.2891 -3.2891 -2.7218 -2.7218 -2.7112 -2.7112 -2.5794 -2.5794 -1.8922 -1.8922 3.1733 3.1733 5.9618 5.9618 7.9418 7.9422 7.9450 7.9450 8.8701 8.8701 9.0677 9.0677 9.1359 9.1368 12.4647 12.4647 13.8191 13.8191 13.8750 13.8927 14.1800 14.1978 14.1978 14.1986 k = 0.0000 0.0000 0.0927 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8761 -3.8761 -3.5435 -3.5435 -3.3006 -3.3006 -2.7333 -2.7333 -2.7217 -2.7217 -2.5793 -2.5793 -1.8766 -1.8766 3.2305 3.2305 5.8058 5.8058 7.9427 7.9431 7.9461 7.9461 9.0462 9.0462 9.0706 9.0706 9.1342 9.1351 12.3869 12.3869 13.8147 13.8147 13.8711 13.8887 14.1880 14.2066 14.2067 14.2067 k = 0.0000 0.0000 0.1030 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8596 -3.8596 -3.5435 -3.5435 -3.3136 -3.3136 -2.7547 -2.7547 -2.7217 -2.7217 -2.5793 -2.5793 -1.8615 -1.8615 3.2939 3.2939 5.6517 5.6517 7.9436 7.9441 7.9472 7.9472 9.0629 9.0629 9.1323 9.1332 9.2335 9.2335 12.2998 12.2998 13.8104 13.8104 13.8674 13.8847 14.1962 14.2144 14.2156 14.2156 k = 0.0000 0.0000 0.1133 ( 2872 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8419 -3.8419 -3.5435 -3.5434 -3.3283 -3.3283 -2.7749 -2.7749 -2.7216 -2.7216 -2.5792 -2.5792 -1.8472 -1.8472 3.3632 3.3632 5.5002 5.5002 7.9446 7.9450 7.9483 7.9483 9.0614 9.0614 9.1305 9.1314 9.4148 9.4148 12.2037 12.2037 13.8063 13.8063 13.8642 13.8807 14.2044 14.2218 14.2243 14.2243 k = 0.0000 0.0000 0.1236 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8233 -3.8233 -3.5435 -3.5435 -3.3445 -3.3445 -2.7937 -2.7937 -2.7216 -2.7216 -2.5793 -2.5793 -1.8339 -1.8339 3.4383 3.4383 5.3514 5.3514 7.9455 7.9459 7.9493 7.9493 9.0596 9.0596 9.1287 9.1296 9.5960 9.5960 12.0987 12.0987 13.8024 13.8024 13.8613 13.8767 14.2125 14.2288 14.2327 14.2327 k = 0.0000 0.0000 0.1339 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.8038 -3.8038 -3.5435 -3.5435 -3.3619 -3.3619 -2.8106 -2.8106 -2.7216 -2.7216 -2.5793 -2.5793 -1.8218 -1.8218 3.5187 3.5187 5.2058 5.2058 7.9463 7.9468 7.9502 7.9502 9.0579 9.0579 9.1271 9.1279 9.7765 9.7765 11.9853 11.9853 13.7988 13.7988 13.8588 13.8728 14.2202 14.2351 14.2405 14.2405 k = 0.0000 0.0000 0.1442 ( 2878 PWs) bands (ev): -43.4054 -43.4054 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7841 -3.7841 -3.5435 -3.5435 -3.3801 -3.3801 -2.8254 -2.8254 -2.7216 -2.7216 -2.5793 -2.5793 -1.8111 -1.8111 3.6043 3.6043 5.0639 5.0639 7.9472 7.9475 7.9511 7.9511 9.0564 9.0564 9.1255 9.1263 9.9560 9.9560 11.8639 11.8639 13.7956 13.7956 13.8568 13.8692 14.2274 14.2406 14.2477 14.2477 k = 0.0000 0.0000 0.1545 ( 2872 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7644 -3.7644 -3.5434 -3.5434 -3.3987 -3.3987 -2.8380 -2.8380 -2.7216 -2.7216 -2.5792 -2.5792 -1.8018 -1.8018 3.6944 3.6944 4.9260 4.9260 7.9479 7.9482 7.9519 7.9519 9.0550 9.0550 9.1242 9.1248 10.1339 10.1339 11.7349 11.7349 13.7929 13.7929 13.8553 13.8659 14.2340 14.2453 14.2540 14.2540 k = 0.0000 0.0000 0.1648 ( 2872 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7455 -3.7455 -3.5434 -3.5434 -3.4168 -3.4168 -2.8483 -2.8483 -2.7216 -2.7216 -2.5792 -2.5792 -1.7941 -1.7941 3.7883 3.7883 4.7930 4.7930 7.9485 7.9488 7.9526 7.9526 9.0538 9.0538 9.1230 9.1236 10.3097 10.3097 11.5988 11.5988 13.7905 13.7905 13.8543 13.8629 14.2398 14.2490 14.2594 14.2594 k = 0.0000 0.0000 0.1751 ( 2860 PWs) bands (ev): -43.4052 -43.4052 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7284 -3.7284 -3.5434 -3.5434 -3.4334 -3.4334 -2.8561 -2.8561 -2.7216 -2.7216 -2.5791 -2.5791 -1.7881 -1.7881 3.8844 3.8844 4.6665 4.6665 7.9491 7.9493 7.9531 7.9531 9.0528 9.0528 9.1222 9.1226 10.4828 10.4828 11.4566 11.4566 13.7887 13.7887 13.8537 13.8603 14.2447 14.2517 14.2636 14.2636 k = 0.0000 0.0000 0.1854 ( 2866 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7146 -3.7146 -3.5434 -3.5434 -3.4472 -3.4472 -2.8619 -2.8619 -2.7216 -2.7216 -2.5791 -2.5791 -1.7838 -1.7838 3.9792 3.9792 4.5499 4.5499 7.9495 7.9496 7.9535 7.9535 9.0521 9.0521 9.1215 9.1218 10.6522 10.6522 11.3090 11.3090 13.7874 13.7874 13.8537 13.8581 14.2486 14.2533 14.2667 14.2667 k = 0.0000 0.0000 0.1957 ( 2872 PWs) bands (ev): -43.4053 -43.4053 -20.9575 -20.9575 -18.9390 -18.9390 -18.7792 -18.7792 -3.7053 -3.7053 -3.5434 -3.5434 -3.4564 -3.4564 -2.8653 -2.8653 -2.7216 -2.7216 -2.5792 -2.5792 -1.7811 -1.7811 4.0622 4.0622 4.4539 4.4539 7.9497 7.9498 7.9537 7.9537 9.0517 9.0517 9.1211 9.1213 10.8150 10.8150 11.1592 11.1592 13.7866 13.7866 13.8541 13.8563 14.2514 14.2538 14.2686 14.2686 k = 0.0000 0.0000 0.2060 ( 2890 PWs) bands (ev): -43.4055 -43.4055 -20.9576 -20.9576 -18.9390 -18.9390 -18.7792 -18.7792 -3.7021 -3.7021 -3.5435 -3.5435 -3.4597 -3.4597 -2.8667 -2.8667 -2.7216 -2.7216 -2.5794 -2.5794 -1.7803 -1.7803 4.1011 4.1011 4.4107 4.4107 7.9498 7.9498 7.9538 7.9538 9.0515 9.0515 9.1210 9.1210 10.9308 10.9308 11.0478 11.0478 13.7863 13.7863 13.8549 13.8549 14.2532 14.2532 14.2692 14.2692 k = 0.0000 0.0000 0.2060 ( 2890 PWs) bands (ev): -43.4055 -43.4055 -20.9576 -20.9576 -18.9390 -18.9390 -18.7792 -18.7792 -3.7021 -3.7021 -3.5435 -3.5435 -3.4597 -3.4597 -2.8667 -2.8667 -2.7216 -2.7216 -2.5794 -2.5794 -1.7803 -1.7803 4.1011 4.1011 4.4107 4.4107 7.9498 7.9498 7.9538 7.9538 9.0515 9.0515 9.1210 9.1210 10.9308 10.9308 11.0478 11.0478 13.7863 13.7863 13.8549 13.8549 14.2532 14.2532 14.2692 14.2692 k = 0.0091 0.0052 0.2060 ( 2880 PWs) bands (ev): -43.4054 -43.4054 -20.9576 -20.9576 -18.9391 -18.9391 -18.7794 -18.7794 -3.7020 -3.7020 -3.5434 -3.5434 -3.4586 -3.4586 -2.8666 -2.8666 -2.7215 -2.7215 -2.5793 -2.5793 -1.7799 -1.7799 4.1021 4.1021 4.4119 4.4119 7.9480 7.9480 7.9538 7.9538 9.0491 9.0491 9.1186 9.1186 10.9311 10.9311 11.0483 11.0483 13.7875 13.7875 13.8560 13.8560 14.2483 14.2483 14.2657 14.2657 k = 0.0182 0.0105 0.2060 ( 2878 PWs) bands (ev): -43.4053 -43.4053 -20.9579 -20.9579 -18.9392 -18.9392 -18.7802 -18.7802 -3.7017 -3.7017 -3.5432 -3.5432 -3.4553 -3.4553 -2.8665 -2.8665 -2.7213 -2.7213 -2.5795 -2.5795 -1.7788 -1.7788 4.1050 4.1050 4.4155 4.4155 7.9399 7.9399 7.9565 7.9565 9.0420 9.0420 9.1113 9.1113 10.9321 10.9321 11.0495 11.0495 13.7905 13.7905 13.8595 13.8595 14.2295 14.2295 14.2594 14.2594 k = 0.0273 0.0157 0.2060 ( 2880 PWs) bands (ev): -43.4051 -43.4051 -20.9584 -20.9584 -18.9393 -18.9393 -18.7814 -18.7814 -3.7014 -3.7014 -3.5430 -3.5430 -3.4499 -3.4499 -2.8665 -2.8665 -2.7209 -2.7209 -2.5797 -2.5797 -1.7770 -1.7770 4.1098 4.1098 4.4214 4.4214 7.9256 7.9256 7.9617 7.9617 9.0300 9.0300 9.0993 9.0993 10.9335 10.9335 11.0514 11.0514 13.7946 13.7946 13.8664 13.8664 14.1961 14.1961 14.2529 14.2529 k = 0.0364 0.0210 0.2060 ( 2886 PWs) bands (ev): -43.4050 -43.4050 -20.9591 -20.9591 -18.9396 -18.9396 -18.7832 -18.7832 -3.7009 -3.7009 -3.5428 -3.5428 -3.4422 -3.4422 -2.8665 -2.8665 -2.7203 -2.7203 -2.5802 -2.5802 -1.7744 -1.7744 4.1166 4.1166 4.4297 4.4297 7.9057 7.9057 7.9691 7.9691 9.0131 9.0131 9.0831 9.0831 10.9352 10.9352 11.0541 11.0541 13.7986 13.7986 13.8779 13.8779 14.1510 14.1510 14.2451 14.2451 k = 0.0455 0.0262 0.2060 ( 2894 PWs) bands (ev): -43.4047 -43.4047 -20.9599 -20.9599 -18.9400 -18.9400 -18.7854 -18.7854 -3.7002 -3.7002 -3.5424 -3.5424 -3.4325 -3.4325 -2.8666 -2.8666 -2.7195 -2.7195 -2.5808 -2.5808 -1.7711 -1.7711 4.1254 4.1254 4.4403 4.4403 7.8804 7.8804 7.9787 7.9787 8.9913 8.9913 9.0630 9.0630 10.9367 10.9367 11.0573 11.0573 13.8019 13.8019 13.8946 13.8946 14.0972 14.0972 14.2356 14.2356 k = 0.0545 0.0315 0.2060 ( 2890 PWs) bands (ev): -43.4043 -43.4043 -20.9609 -20.9609 -18.9404 -18.9404 -18.7880 -18.7880 -3.6994 -3.6994 -3.5418 -3.5418 -3.4206 -3.4206 -2.8665 -2.8665 -2.7186 -2.7186 -2.5814 -2.5814 -1.7671 -1.7671 4.1361 4.1361 4.4532 4.4532 7.8501 7.8501 7.9903 7.9903 8.9647 8.9647 9.0395 9.0395 10.9376 10.9376 11.0610 11.0610 13.8047 13.8047 13.9156 13.9156 14.0378 14.0378 14.2244 14.2244 k = 0.0636 0.0367 0.2060 ( 2892 PWs) bands (ev): -43.4039 -43.4039 -20.9622 -20.9622 -18.9409 -18.9409 -18.7911 -18.7911 -3.6985 -3.6985 -3.5411 -3.5411 -3.4067 -3.4067 -2.8665 -2.8665 -2.7174 -2.7174 -2.5821 -2.5821 -1.7624 -1.7624 4.1488 4.1488 4.4683 4.4683 7.8150 7.8150 8.0040 8.0040 8.9331 8.9331 9.0131 9.0131 10.9377 10.9377 11.0649 11.0649 13.8074 13.8074 13.9309 13.9309 13.9845 13.9845 14.2116 14.2116 k = 0.0727 0.0420 0.2060 ( 2900 PWs) bands (ev): -43.4035 -43.4035 -20.9636 -20.9636 -18.9415 -18.9415 -18.7947 -18.7947 -3.6974 -3.6974 -3.5405 -3.5405 -3.3907 -3.3907 -2.8665 -2.8665 -2.7162 -2.7162 -2.5830 -2.5830 -1.7570 -1.7570 4.1634 4.1634 4.4855 4.4855 7.7754 7.7754 8.0197 8.0197 8.8970 8.8970 8.9840 8.9840 10.9364 10.9364 11.0689 11.0689 13.8094 13.8094 13.8903 13.8903 13.9898 13.9898 14.1975 14.1975 k = 0.0818 0.0472 0.2060 ( 2898 PWs) bands (ev): -43.4030 -43.4030 -20.9651 -20.9651 -18.9422 -18.9422 -18.7986 -18.7986 -3.6962 -3.6962 -3.5396 -3.5396 -3.3728 -3.3728 -2.8665 -2.8665 -2.7148 -2.7148 -2.5838 -2.5838 -1.7509 -1.7509 4.1800 4.1800 4.5049 4.5049 7.7318 7.7318 8.0373 8.0373 8.8567 8.8567 8.9526 8.9526 10.9333 10.9333 11.0728 11.0728 13.7968 13.7968 13.8400 13.8400 14.0230 14.0230 14.1824 14.1824 k = 0.0909 0.0525 0.2060 ( 2898 PWs) bands (ev): -43.4023 -43.4023 -20.9669 -20.9669 -18.9431 -18.9431 -18.8028 -18.8028 -3.6949 -3.6949 -3.5386 -3.5386 -3.3529 -3.3529 -2.8664 -2.8664 -2.7132 -2.7132 -2.5847 -2.5847 -1.7441 -1.7441 4.1985 4.1985 4.5262 4.5262 7.6845 7.6845 8.0568 8.0568 8.8124 8.8124 8.9191 8.9191 10.9282 10.9282 11.0762 11.0762 13.7365 13.7365 13.8365 13.8365 14.0615 14.0615 14.1671 14.1671 k = 0.1000 0.0577 0.2060 ( 2886 PWs) bands (ev): -43.4015 -43.4015 -20.9688 -20.9688 -18.9441 -18.9441 -18.8074 -18.8074 -3.6934 -3.6934 -3.5375 -3.5375 -3.3312 -3.3312 -2.8662 -2.8662 -2.7113 -2.7113 -2.5856 -2.5856 -1.7367 -1.7367 4.2190 4.2190 4.5494 4.5494 7.6338 7.6338 8.0782 8.0782 8.7646 8.7646 8.8836 8.8836 10.9208 10.9208 11.0789 11.0789 13.6648 13.6648 13.8470 13.8470 14.0994 14.0994 14.1554 14.1554 k = 0.1091 0.0630 0.2060 ( 2890 PWs) bands (ev): -43.4009 -43.4009 -20.9709 -20.9709 -18.9452 -18.9452 -18.8123 -18.8123 -3.6918 -3.6918 -3.5364 -3.5364 -3.3077 -3.3077 -2.8660 -2.8660 -2.7095 -2.7095 -2.5866 -2.5866 -1.7287 -1.7287 4.2415 4.2415 4.5744 4.5744 7.5802 7.5802 8.1012 8.1012 8.7138 8.7138 8.8464 8.8464 10.9108 10.9108 11.0804 11.0804 13.5927 13.5927 13.8623 13.8623 14.1136 14.1136 14.1697 14.1697 k = 0.1182 0.0682 0.2060 ( 2888 PWs) bands (ev): -43.4001 -43.4001 -20.9731 -20.9731 -18.9465 -18.9465 -18.8174 -18.8174 -3.6901 -3.6901 -3.5353 -3.5353 -3.2824 -3.2824 -2.8657 -2.8657 -2.7076 -2.7076 -2.5876 -2.5876 -1.7201 -1.7201 4.2659 4.2659 4.6010 4.6010 7.5242 7.5242 8.1260 8.1260 8.6602 8.6602 8.8075 8.8075 10.8984 10.8984 11.0805 11.0805 13.5221 13.5221 13.8818 13.8818 14.1009 14.1009 14.2130 14.2130 k = 0.1273 0.0735 0.2060 ( 2896 PWs) bands (ev): -43.3993 -43.3993 -20.9756 -20.9756 -18.9480 -18.9480 -18.8227 -18.8227 -3.6884 -3.6884 -3.5342 -3.5342 -3.2555 -3.2555 -2.8655 -2.8655 -2.7056 -2.7056 -2.5887 -2.5887 -1.7109 -1.7109 4.2923 4.2923 4.6292 4.6292 7.4660 7.4660 8.1524 8.1524 8.6042 8.6042 8.7672 8.7672 10.8832 10.8832 11.0787 11.0787 13.4543 13.4543 13.9053 13.9053 14.0832 14.0832 14.2632 14.2632 k = 0.1364 0.0787 0.2060 ( 2904 PWs) bands (ev): -43.3985 -43.3985 -20.9781 -20.9781 -18.9497 -18.9497 -18.8281 -18.8281 -3.6867 -3.6867 -3.5330 -3.5330 -3.2270 -3.2270 -2.8651 -2.8651 -2.7036 -2.7036 -2.5897 -2.5897 -1.7011 -1.7011 4.3207 4.3207 4.6588 4.6588 7.4060 7.4060 8.1802 8.1802 8.5462 8.5462 8.7257 8.7257 10.8656 10.8656 11.0746 11.0746 13.3904 13.3904 13.9325 13.9325 14.0645 14.0645 14.3163 14.3163 k = 0.1455 0.0840 0.2060 ( 2906 PWs) bands (ev): -43.3976 -43.3976 -20.9809 -20.9809 -18.9516 -18.9516 -18.8336 -18.8336 -3.6848 -3.6848 -3.5318 -3.5318 -3.1971 -3.1971 -2.8645 -2.8645 -2.7015 -2.7015 -2.5905 -2.5905 -1.6909 -1.6909 4.3511 4.3511 4.6895 4.6895 7.3448 7.3448 8.2094 8.2094 8.4865 8.4865 8.6832 8.6832 10.8455 10.8455 11.0677 11.0677 13.3311 13.3311 13.9625 13.9625 14.0466 14.0466 14.3711 14.3711 k = 0.1545 0.0892 0.2060 ( 2906 PWs) bands (ev): -43.3967 -43.3967 -20.9837 -20.9837 -18.9539 -18.9539 -18.8391 -18.8391 -3.6829 -3.6829 -3.5305 -3.5305 -3.1658 -3.1658 -2.8637 -2.8637 -2.6993 -2.6993 -2.5913 -2.5913 -1.6801 -1.6801 4.3833 4.3833 4.7213 4.7213 7.2825 7.2825 8.2398 8.2398 8.4254 8.4254 8.6398 8.6398 10.8233 10.8233 11.0578 11.0578 13.2774 13.2774 13.9908 13.9908 14.0343 14.0343 14.4271 14.4271 k = 0.1636 0.0945 0.2060 ( 2910 PWs) bands (ev): -43.3957 -43.3957 -20.9867 -20.9867 -18.9564 -18.9564 -18.8446 -18.8446 -3.6809 -3.6809 -3.5292 -3.5292 -3.1334 -3.1334 -2.8628 -2.8628 -2.6971 -2.6971 -2.5920 -2.5920 -1.6688 -1.6688 4.4176 4.4176 4.7540 4.7540 7.2196 7.2196 8.2708 8.2708 8.3637 8.3637 8.5958 8.5958 10.7992 10.7992 11.0445 11.0445 13.2300 13.2300 13.9945 13.9945 14.0502 14.0502 14.4838 14.4838 k = 0.1727 0.0997 0.2060 ( 2912 PWs) bands (ev): -43.3947 -43.3947 -20.9898 -20.9898 -18.9593 -18.9593 -18.8499 -18.8499 -3.6789 -3.6789 -3.5279 -3.5279 -3.1000 -3.1000 -2.8614 -2.8614 -2.6949 -2.6949 -2.5925 -2.5925 -1.6571 -1.6571 4.4537 4.4537 4.7873 4.7873 7.1565 7.1565 8.2886 8.2886 8.3152 8.3152 8.5514 8.5514 10.7734 10.7734 11.0276 11.0276 13.1894 13.1894 13.9800 13.9800 14.0880 14.0880 14.5407 14.5407 k = 0.1818 0.1050 0.2060 ( 2916 PWs) bands (ev): -43.3937 -43.3937 -20.9931 -20.9931 -18.9626 -18.9626 -18.8551 -18.8551 -3.6769 -3.6769 -3.5266 -3.5266 -3.0660 -3.0660 -2.8595 -2.8595 -2.6928 -2.6928 -2.5927 -2.5927 -1.6451 -1.6451 4.4917 4.4917 4.8209 4.8209 7.0934 7.0934 8.2324 8.2324 8.3409 8.3409 8.5067 8.5067 10.7462 10.7462 11.0069 11.0069 13.1560 13.1560 13.9633 13.9633 14.1313 14.1313 14.5977 14.5977 k = 0.1909 0.1102 0.2060 ( 2912 PWs) bands (ev): -43.3926 -43.3926 -20.9964 -20.9964 -18.9663 -18.9663 -18.8600 -18.8600 -3.6749 -3.6749 -3.5253 -3.5253 -3.0317 -3.0317 -2.8567 -2.8567 -2.6907 -2.6907 -2.5926 -2.5926 -1.6326 -1.6326 4.5316 4.5316 4.8548 4.8548 7.0306 7.0306 8.1682 8.1682 8.3744 8.3744 8.4624 8.4624 10.7180 10.7180 10.9824 10.9824 13.1303 13.1303 13.9467 13.9467 14.1773 14.1773 14.6542 14.6542 k = 0.2000 0.1155 0.2060 ( 2916 PWs) bands (ev): -43.3915 -43.3915 -20.9999 -20.9999 -18.9704 -18.9704 -18.8646 -18.8646 -3.6728 -3.6728 -3.5240 -3.5240 -2.9979 -2.9979 -2.8524 -2.8524 -2.6887 -2.6887 -2.5923 -2.5923 -1.6199 -1.6199 4.5733 4.5733 4.8886 4.8886 6.9685 6.9685 8.1032 8.1032 8.4024 8.4024 8.4249 8.4249 10.6890 10.6890 10.9544 10.9544 13.1124 13.1124 13.9309 13.9309 14.2248 14.2248 14.7099 14.7099 k = 0.2091 0.1207 0.2060 ( 2908 PWs) bands (ev): -43.3903 -43.3903 -21.0034 -21.0034 -18.9749 -18.9749 -18.8689 -18.8689 -3.6707 -3.6707 -3.5227 -3.5227 -2.9659 -2.9659 -2.8455 -2.8455 -2.6868 -2.6868 -2.5916 -2.5916 -1.6068 -1.6068 4.6168 4.6168 4.9220 4.9220 6.9074 6.9074 8.0380 8.0380 8.3696 8.3696 8.4490 8.4490 10.6596 10.6596 10.9230 10.9230 13.1024 13.1024 13.9164 13.9164 14.2729 14.2729 14.7646 14.7646 k = 0.2182 0.1260 0.2060 ( 2912 PWs) bands (ev): -43.3892 -43.3892 -21.0071 -21.0071 -18.9799 -18.9799 -18.8728 -18.8728 -3.6687 -3.6687 -3.5216 -3.5216 -2.9378 -2.9378 -2.8341 -2.8341 -2.6850 -2.6850 -2.5904 -2.5904 -1.5935 -1.5935 4.6621 4.6621 4.9548 4.9548 6.8475 6.8475 7.9728 7.9728 8.3259 8.3259 8.4849 8.4849 10.6299 10.6299 10.8887 10.8887 13.0999 13.0999 13.9031 13.9031 14.3204 14.3204 14.8180 14.8180 k = 0.2273 0.1312 0.2060 ( 2916 PWs) bands (ev): -43.3880 -43.3880 -21.0108 -21.0108 -18.9853 -18.9853 -18.8764 -18.8764 -3.6668 -3.6668 -3.5205 -3.5205 -2.9163 -2.9163 -2.8158 -2.8158 -2.6831 -2.6831 -2.5888 -2.5888 -1.5800 -1.5800 4.7090 4.7090 4.9866 4.9866 6.7892 6.7892 7.9079 7.9079 8.2821 8.2821 8.5218 8.5218 10.6002 10.6002 10.8521 10.8521 13.1048 13.1048 13.8914 13.8914 14.3659 14.3659 14.8697 14.8697 k = 0.2364 0.1365 0.2060 ( 2918 PWs) bands (ev): -43.3869 -43.3869 -21.0145 -21.0145 -18.9911 -18.9911 -18.8795 -18.8795 -3.6648 -3.6648 -3.5194 -3.5194 -2.9020 -2.9020 -2.7904 -2.7904 -2.6808 -2.6808 -2.5865 -2.5865 -1.5664 -1.5664 4.7574 4.7574 5.0172 5.0172 6.7325 6.7325 7.8435 7.8435 8.2386 8.2386 8.5590 8.5590 10.5708 10.5708 10.8137 10.8137 13.1167 13.1167 13.8813 13.8813 14.4075 14.4075 14.9195 14.9195 k = 0.2455 0.1417 0.2060 ( 2918 PWs) bands (ev): -43.3857 -43.3857 -21.0184 -21.0184 -18.9972 -18.9972 -18.8823 -18.8823 -3.6629 -3.6629 -3.5183 -3.5183 -2.8933 -2.8933 -2.7606 -2.7606 -2.6775 -2.6775 -2.5835 -2.5835 -1.5526 -1.5526 4.8074 4.8074 5.0463 5.0463 6.6779 6.6779 7.7798 7.7798 8.1958 8.1958 8.5963 8.5963 10.5417 10.5417 10.7742 10.7742 13.1352 13.1352 13.8729 13.8729 14.4426 14.4426 14.9670 14.9670 k = 0.2545 0.1470 0.2060 ( 2914 PWs) bands (ev): -43.3845 -43.3845 -21.0222 -21.0222 -19.0036 -19.0036 -18.8848 -18.8848 -3.6610 -3.6610 -3.5173 -3.5173 -2.8878 -2.8878 -2.7313 -2.7313 -2.6710 -2.6710 -2.5793 -2.5793 -1.5388 -1.5388 4.8588 4.8588 5.0735 5.0735 6.6254 6.6254 7.7171 7.7171 8.1537 8.1537 8.6337 8.6337 10.5133 10.5133 10.7343 10.7343 13.1598 13.1598 13.8664 13.8664 14.4672 14.4672 15.0122 15.0122 k = 0.2636 0.1522 0.2060 ( 2914 PWs) bands (ev): -43.3833 -43.3833 -21.0261 -21.0261 -19.0103 -19.0103 -18.8869 -18.8869 -3.6592 -3.6592 -3.5163 -3.5163 -2.8842 -2.8842 -2.7096 -2.7096 -2.6565 -2.6565 -2.5734 -2.5734 -1.5250 -1.5250 4.9115 4.9115 5.0987 5.0987 6.5754 6.5754 7.6556 7.6556 8.1124 8.1124 8.6708 8.6708 10.4856 10.4856 10.6946 10.6946 13.1901 13.1901 13.8619 13.8619 14.4758 14.4758 15.0546 15.0546 k = 0.2727 0.1575 0.2060 ( 2914 PWs) bands (ev): -43.3821 -43.3821 -21.0300 -21.0300 -19.0171 -19.0171 -18.8888 -18.8888 -3.6575 -3.6575 -3.5155 -3.5155 -2.8815 -2.8815 -2.6994 -2.6994 -2.6330 -2.6330 -2.5638 -2.5638 -1.5112 -1.5112 4.9652 4.9652 5.1215 5.1215 6.5279 6.5279 7.5954 7.5954 8.0721 8.0721 8.7076 8.7076 10.4586 10.4586 10.6558 10.6558 13.2254 13.2254 13.8592 13.8592 14.4611 14.4611 15.0941 15.0941 k = 0.2818 0.1627 0.2060 ( 2918 PWs) bands (ev): -43.3810 -43.3810 -21.0338 -21.0338 -19.0241 -19.0241 -18.8904 -18.8904 -3.6558 -3.6558 -3.5147 -3.5147 -2.8794 -2.8794 -2.6956 -2.6956 -2.6101 -2.6101 -2.5467 -2.5467 -1.4974 -1.4974 5.0199 5.0199 5.1417 5.1417 6.4831 6.4831 7.5368 7.5368 8.0328 8.0328 8.7439 8.7439 10.4326 10.4326 10.6185 10.6185 13.2654 13.2654 13.8586 13.8586 14.4162 14.4162 15.1304 15.1304 k = 0.2909 0.1680 0.2060 ( 2922 PWs) bands (ev): -43.3799 -43.3799 -21.0377 -21.0377 -19.0311 -19.0311 -18.8918 -18.8918 -3.6542 -3.6542 -3.5141 -3.5141 -2.8777 -2.8777 -2.6942 -2.6942 -2.5945 -2.5945 -2.5193 -2.5193 -1.4838 -1.4838 5.0752 5.0752 5.1592 5.1592 6.4410 6.4410 7.4801 7.4801 7.9947 7.9947 8.7796 8.7796 10.4075 10.4075 10.5832 10.5832 13.3095 13.3095 13.8599 13.8599 14.3380 14.3380 15.1633 15.1633 k = 0.3000 0.1732 0.2060 ( 2926 PWs) bands (ev): -43.3788 -43.3788 -21.0416 -21.0416 -19.0381 -19.0381 -18.8930 -18.8930 -3.6527 -3.6527 -3.5134 -3.5134 -2.8762 -2.8762 -2.6939 -2.6939 -2.5850 -2.5850 -2.4849 -2.4849 -1.4704 -1.4704 5.1306 5.1306 5.1743 5.1743 6.4019 6.4019 7.4255 7.4255 7.9577 7.9577 8.8145 8.8145 10.3835 10.3835 10.5505 10.5505 13.3573 13.3573 13.8631 13.8631 14.2305 14.2305 15.1931 15.1931 k = 0.3091 0.1785 0.2060 ( 2920 PWs) bands (ev): -43.3776 -43.3776 -21.0453 -21.0453 -19.0451 -19.0451 -18.8940 -18.8940 -3.6512 -3.6512 -3.5128 -3.5128 -2.8749 -2.8749 -2.6942 -2.6942 -2.5782 -2.5782 -2.4473 -2.4473 -1.4571 -1.4571 5.1780 5.1780 5.1947 5.1947 6.3656 6.3656 7.3731 7.3731 7.9219 7.9219 8.8486 8.8486 10.3604 10.3604 10.5206 10.5206 13.4083 13.4083 13.8681 13.8681 14.1018 14.1018 15.2207 15.2207 k = 0.3182 0.1837 0.2060 ( 2912 PWs) bands (ev): -43.3764 -43.3764 -21.0491 -21.0491 -19.0520 -19.0520 -18.8948 -18.8948 -3.6498 -3.6498 -3.5121 -3.5121 -2.8736 -2.8736 -2.6947 -2.6947 -2.5725 -2.5725 -2.4086 -2.4086 -1.4441 -1.4441 5.1911 5.1911 5.2464 5.2464 6.3321 6.3321 7.3233 7.3233 7.8875 7.8875 8.8818 8.8818 10.3383 10.3383 10.4939 10.4939 13.4620 13.4620 13.8732 13.8732 13.9617 13.9617 15.2469 15.2469 k = 0.3273 0.1890 0.2060 ( 2910 PWs) bands (ev): -43.3753 -43.3753 -21.0527 -21.0527 -19.0588 -19.0588 -18.8955 -18.8955 -3.6485 -3.6485 -3.5117 -3.5117 -2.8725 -2.8725 -2.6955 -2.6955 -2.5674 -2.5674 -2.3697 -2.3697 -1.4314 -1.4314 5.1970 5.1970 5.3022 5.3022 6.3013 6.3013 7.2763 7.2763 7.8544 7.8544 8.9138 8.9138 10.3173 10.3173 10.4707 10.4707 13.5172 13.5172 13.8056 13.8056 13.8900 13.8900 15.2720 15.2720 k = 0.3364 0.1942 0.2060 ( 2914 PWs) bands (ev): -43.3743 -43.3743 -21.0563 -21.0563 -19.0655 -19.0655 -18.8961 -18.8961 -3.6473 -3.6473 -3.5113 -3.5113 -2.8714 -2.8714 -2.6966 -2.6966 -2.5628 -2.5628 -2.3312 -2.3312 -1.4191 -1.4191 5.1997 5.1997 5.3577 5.3577 6.2732 6.2732 7.2324 7.2324 7.8227 7.8227 8.9446 8.9446 10.2972 10.2972 10.4511 10.4511 13.5672 13.5672 13.6641 13.6641 13.8985 13.8985 15.2954 15.2954 k = 0.3455 0.1994 0.2060 ( 2920 PWs) bands (ev): -43.3734 -43.3734 -21.0598 -21.0598 -19.0719 -19.0719 -18.8966 -18.8966 -3.6462 -3.6462 -3.5110 -3.5110 -2.8704 -2.8704 -2.6977 -2.6977 -2.5584 -2.5584 -2.2933 -2.2933 -1.4071 -1.4071 5.1998 5.1998 5.4124 5.4124 6.2474 6.2474 7.1918 7.1918 7.7925 7.7925 8.9742 8.9742 10.2780 10.2780 10.4351 10.4351 13.4917 13.4917 13.6478 13.6478 13.9107 13.9107 15.3164 15.3164 k = 0.3545 0.2047 0.2060 ( 2924 PWs) bands (ev): -43.3724 -43.3724 -21.0632 -21.0632 -19.0782 -19.0782 -18.8971 -18.8971 -3.6452 -3.6452 -3.5107 -3.5107 -2.8695 -2.8695 -2.6989 -2.6989 -2.5542 -2.5542 -2.2563 -2.2563 -1.3956 -1.3956 5.1975 5.1975 5.4658 5.4658 6.2238 6.2238 7.1547 7.1547 7.7638 7.7638 9.0023 9.0023 10.2597 10.2597 10.4228 10.4228 13.3453 13.3453 13.7056 13.7056 13.9250 13.9250 15.3349 15.3349 k = 0.3636 0.2099 0.2060 ( 2926 PWs) bands (ev): -43.3715 -43.3715 -21.0664 -21.0664 -19.0841 -19.0841 -18.8974 -18.8974 -3.6443 -3.6443 -3.5104 -3.5104 -2.8685 -2.8685 -2.7001 -2.7001 -2.5502 -2.5502 -2.2205 -2.2205 -1.3845 -1.3845 5.1932 5.1932 5.5174 5.5174 6.2023 6.2023 7.1214 7.1214 7.7367 7.7367 9.0290 9.0290 10.2423 10.2423 10.4139 10.4139 13.1993 13.1993 13.7672 13.7672 13.9410 13.9410 15.3509 15.3509 k = 0.3727 0.2152 0.2060 ( 2920 PWs) bands (ev): -43.3706 -43.3706 -21.0695 -21.0695 -19.0898 -19.0898 -18.8977 -18.8977 -3.6433 -3.6433 -3.5101 -3.5101 -2.8676 -2.8676 -2.7012 -2.7012 -2.5463 -2.5463 -2.1860 -2.1860 -1.3740 -1.3740 5.1872 5.1872 5.5668 5.5668 6.1825 6.1825 7.0920 7.0920 7.7112 7.7112 9.0543 9.0543 10.2258 10.2258 10.4084 10.4084 13.0574 13.0574 13.8292 13.8292 13.9593 13.9593 15.3645 15.3645 k = 0.3818 0.2204 0.2060 ( 2920 PWs) bands (ev): -43.3698 -43.3698 -21.0725 -21.0725 -19.0952 -19.0952 -18.8979 -18.8979 -3.6425 -3.6425 -3.5099 -3.5099 -2.8667 -2.8667 -2.7024 -2.7024 -2.5425 -2.5425 -2.1531 -2.1531 -1.3640 -1.3640 5.1799 5.1799 5.6135 5.6135 6.1644 6.1644 7.0668 7.0668 7.6873 7.6873 9.0779 9.0779 10.2099 10.2099 10.4060 10.4060 12.9210 12.9210 13.8892 13.8892 13.9811 13.9811 15.3760 15.3760 k = 0.3909 0.2257 0.2060 ( 2916 PWs) bands (ev): -43.3689 -43.3689 -21.0753 -21.0753 -19.1003 -19.1003 -18.8981 -18.8981 -3.6418 -3.6418 -3.5098 -3.5098 -2.8658 -2.8658 -2.7035 -2.7035 -2.5390 -2.5390 -2.1219 -2.1219 -1.3546 -1.3546 5.1717 5.1717 5.6572 5.6572 6.1478 6.1478 7.0457 7.0457 7.6650 7.6650 9.0999 9.0999 10.1949 10.1949 10.4063 10.4063 12.7912 12.7912 13.9415 13.9415 14.0114 14.0114 15.3856 15.3856 k = 0.4000 0.2309 0.2060 ( 2920 PWs) bands (ev): -43.3683 -43.3683 -21.0779 -21.0779 -19.1050 -19.1050 -18.8982 -18.8982 -3.6411 -3.6411 -3.5097 -3.5097 -2.8650 -2.8650 -2.7046 -2.7046 -2.5357 -2.5357 -2.0926 -2.0926 -1.3458 -1.3458 5.1629 5.1629 5.6975 5.6975 6.1325 6.1325 7.0289 7.0289 7.6444 7.6444 9.1203 9.1203 10.1806 10.1806 10.4089 10.4089 12.6686 12.6686 13.9785 13.9785 14.0571 14.0571 15.3934 15.3934 k = 0.4091 0.2362 0.2060 ( 2920 PWs) bands (ev): -43.3676 -43.3676 -21.0803 -21.0803 -19.1094 -19.1094 -18.8984 -18.8984 -3.6405 -3.6405 -3.5096 -3.5096 -2.8643 -2.8643 -2.7057 -2.7057 -2.5327 -2.5327 -2.0653 -2.0653 -1.3376 -1.3376 5.1538 5.1538 5.7339 5.7339 6.1186 6.1186 7.0162 7.0162 7.6256 7.6256 9.1390 9.1390 10.1670 10.1670 10.4135 10.4135 12.5540 12.5540 14.0036 14.0036 14.1141 14.1141 15.3998 15.3998 k = 0.4182 0.2414 0.2060 ( 2920 PWs) bands (ev): -43.3670 -43.3670 -21.0825 -21.0825 -19.1134 -19.1134 -18.8984 -18.8984 -3.6399 -3.6399 -3.5095 -3.5095 -2.8636 -2.8636 -2.7066 -2.7066 -2.5298 -2.5298 -2.0401 -2.0401 -1.3301 -1.3301 5.1448 5.1448 5.7664 5.7664 6.1058 6.1058 7.0074 7.0074 7.6084 7.6084 9.1559 9.1559 10.1541 10.1541 10.4196 10.4196 12.4482 12.4482 14.0237 14.0237 14.1746 14.1746 15.4050 15.4050 k = 0.4273 0.2467 0.2060 ( 2916 PWs) bands (ev): -43.3664 -43.3664 -21.0845 -21.0845 -19.1170 -19.1170 -18.8985 -18.8985 -3.6395 -3.6395 -3.5094 -3.5094 -2.8629 -2.8629 -2.7075 -2.7075 -2.5272 -2.5272 -2.0172 -2.0172 -1.3234 -1.3234 5.1360 5.1360 5.7949 5.7949 6.0943 6.0943 7.0022 7.0022 7.5930 7.5930 9.1711 9.1711 10.1421 10.1421 10.4267 10.4267 12.3516 12.3516 14.0412 14.0412 14.2351 14.2351 15.4090 15.4090 k = 0.4364 0.2519 0.2060 ( 2918 PWs) bands (ev): -43.3659 -43.3659 -21.0863 -21.0863 -19.1202 -19.1202 -18.8985 -18.8985 -3.6391 -3.6391 -3.5094 -3.5094 -2.8624 -2.8624 -2.7083 -2.7083 -2.5248 -2.5248 -1.9967 -1.9967 -1.3174 -1.3174 5.1278 5.1278 5.8192 5.8192 6.0840 6.0840 6.9999 6.9999 7.5794 7.5794 9.1846 9.1846 10.1310 10.1310 10.4344 10.4344 12.2650 12.2650 14.0570 14.0570 14.2939 14.2939 15.4120 15.4120 k = 0.4455 0.2572 0.2060 ( 2918 PWs) bands (ev): -43.3655 -43.3655 -21.0879 -21.0879 -19.1231 -19.1231 -18.8986 -18.8986 -3.6387 -3.6387 -3.5094 -3.5094 -2.8619 -2.8619 -2.7090 -2.7090 -2.5228 -2.5228 -1.9786 -1.9786 -1.3121 -1.3121 5.1202 5.1202 5.8395 5.8395 6.0749 6.0749 6.9999 6.9999 7.5676 7.5676 9.1963 9.1963 10.1209 10.1209 10.4422 10.4422 12.1888 12.1888 14.0711 14.0711 14.3495 14.3495 15.4143 15.4143 k = 0.4545 0.2624 0.2060 ( 2914 PWs) bands (ev): -43.3650 -43.3650 -21.0892 -21.0892 -19.1254 -19.1254 -18.8986 -18.8986 -3.6384 -3.6384 -3.5094 -3.5094 -2.8614 -2.8614 -2.7096 -2.7096 -2.5209 -2.5209 -1.9632 -1.9632 -1.3076 -1.3076 5.1136 5.1136 5.8561 5.8561 6.0671 6.0671 7.0017 7.0017 7.5576 7.5576 9.2062 9.2062 10.1120 10.1120 10.4496 10.4496 12.1234 12.1234 14.0834 14.0834 14.4007 14.4007 15.4159 15.4159 k = 0.4636 0.2677 0.2060 ( 2922 PWs) bands (ev): -43.3648 -43.3648 -21.0904 -21.0904 -19.1274 -19.1274 -18.8986 -18.8986 -3.6382 -3.6382 -3.5094 -3.5094 -2.8611 -2.8611 -2.7102 -2.7102 -2.5196 -2.5196 -1.9505 -1.9505 -1.3039 -1.3039 5.1079 5.1079 5.8692 5.8692 6.0607 6.0607 7.0044 7.0044 7.5494 7.5494 9.2143 9.2143 10.1043 10.1043 10.4563 10.4563 12.0694 12.0694 14.0937 14.0937 14.4460 14.4460 15.4170 15.4170 k = 0.4727 0.2729 0.2060 ( 2926 PWs) bands (ev): -43.3646 -43.3646 -21.0912 -21.0912 -19.1290 -19.1290 -18.8986 -18.8986 -3.6380 -3.6380 -3.5095 -3.5095 -2.8608 -2.8608 -2.7106 -2.7106 -2.5185 -2.5185 -1.9406 -1.9406 -1.3010 -1.3010 5.1034 5.1034 5.8790 5.8790 6.0556 6.0556 7.0073 7.0073 7.5430 7.5430 9.2206 9.2206 10.0982 10.0982 10.4618 10.4618 12.0270 12.0270 14.1019 14.1019 14.4838 14.4838 15.4177 15.4177 k = 0.4818 0.2782 0.2060 ( 2928 PWs) bands (ev): -43.3645 -43.3645 -21.0919 -21.0919 -19.1301 -19.1301 -18.8986 -18.8986 -3.6379 -3.6379 -3.5095 -3.5095 -2.8606 -2.8606 -2.7109 -2.7109 -2.5177 -2.5177 -1.9334 -1.9334 -1.2990 -1.2990 5.1002 5.1002 5.8858 5.8858 6.0520 6.0520 7.0099 7.0099 7.5384 7.5384 9.2251 9.2251 10.0937 10.0937 10.4660 10.4660 11.9965 11.9965 14.1079 14.1079 14.5123 14.5123 15.4181 15.4181 k = 0.4909 0.2834 0.2060 ( 2932 PWs) bands (ev): -43.3644 -43.3644 -21.0922 -21.0922 -19.1307 -19.1307 -18.8986 -18.8986 -3.6379 -3.6379 -3.5095 -3.5095 -2.8605 -2.8605 -2.7111 -2.7111 -2.5172 -2.5172 -1.9291 -1.9291 -1.2977 -1.2977 5.0982 5.0982 5.8898 5.8898 6.0498 6.0498 7.0117 7.0117 7.5356 7.5356 9.2278 9.2278 10.0909 10.0909 10.4686 10.4686 11.9782 11.9782 14.1115 14.1115 14.5301 14.5301 15.4183 15.4183 k = 0.5000 0.2887 0.2060 ( 2936 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6379 -3.6379 -3.5096 -3.5096 -2.8605 -2.8605 -2.7112 -2.7112 -2.5171 -2.5171 -1.9276 -1.9276 -1.2973 -1.2973 5.0975 5.0975 5.8911 5.8911 6.0491 6.0491 7.0123 7.0123 7.5347 7.5347 9.2287 9.2287 10.0900 10.0900 10.4695 10.4695 11.9721 11.9721 14.1127 14.1127 14.5362 14.5362 15.4183 15.4183 k = 0.5000 0.2887 0.2060 ( 2936 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6379 -3.6379 -3.5096 -3.5096 -2.8605 -2.8605 -2.7112 -2.7112 -2.5171 -2.5171 -1.9276 -1.9276 -1.2973 -1.2973 5.0975 5.0975 5.8911 5.8911 6.0491 6.0491 7.0123 7.0123 7.5347 7.5347 9.2287 9.2287 10.0900 10.0900 10.4695 10.4695 11.9721 11.9721 14.1127 14.1127 14.5362 14.5362 15.4183 15.4183 k = 0.4948 0.2977 0.2060 ( 2932 PWs) bands (ev): -43.3644 -43.3644 -21.0936 -21.0911 -19.1325 -19.1293 -18.8989 -18.8987 -3.6378 -3.6378 -3.5095 -3.5094 -2.8605 -2.8605 -2.7111 -2.7111 -2.5172 -2.5172 -1.9291 -1.9253 -1.2972 -1.2971 5.0985 5.0998 5.8906 5.8912 6.0486 6.0499 7.0071 7.0118 7.5337 7.5406 9.2175 9.2277 10.0921 10.0925 10.4671 10.4777 11.9703 11.9730 14.1070 14.1148 14.5297 14.5428 15.4084 15.4112 k = 0.4896 0.3067 0.2060 ( 2932 PWs) bands (ev): -43.3644 -43.3644 -21.0949 -21.0899 -19.1341 -19.1275 -18.8994 -18.8991 -3.6376 -3.6376 -3.5092 -3.5092 -2.8604 -2.8604 -2.7109 -2.7109 -2.5177 -2.5177 -1.9296 -1.9221 -1.2967 -1.2965 5.1028 5.1053 5.8898 5.8910 6.0486 6.0511 6.9967 7.0055 7.5375 7.5508 9.1946 9.2145 10.0989 10.0998 10.4705 10.4912 11.9677 11.9732 14.0976 14.1130 14.5234 14.5494 15.3836 15.3871 k = 0.4844 0.3157 0.2060 ( 2920 PWs) bands (ev): -43.3642 -43.3642 -21.0962 -21.0888 -19.1355 -19.1257 -18.9003 -18.8998 -3.6372 -3.6372 -3.5088 -3.5087 -2.8603 -2.8602 -2.7106 -2.7106 -2.5185 -2.5184 -1.9292 -1.9180 -1.2959 -1.2956 5.1103 5.1141 5.8885 5.8903 6.0489 6.0527 6.9818 6.9940 7.5458 7.5648 9.1606 9.1895 10.1104 10.1116 10.4795 10.5095 11.9643 11.9725 14.0849 14.1074 14.5176 14.5559 15.3470 15.3485 k = 0.4792 0.3248 0.2060 ( 2928 PWs) bands (ev): -43.3642 -43.3642 -21.0975 -21.0877 -19.1369 -19.1238 -18.9014 -18.9008 -3.6369 -3.6368 -3.5083 -3.5081 -2.8602 -2.8602 -2.7102 -2.7102 -2.5197 -2.5196 -1.9279 -1.9130 -1.2947 -1.2944 5.1211 5.1262 5.8867 5.8892 6.0496 6.0547 6.9634 6.9782 7.5578 7.5816 9.1166 9.1533 10.1263 10.1279 10.4936 10.5319 11.9600 11.9710 14.0690 14.0980 14.5121 14.5619 15.2982 15.3010 k = 0.4740 0.3338 0.2060 ( 2922 PWs) bands (ev): -43.3640 -43.3640 -21.0989 -21.0866 -19.1382 -19.1218 -18.9028 -18.9021 -3.6363 -3.6363 -3.5075 -3.5073 -2.8601 -2.8600 -2.7097 -2.7096 -2.5211 -2.5210 -1.9258 -1.9072 -1.2932 -1.2928 5.1351 5.1414 5.8841 5.8875 6.0507 6.0570 6.9426 6.9591 7.5728 7.6005 9.0634 9.1069 10.1466 10.1485 10.5122 10.5577 11.9550 11.9687 14.0501 14.0849 14.5071 14.5675 15.2387 15.2473 k = 0.4688 0.3428 0.2060 ( 2930 PWs) bands (ev): -43.3640 -43.3640 -21.1003 -21.0856 -19.1394 -19.1197 -18.9044 -18.9038 -3.6358 -3.6357 -3.5067 -3.5065 -2.8600 -2.8599 -2.7091 -2.7091 -2.5230 -2.5228 -1.9228 -1.9006 -1.2915 -1.2909 5.1522 5.1598 5.8807 5.8849 6.0521 6.0597 6.9205 6.9379 7.5899 7.6208 9.0022 9.0512 10.1710 10.1732 10.5346 10.5862 11.9492 11.9655 14.0284 14.0681 14.5026 14.5727 15.1714 15.1869 k = 0.4635 0.3518 0.2060 ( 2926 PWs) bands (ev): -43.3638 -43.3638 -21.1016 -21.0846 -19.1406 -19.1175 -18.9062 -18.9058 -3.6351 -3.6350 -3.5057 -3.5055 -2.8598 -2.8597 -2.7083 -2.7083 -2.5250 -2.5248 -1.9190 -1.8932 -1.2894 -1.2888 5.1726 5.1814 5.8761 5.8814 6.0539 6.0628 6.8980 6.9156 7.6084 7.6419 8.9339 8.9873 10.1994 10.2018 10.5602 10.6168 11.9426 11.9616 14.0041 14.0480 14.4988 14.5775 15.0976 15.1205 k = 0.4583 0.3608 0.2060 ( 2922 PWs) bands (ev): -43.3636 -43.3636 -21.1030 -21.0836 -19.1418 -19.1153 -18.9083 -18.9080 -3.6342 -3.6342 -3.5046 -3.5043 -2.8595 -2.8595 -2.7074 -2.7073 -2.5274 -2.5272 -1.9145 -1.8851 -1.2870 -1.2863 5.1960 5.2061 5.8703 5.8767 6.0560 6.0661 6.8760 6.8933 7.6278 7.6632 8.8594 8.9163 10.2315 10.2341 10.5883 10.6492 11.9353 11.9569 13.9770 14.0243 14.4955 14.5821 15.0179 15.0487 k = 0.4531 0.3699 0.2060 ( 2928 PWs) bands (ev): -43.3635 -43.3635 -21.1044 -21.0828 -19.1429 -19.1129 -18.9106 -18.9105 -3.6334 -3.6333 -3.5034 -3.5030 -2.8593 -2.8593 -2.7064 -2.7064 -2.5300 -2.5298 -1.9092 -1.8764 -1.2843 -1.2836 5.2225 5.2338 5.8629 5.8706 6.0584 6.0698 6.8554 6.8718 7.6475 7.6843 8.7795 8.8391 10.2671 10.2697 10.6185 10.6830 11.9274 11.9515 13.9473 13.9973 14.4931 14.5866 14.9330 14.9717 k = 0.4479 0.3789 0.2060 ( 2928 PWs) bands (ev): -43.3633 -43.3633 -21.1058 -21.0819 -19.1440 -19.1105 -18.9134 -18.9129 -3.6325 -3.6324 -3.5020 -3.5016 -2.8591 -2.8590 -2.7052 -2.7052 -2.5329 -2.5327 -1.9032 -1.8670 -1.2815 -1.2806 5.2520 5.2644 5.8538 5.8628 6.0612 6.0738 6.8368 6.8520 7.6670 7.7049 8.6950 8.7565 10.3060 10.3083 10.6505 10.7179 11.9189 11.9454 13.9149 13.9668 14.4914 14.5913 14.8433 14.8900 k = 0.4427 0.3879 0.2060 ( 2926 PWs) bands (ev): -43.3631 -43.3631 -21.1072 -21.0812 -19.1451 -19.1080 -18.9165 -18.9153 -3.6316 -3.6315 -3.5005 -3.5001 -2.8588 -2.8587 -2.7039 -2.7039 -2.5360 -2.5357 -1.8966 -1.8571 -1.2783 -1.2774 5.2844 5.2980 5.8427 5.8532 6.0643 6.0781 6.8208 6.8347 7.6861 7.7248 8.6066 8.6693 10.3479 10.3498 10.6841 10.7540 11.9101 11.9388 13.8798 13.9330 14.4904 14.5964 14.7489 14.8039 k = 0.4375 0.3969 0.2060 ( 2926 PWs) bands (ev): -43.3629 -43.3629 -21.1086 -21.0805 -19.1461 -19.1055 -18.9198 -18.9179 -3.6306 -3.6305 -3.4989 -3.4985 -2.8586 -2.8585 -2.7025 -2.7024 -2.5393 -2.5390 -1.8894 -1.8467 -1.2750 -1.2740 5.3197 5.3344 5.8297 5.8416 6.0677 6.0827 6.8079 6.8203 7.7044 7.7435 8.5148 8.5782 10.3925 10.3938 10.7190 10.7910 11.9012 11.9317 13.8420 13.8957 14.4893 14.6022 14.6501 14.7145 k = 0.4323 0.4059 0.2060 ( 2918 PWs) bands (ev): -43.3626 -43.3625 -21.1100 -21.0798 -19.1472 -19.1029 -18.9232 -18.9205 -3.6295 -3.6294 -3.4972 -3.4968 -2.8582 -2.8581 -2.7008 -2.7007 -2.5428 -2.5424 -1.8817 -1.8359 -1.2715 -1.2705 5.3577 5.3735 5.8146 5.8279 6.0714 6.0875 6.7985 6.8093 7.7216 7.7609 8.4205 8.4840 10.4397 10.4399 10.7551 10.8290 11.8923 11.9244 13.8013 13.8551 14.4846 14.5464 14.6096 14.6255 k = 0.4271 0.4150 0.2060 ( 2922 PWs) bands (ev): -43.3624 -43.3624 -21.1113 -21.0792 -19.1482 -19.1002 -18.9269 -18.9232 -3.6285 -3.6284 -3.4956 -3.4951 -2.8580 -2.8578 -2.6991 -2.6990 -2.5465 -2.5462 -1.8736 -1.8248 -1.2679 -1.2668 5.3984 5.4152 5.7976 5.8123 6.0755 6.0926 6.7927 6.8020 7.7376 7.7766 8.3241 8.3870 10.4880 10.4893 10.7923 10.8680 11.8838 11.9170 13.7577 13.8110 14.4387 14.4568 14.5564 14.6177 k = 0.4219 0.4240 0.2060 ( 2918 PWs) bands (ev): -43.3621 -43.3621 -21.1127 -21.0787 -19.1493 -19.0975 -18.9307 -18.9258 -3.6275 -3.6274 -3.4938 -3.4933 -2.8577 -2.8575 -2.6972 -2.6971 -2.5503 -2.5499 -1.8651 -1.8134 -1.2642 -1.2629 5.4417 5.4595 5.7788 5.7946 6.0799 6.0979 6.7909 6.7986 7.7521 7.7903 8.2264 8.2880 10.5376 10.5409 10.8307 10.9080 11.8760 11.9098 13.7115 13.7638 14.3267 14.3767 14.5367 14.6275 k = 0.4167 0.4330 0.2060 ( 2916 PWs) bands (ev): -43.3618 -43.3618 -21.1140 -21.0782 -19.1503 -19.0948 -18.9347 -18.9284 -3.6265 -3.6264 -3.4920 -3.4915 -2.8573 -2.8572 -2.6951 -2.6950 -2.5543 -2.5539 -1.8563 -1.8019 -1.2603 -1.2590 5.4873 5.5061 5.7584 5.7753 6.0847 6.1033 6.7928 6.7992 7.7649 7.8011 8.1285 8.1874 10.5885 10.5945 10.8701 10.9490 11.8693 11.9030 13.6626 13.7135 14.2105 14.2713 14.5394 14.6389 k = 0.4115 0.4420 0.2060 ( 2912 PWs) bands (ev): -43.3615 -43.3615 -21.1152 -21.0778 -19.1513 -19.0921 -18.9387 -18.9310 -3.6255 -3.6254 -3.4902 -3.4897 -2.8570 -2.8568 -2.6929 -2.6928 -2.5583 -2.5579 -1.8473 -1.7903 -1.2564 -1.2551 5.5353 5.5549 5.7368 5.7546 6.0898 6.1090 6.7985 6.8036 7.7757 7.8075 8.0322 8.0858 10.6404 10.6498 10.9105 10.9910 11.8642 11.8970 13.6111 13.6605 14.0904 14.1565 14.5489 14.6521 k = 0.4062 0.4511 0.2060 ( 2916 PWs) bands (ev): -43.3613 -43.3613 -21.1165 -21.0774 -19.1524 -19.0893 -18.9428 -18.9335 -3.6246 -3.6245 -3.4885 -3.4880 -2.8567 -2.8565 -2.6906 -2.6905 -2.5625 -2.5620 -1.8383 -1.7787 -1.2525 -1.2511 5.5851 5.6058 5.7146 5.7328 6.0954 6.1148 6.8077 6.8117 7.7845 7.8034 7.9439 7.9836 10.6930 10.7067 10.9518 11.0340 11.8612 11.8920 13.5575 13.6050 13.9667 14.0358 14.5618 14.6671 k = 0.4010 0.4601 0.2060 ( 2920 PWs) bands (ev): -43.3611 -43.3611 -21.1177 -21.0771 -19.1535 -19.0866 -18.9470 -18.9359 -3.6237 -3.6236 -3.4868 -3.4862 -2.8564 -2.8562 -2.6883 -2.6881 -2.5668 -2.5663 -1.8291 -1.7672 -1.2487 -1.2472 5.6354 5.6581 5.6933 5.7106 6.1014 6.1208 6.8202 6.8233 7.7677 7.7906 7.8816 7.8849 10.7458 10.7649 10.9940 11.0779 11.8607 11.8885 13.5017 13.5474 13.8400 13.9104 14.5773 14.6837 k = 0.3958 0.4691 0.2060 ( 2924 PWs) bands (ev): -43.3609 -43.3609 -21.1189 -21.0769 -19.1545 -19.0839 -18.9511 -18.9381 -3.6229 -3.6228 -3.4852 -3.4846 -2.8561 -2.8559 -2.6858 -2.6857 -2.5710 -2.5705 -1.8201 -1.7559 -1.2449 -1.2434 5.6602 5.6855 5.6992 5.7145 6.1080 6.1270 6.8356 6.8380 7.6899 7.7738 7.8003 7.8660 10.7986 10.8244 11.0368 11.1226 11.8634 11.8866 13.4441 13.4883 13.7111 13.7813 14.5950 14.7020 k = 0.3906 0.4781 0.2060 ( 2920 PWs) bands (ev): -43.3606 -43.3606 -21.1200 -21.0767 -19.1556 -19.0813 -18.9551 -18.9402 -3.6221 -3.6219 -3.4835 -3.4830 -2.8557 -2.8555 -2.6832 -2.6831 -2.5752 -2.5746 -1.8112 -1.7449 -1.2412 -1.2396 5.6410 5.6637 5.7509 5.7690 6.1153 6.1334 6.8536 6.8555 7.5970 7.6757 7.7987 7.8608 10.8510 10.8848 11.0801 11.1680 11.8698 11.8869 13.3845 13.4281 13.5813 13.6495 14.6143 14.7216 k = 0.3854 0.4871 0.2060 ( 2920 PWs) bands (ev): -43.3604 -43.3604 -21.1210 -21.0765 -19.1566 -19.0787 -18.9590 -18.9422 -3.6213 -3.6212 -3.4820 -3.4814 -2.8554 -2.8552 -2.6806 -2.6804 -2.5793 -2.5787 -1.8025 -1.7344 -1.2376 -1.2360 5.6190 5.6415 5.8072 5.8249 6.1235 6.1401 6.8738 6.8753 7.5008 7.5756 7.7979 7.8575 10.9026 10.9460 11.1235 11.2136 11.8805 11.8894 13.3215 13.3674 13.4534 13.5158 14.6349 14.7424 k = 0.3802 0.4962 0.2060 ( 2918 PWs) bands (ev): -43.3601 -43.3601 -21.1220 -21.0764 -19.1576 -19.0763 -18.9628 -18.9440 -3.6206 -3.6205 -3.4806 -3.4800 -2.8550 -2.8548 -2.6780 -2.6778 -2.5833 -2.5826 -1.7942 -1.7243 -1.2342 -1.2325 5.5976 5.6201 5.8649 5.8808 6.1333 6.1473 6.8957 6.8971 7.4046 7.4768 7.7948 7.8534 10.9531 11.0079 11.1667 11.2592 11.8945 11.8959 13.2478 13.3063 13.3365 13.3820 14.6564 14.7640 k = 0.3750 0.5052 0.2060 ( 2918 PWs) bands (ev): -43.3599 -43.3599 -21.1229 -21.0764 -19.1586 -19.0740 -18.9663 -18.9456 -3.6200 -3.6199 -3.4793 -3.4787 -2.8547 -2.8545 -2.6754 -2.6752 -2.5871 -2.5864 -1.7864 -1.7149 -1.2310 -1.2293 5.5773 5.5998 5.9229 5.9353 6.1455 6.1551 6.9189 6.9203 7.3098 7.3802 7.7894 7.8478 11.0020 11.0700 11.2091 11.3043 11.9021 11.9164 13.1468 13.2341 13.2491 13.2606 14.6784 14.7860 k = 0.3698 0.5142 0.2060 ( 2918 PWs) bands (ev): -43.3597 -43.3597 -21.1237 -21.0763 -19.1595 -19.0719 -18.9696 -18.9470 -3.6194 -3.6193 -3.4782 -3.4775 -2.8544 -2.8542 -2.6729 -2.6727 -2.5907 -2.5900 -1.7791 -1.7062 -1.2280 -1.2263 5.5585 5.5811 5.9801 5.9860 6.1619 6.1643 6.9428 6.9442 7.2174 7.2865 7.7819 7.8406 11.0489 11.1321 11.2503 11.3481 11.9122 11.9424 13.0263 13.1092 13.1856 13.1953 14.7004 14.8080 k = 0.3646 0.5232 0.2060 ( 2922 PWs) bands (ev): -43.3596 -43.3596 -21.1245 -21.0763 -19.1604 -19.0700 -18.9726 -18.9482 -3.6190 -3.6189 -3.4771 -3.4765 -2.8542 -2.8540 -2.6706 -2.6703 -2.5941 -2.5933 -1.7724 -1.6983 -1.2254 -1.2236 5.5415 5.5641 6.0296 6.0343 6.1764 6.1850 6.9667 6.9683 7.1283 7.1965 7.7727 7.8319 11.0934 11.1937 11.2893 11.3899 11.9242 11.9739 12.9034 12.9792 13.1319 13.1411 14.7217 14.8293 k = 0.3594 0.5322 0.2060 ( 2918 PWs) bands (ev): -43.3594 -43.3594 -21.1251 -21.0763 -19.1612 -19.0683 -18.9752 -18.9492 -3.6186 -3.6185 -3.4762 -3.4756 -2.8539 -2.8537 -2.6684 -2.6681 -2.5970 -2.5962 -1.7665 -1.6914 -1.2230 -1.2212 5.5267 5.5493 6.0630 6.0814 6.1943 6.2171 6.9898 6.9912 7.0436 7.1118 7.7622 7.8220 11.1348 11.2540 11.3254 11.4286 11.9372 12.0108 12.7849 12.8528 13.0847 13.0921 14.7417 14.8494 k = 0.3542 0.5413 0.2060 ( 2916 PWs) bands (ev): -43.3593 -43.3592 -21.1257 -21.0764 -19.1619 -19.0669 -18.9774 -18.9500 -3.6182 -3.6181 -3.4755 -3.4749 -2.8537 -2.8534 -2.6665 -2.6662 -2.5996 -2.5987 -1.7615 -1.6855 -1.2210 -1.2192 5.5142 5.5367 6.0858 6.1158 6.2224 6.2567 6.9648 7.0069 7.0115 7.0392 7.7511 7.8118 11.1724 11.3120 11.3574 11.4630 11.9496 12.0525 12.6755 12.7326 13.0441 13.0491 14.7598 14.8676 k = 0.3490 0.5503 0.2060 ( 2916 PWs) bands (ev): -43.3591 -43.3591 -21.1261 -21.0764 -19.1625 -19.0658 -18.9792 -18.9506 -3.6179 -3.6178 -3.4750 -3.4743 -2.8535 -2.8532 -2.6650 -2.6646 -2.6017 -2.6008 -1.7574 -1.6808 -1.2194 -1.2176 5.5042 5.5267 6.1008 6.1364 6.2591 6.2987 6.8948 6.9585 7.0303 7.0373 7.7404 7.8019 11.2051 11.3652 11.3849 11.4919 11.9587 12.0976 12.5808 12.6219 13.0109 13.0136 14.7752 14.8831 k = 0.3438 0.5593 0.2060 ( 2916 PWs) bands (ev): -43.3591 -43.3591 -21.1264 -21.0764 -19.1629 -19.0650 -18.9804 -18.9511 -3.6177 -3.6176 -3.4746 -3.4739 -2.8534 -2.8531 -2.6638 -2.6634 -2.6032 -2.6023 -1.7544 -1.6773 -1.2182 -1.2164 5.4968 5.5194 6.1106 6.1479 6.2958 6.3366 6.8375 6.9030 7.0452 7.0517 7.7311 7.7934 11.2315 11.4015 11.4156 11.5139 11.9616 12.1432 12.5076 12.5258 12.9862 12.9869 14.7871 14.8952 k = 0.3385 0.5683 0.2060 ( 2916 PWs) bands (ev): -43.3590 -43.3590 -21.1266 -21.0765 -19.1632 -19.0646 -18.9812 -18.9513 -3.6176 -3.6175 -3.4744 -3.4737 -2.8533 -2.8530 -2.6631 -2.6627 -2.6041 -2.6032 -1.7525 -1.6751 -1.2175 -1.2157 5.4923 5.5149 6.1164 6.1542 6.3227 6.3632 6.7988 6.8653 7.0551 7.0618 7.7246 7.7875 11.2493 11.4157 11.4482 11.5277 11.9581 12.1817 12.4547 12.4627 12.9703 12.9709 14.7948 14.9030 k = 0.3333 0.5774 0.2060 ( 2916 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6175 -3.6174 -3.4743 -3.4736 -2.8532 -2.8530 -2.6629 -2.6625 -2.6044 -2.6035 -1.7518 -1.6744 -1.2172 -1.2154 5.4908 5.5133 6.1184 6.1564 6.3324 6.3726 6.7851 6.8520 7.0587 7.0655 7.7222 7.7853 11.2558 11.4202 11.4613 11.5324 11.9542 12.1975 12.4272 12.4483 12.9646 12.9657 14.7975 14.9057 k = 0.3333 0.5774 0.2060 ( 2916 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6175 -3.6174 -3.4743 -3.4736 -2.8532 -2.8530 -2.6629 -2.6625 -2.6044 -2.6035 -1.7518 -1.6744 -1.2172 -1.2154 5.4908 5.5133 6.1184 6.1564 6.3324 6.3726 6.7851 6.8520 7.0587 7.0655 7.7222 7.7853 11.2558 11.4202 11.4613 11.5324 11.9542 12.1975 12.4272 12.4483 12.9646 12.9657 14.7975 14.9057 k = 0.3281 0.5683 0.2060 ( 2912 PWs) bands (ev): -43.3590 -43.3590 -21.1266 -21.0765 -19.1631 -19.0646 -18.9812 -18.9513 -3.6176 -3.6174 -3.4743 -3.4737 -2.8533 -2.8530 -2.6631 -2.6627 -2.6041 -2.6031 -1.7525 -1.6751 -1.2175 -1.2157 5.4924 5.5149 6.1160 6.1537 6.3238 6.3641 6.7982 6.8648 7.0548 7.0615 7.7249 7.7878 11.2484 11.4153 11.4467 11.5276 11.9620 12.1860 12.4514 12.4607 12.9703 12.9709 14.7947 14.9028 k = 0.3229 0.5593 0.2060 ( 2904 PWs) bands (ev): -43.3589 -43.3589 -21.1264 -21.0764 -19.1628 -19.0649 -18.9805 -18.9511 -3.6176 -3.6175 -3.4745 -3.4738 -2.8533 -2.8530 -2.6636 -2.6632 -2.6032 -2.6023 -1.7546 -1.6775 -1.2183 -1.2165 5.4971 5.5196 6.1075 6.1438 6.3039 6.3435 6.8336 6.8991 7.0430 7.0493 7.7335 7.7956 11.2250 11.3928 11.4117 11.5134 11.9889 12.1693 12.4937 12.5073 12.9862 12.9870 14.7857 14.8936 k = 0.3177 0.5503 0.2060 ( 2896 PWs) bands (ev): -43.3589 -43.3589 -21.1260 -21.0763 -19.1623 -19.0655 -18.9794 -18.9507 -3.6178 -3.6176 -3.4748 -3.4741 -2.8534 -2.8531 -2.6645 -2.6641 -2.6019 -2.6010 -1.7582 -1.6815 -1.2196 -1.2178 5.5050 5.5276 6.0908 6.1233 6.2831 6.3196 6.8839 6.9475 7.0229 7.0294 7.7479 7.8090 11.1854 11.3305 11.3861 11.4904 12.0339 12.1645 12.5416 12.5783 13.0110 13.0140 14.7705 14.8780 k = 0.3125 0.5413 0.2060 ( 2900 PWs) bands (ev): -43.3591 -43.3591 -21.1255 -21.0762 -19.1615 -19.0661 -18.9779 -18.9502 -3.6180 -3.6179 -3.4753 -3.4747 -2.8537 -2.8534 -2.6657 -2.6653 -2.6004 -2.5996 -1.7633 -1.6873 -1.2215 -1.2197 5.5161 5.5388 6.0646 6.0910 6.2684 6.2993 6.9432 6.9874 6.9951 7.0196 7.7678 7.8276 11.1317 11.2505 11.3575 11.4597 12.0923 12.1763 12.6006 12.6578 13.0440 13.0496 14.7491 14.8559 k = 0.3073 0.5322 0.2060 ( 2906 PWs) bands (ev): -43.3593 -43.3593 -21.1248 -21.0760 -19.1604 -19.0669 -18.9762 -18.9496 -3.6184 -3.6183 -3.4760 -3.4753 -2.8541 -2.8538 -2.6670 -2.6667 -2.5987 -2.5979 -1.7700 -1.6949 -1.2239 -1.2221 5.5305 5.5532 6.0293 6.0496 6.2605 6.2854 6.9585 6.9586 7.0098 7.0771 7.7924 7.8508 11.0675 11.1633 11.3231 11.4226 12.1600 12.2042 12.6680 12.7432 13.0838 13.0924 14.7219 14.8276 k = 0.3021 0.5232 0.2060 ( 2910 PWs) bands (ev): -43.3596 -43.3596 -21.1240 -21.0757 -19.1591 -19.0676 -18.9741 -18.9488 -3.6189 -3.6187 -3.4768 -3.4761 -2.8545 -2.8542 -2.6684 -2.6681 -2.5968 -2.5960 -1.7785 -1.7043 -1.2270 -1.2252 5.5481 5.5709 5.9874 6.0032 6.2574 6.2776 6.9162 6.9171 7.0784 7.1455 7.8207 7.8778 10.9963 11.0736 11.2838 11.3803 12.2346 12.2460 12.7424 12.8331 13.1287 13.1404 14.6894 14.7939 k = 0.2969 0.5142 0.2060 ( 2904 PWs) bands (ev): -43.3598 -43.3598 -21.1229 -21.0753 -19.1575 -19.0683 -18.9719 -18.9480 -3.6193 -3.6192 -3.4776 -3.4770 -2.8549 -2.8546 -2.6697 -2.6695 -2.5949 -2.5941 -1.7886 -1.7156 -1.2306 -1.2288 5.5689 5.5919 5.9420 5.9551 6.2570 6.2743 6.8679 6.8698 7.1497 7.2170 7.8517 7.9076 10.9216 10.9843 11.2406 11.3342 12.2990 12.3144 12.8226 12.9269 13.1771 13.1916 14.6527 14.7554 k = 0.2917 0.5052 0.2060 ( 2904 PWs) bands (ev): -43.3601 -43.3601 -21.1217 -21.0749 -19.1555 -19.0688 -18.9694 -18.9471 -3.6198 -3.6197 -3.4786 -3.4779 -2.8554 -2.8552 -2.6711 -2.6709 -2.5929 -2.5922 -1.8005 -1.7288 -1.2348 -1.2331 5.5928 5.6160 5.8953 5.9073 6.2581 6.2739 6.8149 6.8178 7.2223 7.2902 7.8844 7.9394 10.8459 10.8974 11.1947 11.2855 12.3613 12.3986 12.9077 13.0239 13.2271 13.2442 14.6130 14.7134 k = 0.2865 0.4962 0.2060 ( 2916 PWs) bands (ev): -43.3606 -43.3606 -21.1204 -21.0743 -19.1533 -19.0693 -18.9669 -18.9461 -3.6205 -3.6204 -3.4797 -3.4791 -2.8561 -2.8559 -2.6725 -2.6723 -2.5911 -2.5904 -1.8142 -1.7440 -1.2396 -1.2379 5.6196 5.6431 5.8487 5.8607 6.2601 6.2752 6.7583 6.7621 7.2958 7.3643 7.9181 7.9723 10.7714 10.8140 11.1470 11.2350 12.4313 12.4864 12.9970 13.1237 13.2770 13.2962 14.5716 14.6692 k = 0.2812 0.4871 0.2060 ( 2916 PWs) bands (ev): -43.3609 -43.3609 -21.1188 -21.0737 -19.1508 -19.0696 -18.9642 -18.9450 -3.6212 -3.6211 -3.4808 -3.4802 -2.8568 -2.8566 -2.6738 -2.6735 -2.5893 -2.5886 -1.8297 -1.7611 -1.2450 -1.2433 5.6492 5.6729 5.8035 5.8162 6.2625 6.2778 6.6989 6.7035 7.3696 7.4389 7.9520 8.0056 10.6995 10.7352 11.0982 11.1838 12.5077 12.5776 13.0900 13.2253 13.3251 13.3464 14.5300 14.6241 k = 0.2760 0.4781 0.2060 ( 2916 PWs) bands (ev): -43.3614 -43.3614 -21.1170 -21.0729 -19.1479 -19.0697 -18.9614 -18.9438 -3.6219 -3.6218 -3.4820 -3.4814 -2.8575 -2.8574 -2.6749 -2.6747 -2.5877 -2.5870 -1.8470 -1.7802 -1.2510 -1.2493 5.6812 5.7051 5.7602 5.7743 6.2650 6.2810 6.6376 6.6429 7.4434 7.5136 7.9853 8.0387 10.6315 10.6616 11.0493 11.1326 12.5896 12.6718 13.1859 13.3250 13.3700 13.3962 14.4899 14.5796 k = 0.2708 0.4691 0.2060 ( 2916 PWs) bands (ev): -43.3619 -43.3619 -21.1151 -21.0720 -19.1447 -19.0695 -18.9586 -18.9426 -3.6227 -3.6226 -3.4832 -3.4826 -2.8583 -2.8582 -2.6759 -2.6757 -2.5862 -2.5856 -1.8662 -1.8012 -1.2575 -1.2559 5.7129 5.7171 5.7372 5.7415 6.2677 6.2847 6.5753 6.5812 7.5167 7.5879 8.0176 8.0708 10.5683 10.5939 11.0007 11.0820 12.6763 12.7687 13.2827 13.4014 13.4116 13.4649 14.4527 14.5370 k = 0.2656 0.4601 0.2060 ( 2922 PWs) bands (ev): -43.3625 -43.3624 -21.1130 -21.0710 -19.1412 -19.0692 -18.9557 -18.9414 -3.6236 -3.6235 -3.4846 -3.4840 -2.8592 -2.8591 -2.6768 -2.6767 -2.5850 -2.5845 -1.8872 -1.8242 -1.2647 -1.2631 5.6791 5.6953 5.7534 5.7767 6.2702 6.2886 6.5130 6.5195 7.5893 7.6616 8.0483 8.1015 10.5105 10.5325 10.9532 11.0325 12.7670 12.8679 13.3732 13.4390 13.4552 13.5660 14.4198 14.4977 k = 0.2604 0.4511 0.2060 ( 2922 PWs) bands (ev): -43.3630 -43.3630 -21.1107 -21.0699 -19.1374 -19.0685 -18.9528 -18.9401 -3.6246 -3.6244 -3.4859 -3.4853 -2.8601 -2.8600 -2.6776 -2.6775 -2.5839 -2.5834 -1.9099 -1.8490 -1.2724 -1.2708 5.6427 5.6615 5.7890 5.8130 6.2726 6.2927 6.4523 6.4593 7.6610 7.7344 8.0770 8.1305 10.4587 10.4777 10.9072 10.9846 12.8611 12.9692 13.4306 13.4592 13.5261 13.6770 14.3921 14.4626 k = 0.2552 0.4420 0.2060 ( 2930 PWs) bands (ev): -43.3637 -43.3637 -21.1082 -21.0687 -19.1333 -19.0677 -18.9499 -18.9388 -3.6256 -3.6254 -3.4874 -3.4868 -2.8611 -2.8610 -2.6783 -2.6782 -2.5832 -2.5827 -1.9345 -1.8757 -1.2806 -1.2791 5.6087 5.6297 5.8237 5.8478 6.2746 6.2967 6.3953 6.4029 7.7313 7.8059 8.1034 8.1573 10.4133 10.4298 10.8630 10.9389 12.9581 13.0720 13.4526 13.4674 13.6258 13.7918 14.3697 14.4321 k = 0.2500 0.4330 0.2060 ( 2928 PWs) bands (ev): -43.3644 -43.3644 -21.1055 -21.0673 -19.1288 -19.0665 -18.9470 -18.9374 -3.6266 -3.6265 -3.4887 -3.4882 -2.8620 -2.8620 -2.6788 -2.6787 -2.5826 -2.5822 -1.9607 -1.9041 -1.2894 -1.2879 5.5771 5.6003 5.8542 5.8777 6.2757 6.3004 6.3459 6.3542 7.7999 7.8760 8.1272 8.1816 10.3745 10.3890 10.8212 10.8955 13.0569 13.1757 13.4588 13.4655 13.7347 13.9091 14.3522 14.4061 k = 0.2448 0.4240 0.2060 ( 2924 PWs) bands (ev): -43.3650 -43.3650 -21.1027 -21.0657 -19.1241 -19.0650 -18.9440 -18.9360 -3.6277 -3.6275 -3.4901 -3.4896 -2.8630 -2.8630 -2.6792 -2.6791 -2.5822 -2.5819 -1.9886 -1.9343 -1.2987 -1.2973 5.5479 5.5730 5.8754 5.8972 6.2741 6.2995 6.3143 6.3201 7.8666 7.9442 8.1482 8.2035 10.3426 10.3552 10.7821 10.8549 13.1560 13.2783 13.4559 13.4559 13.8478 14.0284 14.3382 14.3839 k = 0.2396 0.4150 0.2060 ( 2924 PWs) bands (ev): -43.3658 -43.3658 -21.0997 -21.0641 -19.1190 -19.0633 -18.9411 -18.9346 -3.6289 -3.6287 -3.4915 -3.4910 -2.8640 -2.8640 -2.6795 -2.6794 -2.5821 -2.5817 -2.0181 -1.9662 -1.3085 -1.3071 5.5207 5.5477 5.8808 5.8994 6.2708 6.2883 6.3065 6.3132 7.9309 8.0103 8.1664 8.2230 10.3174 10.3283 10.7460 10.8173 13.2506 13.3691 13.4446 13.4565 13.9637 14.1495 14.3261 14.3643 k = 0.2344 0.4059 0.2060 ( 2924 PWs) bands (ev): -43.3666 -43.3666 -21.0965 -21.0623 -19.1136 -19.0612 -18.9382 -18.9331 -3.6302 -3.6300 -3.4929 -3.4923 -2.8651 -2.8651 -2.6797 -2.6796 -2.5822 -2.5820 -2.0491 -1.9996 -1.3187 -1.3174 5.4955 5.5242 5.8658 5.8800 6.2767 6.2960 6.3074 6.3181 7.9922 8.0739 8.1819 8.2402 10.2988 10.3084 10.7131 10.7829 13.3206 13.3939 13.4530 13.5160 14.0820 14.2714 14.3145 14.3458 k = 0.2292 0.3969 0.2060 ( 2924 PWs) bands (ev): -43.3674 -43.3674 -21.0931 -21.0603 -19.1080 -19.0589 -18.9353 -18.9317 -3.6315 -3.6313 -3.4942 -3.4937 -2.8662 -2.8661 -2.6799 -2.6798 -2.5826 -2.5824 -2.0816 -2.0345 -1.3294 -1.3282 5.4719 5.5021 5.8314 5.8416 6.2923 6.3203 6.3216 6.3286 8.0500 8.1345 8.1950 8.2556 10.2867 10.2949 10.6837 10.7521 13.3310 13.3742 13.5173 13.6141 14.2021 14.2998 14.3270 14.3959 k = 0.2240 0.3879 0.2060 ( 2916 PWs) bands (ev): -43.3682 -43.3682 -21.0896 -21.0583 -19.1020 -19.0563 -18.9324 -18.9302 -3.6328 -3.6326 -3.4955 -3.4950 -2.8672 -2.8671 -2.6799 -2.6797 -2.5831 -2.5830 -2.1154 -2.0707 -1.3406 -1.3394 5.4498 5.4812 5.7833 5.7905 6.3037 6.3292 6.3576 6.3710 8.1033 8.1892 8.2084 8.2702 10.2807 10.2877 10.6582 10.7250 13.3087 13.3454 13.6114 13.7157 14.2838 14.3053 14.3253 14.5195 k = 0.2188 0.3789 0.2060 ( 2920 PWs) bands (ev): -43.3692 -43.3691 -21.0860 -21.0561 -19.0959 -19.0534 -18.9296 -18.9287 -3.6343 -3.6341 -3.4969 -3.4964 -2.8683 -2.8682 -2.6799 -2.6797 -2.5840 -2.5840 -2.1505 -2.1082 -1.3521 -1.3510 5.4287 5.4610 5.7268 5.7319 6.3125 6.3370 6.4089 6.4260 8.1506 8.2105 8.2497 8.2853 10.2803 10.2861 10.6366 10.7019 13.2779 13.3134 13.7113 13.8155 14.2643 14.2837 14.4476 14.6425 k = 0.2135 0.3699 0.2060 ( 2928 PWs) bands (ev): -43.3702 -43.3702 -21.0823 -21.0538 -19.0895 -19.0503 -18.9271 -18.9267 -3.6358 -3.6356 -3.4983 -3.4979 -2.8694 -2.8693 -2.6799 -2.6797 -2.5853 -2.5852 -2.1867 -2.1469 -1.3641 -1.3630 5.4084 5.4413 5.6654 5.6691 6.3220 6.3460 6.4690 6.4884 8.1897 8.2177 8.2994 8.3032 10.2850 10.2898 10.6192 10.6828 13.2448 13.2801 13.8104 13.9108 14.2414 14.2586 14.5719 14.7632 k = 0.2083 0.3608 0.2060 ( 2932 PWs) bands (ev): -43.3712 -43.3712 -21.0784 -21.0513 -19.0829 -19.0469 -18.9255 -18.9239 -3.6374 -3.6372 -3.4998 -3.4993 -2.8705 -2.8703 -2.6798 -2.6797 -2.5868 -2.5866 -2.2239 -2.1866 -1.3764 -1.3754 5.3884 5.4216 5.6015 5.6041 6.3331 6.3564 6.5349 6.5561 8.2185 8.2228 8.3260 8.3456 10.2944 10.2982 10.6061 10.6679 13.2117 13.2468 13.9056 13.9996 14.2151 14.2310 14.6972 14.8778 k = 0.2031 0.3518 0.2060 ( 2924 PWs) bands (ev): -43.3721 -43.3721 -21.0744 -21.0488 -19.0760 -19.0432 -18.9239 -18.9210 -3.6389 -3.6388 -3.5011 -3.5006 -2.8715 -2.8712 -2.6797 -2.6795 -2.5884 -2.5881 -2.2620 -2.2271 -1.3890 -1.3880 5.3686 5.4015 5.5362 5.5381 6.3462 6.3687 6.6053 6.6278 8.2269 8.2376 8.3534 8.3875 10.3078 10.3107 10.5977 10.6575 13.1798 13.2144 13.9940 14.0792 14.1858 14.2013 14.8231 14.9785 k = 0.1979 0.3428 0.2060 ( 2924 PWs) bands (ev): -43.3732 -43.3732 -21.0703 -21.0461 -19.0690 -19.0393 -18.9222 -18.9182 -3.6406 -3.6404 -3.5024 -3.5020 -2.8726 -2.8723 -2.6797 -2.6795 -2.5903 -2.5898 -2.3008 -2.2683 -1.4019 -1.4010 5.3484 5.3808 5.4706 5.4718 6.3618 6.3831 6.6792 6.7029 8.2304 8.2499 8.3824 8.4246 10.3248 10.3267 10.5938 10.6516 13.1498 13.1836 14.0726 14.1432 14.1544 14.1743 14.9490 15.0524 k = 0.1927 0.3338 0.2060 ( 2924 PWs) bands (ev): -43.3743 -43.3743 -21.0661 -21.0433 -19.0619 -19.0352 -18.9205 -18.9153 -3.6423 -3.6421 -3.5037 -3.5033 -2.8736 -2.8733 -2.6797 -2.6795 -2.5925 -2.5918 -2.3400 -2.3100 -1.4151 -1.4143 5.3277 5.3586 5.4057 5.4058 6.3799 6.3998 6.7559 6.7807 8.2337 8.2585 8.4102 8.4567 10.3447 10.3458 10.5947 10.6501 13.1222 13.1548 14.1198 14.1326 14.1403 14.2076 15.0731 15.0973 k = 0.1875 0.3248 0.2060 ( 2922 PWs) bands (ev): -43.3753 -43.3753 -21.0619 -21.0405 -19.0546 -19.0309 -18.9187 -18.9124 -3.6441 -3.6439 -3.5050 -3.5047 -2.8747 -2.8743 -2.6798 -2.6795 -2.5951 -2.5941 -2.3796 -2.3521 -1.4285 -1.4277 5.3058 5.3295 5.3407 5.3470 6.4010 6.4191 6.8350 6.8609 8.2373 8.2655 8.4349 8.4836 10.3672 10.3675 10.6002 10.6532 13.0973 13.1284 14.0869 14.1000 14.1906 14.2481 15.1281 15.1883 k = 0.1823 0.3157 0.2060 ( 2926 PWs) bands (ev): -43.3765 -43.3765 -21.0576 -21.0375 -19.0473 -19.0265 -18.9168 -18.9095 -3.6459 -3.6457 -3.5064 -3.5060 -2.8759 -2.8754 -2.6801 -2.6797 -2.5982 -2.5968 -2.4190 -2.3942 -1.4421 -1.4414 5.2724 5.2728 5.2865 5.3158 6.4250 6.4413 6.9161 6.9430 8.2415 8.2719 8.4556 8.5050 10.3911 10.3916 10.6103 10.6606 13.0754 13.1046 14.0532 14.0671 14.2256 14.2751 15.1570 15.2705 k = 0.1771 0.3067 0.2060 ( 2930 PWs) bands (ev): -43.3777 -43.3777 -21.0532 -21.0345 -19.0399 -19.0219 -18.9147 -18.9066 -3.6478 -3.6476 -3.5078 -3.5074 -2.8772 -2.8766 -2.6807 -2.6802 -2.6022 -2.6001 -2.4578 -2.4358 -1.4559 -1.4553 5.2098 5.2110 5.2610 5.2898 6.4523 6.4664 6.9989 7.0268 8.2467 8.2787 8.4718 8.5211 10.4164 10.4176 10.6248 10.6724 13.0564 13.0834 14.0204 14.0351 14.2450 14.2889 15.1868 15.3070 k = 0.1719 0.2977 0.2060 ( 2930 PWs) bands (ev): -43.3789 -43.3789 -21.0488 -21.0315 -19.0326 -19.0172 -18.9126 -18.9035 -3.6497 -3.6495 -3.5091 -3.5087 -2.8785 -2.8778 -2.6815 -2.6808 -2.6077 -2.6045 -2.4950 -2.4762 -1.4699 -1.4693 5.1478 5.1488 5.2358 5.2628 6.4827 6.4946 7.0831 7.1121 8.2530 8.2863 8.4834 8.5317 10.4429 10.4448 10.6435 10.6881 13.0405 13.0649 13.9894 14.0051 14.2507 14.2914 15.2153 15.3219 k = 0.1667 0.2887 0.2060 ( 2926 PWs) bands (ev): -43.3800 -43.3800 -21.0444 -21.0283 -19.0252 -19.0124 -18.9103 -18.9004 -3.6517 -3.6515 -3.5104 -3.5100 -2.8799 -2.8792 -2.6830 -2.6819 -2.6163 -2.6111 -2.5284 -2.5140 -1.4839 -1.4833 5.0870 5.0878 5.2093 5.2345 6.5163 6.5260 7.1684 7.1985 8.2609 8.2950 8.4902 8.5372 10.4703 10.4729 10.6660 10.7075 13.0275 13.0493 13.9608 13.9776 14.2451 14.2847 15.2383 15.3246 k = 0.1615 0.2797 0.2060 ( 2914 PWs) bands (ev): -43.3810 -43.3810 -21.0400 -21.0251 -19.0180 -19.0076 -18.9078 -18.8972 -3.6536 -3.6534 -3.5115 -3.5112 -2.8817 -2.8807 -2.6858 -2.6838 -2.6303 -2.6224 -2.5547 -2.5459 -1.4979 -1.4975 5.0275 5.0282 5.1815 5.2048 6.5531 6.5605 7.2546 7.2857 8.2704 8.3052 8.4924 8.5377 10.4983 10.5015 10.6918 10.7302 13.0176 13.0364 13.9354 13.9535 14.2310 14.2708 15.2517 15.3162 k = 0.1562 0.2706 0.2060 ( 2914 PWs) bands (ev): -43.3822 -43.3822 -21.0356 -21.0219 -19.0109 -19.0027 -18.9050 -18.8939 -3.6556 -3.6555 -3.5129 -3.5126 -2.8839 -2.8827 -2.6927 -2.6881 -2.6497 -2.6411 -2.5713 -2.5676 -1.5121 -1.5116 4.9696 4.9702 5.1524 5.1738 6.5931 6.5981 7.3413 7.3736 8.2817 8.3170 8.4903 8.5334 10.5266 10.5305 10.7204 10.7556 13.0107 13.0265 13.9137 13.9330 14.2107 14.2517 15.2531 15.2968 k = 0.1510 0.2616 0.2060 ( 2902 PWs) bands (ev): -43.3833 -43.3833 -21.0312 -21.0186 -19.0041 -18.9979 -18.9021 -18.8905 -3.6577 -3.6575 -3.5140 -3.5138 -2.8867 -2.8852 -2.7097 -2.7001 -2.6653 -2.6611 -2.5805 -2.5794 -1.5262 -1.5258 4.9133 4.9137 5.1220 5.1415 6.6359 6.6388 7.4283 7.4618 8.2951 8.3305 8.4843 8.5249 10.5550 10.5594 10.7512 10.7833 13.0069 13.0195 13.8961 13.9166 14.1861 14.2287 15.2413 15.2668 k = 0.1458 0.2526 0.2060 ( 2904 PWs) bands (ev): -43.3845 -43.3845 -21.0268 -21.0154 -18.9975 -18.9932 -18.8988 -18.8869 -3.6598 -3.6596 -3.5154 -3.5152 -2.8908 -2.8888 -2.7376 -2.7258 -2.6727 -2.6718 -2.5858 -2.5856 -1.5403 -1.5399 4.8586 4.8590 5.0905 5.1081 6.6816 6.6824 7.5154 7.5501 8.3105 8.3456 8.4750 8.5125 10.5832 10.5882 10.7835 10.8124 13.0063 13.0157 13.8828 13.9045 14.1587 14.2033 15.2169 15.2271 k = 0.1406 0.2436 0.2060 ( 2904 PWs) bands (ev): -43.3857 -43.3857 -21.0225 -21.0121 -18.9913 -18.9886 -18.8952 -18.8831 -3.6619 -3.6617 -3.5168 -3.5165 -2.8970 -2.8941 -2.7685 -2.7579 -2.6765 -2.6764 -2.5893 -2.5891 -1.5542 -1.5539 4.8057 4.8060 5.0579 5.0738 6.7287 6.7299 7.6023 7.6382 8.3280 8.3619 8.4632 8.4966 10.6111 10.6167 10.8167 10.8425 13.0091 13.0153 13.8741 13.8968 14.1295 14.1762 15.1789 15.1812 k = 0.1354 0.2345 0.2060 ( 2908 PWs) bands (ev): -43.3869 -43.3869 -21.0183 -21.0089 -18.9854 -18.9841 -18.8912 -18.8792 -3.6640 -3.6639 -3.5182 -3.5180 -2.9069 -2.9028 -2.7975 -2.7892 -2.6793 -2.6791 -2.5916 -2.5913 -1.5681 -1.5678 4.7546 4.7548 5.0246 5.0387 6.7776 6.7807 7.6886 7.7259 8.3476 8.3777 8.4511 8.4777 10.6386 10.6446 10.8499 10.8728 13.0156 13.0187 13.8699 13.8934 14.0995 14.1484 15.1236 15.1358 k = 0.1302 0.2255 0.2060 ( 2900 PWs) bands (ev): -43.3880 -43.3880 -21.0141 -21.0057 -18.9800 -18.9798 -18.8869 -18.8750 -3.6661 -3.6660 -3.5195 -3.5193 -2.9228 -2.9170 -2.8210 -2.8155 -2.6815 -2.6813 -2.5929 -2.5927 -1.5818 -1.5816 4.7053 4.7055 4.9905 5.0031 6.8289 6.8337 7.7742 7.8128 8.3693 8.3874 8.4447 8.4564 10.6655 10.6720 10.8826 10.9027 13.0261 13.0263 13.8702 13.8941 14.0693 14.1205 15.0623 15.0825 k = 0.1250 0.2165 0.2060 ( 2896 PWs) bands (ev): -43.3892 -43.3892 -21.0100 -21.0025 -18.9757 -18.9750 -18.8822 -18.8707 -3.6683 -3.6681 -3.5208 -3.5206 -2.9459 -2.9387 -2.8372 -2.8342 -2.6836 -2.6834 -2.5938 -2.5935 -1.5953 -1.5951 4.6578 4.6580 4.9560 4.9671 6.8823 6.8886 7.8587 7.8987 8.3817 8.3923 8.4339 8.4536 10.6918 10.6986 10.9141 10.9314 13.0385 13.0409 13.8746 13.8985 14.0394 14.0931 14.9965 15.0229 k = 0.1198 0.2075 0.2060 ( 2896 PWs) bands (ev): -43.3903 -43.3903 -21.0061 -20.9993 -18.9718 -18.9704 -18.8772 -18.8662 -3.6704 -3.6703 -3.5222 -3.5220 -2.9747 -2.9671 -2.8472 -2.8457 -2.6858 -2.6856 -2.5942 -2.5940 -1.6086 -1.6084 4.6123 4.6124 4.9212 4.9309 6.9375 6.9452 7.9419 7.9833 8.3643 8.4014 8.4256 8.4748 10.7173 10.7244 10.9436 10.9585 13.0556 13.0606 13.8829 13.9062 14.0103 14.0667 14.9270 14.9585 k = 0.1146 0.1985 0.2060 ( 2896 PWs) bands (ev): -43.3914 -43.3914 -21.0022 -20.9962 -18.9682 -18.9664 -18.8718 -18.8615 -3.6726 -3.6725 -3.5236 -3.5234 -3.0067 -2.9995 -2.8534 -2.8526 -2.6879 -2.6877 -2.5943 -2.5941 -1.6216 -1.6215 4.5686 4.5688 4.8863 4.8948 6.9944 7.0033 8.0234 8.0662 8.3420 8.3779 8.4507 8.5015 10.7419 10.7492 10.9708 10.9835 13.0781 13.0853 13.8947 13.9161 13.9822 14.0420 14.8550 14.8905 k = 0.1094 0.1894 0.2060 ( 2896 PWs) bands (ev): -43.3926 -43.3926 -20.9984 -20.9932 -18.9648 -18.9628 -18.8662 -18.8566 -3.6747 -3.6746 -3.5250 -3.5248 -3.0401 -3.0335 -2.8572 -2.8569 -2.6902 -2.6900 -2.5942 -2.5940 -1.6343 -1.6342 4.5269 4.5270 4.8515 4.8588 7.0526 7.0625 8.1031 8.1471 8.3174 8.3507 8.4806 8.5315 10.7655 10.7729 10.9952 11.0058 13.1063 13.1153 13.9094 13.9270 13.9556 14.0204 14.7813 14.8201 k = 0.1042 0.1804 0.2060 ( 2896 PWs) bands (ev): -43.3936 -43.3936 -20.9948 -20.9902 -18.9617 -18.9596 -18.8603 -18.8516 -3.6768 -3.6767 -3.5264 -3.5262 -3.0739 -3.0680 -2.8598 -2.8596 -2.6924 -2.6922 -2.5938 -2.5936 -1.6467 -1.6466 4.4871 4.4872 4.8169 4.8232 7.1119 7.1225 8.1807 8.2253 8.2916 8.3231 8.5128 8.5639 10.7880 10.7955 11.0166 11.0253 13.1402 13.1508 13.9267 13.9305 13.9354 14.0050 14.7069 14.7482 k = 0.0990 0.1714 0.2060 ( 2896 PWs) bands (ev): -43.3947 -43.3947 -20.9913 -20.9874 -18.9589 -18.9567 -18.8543 -18.8465 -3.6789 -3.6788 -3.5277 -3.5276 -3.1073 -3.1021 -2.8616 -2.8615 -2.6947 -2.6946 -2.5932 -2.5930 -1.6587 -1.6586 4.4493 4.4494 4.7829 4.7882 7.1718 7.1831 8.2540 8.2670 8.2858 8.3102 8.5469 8.5981 10.8093 10.8168 11.0347 11.0418 13.1799 13.1919 13.9072 13.9352 13.9461 14.0017 14.6323 14.6757 k = 0.0938 0.1624 0.2060 ( 2890 PWs) bands (ev): -43.3956 -43.3956 -20.9879 -20.9846 -18.9563 -18.9542 -18.8482 -18.8413 -3.6809 -3.6808 -3.5290 -3.5289 -3.1400 -3.1355 -2.8629 -2.8629 -2.6969 -2.6968 -2.5925 -2.5923 -1.6703 -1.6702 4.4134 4.4135 4.7495 4.7540 7.2321 7.2439 8.2378 8.2631 8.3292 8.3777 8.5827 8.6340 10.8294 10.8366 11.0495 11.0553 13.2253 13.2384 13.8859 13.9251 13.9671 14.0114 14.5583 14.6033 k = 0.0885 0.1534 0.2060 ( 2886 PWs) bands (ev): -43.3966 -43.3966 -20.9847 -20.9819 -18.9539 -18.9521 -18.8420 -18.8360 -3.6829 -3.6828 -3.5303 -3.5302 -3.1717 -3.1680 -2.8638 -2.8638 -2.6991 -2.6990 -2.5916 -2.5915 -1.6814 -1.6813 4.3795 4.3796 4.7169 4.7207 7.2925 7.3046 8.2112 8.2351 8.3992 8.4477 8.6200 8.6711 10.8480 10.8550 11.0612 11.0657 13.2762 13.2901 13.8667 13.9109 13.9893 14.0281 14.4856 14.5319 k = 0.0833 0.1443 0.2060 ( 2886 PWs) bands (ev): -43.3975 -43.3975 -20.9817 -20.9793 -18.9518 -18.9502 -18.8359 -18.8308 -3.6849 -3.6848 -3.5317 -3.5316 -3.2023 -3.1991 -2.8645 -2.8645 -2.7014 -2.7013 -2.5907 -2.5906 -1.6921 -1.6920 4.3476 4.3476 4.6853 4.6884 7.3525 7.3648 8.1850 8.2072 8.4665 8.5147 8.6585 8.7090 10.8651 10.8717 11.0698 11.0734 13.3321 13.3467 13.8498 13.8962 14.0121 14.0477 14.4147 14.4619 k = 0.0781 0.1353 0.2060 ( 2886 PWs) bands (ev): -43.3984 -43.3984 -20.9788 -20.9768 -18.9499 -18.9485 -18.8299 -18.8256 -3.6867 -3.6867 -3.5329 -3.5329 -3.2316 -3.2290 -2.8651 -2.8651 -2.7036 -2.7035 -2.5897 -2.5896 -1.7022 -1.7022 4.3176 4.3176 4.6548 4.6574 7.4118 7.4242 8.1594 8.1799 8.5308 8.5782 8.6982 8.7473 10.8805 10.8867 11.0757 11.0784 13.3927 13.4076 13.8351 13.8825 14.0351 14.0686 14.3462 14.3940 k = 0.0729 0.1263 0.2060 ( 2886 PWs) bands (ev): -43.3993 -43.3993 -20.9761 -20.9745 -18.9483 -18.9470 -18.8241 -18.8205 -3.6886 -3.6885 -3.5342 -3.5341 -3.2595 -3.2573 -2.8655 -2.8655 -2.7057 -2.7056 -2.5886 -2.5886 -1.7119 -1.7119 4.2896 4.2896 4.6256 4.6277 7.4701 7.4823 8.1346 8.1535 8.5922 8.6378 8.7387 8.7857 10.8941 10.8998 11.0792 11.0812 13.4571 13.4724 13.8227 13.8703 14.0580 14.0899 14.2806 14.3290 k = 0.0677 0.1173 0.2060 ( 2894 PWs) bands (ev): -43.4002 -43.4002 -20.9736 -20.9723 -18.9468 -18.9457 -18.8185 -18.8155 -3.6904 -3.6903 -3.5355 -3.5354 -3.2859 -3.2841 -2.8658 -2.8658 -2.7078 -2.7077 -2.5877 -2.5876 -1.7210 -1.7210 4.2635 4.2635 4.5978 4.5994 7.5268 7.5388 8.1108 8.1282 8.6505 8.6933 8.7797 8.8236 10.9059 10.9110 11.0806 11.0821 13.5248 13.5403 13.8126 13.8600 14.0799 14.1110 14.2184 14.2675 k = 0.0625 0.1083 0.2060 ( 2890 PWs) bands (ev): -43.4009 -43.4009 -20.9712 -20.9702 -18.9454 -18.9446 -18.8131 -18.8107 -3.6920 -3.6919 -3.5366 -3.5365 -3.3106 -3.3092 -2.8660 -2.8660 -2.7097 -2.7096 -2.5866 -2.5866 -1.7295 -1.7295 4.2394 4.2394 4.5716 4.5728 7.5817 7.5933 8.0883 8.1042 8.7057 8.7448 8.8208 8.8606 10.9157 10.9202 11.0803 11.0813 13.5947 13.6106 13.8048 13.8517 14.0995 14.1315 14.1601 14.2112 k = 0.0573 0.0992 0.2060 ( 2904 PWs) bands (ev): -43.4018 -43.4018 -20.9691 -20.9683 -18.9443 -18.9436 -18.8080 -18.8062 -3.6936 -3.6936 -3.5378 -3.5377 -3.3336 -3.3326 -2.8663 -2.8663 -2.7116 -2.7116 -2.5857 -2.5857 -1.7374 -1.7374 4.2172 4.2172 4.5470 4.5480 7.6342 7.6453 8.0671 8.0815 8.7577 8.7921 8.8614 8.8964 10.9236 10.9274 11.0786 11.0793 13.6658 13.6824 13.7991 13.8457 14.1057 14.1098 14.1514 14.1672 k = 0.0521 0.0902 0.2060 ( 2904 PWs) bands (ev): -43.4025 -43.4025 -20.9671 -20.9665 -18.9433 -18.9428 -18.8032 -18.8018 -3.6950 -3.6950 -3.5387 -3.5387 -3.3549 -3.3541 -2.8665 -2.8665 -2.7133 -2.7133 -2.5848 -2.5848 -1.7447 -1.7447 4.1970 4.1970 4.5242 4.5249 7.6841 7.6946 8.0474 8.0604 8.8064 8.8355 8.9009 8.9305 10.9296 10.9328 11.0759 11.0763 13.7353 13.7548 13.7953 13.8435 14.0562 14.0866 14.1601 14.1699 k = 0.0469 0.0812 0.2060 ( 2900 PWs) bands (ev): -43.4030 -43.4030 -20.9653 -20.9648 -18.9424 -18.9420 -18.7988 -18.7978 -3.6963 -3.6963 -3.5396 -3.5396 -3.3744 -3.3738 -2.8665 -2.8665 -2.7148 -2.7148 -2.5838 -2.5838 -1.7513 -1.7513 4.1788 4.1788 4.5032 4.5038 7.7308 7.7406 8.0293 8.0409 8.8514 8.8751 8.9386 8.9626 10.9338 10.9363 11.0725 11.0728 13.7930 13.7933 13.8262 13.8542 14.0119 14.0466 14.1737 14.1872 k = 0.0417 0.0722 0.2060 ( 2900 PWs) bands (ev): -43.4036 -43.4036 -20.9636 -20.9633 -18.9416 -18.9413 -18.7948 -18.7941 -3.6975 -3.6975 -3.5405 -3.5405 -3.3920 -3.3916 -2.8666 -2.8666 -2.7163 -2.7162 -2.5830 -2.5830 -1.7573 -1.7573 4.1624 4.1624 4.4843 4.4846 7.7740 7.7830 8.0129 8.0232 8.8926 8.9109 8.9740 8.9924 10.9363 10.9382 11.0686 11.0688 13.7926 13.8134 13.8933 13.9007 13.9741 14.0107 14.1896 14.2030 k = 0.0365 0.0631 0.2060 ( 2900 PWs) bands (ev): -43.4040 -43.4040 -20.9622 -20.9620 -18.9410 -18.9408 -18.7912 -18.7907 -3.6986 -3.6986 -3.5412 -3.5412 -3.4076 -3.4073 -2.8666 -2.8666 -2.7175 -2.7175 -2.5822 -2.5822 -1.7627 -1.7627 4.1480 4.1480 4.4673 4.4676 7.8133 7.8214 7.9984 8.0073 8.9297 8.9429 9.0064 9.0197 10.9374 10.9388 11.0647 11.0648 13.7929 13.8151 13.9317 13.9358 13.9742 14.0010 14.2048 14.2171 k = 0.0312 0.0541 0.2060 ( 2888 PWs) bands (ev): -43.4043 -43.4043 -20.9610 -20.9608 -18.9404 -18.9403 -18.7881 -18.7878 -3.6994 -3.6994 -3.5418 -3.5418 -3.4213 -3.4211 -2.8665 -2.8665 -2.7186 -2.7186 -2.5813 -2.5813 -1.7673 -1.7673 4.1356 4.1356 4.4525 4.4526 7.8483 7.8554 7.9857 7.9933 8.9622 8.9711 9.0355 9.0444 10.9373 10.9382 11.0608 11.0608 13.7936 13.8130 13.9081 13.9233 14.0352 14.0476 14.2187 14.2295 k = 0.0260 0.0451 0.2060 ( 2884 PWs) bands (ev): -43.4046 -43.4046 -20.9599 -20.9598 -18.9400 -18.9399 -18.7854 -18.7852 -3.7002 -3.7002 -3.5423 -3.5423 -3.4329 -3.4328 -2.8665 -2.8665 -2.7195 -2.7195 -2.5807 -2.5807 -1.7713 -1.7712 4.1250 4.1250 4.4398 4.4399 7.8787 7.8847 7.9749 7.9813 8.9898 8.9952 9.0608 9.0663 10.9364 10.9370 11.0572 11.0572 13.7941 13.8088 13.8876 13.9008 14.0953 14.1043 14.2310 14.2401 k = 0.0208 0.0361 0.2060 ( 2876 PWs) bands (ev): -43.4049 -43.4049 -20.9590 -20.9590 -18.9396 -18.9396 -18.7831 -18.7830 -3.7008 -3.7008 -3.5427 -3.5427 -3.4425 -3.4425 -2.8665 -2.8665 -2.7202 -2.7202 -2.5801 -2.5801 -1.7745 -1.7745 4.1164 4.1164 4.4294 4.4295 7.9041 7.9090 7.9662 7.9712 9.0124 9.0152 9.0821 9.0850 10.9350 10.9353 11.0540 11.0540 13.7938 13.8031 13.8731 13.8818 14.1493 14.1563 14.2414 14.2487 k = 0.0156 0.0271 0.2060 ( 2874 PWs) bands (ev): -43.4051 -43.4051 -20.9584 -20.9584 -18.9393 -18.9393 -18.7814 -18.7814 -3.7013 -3.7013 -3.5430 -3.5430 -3.4500 -3.4500 -2.8664 -2.8664 -2.7208 -2.7208 -2.5797 -2.5797 -1.7770 -1.7770 4.1097 4.1097 4.4213 4.4213 7.9243 7.9279 7.9596 7.9633 9.0297 9.0309 9.0990 9.1002 10.9334 10.9336 11.0514 11.0514 13.7923 13.7968 13.8640 13.8683 14.1946 14.1997 14.2503 14.2556 k = 0.0104 0.0180 0.2060 ( 2882 PWs) bands (ev): -43.4053 -43.4053 -20.9579 -20.9579 -18.9392 -18.9392 -18.7802 -18.7802 -3.7018 -3.7018 -3.5433 -3.5433 -3.4554 -3.4554 -2.8665 -2.8665 -2.7213 -2.7213 -2.5795 -2.5795 -1.7788 -1.7788 4.1049 4.1049 4.4154 4.4154 7.9389 7.9413 7.9551 7.9575 9.0419 9.0423 9.1112 9.1116 10.9320 10.9321 11.0494 11.0494 13.7898 13.7912 13.8587 13.8600 14.2285 14.2315 14.2579 14.2610 k = 0.0052 0.0090 0.2060 ( 2882 PWs) bands (ev): -43.4054 -43.4054 -20.9576 -20.9576 -18.9391 -18.9391 -18.7794 -18.7794 -3.7020 -3.7020 -3.5434 -3.5434 -3.4586 -3.4586 -2.8666 -2.8666 -2.7215 -2.7215 -2.5794 -2.5794 -1.7799 -1.7799 4.1020 4.1020 4.4119 4.4119 7.9476 7.9485 7.9533 7.9542 9.0491 9.0492 9.1186 9.1187 10.9311 10.9311 11.0482 11.0482 13.7874 13.7875 13.8559 13.8560 14.2480 14.2487 14.2654 14.2660 k = 0.0000 0.0000 0.2060 ( 2890 PWs) bands (ev): -43.4055 -43.4055 -20.9576 -20.9576 -18.9390 -18.9390 -18.7792 -18.7792 -3.7021 -3.7021 -3.5435 -3.5435 -3.4597 -3.4597 -2.8667 -2.8667 -2.7216 -2.7216 -2.5794 -2.5794 -1.7803 -1.7803 4.1011 4.1011 4.4107 4.4107 7.9498 7.9498 7.9538 7.9538 9.0515 9.0515 9.1210 9.1210 10.9308 10.9308 11.0478 11.0478 13.7863 13.7863 13.8549 13.8549 14.2532 14.2532 14.2692 14.2692 k = 0.5000 0.2887 0.2060 ( 2936 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6379 -3.6379 -3.5096 -3.5096 -2.8605 -2.8605 -2.7112 -2.7112 -2.5171 -2.5171 -1.9276 -1.9276 -1.2973 -1.2973 5.0975 5.0975 5.8911 5.8911 6.0491 6.0491 7.0123 7.0123 7.5347 7.5347 9.2287 9.2287 10.0900 10.0900 10.4695 10.4695 11.9721 11.9721 14.1127 14.1127 14.5362 14.5362 15.4183 15.4183 k = 0.5000 0.2887 0.1957 ( 2932 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6381 -3.6376 -3.5096 -3.5095 -2.8609 -2.8603 -2.7112 -2.7111 -2.5172 -2.5170 -1.9273 -1.9259 -1.2991 -1.2974 5.0963 5.0965 5.8831 5.8949 6.0427 6.0571 7.0163 7.0202 7.5349 7.5349 9.2282 9.2284 10.0861 10.0910 10.4641 10.4689 11.9690 11.9707 14.1121 14.1128 14.5368 14.5371 15.4197 15.4213 k = 0.5000 0.2887 0.1854 ( 2936 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6384 -3.6376 -3.5097 -3.5095 -2.8617 -2.8605 -2.7113 -2.7111 -2.5173 -2.5170 -1.9250 -1.9220 -1.3027 -1.2995 5.0927 5.0931 5.8719 5.8938 6.0391 6.0660 7.0322 7.0396 7.5354 7.5354 9.2270 9.2274 10.0792 10.0892 10.4526 10.4625 11.9615 11.9648 14.1109 14.1122 14.5387 14.5395 15.4245 15.4288 k = 0.5000 0.2887 0.1751 ( 2924 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1310 -19.1309 -18.8986 -18.8986 -3.6387 -3.6375 -3.5097 -3.5093 -2.8625 -2.8608 -2.7112 -2.7110 -2.5172 -2.5169 -1.9206 -1.9162 -1.3082 -1.3034 5.0869 5.0875 5.8582 5.8873 6.0390 6.0752 7.0592 7.0701 7.5363 7.5363 9.2252 9.2258 10.0690 10.0846 10.4354 10.4505 11.9501 11.9550 14.1093 14.1111 14.5420 14.5434 15.4302 15.4410 k = 0.5000 0.2887 0.1648 ( 2920 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6391 -3.6375 -3.5097 -3.5092 -2.8637 -2.8614 -2.7112 -2.7109 -2.5173 -2.5168 -1.9142 -1.9084 -1.3156 -1.3092 5.0791 5.0799 5.8427 5.8760 6.0425 6.0847 7.0968 7.1106 7.5375 7.5375 9.2226 9.2234 10.0552 10.0767 10.4126 10.4334 11.9354 11.9416 14.1071 14.1095 14.5462 14.5485 15.4240 15.4576 k = 0.5000 0.2887 0.1545 ( 2920 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6396 -3.6376 -3.5098 -3.5092 -2.8650 -2.8623 -2.7112 -2.7109 -2.5174 -2.5168 -1.9059 -1.8986 -1.3247 -1.3168 5.0697 5.0706 5.8259 5.8609 6.0491 6.0942 7.1437 7.1601 7.5389 7.5390 9.2194 9.2205 10.0372 10.0653 10.3849 10.4118 11.9180 11.9254 14.1045 14.1074 14.5511 14.5547 15.3786 15.4224 k = 0.5000 0.2887 0.1442 ( 2914 PWs) bands (ev): -43.3642 -43.3642 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6399 -3.6377 -3.5098 -3.5092 -2.8665 -2.8633 -2.7112 -2.7108 -2.5175 -2.5169 -1.8957 -1.8871 -1.3355 -1.3262 5.0588 5.0599 5.8085 5.8434 6.0580 6.1040 7.1990 7.2176 7.5407 7.5408 9.2158 9.2170 10.0143 10.0494 10.3535 10.3867 11.8990 11.9072 14.1017 14.1049 14.5566 14.5618 15.3112 15.3413 k = 0.5000 0.2887 0.1339 ( 2916 PWs) bands (ev): -43.3642 -43.3642 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6405 -3.6380 -3.5099 -3.5092 -2.8681 -2.8647 -2.7112 -2.7108 -2.5176 -2.5170 -1.8837 -1.8738 -1.3480 -1.3373 5.0469 5.0481 5.7908 5.8246 6.0685 6.1139 7.2615 7.2818 7.5427 7.5428 9.2116 9.2131 9.9858 10.0278 10.3199 10.3592 11.8789 11.8878 14.0986 14.1021 14.5624 14.5694 15.2422 15.2641 k = 0.5000 0.2887 0.1236 ( 2916 PWs) bands (ev): -43.3642 -43.3642 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6410 -3.6384 -3.5099 -3.5092 -2.8698 -2.8661 -2.7112 -2.7108 -2.5177 -2.5170 -1.8700 -1.8589 -1.3621 -1.3501 5.0343 5.0355 5.7733 5.8053 6.0801 6.1238 7.3299 7.3519 7.5449 7.5451 9.2072 9.2089 9.9508 9.9992 10.2862 10.3308 11.8587 11.8680 14.0954 14.0991 14.5681 14.5775 15.1762 15.1915 k = 0.5000 0.2887 0.1133 ( 2912 PWs) bands (ev): -43.3642 -43.3642 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6414 -3.6387 -3.5099 -3.5091 -2.8714 -2.8676 -2.7112 -2.7108 -2.5177 -2.5171 -1.8548 -1.8424 -1.3777 -1.3644 5.0213 5.0226 5.7564 5.7863 6.0922 6.1337 7.4032 7.4264 7.5474 7.5477 9.2024 9.2044 9.9087 9.9620 10.2545 10.3027 11.8389 11.8483 14.0922 14.0959 14.5737 14.5857 15.1149 15.1241 k = 0.5000 0.2887 0.1030 ( 2918 PWs) bands (ev): -43.3642 -43.3642 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6419 -3.6392 -3.5100 -3.5092 -2.8731 -2.8693 -2.7113 -2.7109 -2.5178 -2.5172 -1.8381 -1.8246 -1.3946 -1.3802 5.0083 5.0096 5.7405 5.7679 6.1046 6.1434 7.4794 7.5033 7.5513 7.5515 9.1976 9.1998 9.8595 9.9154 10.2267 10.2760 11.8202 11.8295 14.0890 14.0927 14.5790 14.5938 15.0587 15.0621 k = 0.5000 0.2887 0.0927 ( 2922 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6424 -3.6397 -3.5101 -3.5093 -2.8747 -2.8709 -2.7114 -2.7110 -2.5179 -2.5173 -1.8200 -1.8054 -1.4129 -1.3974 4.9955 4.9968 5.7257 5.7506 6.1170 6.1526 7.5411 7.5478 7.5727 7.5902 9.1927 9.1952 9.8035 9.8597 10.2035 10.2516 11.8029 11.8118 14.0859 14.0896 14.5840 14.6018 15.0056 15.0078 k = 0.5000 0.2887 0.0824 ( 2922 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6427 -3.6401 -3.5101 -3.5093 -2.8762 -2.8726 -2.7114 -2.7110 -2.5180 -2.5173 -1.8007 -1.7852 -1.4323 -1.4159 4.9834 4.9846 5.7122 5.7345 6.1289 6.1613 7.5507 7.5520 7.6476 7.6707 9.1879 9.1907 9.7419 9.7965 10.1849 10.2298 11.7873 11.7957 14.0830 14.0865 14.5887 14.6093 14.9549 14.9622 k = 0.5000 0.2887 0.0721 ( 2922 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6431 -3.6406 -3.5101 -3.5094 -2.8775 -2.8741 -2.7114 -2.7110 -2.5180 -2.5174 -1.7803 -1.7640 -1.4527 -1.4355 4.9721 4.9732 5.7003 5.7199 6.1404 6.1691 7.5538 7.5545 7.7292 7.7527 9.1832 9.1864 9.6763 9.7280 10.1702 10.2106 11.7736 11.7813 14.0804 14.0836 14.5931 14.6162 14.9100 14.9220 k = 0.5000 0.2887 0.0618 ( 2930 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6434 -3.6412 -3.5101 -3.5095 -2.8788 -2.8757 -2.7114 -2.7111 -2.5181 -2.5176 -1.7591 -1.7419 -1.4740 -1.4561 4.9619 4.9629 5.6900 5.7068 6.1510 6.1760 7.5562 7.5566 7.8101 7.8331 9.1789 9.1824 9.6091 9.6569 10.1587 10.1939 11.7619 11.7687 14.0781 14.0809 14.5973 14.6223 14.8710 14.8869 k = 0.5000 0.2887 0.0515 ( 2928 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1309 -18.8986 -18.8986 -3.6435 -3.6416 -3.5101 -3.5096 -2.8797 -2.8771 -2.7114 -2.7111 -2.5181 -2.5177 -1.7370 -1.7192 -1.4961 -1.4777 4.9529 4.9538 5.6814 5.6954 6.1607 6.1817 7.5581 7.5585 7.8879 7.9097 9.1750 9.1787 9.5429 9.5860 10.1501 10.1797 11.7521 11.7580 14.0761 14.0785 14.6014 14.6273 14.8383 14.8568 k = 0.5000 0.2887 0.0412 ( 2928 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1309 -18.8986 -18.8986 -3.6437 -3.6421 -3.5101 -3.5096 -2.8805 -2.8783 -2.7114 -2.7112 -2.5181 -2.5178 -1.7142 -1.6960 -1.5187 -1.4999 4.9454 4.9461 5.6745 5.6858 6.1692 6.1862 7.5597 7.5600 7.9600 7.9796 9.1715 9.1754 9.4811 9.5185 10.1439 10.1677 11.7443 11.7492 14.0745 14.0765 14.6057 14.6308 14.8121 14.8315 k = 0.5000 0.2887 0.0309 ( 2930 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6437 -3.6425 -3.5101 -3.5097 -2.8810 -2.8793 -2.7114 -2.7112 -2.5181 -2.5178 -1.6911 -1.6726 -1.5416 -1.5227 4.9394 4.9400 5.6694 5.6779 6.1765 6.1893 7.5610 7.5612 8.0231 8.0395 9.1687 9.1725 9.4277 9.4581 10.1399 10.1578 11.7385 11.7422 14.0732 14.0748 14.6102 14.6324 14.7928 14.8107 k = 0.5000 0.2887 0.0206 ( 2930 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6437 -3.6429 -3.5100 -3.5097 -2.8814 -2.8802 -2.7114 -2.7112 -2.5181 -2.5179 -1.6679 -1.6497 -1.5641 -1.5456 4.9351 4.9355 5.6662 5.6719 6.1824 6.1910 7.5620 7.5621 8.0736 8.0856 9.1668 9.1699 9.3869 9.4088 10.1380 10.1499 11.7346 11.7371 14.0724 14.0735 14.6150 14.6318 14.7805 14.7945 k = 0.5000 0.2887 0.0103 ( 2930 PWs) bands (ev): -43.3644 -43.3644 -21.0924 -21.0924 -19.1310 -19.1310 -18.8986 -18.8986 -3.6436 -3.6432 -3.5099 -3.5098 -2.8814 -2.8808 -2.7114 -2.7113 -2.5181 -2.5180 -1.6454 -1.6298 -1.5838 -1.5681 4.9326 4.9328 5.6648 5.6677 6.1868 6.1911 7.5626 7.5626 8.1075 8.1139 9.1658 9.1677 9.3630 9.3745 10.1380 10.1440 11.7325 11.7337 14.0720 14.0726 14.6201 14.6292 14.7752 14.7829 k = 0.5000 0.2887-0.0000 ( 2926 PWs) bands (ev): -43.3643 -43.3643 -21.0923 -21.0923 -19.1309 -19.1309 -18.8986 -18.8986 -3.6435 -3.6435 -3.5098 -3.5098 -2.8813 -2.8813 -2.7113 -2.7113 -2.5179 -2.5179 -1.6272 -1.6272 -1.5863 -1.5863 4.9318 4.9318 5.6653 5.6653 6.1898 6.1898 7.5628 7.5628 8.1215 8.1215 9.1662 9.1662 9.3587 9.3587 10.1400 10.1400 11.7322 11.7322 14.0721 14.0721 14.6250 14.6250 14.7763 14.7763 k = 0.3333 0.5774-0.0000 ( 2943 PWs) bands (ev): -43.3593 -43.3593 -21.1267 -21.0765 -19.1633 -19.0645 -18.9815 -18.9514 -3.6196 -3.6175 -3.4743 -3.4738 -2.8638 -2.8572 -2.6630 -2.6628 -2.6044 -2.6035 -1.4988 -1.4969 -1.4753 -1.4055 5.5574 5.5783 5.8059 5.8399 6.2163 6.2591 6.6715 6.7278 7.8430 7.8530 7.9774 8.0298 11.0269 11.1623 11.1938 11.2067 11.6084 11.8387 12.0764 12.2707 13.0028 13.0145 14.5956 14.6201 k = 0.3333 0.5774 0.0103 ( 2937 PWs) bands (ev): -43.3592 -43.3592 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6195 -3.6175 -3.4743 -3.4737 -2.8637 -2.8572 -2.6629 -2.6628 -2.6044 -2.6035 -1.5109 -1.5001 -1.4631 -1.4022 5.5570 5.5779 5.8072 5.8412 6.2169 6.2598 6.6722 6.7286 7.8380 7.8481 7.9759 8.0283 11.0275 11.1630 11.2009 11.2137 11.6106 11.8408 12.0727 12.2665 13.0026 13.0143 14.6021 14.6263 k = 0.3333 0.5774 0.0206 ( 2937 PWs) bands (ev): -43.3592 -43.3592 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6195 -3.6175 -3.4743 -3.4737 -2.8635 -2.8571 -2.6629 -2.6628 -2.6044 -2.6035 -1.5301 -1.5086 -1.4438 -1.3935 5.5556 5.5766 5.8112 5.8452 6.2188 6.2616 6.6744 6.7310 7.8233 7.8333 7.9714 8.0239 11.0293 11.1652 11.2220 11.2345 11.6169 11.8470 12.0614 12.2541 13.0021 13.0137 14.6215 14.6449 k = 0.3333 0.5774 0.0309 ( 2931 PWs) bands (ev): -43.3592 -43.3592 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6194 -3.6174 -3.4742 -3.4737 -2.8631 -2.8569 -2.6628 -2.6627 -2.6043 -2.6034 -1.5500 -1.5203 -1.4238 -1.3814 5.5535 5.5745 5.8177 5.8518 6.2220 6.2647 6.6780 6.7349 7.7993 7.8094 7.9639 8.0166 11.0323 11.1687 11.2566 11.2684 11.6273 11.8573 12.0432 12.2341 13.0011 13.0128 14.6532 14.6753 k = 0.3333 0.5774 0.0412 ( 2925 PWs) bands (ev): -43.3591 -43.3591 -21.1267 -21.0765 -19.1633 -19.0644 -18.9814 -18.9514 -3.6193 -3.6174 -3.4742 -3.4737 -2.8627 -2.8567 -2.6627 -2.6626 -2.6043 -2.6034 -1.5697 -1.5336 -1.4039 -1.3676 5.5506 5.5716 5.8269 5.8609 6.2263 6.2689 6.6828 6.7402 7.7668 7.7770 7.9537 8.0067 11.0365 11.1737 11.3036 11.3147 11.6417 11.8713 12.0187 12.2071 12.9998 13.0115 14.6966 14.7168 k = 0.3333 0.5774 0.0515 ( 2919 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6192 -3.6174 -3.4741 -3.4736 -2.8621 -2.8565 -2.6627 -2.6626 -2.6043 -2.6034 -1.5890 -1.5475 -1.3843 -1.3531 5.5470 5.5681 5.8386 5.8726 6.2317 6.2742 6.6888 6.7467 7.7270 7.7371 7.9409 7.9944 11.0420 11.1803 11.3619 11.3719 11.6596 11.8888 11.9886 12.1741 12.9982 13.0097 14.7505 14.7688 k = 0.3333 0.5774 0.0618 ( 2919 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6191 -3.6174 -3.4741 -3.4736 -2.8615 -2.8562 -2.6627 -2.6626 -2.6043 -2.6034 -1.6077 -1.5615 -1.3653 -1.3383 5.5428 5.5640 5.8526 5.8868 6.2381 6.2804 6.6957 6.7543 7.6809 7.6909 7.9259 7.9800 11.0489 11.1883 11.4301 11.4387 11.6809 11.9093 11.9540 12.1360 12.9962 13.0076 14.8139 14.8300 k = 0.3333 0.5774 0.0721 ( 2913 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6189 -3.6173 -3.4741 -3.4736 -2.8608 -2.8559 -2.6626 -2.6626 -2.6043 -2.6034 -1.6257 -1.5753 -1.3469 -1.3237 5.5381 5.5595 5.8690 5.9033 6.2453 6.2875 6.7035 6.7628 7.6297 7.6397 7.9090 7.9638 11.0571 11.1979 11.5063 11.5133 11.7053 11.9159 11.9324 12.0940 12.9939 13.0051 14.8857 14.8995 k = 0.3333 0.5774 0.0824 ( 2913 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6187 -3.6173 -3.4741 -3.4736 -2.8601 -2.8556 -2.6626 -2.6626 -2.6043 -2.6034 -1.6429 -1.5886 -1.3294 -1.3095 5.5332 5.5546 5.8876 5.9219 6.2533 6.2953 6.7118 6.7720 7.5747 7.5846 7.8907 7.9462 11.0666 11.2091 11.5884 11.5934 11.7330 11.8761 11.9575 12.0489 12.9913 13.0022 14.9647 14.9761 k = 0.3333 0.5774 0.0927 ( 2913 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6186 -3.6174 -3.4741 -3.4736 -2.8593 -2.8553 -2.6627 -2.6625 -2.6043 -2.6034 -1.6592 -1.6013 -1.3127 -1.2958 5.5280 5.5496 5.9080 5.9425 6.2619 6.3037 6.7206 6.7815 7.5171 7.5268 7.8713 7.9277 11.0777 11.2220 11.6721 11.6746 11.7662 11.8379 11.9828 12.0031 12.9885 12.9990 15.0498 15.0587 k = 0.3333 0.5774 0.1030 ( 2901 PWs) bands (ev): -43.3588 -43.3588 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6183 -3.6172 -3.4741 -3.4735 -2.8584 -2.8549 -2.6626 -2.6625 -2.6043 -2.6033 -1.6744 -1.6132 -1.2971 -1.2828 5.5228 5.5445 5.9303 5.9649 6.2709 6.3125 6.7295 6.7913 7.4581 7.4676 7.8514 7.9087 11.0901 11.2366 11.7342 11.7449 11.8144 11.8235 11.9518 12.0130 12.9855 12.9955 15.1399 15.1459 k = 0.3333 0.5774 0.1133 ( 2907 PWs) bands (ev): -43.3589 -43.3589 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6182 -3.6173 -3.4741 -3.4735 -2.8576 -2.8546 -2.6627 -2.6625 -2.6043 -2.6033 -1.6884 -1.6243 -1.2827 -1.2708 5.5176 5.5394 5.9538 5.9887 6.2800 6.3214 6.7383 6.8010 7.3989 7.4082 7.8315 7.8896 11.1041 11.2530 11.7203 11.7906 11.8864 11.8888 11.9027 12.0407 12.9824 12.9917 15.2328 15.2338 k = 0.3333 0.5774 0.1236 ( 2907 PWs) bands (ev): -43.3589 -43.3589 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6182 -3.6174 -3.4741 -3.4735 -2.8569 -2.8544 -2.6627 -2.6625 -2.6042 -2.6033 -1.7013 -1.6344 -1.2695 -1.2597 5.5126 5.5346 5.9783 6.0135 6.2891 6.3302 6.7469 6.8104 7.3406 7.3496 7.8119 7.8709 11.1196 11.2713 11.6805 11.8235 11.8534 11.9753 11.9753 12.0681 12.9792 12.9877 15.2059 15.2902 k = 0.3333 0.5774 0.1339 ( 2904 PWs) bands (ev): -43.3589 -43.3589 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6180 -3.6174 -3.4741 -3.4735 -2.8561 -2.8540 -2.6627 -2.6624 -2.6042 -2.6032 -1.7128 -1.6436 -1.2576 -1.2497 5.5080 5.5301 6.0033 6.0388 6.2978 6.3388 6.7550 6.8193 7.2845 7.2932 7.7933 7.8531 11.1366 11.2915 11.6376 11.8045 11.8518 12.0627 12.0659 12.0946 12.9761 12.9837 15.1283 15.2156 k = 0.3333 0.5774 0.1442 ( 2910 PWs) bands (ev): -43.3589 -43.3589 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6180 -3.6174 -3.4741 -3.4735 -2.8554 -2.8538 -2.6628 -2.6625 -2.6042 -2.6033 -1.7229 -1.6516 -1.2471 -1.2408 5.5037 5.5259 6.0280 6.0639 6.3061 6.3468 6.7624 6.8275 7.2317 7.2401 7.7760 7.8366 11.1551 11.3136 11.5948 11.7565 11.8771 12.1193 12.1468 12.1532 12.9732 12.9797 15.0531 15.1447 k = 0.3333 0.5774 0.1545 ( 2910 PWs) bands (ev): -43.3589 -43.3589 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6179 -3.6175 -3.4741 -3.4735 -2.8548 -2.8536 -2.6628 -2.6624 -2.6042 -2.6033 -1.7317 -1.6584 -1.2381 -1.2332 5.4999 5.5222 6.0516 6.0880 6.3136 6.3541 6.7690 6.8347 7.1835 7.1915 7.7605 7.8218 11.1747 11.3376 11.5535 11.7098 11.8995 12.1416 12.2244 12.2341 12.9706 12.9760 14.9833 15.0791 k = 0.3333 0.5774 0.1648 ( 2919 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6178 -3.6175 -3.4742 -3.4736 -2.8543 -2.8534 -2.6629 -2.6625 -2.6044 -2.6034 -1.7389 -1.6641 -1.2307 -1.2269 5.4967 5.5191 6.0733 6.1101 6.3201 6.3605 6.7746 6.8408 7.1413 7.1490 7.7472 7.8092 11.1953 11.3635 11.5146 11.6650 11.9185 12.1608 12.2928 12.3058 12.9684 12.9725 14.9213 15.0211 k = 0.3333 0.5774 0.1751 ( 2919 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6178 -3.6175 -3.4742 -3.4736 -2.8539 -2.8533 -2.6629 -2.6625 -2.6044 -2.6034 -1.7445 -1.6686 -1.2249 -1.2219 5.4942 5.5166 6.0919 6.1291 6.3253 6.3657 6.7791 6.8457 7.1065 7.1138 7.7365 7.7989 11.2160 11.3911 11.4793 11.6224 11.9338 12.1765 12.3494 12.3656 12.9667 12.9697 14.8696 14.9727 k = 0.3333 0.5774 0.1854 ( 2913 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1632 -19.0644 -18.9814 -18.9514 -3.6176 -3.6175 -3.4742 -3.4736 -2.8535 -2.8531 -2.6629 -2.6624 -2.6044 -2.6034 -1.7486 -1.6718 -1.2206 -1.2183 5.4923 5.5148 6.1062 6.1438 6.3292 6.3695 6.7824 6.8492 7.0804 7.0874 7.7286 7.7914 11.2352 11.4197 11.4495 11.5829 11.9451 12.1880 12.3919 12.4106 12.9655 12.9675 14.8304 14.9362 k = 0.3333 0.5774 0.1957 ( 2919 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6176 -3.6175 -3.4743 -3.4736 -2.8534 -2.8530 -2.6629 -2.6625 -2.6044 -2.6034 -1.7510 -1.6737 -1.2181 -1.2162 5.4912 5.5137 6.1153 6.1532 6.3316 6.3718 6.7844 6.8513 7.0642 7.0710 7.7238 7.7868 11.2500 11.4282 11.4468 11.5491 11.9519 12.1951 12.4183 12.4387 12.9648 12.9661 14.8059 14.9135 k = 0.3333 0.5774 0.2060 ( 2916 PWs) bands (ev): -43.3590 -43.3590 -21.1267 -21.0765 -19.1633 -19.0645 -18.9814 -18.9514 -3.6175 -3.6174 -3.4743 -3.4736 -2.8532 -2.8530 -2.6629 -2.6625 -2.6044 -2.6035 -1.7518 -1.6744 -1.2172 -1.2154 5.4908 5.5133 6.1184 6.1564 6.3324 6.3726 6.7851 6.8520 7.0587 7.0655 7.7222 7.7853 11.2558 11.4202 11.4613 11.5324 11.9542 12.1975 12.4272 12.4483 12.9646 12.9657 14.7975 14.9057 Writing output data file NbInS2.save init_run : 5.00s CPU 13.40s WALL ( 1 calls) electrons : 405.24s CPU 411.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.21s CPU 1.56s WALL ( 1 calls) Called by electrons: c_bands : 405.15s CPU 410.97s WALL ( 1 calls) v_of_rho : 0.06s CPU 0.92s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.06s CPU 0.54s WALL ( 1 calls) newd : 0.42s CPU 0.55s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.11s WALL ( 371 calls) cegterg : 357.56s CPU 360.26s WALL ( 519 calls) Called by sum_band: Called by *egterg: h_psi : 166.86s CPU 171.92s WALL ( 8386 calls) s_psi : 23.14s CPU 23.50s WALL ( 8386 calls) g_psi : 0.35s CPU 0.39s WALL ( 7496 calls) cdiaghg : 124.13s CPU 122.74s WALL ( 7867 calls) cegterg:over : 34.91s CPU 32.53s WALL ( 7496 calls) cegterg:upda : 5.05s CPU 7.29s WALL ( 7496 calls) cegterg:last : 4.84s CPU 5.51s WALL ( 1632 calls) Called by h_psi: h_psi:vloc : 125.07s CPU 128.63s WALL ( 8386 calls) h_psi:vnl : 41.66s CPU 42.82s WALL ( 8386 calls) add_vuspsi : 13.93s CPU 16.88s WALL ( 8386 calls) General routines calbec : 27.70s CPU 25.89s WALL ( 8386 calls) fft : 0.24s CPU 1.35s WALL ( 19 calls) ffts : 0.00s CPU 0.04s WALL ( 4 calls) fftw : 121.75s CPU 122.96s WALL ( 968840 calls) interpolate : 0.03s CPU 0.08s WALL ( 4 calls) davcio : 0.06s CPU 2.53s WALL ( 742 calls) Parallel routines fft_scatter : 86.14s CPU 82.06s WALL ( 968863 calls) PWSCF : 7m40.31s CPU 9m17.47s WALL This run was terminated on: 13:58:48 9Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=