Program PWSCF v.5.1.1 starts on 16Jul2015 at 16:26:42 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 32 processors R & G space division: proc/nbgrp/npool/nimage = 32 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: ./NiS2.save/ file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 27 19 6 865 511 88 Max 28 20 7 872 536 92 Sum 891 633 199 27793 16715 2893 bravais-lattice index = 14 lattice parameter (alat) = 5.8521 a.u. unit-cell volume = 454.7042 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 42.0000 Ry charge density cutoff = 236.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.852103 celldm(2)= 1.370092 celldm(3)= 1.655935 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.370092 0.000000 ) a(3) = ( 0.000000 0.000000 1.655935 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.729878 -0.000000 ) b(3) = ( 0.000000 0.000000 0.603888 ) 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 Ni read from file: /home/autes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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) Ni 10.00 58.69340 Ni( 1.00) 8 Sym. Ops., with inversion, found ( 4 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.6850459 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8279676 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.6850459 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8279676 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.6850459 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8279676 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.6850459 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8279676 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 0 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 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 C2' -C2' 3 -3 C2'' -C2'' 4 -4 i 5 s_v -s_v 6 -6 s_v'-s_v' 7 -7 s_v''-s_v' 8 -8 -E -1 -i -5 Cartesian axes number of k points= 492 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 2) = ( 0.0098039 -0.0000000 -0.0000000), wk = 0.0020325 k( 3) = ( 0.0196078 -0.0000000 -0.0000000), wk = 0.0020325 k( 4) = ( 0.0294118 -0.0000000 -0.0000000), wk = 0.0020325 k( 5) = ( 0.0392157 -0.0000000 -0.0000000), wk = 0.0020325 k( 6) = ( 0.0490196 -0.0000000 -0.0000000), wk = 0.0020325 k( 7) = ( 0.0588235 -0.0000000 -0.0000000), wk = 0.0020325 k( 8) = ( 0.0686275 -0.0000000 -0.0000000), wk = 0.0020325 k( 9) = ( 0.0784314 -0.0000000 -0.0000000), wk = 0.0020325 k( 10) = ( 0.0882353 -0.0000000 -0.0000000), wk = 0.0020325 k( 11) = ( 0.0980392 -0.0000000 -0.0000000), wk = 0.0020325 k( 12) = ( 0.1078431 -0.0000000 -0.0000000), wk = 0.0020325 k( 13) = ( 0.1176471 -0.0000000 -0.0000000), wk = 0.0020325 k( 14) = ( 0.1274510 -0.0000000 -0.0000000), wk = 0.0020325 k( 15) = ( 0.1372549 -0.0000000 -0.0000000), wk = 0.0020325 k( 16) = ( 0.1470588 -0.0000000 -0.0000000), wk = 0.0020325 k( 17) = ( 0.1568627 -0.0000000 -0.0000000), wk = 0.0020325 k( 18) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0020325 k( 19) = ( 0.1764706 -0.0000000 -0.0000000), wk = 0.0020325 k( 20) = ( 0.1862745 -0.0000000 -0.0000000), wk = 0.0020325 k( 21) = ( 0.1960784 -0.0000000 -0.0000000), wk = 0.0020325 k( 22) = ( 0.2058823 -0.0000000 -0.0000000), wk = 0.0020325 k( 23) = ( 0.2156863 -0.0000000 -0.0000000), wk = 0.0020325 k( 24) = ( 0.2254902 -0.0000000 -0.0000000), wk = 0.0020325 k( 25) = ( 0.2352941 -0.0000000 -0.0000000), wk = 0.0020325 k( 26) = ( 0.2450980 -0.0000000 -0.0000000), wk = 0.0020325 k( 27) = ( 0.2549020 -0.0000000 -0.0000000), wk = 0.0020325 k( 28) = ( 0.2647059 -0.0000000 -0.0000000), wk = 0.0020325 k( 29) = ( 0.2745098 -0.0000000 -0.0000000), wk = 0.0020325 k( 30) = ( 0.2843137 -0.0000000 -0.0000000), wk = 0.0020325 k( 31) = ( 0.2941177 -0.0000000 -0.0000000), wk = 0.0020325 k( 32) = ( 0.3039216 -0.0000000 -0.0000000), wk = 0.0020325 k( 33) = ( 0.3137255 -0.0000000 -0.0000000), wk = 0.0020325 k( 34) = ( 0.3235294 -0.0000000 -0.0000000), wk = 0.0020325 k( 35) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0020325 k( 36) = ( 0.3431373 -0.0000000 -0.0000000), wk = 0.0020325 k( 37) = ( 0.3529412 -0.0000000 -0.0000000), wk = 0.0020325 k( 38) = ( 0.3627451 -0.0000000 -0.0000000), wk = 0.0020325 k( 39) = ( 0.3725490 -0.0000000 -0.0000000), wk = 0.0020325 k( 40) = ( 0.3823529 -0.0000000 -0.0000000), wk = 0.0020325 k( 41) = ( 0.3921569 -0.0000000 -0.0000000), wk = 0.0020325 k( 42) = ( 0.4019608 -0.0000000 -0.0000000), wk = 0.0020325 k( 43) = ( 0.4117647 -0.0000000 -0.0000000), wk = 0.0020325 k( 44) = ( 0.4215686 -0.0000000 -0.0000000), wk = 0.0020325 k( 45) = ( 0.4313726 -0.0000000 -0.0000000), wk = 0.0020325 k( 46) = ( 0.4411765 -0.0000000 -0.0000000), wk = 0.0020325 k( 47) = ( 0.4509804 -0.0000000 -0.0000000), wk = 0.0020325 k( 48) = ( 0.4607843 -0.0000000 -0.0000000), wk = 0.0020325 k( 49) = ( 0.4705882 -0.0000000 -0.0000000), wk = 0.0020325 k( 50) = ( 0.4803922 -0.0000000 -0.0000000), wk = 0.0020325 k( 51) = ( 0.4901961 -0.0000000 -0.0000000), wk = 0.0020325 k( 52) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 53) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 54) = ( 0.5000000 0.0096037 -0.0000000), wk = 0.0020325 k( 55) = ( 0.5000000 0.0192073 -0.0000000), wk = 0.0020325 k( 56) = ( 0.5000000 0.0288110 -0.0000000), wk = 0.0020325 k( 57) = ( 0.5000000 0.0384146 -0.0000000), wk = 0.0020325 k( 58) = ( 0.5000000 0.0480183 -0.0000000), wk = 0.0020325 k( 59) = ( 0.5000000 0.0576220 -0.0000000), wk = 0.0020325 k( 60) = ( 0.5000000 0.0672256 -0.0000000), wk = 0.0020325 k( 61) = ( 0.5000000 0.0768293 -0.0000000), wk = 0.0020325 k( 62) = ( 0.5000000 0.0864329 -0.0000000), wk = 0.0020325 k( 63) = ( 0.5000000 0.0960366 -0.0000000), wk = 0.0020325 k( 64) = ( 0.5000000 0.1056403 -0.0000000), wk = 0.0020325 k( 65) = ( 0.5000000 0.1152439 -0.0000000), wk = 0.0020325 k( 66) = ( 0.5000000 0.1248476 -0.0000000), wk = 0.0020325 k( 67) = ( 0.5000000 0.1344512 -0.0000000), wk = 0.0020325 k( 68) = ( 0.5000000 0.1440549 -0.0000000), wk = 0.0020325 k( 69) = ( 0.5000000 0.1536586 -0.0000000), wk = 0.0020325 k( 70) = ( 0.5000000 0.1632622 -0.0000000), wk = 0.0020325 k( 71) = ( 0.5000000 0.1728659 -0.0000000), wk = 0.0020325 k( 72) = ( 0.5000000 0.1824695 -0.0000000), wk = 0.0020325 k( 73) = ( 0.5000000 0.1920732 -0.0000000), wk = 0.0020325 k( 74) = ( 0.5000000 0.2016769 -0.0000000), wk = 0.0020325 k( 75) = ( 0.5000000 0.2112805 -0.0000000), wk = 0.0020325 k( 76) = ( 0.5000000 0.2208842 -0.0000000), wk = 0.0020325 k( 77) = ( 0.5000000 0.2304878 -0.0000000), wk = 0.0020325 k( 78) = ( 0.5000000 0.2400915 -0.0000000), wk = 0.0020325 k( 79) = ( 0.5000000 0.2496952 -0.0000000), wk = 0.0020325 k( 80) = ( 0.5000000 0.2592988 -0.0000000), wk = 0.0020325 k( 81) = ( 0.5000000 0.2689025 -0.0000000), wk = 0.0020325 k( 82) = ( 0.5000000 0.2785061 -0.0000000), wk = 0.0020325 k( 83) = ( 0.5000000 0.2881098 -0.0000000), wk = 0.0020325 k( 84) = ( 0.5000000 0.2977135 -0.0000000), wk = 0.0020325 k( 85) = ( 0.5000000 0.3073171 -0.0000000), wk = 0.0020325 k( 86) = ( 0.5000000 0.3169208 -0.0000000), wk = 0.0020325 k( 87) = ( 0.5000000 0.3265244 -0.0000000), wk = 0.0020325 k( 88) = ( 0.5000000 0.3361281 -0.0000000), wk = 0.0020325 k( 89) = ( 0.5000000 0.3457318 -0.0000000), wk = 0.0020325 k( 90) = ( 0.5000000 0.3553354 -0.0000000), wk = 0.0020325 k( 91) = ( 0.5000000 0.3649391 -0.0000000), wk = 0.0020325 k( 92) = ( 0.5000000 0.3649391 -0.0000000), wk = 0.0020325 k( 93) = ( 0.4901961 0.3649391 -0.0000000), wk = 0.0020325 k( 94) = ( 0.4803922 0.3649391 -0.0000000), wk = 0.0020325 k( 95) = ( 0.4705882 0.3649391 -0.0000000), wk = 0.0020325 k( 96) = ( 0.4607843 0.3649391 -0.0000000), wk = 0.0020325 k( 97) = ( 0.4509804 0.3649391 -0.0000000), wk = 0.0020325 k( 98) = ( 0.4411765 0.3649391 -0.0000000), wk = 0.0020325 k( 99) = ( 0.4313726 0.3649391 -0.0000000), wk = 0.0020325 k( 100) = ( 0.4215686 0.3649391 -0.0000000), wk = 0.0020325 k( 101) = ( 0.4117647 0.3649391 -0.0000000), wk = 0.0020325 k( 102) = ( 0.4019608 0.3649391 -0.0000000), wk = 0.0020325 k( 103) = ( 0.3921569 0.3649391 -0.0000000), wk = 0.0020325 k( 104) = ( 0.3823529 0.3649391 -0.0000000), wk = 0.0020325 k( 105) = ( 0.3725490 0.3649391 -0.0000000), wk = 0.0020325 k( 106) = ( 0.3627451 0.3649391 -0.0000000), wk = 0.0020325 k( 107) = ( 0.3529412 0.3649391 -0.0000000), wk = 0.0020325 k( 108) = ( 0.3431373 0.3649391 -0.0000000), wk = 0.0020325 k( 109) = ( 0.3333333 0.3649391 -0.0000000), wk = 0.0020325 k( 110) = ( 0.3235294 0.3649391 -0.0000000), wk = 0.0020325 k( 111) = ( 0.3137255 0.3649391 -0.0000000), wk = 0.0020325 k( 112) = ( 0.3039216 0.3649391 -0.0000000), wk = 0.0020325 k( 113) = ( 0.2941177 0.3649391 -0.0000000), wk = 0.0020325 k( 114) = ( 0.2843137 0.3649391 -0.0000000), wk = 0.0020325 k( 115) = ( 0.2745098 0.3649391 -0.0000000), wk = 0.0020325 k( 116) = ( 0.2647059 0.3649391 -0.0000000), wk = 0.0020325 k( 117) = ( 0.2549020 0.3649391 -0.0000000), wk = 0.0020325 k( 118) = ( 0.2450980 0.3649391 -0.0000000), wk = 0.0020325 k( 119) = ( 0.2352941 0.3649391 -0.0000000), wk = 0.0020325 k( 120) = ( 0.2254902 0.3649391 -0.0000000), wk = 0.0020325 k( 121) = ( 0.2156863 0.3649391 -0.0000000), wk = 0.0020325 k( 122) = ( 0.2058823 0.3649391 -0.0000000), wk = 0.0020325 k( 123) = ( 0.1960784 0.3649391 -0.0000000), wk = 0.0020325 k( 124) = ( 0.1862745 0.3649391 -0.0000000), wk = 0.0020325 k( 125) = ( 0.1764706 0.3649391 -0.0000000), wk = 0.0020325 k( 126) = ( 0.1666667 0.3649391 -0.0000000), wk = 0.0020325 k( 127) = ( 0.1568627 0.3649391 -0.0000000), wk = 0.0020325 k( 128) = ( 0.1470588 0.3649391 -0.0000000), wk = 0.0020325 k( 129) = ( 0.1372549 0.3649391 -0.0000000), wk = 0.0020325 k( 130) = ( 0.1274510 0.3649391 -0.0000000), wk = 0.0020325 k( 131) = ( 0.1176471 0.3649391 -0.0000000), wk = 0.0020325 k( 132) = ( 0.1078431 0.3649391 -0.0000000), wk = 0.0020325 k( 133) = ( 0.0980392 0.3649391 -0.0000000), wk = 0.0020325 k( 134) = ( 0.0882353 0.3649391 -0.0000000), wk = 0.0020325 k( 135) = ( 0.0784314 0.3649391 -0.0000000), wk = 0.0020325 k( 136) = ( 0.0686275 0.3649391 -0.0000000), wk = 0.0020325 k( 137) = ( 0.0588235 0.3649391 -0.0000000), wk = 0.0020325 k( 138) = ( 0.0490196 0.3649391 -0.0000000), wk = 0.0020325 k( 139) = ( 0.0392157 0.3649391 -0.0000000), wk = 0.0020325 k( 140) = ( 0.0294118 0.3649391 -0.0000000), wk = 0.0020325 k( 141) = ( 0.0196078 0.3649391 -0.0000000), wk = 0.0020325 k( 142) = ( 0.0098039 0.3649391 -0.0000000), wk = 0.0020325 k( 143) = ( 0.0000000 0.3649391 -0.0000000), wk = 0.0020325 k( 144) = ( 0.0000000 0.3649391 -0.0000000), wk = 0.0020325 k( 145) = ( 0.0000000 0.3553354 -0.0000000), wk = 0.0020325 k( 146) = ( 0.0000000 0.3457318 -0.0000000), wk = 0.0020325 k( 147) = ( 0.0000000 0.3361281 -0.0000000), wk = 0.0020325 k( 148) = ( 0.0000000 0.3265244 -0.0000000), wk = 0.0020325 k( 149) = ( 0.0000000 0.3169208 -0.0000000), wk = 0.0020325 k( 150) = ( 0.0000000 0.3073171 -0.0000000), wk = 0.0020325 k( 151) = ( 0.0000000 0.2977135 -0.0000000), wk = 0.0020325 k( 152) = ( 0.0000000 0.2881098 -0.0000000), wk = 0.0020325 k( 153) = ( 0.0000000 0.2785061 -0.0000000), wk = 0.0020325 k( 154) = ( 0.0000000 0.2689025 -0.0000000), wk = 0.0020325 k( 155) = ( 0.0000000 0.2592988 -0.0000000), wk = 0.0020325 k( 156) = ( 0.0000000 0.2496952 -0.0000000), wk = 0.0020325 k( 157) = ( 0.0000000 0.2400915 -0.0000000), wk = 0.0020325 k( 158) = ( 0.0000000 0.2304878 -0.0000000), wk = 0.0020325 k( 159) = ( 0.0000000 0.2208842 -0.0000000), wk = 0.0020325 k( 160) = ( 0.0000000 0.2112805 -0.0000000), wk = 0.0020325 k( 161) = ( 0.0000000 0.2016769 -0.0000000), wk = 0.0020325 k( 162) = ( 0.0000000 0.1920732 -0.0000000), wk = 0.0020325 k( 163) = ( 0.0000000 0.1824695 -0.0000000), wk = 0.0020325 k( 164) = ( 0.0000000 0.1728659 -0.0000000), wk = 0.0020325 k( 165) = ( 0.0000000 0.1632622 -0.0000000), wk = 0.0020325 k( 166) = ( 0.0000000 0.1536586 -0.0000000), wk = 0.0020325 k( 167) = ( 0.0000000 0.1440549 -0.0000000), wk = 0.0020325 k( 168) = ( 0.0000000 0.1344512 -0.0000000), wk = 0.0020325 k( 169) = ( 0.0000000 0.1248476 -0.0000000), wk = 0.0020325 k( 170) = ( 0.0000000 0.1152439 -0.0000000), wk = 0.0020325 k( 171) = ( 0.0000000 0.1056403 -0.0000000), wk = 0.0020325 k( 172) = ( 0.0000000 0.0960366 -0.0000000), wk = 0.0020325 k( 173) = ( 0.0000000 0.0864329 -0.0000000), wk = 0.0020325 k( 174) = ( 0.0000000 0.0768293 -0.0000000), wk = 0.0020325 k( 175) = ( 0.0000000 0.0672256 -0.0000000), wk = 0.0020325 k( 176) = ( 0.0000000 0.0576220 -0.0000000), wk = 0.0020325 k( 177) = ( 0.0000000 0.0480183 -0.0000000), wk = 0.0020325 k( 178) = ( 0.0000000 0.0384146 -0.0000000), wk = 0.0020325 k( 179) = ( 0.0000000 0.0288110 -0.0000000), wk = 0.0020325 k( 180) = ( 0.0000000 0.0192073 -0.0000000), wk = 0.0020325 k( 181) = ( 0.0000000 0.0096037 -0.0000000), wk = 0.0020325 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 183) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 184) = ( 0.0000000 0.0000000 0.0097401), wk = 0.0020325 k( 185) = ( 0.0000000 0.0000000 0.0194803), wk = 0.0020325 k( 186) = ( 0.0000000 0.0000000 0.0292204), wk = 0.0020325 k( 187) = ( 0.0000000 0.0000000 0.0389605), wk = 0.0020325 k( 188) = ( 0.0000000 0.0000000 0.0487007), wk = 0.0020325 k( 189) = ( 0.0000000 0.0000000 0.0584408), wk = 0.0020325 k( 190) = ( 0.0000000 0.0000000 0.0681809), wk = 0.0020325 k( 191) = ( 0.0000000 0.0000000 0.0779211), wk = 0.0020325 k( 192) = ( 0.0000000 0.0000000 0.0876612), wk = 0.0020325 k( 193) = ( 0.0000000 0.0000000 0.0974014), wk = 0.0020325 k( 194) = ( 0.0000000 0.0000000 0.1071415), wk = 0.0020325 k( 195) = ( 0.0000000 0.0000000 0.1168816), wk = 0.0020325 k( 196) = ( 0.0000000 0.0000000 0.1266218), wk = 0.0020325 k( 197) = ( 0.0000000 0.0000000 0.1363619), wk = 0.0020325 k( 198) = ( 0.0000000 0.0000000 0.1461020), wk = 0.0020325 k( 199) = ( 0.0000000 0.0000000 0.1558422), wk = 0.0020325 k( 200) = ( 0.0000000 0.0000000 0.1655823), wk = 0.0020325 k( 201) = ( 0.0000000 0.0000000 0.1753224), wk = 0.0020325 k( 202) = ( 0.0000000 0.0000000 0.1850626), wk = 0.0020325 k( 203) = ( 0.0000000 0.0000000 0.1948027), wk = 0.0020325 k( 204) = ( 0.0000000 0.0000000 0.2045428), wk = 0.0020325 k( 205) = ( 0.0000000 0.0000000 0.2142830), wk = 0.0020325 k( 206) = ( 0.0000000 0.0000000 0.2240231), wk = 0.0020325 k( 207) = ( 0.0000000 0.0000000 0.2337632), wk = 0.0020325 k( 208) = ( 0.0000000 0.0000000 0.2435034), wk = 0.0020325 k( 209) = ( 0.0000000 0.0000000 0.2532435), wk = 0.0020325 k( 210) = ( 0.0000000 0.0000000 0.2629836), wk = 0.0020325 k( 211) = ( 0.0000000 0.0000000 0.2727238), wk = 0.0020325 k( 212) = ( 0.0000000 0.0000000 0.2824639), wk = 0.0020325 k( 213) = ( 0.0000000 0.0000000 0.2922041), wk = 0.0020325 k( 214) = ( 0.0000000 0.0000000 0.3019442), wk = 0.0020325 k( 215) = ( 0.0000000 0.0000000 0.3019442), wk = 0.0020325 k( 216) = ( 0.0098039 -0.0000000 0.3019442), wk = 0.0020325 k( 217) = ( 0.0196078 -0.0000000 0.3019442), wk = 0.0020325 k( 218) = ( 0.0294118 -0.0000000 0.3019442), wk = 0.0020325 k( 219) = ( 0.0392157 -0.0000000 0.3019442), wk = 0.0020325 k( 220) = ( 0.0490196 -0.0000000 0.3019442), wk = 0.0020325 k( 221) = ( 0.0588235 -0.0000000 0.3019442), wk = 0.0020325 k( 222) = ( 0.0686275 -0.0000000 0.3019442), wk = 0.0020325 k( 223) = ( 0.0784314 -0.0000000 0.3019442), wk = 0.0020325 k( 224) = ( 0.0882353 -0.0000000 0.3019442), wk = 0.0020325 k( 225) = ( 0.0980392 -0.0000000 0.3019442), wk = 0.0020325 k( 226) = ( 0.1078431 -0.0000000 0.3019442), wk = 0.0020325 k( 227) = ( 0.1176471 -0.0000000 0.3019442), wk = 0.0020325 k( 228) = ( 0.1274510 -0.0000000 0.3019442), wk = 0.0020325 k( 229) = ( 0.1372549 -0.0000000 0.3019442), wk = 0.0020325 k( 230) = ( 0.1470588 -0.0000000 0.3019442), wk = 0.0020325 k( 231) = ( 0.1568627 -0.0000000 0.3019442), wk = 0.0020325 k( 232) = ( 0.1666667 -0.0000000 0.3019442), wk = 0.0020325 k( 233) = ( 0.1764706 -0.0000000 0.3019442), wk = 0.0020325 k( 234) = ( 0.1862745 -0.0000000 0.3019442), wk = 0.0020325 k( 235) = ( 0.1960784 -0.0000000 0.3019442), wk = 0.0020325 k( 236) = ( 0.2058823 -0.0000000 0.3019442), wk = 0.0020325 k( 237) = ( 0.2156863 -0.0000000 0.3019442), wk = 0.0020325 k( 238) = ( 0.2254902 -0.0000000 0.3019442), wk = 0.0020325 k( 239) = ( 0.2352941 -0.0000000 0.3019442), wk = 0.0020325 k( 240) = ( 0.2450980 -0.0000000 0.3019442), wk = 0.0020325 k( 241) = ( 0.2549020 -0.0000000 0.3019442), wk = 0.0020325 k( 242) = ( 0.2647059 -0.0000000 0.3019442), wk = 0.0020325 k( 243) = ( 0.2745098 -0.0000000 0.3019442), wk = 0.0020325 k( 244) = ( 0.2843137 -0.0000000 0.3019442), wk = 0.0020325 k( 245) = ( 0.2941177 -0.0000000 0.3019442), wk = 0.0020325 k( 246) = ( 0.3039216 -0.0000000 0.3019442), wk = 0.0020325 k( 247) = ( 0.3137255 -0.0000000 0.3019442), wk = 0.0020325 k( 248) = ( 0.3235294 -0.0000000 0.3019442), wk = 0.0020325 k( 249) = ( 0.3333333 -0.0000000 0.3019442), wk = 0.0020325 k( 250) = ( 0.3431373 -0.0000000 0.3019442), wk = 0.0020325 k( 251) = ( 0.3529412 -0.0000000 0.3019442), wk = 0.0020325 k( 252) = ( 0.3627451 -0.0000000 0.3019442), wk = 0.0020325 k( 253) = ( 0.3725490 -0.0000000 0.3019442), wk = 0.0020325 k( 254) = ( 0.3823529 -0.0000000 0.3019442), wk = 0.0020325 k( 255) = ( 0.3921569 -0.0000000 0.3019442), wk = 0.0020325 k( 256) = ( 0.4019608 -0.0000000 0.3019442), wk = 0.0020325 k( 257) = ( 0.4117647 -0.0000000 0.3019442), wk = 0.0020325 k( 258) = ( 0.4215686 -0.0000000 0.3019442), wk = 0.0020325 k( 259) = ( 0.4313726 -0.0000000 0.3019442), wk = 0.0020325 k( 260) = ( 0.4411765 -0.0000000 0.3019442), wk = 0.0020325 k( 261) = ( 0.4509804 -0.0000000 0.3019442), wk = 0.0020325 k( 262) = ( 0.4607843 -0.0000000 0.3019442), wk = 0.0020325 k( 263) = ( 0.4705882 -0.0000000 0.3019442), wk = 0.0020325 k( 264) = ( 0.4803922 -0.0000000 0.3019442), wk = 0.0020325 k( 265) = ( 0.4901961 -0.0000000 0.3019442), wk = 0.0020325 k( 266) = ( 0.5000000 -0.0000000 0.3019442), wk = 0.0020325 k( 267) = ( 0.5000000 -0.0000000 0.3019442), wk = 0.0020325 k( 268) = ( 0.5000000 0.0096037 0.3019442), wk = 0.0020325 k( 269) = ( 0.5000000 0.0192073 0.3019442), wk = 0.0020325 k( 270) = ( 0.5000000 0.0288110 0.3019442), wk = 0.0020325 k( 271) = ( 0.5000000 0.0384146 0.3019442), wk = 0.0020325 k( 272) = ( 0.5000000 0.0480183 0.3019442), wk = 0.0020325 k( 273) = ( 0.5000000 0.0576220 0.3019442), wk = 0.0020325 k( 274) = ( 0.5000000 0.0672256 0.3019442), wk = 0.0020325 k( 275) = ( 0.5000000 0.0768293 0.3019442), wk = 0.0020325 k( 276) = ( 0.5000000 0.0864329 0.3019442), wk = 0.0020325 k( 277) = ( 0.5000000 0.0960366 0.3019442), wk = 0.0020325 k( 278) = ( 0.5000000 0.1056403 0.3019442), wk = 0.0020325 k( 279) = ( 0.5000000 0.1152439 0.3019442), wk = 0.0020325 k( 280) = ( 0.5000000 0.1248476 0.3019442), wk = 0.0020325 k( 281) = ( 0.5000000 0.1344512 0.3019442), wk = 0.0020325 k( 282) = ( 0.5000000 0.1440549 0.3019442), wk = 0.0020325 k( 283) = ( 0.5000000 0.1536586 0.3019442), wk = 0.0020325 k( 284) = ( 0.5000000 0.1632622 0.3019442), wk = 0.0020325 k( 285) = ( 0.5000000 0.1728659 0.3019442), wk = 0.0020325 k( 286) = ( 0.5000000 0.1824695 0.3019442), wk = 0.0020325 k( 287) = ( 0.5000000 0.1920732 0.3019442), wk = 0.0020325 k( 288) = ( 0.5000000 0.2016769 0.3019442), wk = 0.0020325 k( 289) = ( 0.5000000 0.2112805 0.3019442), wk = 0.0020325 k( 290) = ( 0.5000000 0.2208842 0.3019442), wk = 0.0020325 k( 291) = ( 0.5000000 0.2304878 0.3019442), wk = 0.0020325 k( 292) = ( 0.5000000 0.2400915 0.3019442), wk = 0.0020325 k( 293) = ( 0.5000000 0.2496952 0.3019442), wk = 0.0020325 k( 294) = ( 0.5000000 0.2592988 0.3019442), wk = 0.0020325 k( 295) = ( 0.5000000 0.2689025 0.3019442), wk = 0.0020325 k( 296) = ( 0.5000000 0.2785061 0.3019442), wk = 0.0020325 k( 297) = ( 0.5000000 0.2881098 0.3019442), wk = 0.0020325 k( 298) = ( 0.5000000 0.2977135 0.3019442), wk = 0.0020325 k( 299) = ( 0.5000000 0.3073171 0.3019442), wk = 0.0020325 k( 300) = ( 0.5000000 0.3169208 0.3019442), wk = 0.0020325 k( 301) = ( 0.5000000 0.3265244 0.3019442), wk = 0.0020325 k( 302) = ( 0.5000000 0.3361281 0.3019442), wk = 0.0020325 k( 303) = ( 0.5000000 0.3457318 0.3019442), wk = 0.0020325 k( 304) = ( 0.5000000 0.3553354 0.3019442), wk = 0.0020325 k( 305) = ( 0.5000000 0.3649391 0.3019442), wk = 0.0020325 k( 306) = ( 0.5000000 0.3649391 0.3019442), wk = 0.0020325 k( 307) = ( 0.4901961 0.3649391 0.3019442), wk = 0.0020325 k( 308) = ( 0.4803922 0.3649391 0.3019442), wk = 0.0020325 k( 309) = ( 0.4705882 0.3649391 0.3019442), wk = 0.0020325 k( 310) = ( 0.4607843 0.3649391 0.3019442), wk = 0.0020325 k( 311) = ( 0.4509804 0.3649391 0.3019442), wk = 0.0020325 k( 312) = ( 0.4411765 0.3649391 0.3019442), wk = 0.0020325 k( 313) = ( 0.4313726 0.3649391 0.3019442), wk = 0.0020325 k( 314) = ( 0.4215686 0.3649391 0.3019442), wk = 0.0020325 k( 315) = ( 0.4117647 0.3649391 0.3019442), wk = 0.0020325 k( 316) = ( 0.4019608 0.3649391 0.3019442), wk = 0.0020325 k( 317) = ( 0.3921569 0.3649391 0.3019442), wk = 0.0020325 k( 318) = ( 0.3823529 0.3649391 0.3019442), wk = 0.0020325 k( 319) = ( 0.3725490 0.3649391 0.3019442), wk = 0.0020325 k( 320) = ( 0.3627451 0.3649391 0.3019442), wk = 0.0020325 k( 321) = ( 0.3529412 0.3649391 0.3019442), wk = 0.0020325 k( 322) = ( 0.3431373 0.3649391 0.3019442), wk = 0.0020325 k( 323) = ( 0.3333333 0.3649391 0.3019442), wk = 0.0020325 k( 324) = ( 0.3235294 0.3649391 0.3019442), wk = 0.0020325 k( 325) = ( 0.3137255 0.3649391 0.3019442), wk = 0.0020325 k( 326) = ( 0.3039216 0.3649391 0.3019442), wk = 0.0020325 k( 327) = ( 0.2941177 0.3649391 0.3019442), wk = 0.0020325 k( 328) = ( 0.2843137 0.3649391 0.3019442), wk = 0.0020325 k( 329) = ( 0.2745098 0.3649391 0.3019442), wk = 0.0020325 k( 330) = ( 0.2647059 0.3649391 0.3019442), wk = 0.0020325 k( 331) = ( 0.2549020 0.3649391 0.3019442), wk = 0.0020325 k( 332) = ( 0.2450980 0.3649391 0.3019442), wk = 0.0020325 k( 333) = ( 0.2352941 0.3649391 0.3019442), wk = 0.0020325 k( 334) = ( 0.2254902 0.3649391 0.3019442), wk = 0.0020325 k( 335) = ( 0.2156863 0.3649391 0.3019442), wk = 0.0020325 k( 336) = ( 0.2058823 0.3649391 0.3019442), wk = 0.0020325 k( 337) = ( 0.1960784 0.3649391 0.3019442), wk = 0.0020325 k( 338) = ( 0.1862745 0.3649391 0.3019442), wk = 0.0020325 k( 339) = ( 0.1764706 0.3649391 0.3019442), wk = 0.0020325 k( 340) = ( 0.1666667 0.3649391 0.3019442), wk = 0.0020325 k( 341) = ( 0.1568627 0.3649391 0.3019442), wk = 0.0020325 k( 342) = ( 0.1470588 0.3649391 0.3019442), wk = 0.0020325 k( 343) = ( 0.1372549 0.3649391 0.3019442), wk = 0.0020325 k( 344) = ( 0.1274510 0.3649391 0.3019442), wk = 0.0020325 k( 345) = ( 0.1176471 0.3649391 0.3019442), wk = 0.0020325 k( 346) = ( 0.1078431 0.3649391 0.3019442), wk = 0.0020325 k( 347) = ( 0.0980392 0.3649391 0.3019442), wk = 0.0020325 k( 348) = ( 0.0882353 0.3649391 0.3019442), wk = 0.0020325 k( 349) = ( 0.0784314 0.3649391 0.3019442), wk = 0.0020325 k( 350) = ( 0.0686275 0.3649391 0.3019442), wk = 0.0020325 k( 351) = ( 0.0588235 0.3649391 0.3019442), wk = 0.0020325 k( 352) = ( 0.0490196 0.3649391 0.3019442), wk = 0.0020325 k( 353) = ( 0.0392157 0.3649391 0.3019442), wk = 0.0020325 k( 354) = ( 0.0294118 0.3649391 0.3019442), wk = 0.0020325 k( 355) = ( 0.0196078 0.3649391 0.3019442), wk = 0.0020325 k( 356) = ( 0.0098039 0.3649391 0.3019442), wk = 0.0020325 k( 357) = ( 0.0000000 0.3649391 0.3019442), wk = 0.0020325 k( 358) = ( 0.0000000 0.3649391 0.3019442), wk = 0.0020325 k( 359) = ( 0.0000000 0.3553354 0.3019442), wk = 0.0020325 k( 360) = ( 0.0000000 0.3457318 0.3019442), wk = 0.0020325 k( 361) = ( 0.0000000 0.3361281 0.3019442), wk = 0.0020325 k( 362) = ( 0.0000000 0.3265244 0.3019442), wk = 0.0020325 k( 363) = ( 0.0000000 0.3169208 0.3019442), wk = 0.0020325 k( 364) = ( 0.0000000 0.3073171 0.3019442), wk = 0.0020325 k( 365) = ( 0.0000000 0.2977135 0.3019442), wk = 0.0020325 k( 366) = ( 0.0000000 0.2881098 0.3019442), wk = 0.0020325 k( 367) = ( 0.0000000 0.2785061 0.3019442), wk = 0.0020325 k( 368) = ( 0.0000000 0.2689025 0.3019442), wk = 0.0020325 k( 369) = ( 0.0000000 0.2592988 0.3019442), wk = 0.0020325 k( 370) = ( 0.0000000 0.2496952 0.3019442), wk = 0.0020325 k( 371) = ( 0.0000000 0.2400915 0.3019442), wk = 0.0020325 k( 372) = ( 0.0000000 0.2304878 0.3019442), wk = 0.0020325 k( 373) = ( 0.0000000 0.2208842 0.3019442), wk = 0.0020325 k( 374) = ( 0.0000000 0.2112805 0.3019442), wk = 0.0020325 k( 375) = ( 0.0000000 0.2016769 0.3019442), wk = 0.0020325 k( 376) = ( 0.0000000 0.1920732 0.3019442), wk = 0.0020325 k( 377) = ( 0.0000000 0.1824695 0.3019442), wk = 0.0020325 k( 378) = ( 0.0000000 0.1728659 0.3019442), wk = 0.0020325 k( 379) = ( 0.0000000 0.1632622 0.3019442), wk = 0.0020325 k( 380) = ( 0.0000000 0.1536586 0.3019442), wk = 0.0020325 k( 381) = ( 0.0000000 0.1440549 0.3019442), wk = 0.0020325 k( 382) = ( 0.0000000 0.1344512 0.3019442), wk = 0.0020325 k( 383) = ( 0.0000000 0.1248476 0.3019442), wk = 0.0020325 k( 384) = ( 0.0000000 0.1152439 0.3019442), wk = 0.0020325 k( 385) = ( 0.0000000 0.1056403 0.3019442), wk = 0.0020325 k( 386) = ( 0.0000000 0.0960366 0.3019442), wk = 0.0020325 k( 387) = ( 0.0000000 0.0864329 0.3019442), wk = 0.0020325 k( 388) = ( 0.0000000 0.0768293 0.3019442), wk = 0.0020325 k( 389) = ( 0.0000000 0.0672256 0.3019442), wk = 0.0020325 k( 390) = ( 0.0000000 0.0576220 0.3019442), wk = 0.0020325 k( 391) = ( 0.0000000 0.0480183 0.3019442), wk = 0.0020325 k( 392) = ( 0.0000000 0.0384146 0.3019442), wk = 0.0020325 k( 393) = ( 0.0000000 0.0288110 0.3019442), wk = 0.0020325 k( 394) = ( 0.0000000 0.0192073 0.3019442), wk = 0.0020325 k( 395) = ( 0.0000000 0.0096037 0.3019442), wk = 0.0020325 k( 396) = ( 0.0000000 0.0000000 0.3019442), wk = 0.0020325 k( 397) = ( 0.0000000 0.3649391 -0.0000000), wk = 0.0020325 k( 398) = ( 0.0000000 0.3649391 0.0097401), wk = 0.0020325 k( 399) = ( 0.0000000 0.3649391 0.0194803), wk = 0.0020325 k( 400) = ( 0.0000000 0.3649391 0.0292204), wk = 0.0020325 k( 401) = ( 0.0000000 0.3649391 0.0389605), wk = 0.0020325 k( 402) = ( 0.0000000 0.3649391 0.0487007), wk = 0.0020325 k( 403) = ( 0.0000000 0.3649391 0.0584408), wk = 0.0020325 k( 404) = ( 0.0000000 0.3649391 0.0681809), wk = 0.0020325 k( 405) = ( 0.0000000 0.3649391 0.0779211), wk = 0.0020325 k( 406) = ( 0.0000000 0.3649391 0.0876612), wk = 0.0020325 k( 407) = ( 0.0000000 0.3649391 0.0974014), wk = 0.0020325 k( 408) = ( 0.0000000 0.3649391 0.1071415), wk = 0.0020325 k( 409) = ( 0.0000000 0.3649391 0.1168816), wk = 0.0020325 k( 410) = ( 0.0000000 0.3649391 0.1266218), wk = 0.0020325 k( 411) = ( 0.0000000 0.3649391 0.1363619), wk = 0.0020325 k( 412) = ( 0.0000000 0.3649391 0.1461020), wk = 0.0020325 k( 413) = ( 0.0000000 0.3649391 0.1558422), wk = 0.0020325 k( 414) = ( 0.0000000 0.3649391 0.1655823), wk = 0.0020325 k( 415) = ( 0.0000000 0.3649391 0.1753224), wk = 0.0020325 k( 416) = ( 0.0000000 0.3649391 0.1850626), wk = 0.0020325 k( 417) = ( 0.0000000 0.3649391 0.1948027), wk = 0.0020325 k( 418) = ( 0.0000000 0.3649391 0.2045428), wk = 0.0020325 k( 419) = ( 0.0000000 0.3649391 0.2142830), wk = 0.0020325 k( 420) = ( 0.0000000 0.3649391 0.2240231), wk = 0.0020325 k( 421) = ( 0.0000000 0.3649391 0.2337632), wk = 0.0020325 k( 422) = ( 0.0000000 0.3649391 0.2435034), wk = 0.0020325 k( 423) = ( 0.0000000 0.3649391 0.2532435), wk = 0.0020325 k( 424) = ( 0.0000000 0.3649391 0.2629836), wk = 0.0020325 k( 425) = ( 0.0000000 0.3649391 0.2727238), wk = 0.0020325 k( 426) = ( 0.0000000 0.3649391 0.2824639), wk = 0.0020325 k( 427) = ( 0.0000000 0.3649391 0.2922041), wk = 0.0020325 k( 428) = ( 0.0000000 0.3649391 0.3019442), wk = 0.0020325 k( 429) = ( 0.5000000 -0.0000000 0.3019442), wk = 0.0020325 k( 430) = ( 0.5000000 -0.0000000 0.2922041), wk = 0.0020325 k( 431) = ( 0.5000000 -0.0000000 0.2824639), wk = 0.0020325 k( 432) = ( 0.5000000 -0.0000000 0.2727238), wk = 0.0020325 k( 433) = ( 0.5000000 -0.0000000 0.2629836), wk = 0.0020325 k( 434) = ( 0.5000000 -0.0000000 0.2532435), wk = 0.0020325 k( 435) = ( 0.5000000 -0.0000000 0.2435034), wk = 0.0020325 k( 436) = ( 0.5000000 -0.0000000 0.2337632), wk = 0.0020325 k( 437) = ( 0.5000000 -0.0000000 0.2240231), wk = 0.0020325 k( 438) = ( 0.5000000 -0.0000000 0.2142830), wk = 0.0020325 k( 439) = ( 0.5000000 -0.0000000 0.2045428), wk = 0.0020325 k( 440) = ( 0.5000000 -0.0000000 0.1948027), wk = 0.0020325 k( 441) = ( 0.5000000 -0.0000000 0.1850626), wk = 0.0020325 k( 442) = ( 0.5000000 -0.0000000 0.1753224), wk = 0.0020325 k( 443) = ( 0.5000000 -0.0000000 0.1655823), wk = 0.0020325 k( 444) = ( 0.5000000 -0.0000000 0.1558422), wk = 0.0020325 k( 445) = ( 0.5000000 -0.0000000 0.1461020), wk = 0.0020325 k( 446) = ( 0.5000000 -0.0000000 0.1363619), wk = 0.0020325 k( 447) = ( 0.5000000 -0.0000000 0.1266218), wk = 0.0020325 k( 448) = ( 0.5000000 -0.0000000 0.1168816), wk = 0.0020325 k( 449) = ( 0.5000000 -0.0000000 0.1071415), wk = 0.0020325 k( 450) = ( 0.5000000 -0.0000000 0.0974014), wk = 0.0020325 k( 451) = ( 0.5000000 -0.0000000 0.0876612), wk = 0.0020325 k( 452) = ( 0.5000000 -0.0000000 0.0779211), wk = 0.0020325 k( 453) = ( 0.5000000 -0.0000000 0.0681809), wk = 0.0020325 k( 454) = ( 0.5000000 -0.0000000 0.0584408), wk = 0.0020325 k( 455) = ( 0.5000000 -0.0000000 0.0487007), wk = 0.0020325 k( 456) = ( 0.5000000 -0.0000000 0.0389605), wk = 0.0020325 k( 457) = ( 0.5000000 -0.0000000 0.0292204), wk = 0.0020325 k( 458) = ( 0.5000000 -0.0000000 0.0194803), wk = 0.0020325 k( 459) = ( 0.5000000 -0.0000000 0.0097401), wk = 0.0020325 k( 460) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 461) = ( 0.5000000 0.3649391 -0.0000000), wk = 0.0020325 k( 462) = ( 0.5000000 0.3649391 0.0097401), wk = 0.0020325 k( 463) = ( 0.5000000 0.3649391 0.0194803), wk = 0.0020325 k( 464) = ( 0.5000000 0.3649391 0.0292204), wk = 0.0020325 k( 465) = ( 0.5000000 0.3649391 0.0389605), wk = 0.0020325 k( 466) = ( 0.5000000 0.3649391 0.0487007), wk = 0.0020325 k( 467) = ( 0.5000000 0.3649391 0.0584408), wk = 0.0020325 k( 468) = ( 0.5000000 0.3649391 0.0681809), wk = 0.0020325 k( 469) = ( 0.5000000 0.3649391 0.0779211), wk = 0.0020325 k( 470) = ( 0.5000000 0.3649391 0.0876612), wk = 0.0020325 k( 471) = ( 0.5000000 0.3649391 0.0974014), wk = 0.0020325 k( 472) = ( 0.5000000 0.3649391 0.1071415), wk = 0.0020325 k( 473) = ( 0.5000000 0.3649391 0.1168816), wk = 0.0020325 k( 474) = ( 0.5000000 0.3649391 0.1266218), wk = 0.0020325 k( 475) = ( 0.5000000 0.3649391 0.1363619), wk = 0.0020325 k( 476) = ( 0.5000000 0.3649391 0.1461020), wk = 0.0020325 k( 477) = ( 0.5000000 0.3649391 0.1558422), wk = 0.0020325 k( 478) = ( 0.5000000 0.3649391 0.1655823), wk = 0.0020325 k( 479) = ( 0.5000000 0.3649391 0.1753224), wk = 0.0020325 k( 480) = ( 0.5000000 0.3649391 0.1850626), wk = 0.0020325 k( 481) = ( 0.5000000 0.3649391 0.1948027), wk = 0.0020325 k( 482) = ( 0.5000000 0.3649391 0.2045428), wk = 0.0020325 k( 483) = ( 0.5000000 0.3649391 0.2142830), wk = 0.0020325 k( 484) = ( 0.5000000 0.3649391 0.2240231), wk = 0.0020325 k( 485) = ( 0.5000000 0.3649391 0.2337632), wk = 0.0020325 k( 486) = ( 0.5000000 0.3649391 0.2435034), wk = 0.0020325 k( 487) = ( 0.5000000 0.3649391 0.2532435), wk = 0.0020325 k( 488) = ( 0.5000000 0.3649391 0.2629836), wk = 0.0020325 k( 489) = ( 0.5000000 0.3649391 0.2727238), wk = 0.0020325 k( 490) = ( 0.5000000 0.3649391 0.2824639), wk = 0.0020325 k( 491) = ( 0.5000000 0.3649391 0.2922041), wk = 0.0020325 k( 492) = ( 0.5000000 0.3649391 0.3019442), wk = 0.0020325 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 2) = ( 0.0098039 -0.0000000 0.0000000), wk = 0.0020325 k( 3) = ( 0.0196078 -0.0000000 0.0000000), wk = 0.0020325 k( 4) = ( 0.0294118 -0.0000000 -0.0000000), wk = 0.0020325 k( 5) = ( 0.0392157 -0.0000000 -0.0000000), wk = 0.0020325 k( 6) = ( 0.0490196 -0.0000000 -0.0000000), wk = 0.0020325 k( 7) = ( 0.0588235 0.0000000 0.0000000), wk = 0.0020325 k( 8) = ( 0.0686275 -0.0000000 0.0000000), wk = 0.0020325 k( 9) = ( 0.0784314 -0.0000000 -0.0000000), wk = 0.0020325 k( 10) = ( 0.0882353 -0.0000000 0.0000000), wk = 0.0020325 k( 11) = ( 0.0980392 -0.0000000 -0.0000000), wk = 0.0020325 k( 12) = ( 0.1078431 0.0000000 -0.0000000), wk = 0.0020325 k( 13) = ( 0.1176471 0.0000000 0.0000000), wk = 0.0020325 k( 14) = ( 0.1274510 -0.0000000 -0.0000000), wk = 0.0020325 k( 15) = ( 0.1372549 -0.0000000 0.0000000), wk = 0.0020325 k( 16) = ( 0.1470588 0.0000000 0.0000000), wk = 0.0020325 k( 17) = ( 0.1568627 -0.0000000 -0.0000000), wk = 0.0020325 k( 18) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0020325 k( 19) = ( 0.1764706 0.0000000 -0.0000000), wk = 0.0020325 k( 20) = ( 0.1862745 0.0000000 -0.0000000), wk = 0.0020325 k( 21) = ( 0.1960784 0.0000000 -0.0000000), wk = 0.0020325 k( 22) = ( 0.2058823 -0.0000000 -0.0000000), wk = 0.0020325 k( 23) = ( 0.2156863 -0.0000000 -0.0000000), wk = 0.0020325 k( 24) = ( 0.2254902 0.0000000 0.0000000), wk = 0.0020325 k( 25) = ( 0.2352941 0.0000000 0.0000000), wk = 0.0020325 k( 26) = ( 0.2450980 0.0000000 -0.0000000), wk = 0.0020325 k( 27) = ( 0.2549020 -0.0000000 -0.0000000), wk = 0.0020325 k( 28) = ( 0.2647059 -0.0000000 -0.0000000), wk = 0.0020325 k( 29) = ( 0.2745098 -0.0000000 0.0000000), wk = 0.0020325 k( 30) = ( 0.2843137 -0.0000000 -0.0000000), wk = 0.0020325 k( 31) = ( 0.2941177 0.0000000 -0.0000000), wk = 0.0020325 k( 32) = ( 0.3039216 -0.0000000 -0.0000000), wk = 0.0020325 k( 33) = ( 0.3137255 0.0000000 0.0000000), wk = 0.0020325 k( 34) = ( 0.3235294 -0.0000000 -0.0000000), wk = 0.0020325 k( 35) = ( 0.3333333 0.0000000 -0.0000000), wk = 0.0020325 k( 36) = ( 0.3431373 -0.0000000 0.0000000), wk = 0.0020325 k( 37) = ( 0.3529412 0.0000000 -0.0000000), wk = 0.0020325 k( 38) = ( 0.3627451 -0.0000000 0.0000000), wk = 0.0020325 k( 39) = ( 0.3725490 0.0000000 -0.0000000), wk = 0.0020325 k( 40) = ( 0.3823529 -0.0000000 0.0000000), wk = 0.0020325 k( 41) = ( 0.3921569 0.0000000 -0.0000000), wk = 0.0020325 k( 42) = ( 0.4019608 -0.0000000 0.0000000), wk = 0.0020325 k( 43) = ( 0.4117647 0.0000000 -0.0000000), wk = 0.0020325 k( 44) = ( 0.4215686 -0.0000000 -0.0000000), wk = 0.0020325 k( 45) = ( 0.4313726 0.0000000 -0.0000000), wk = 0.0020325 k( 46) = ( 0.4411765 0.0000000 -0.0000000), wk = 0.0020325 k( 47) = ( 0.4509804 0.0000000 -0.0000000), wk = 0.0020325 k( 48) = ( 0.4607843 0.0000000 -0.0000000), wk = 0.0020325 k( 49) = ( 0.4705882 0.0000000 0.0000000), wk = 0.0020325 k( 50) = ( 0.4803922 -0.0000000 -0.0000000), wk = 0.0020325 k( 51) = ( 0.4901961 0.0000000 -0.0000000), wk = 0.0020325 k( 52) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 53) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 54) = ( 0.5000000 0.0131579 0.0000000), wk = 0.0020325 k( 55) = ( 0.5000000 0.0263158 0.0000000), wk = 0.0020325 k( 56) = ( 0.5000000 0.0394737 0.0000000), wk = 0.0020325 k( 57) = ( 0.5000000 0.0526316 -0.0000000), wk = 0.0020325 k( 58) = ( 0.5000000 0.0657895 -0.0000000), wk = 0.0020325 k( 59) = ( 0.5000000 0.0789474 -0.0000000), wk = 0.0020325 k( 60) = ( 0.5000000 0.0921053 -0.0000000), wk = 0.0020325 k( 61) = ( 0.5000000 0.1052632 0.0000000), wk = 0.0020325 k( 62) = ( 0.5000000 0.1184211 -0.0000000), wk = 0.0020325 k( 63) = ( 0.5000000 0.1315790 -0.0000000), wk = 0.0020325 k( 64) = ( 0.5000000 0.1447368 0.0000000), wk = 0.0020325 k( 65) = ( 0.5000000 0.1578947 -0.0000000), wk = 0.0020325 k( 66) = ( 0.5000000 0.1710526 -0.0000000), wk = 0.0020325 k( 67) = ( 0.5000000 0.1842105 -0.0000000), wk = 0.0020325 k( 68) = ( 0.5000000 0.1973684 -0.0000000), wk = 0.0020325 k( 69) = ( 0.5000000 0.2105263 -0.0000000), wk = 0.0020325 k( 70) = ( 0.5000000 0.2236842 0.0000000), wk = 0.0020325 k( 71) = ( 0.5000000 0.2368421 0.0000000), wk = 0.0020325 k( 72) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0020325 k( 73) = ( 0.5000000 0.2631579 0.0000000), wk = 0.0020325 k( 74) = ( 0.5000000 0.2763158 0.0000000), wk = 0.0020325 k( 75) = ( 0.5000000 0.2894737 0.0000000), wk = 0.0020325 k( 76) = ( 0.5000000 0.3026316 0.0000000), wk = 0.0020325 k( 77) = ( 0.5000000 0.3157895 -0.0000000), wk = 0.0020325 k( 78) = ( 0.5000000 0.3289474 0.0000000), wk = 0.0020325 k( 79) = ( 0.5000000 0.3421053 0.0000000), wk = 0.0020325 k( 80) = ( 0.5000000 0.3552632 -0.0000000), wk = 0.0020325 k( 81) = ( 0.5000000 0.3684211 -0.0000000), wk = 0.0020325 k( 82) = ( 0.5000000 0.3815789 0.0000000), wk = 0.0020325 k( 83) = ( 0.5000000 0.3947368 0.0000000), wk = 0.0020325 k( 84) = ( 0.5000000 0.4078947 -0.0000000), wk = 0.0020325 k( 85) = ( 0.5000000 0.4210526 0.0000000), wk = 0.0020325 k( 86) = ( 0.5000000 0.4342105 0.0000000), wk = 0.0020325 k( 87) = ( 0.5000000 0.4473684 0.0000000), wk = 0.0020325 k( 88) = ( 0.5000000 0.4605263 0.0000000), wk = 0.0020325 k( 89) = ( 0.5000000 0.4736842 0.0000000), wk = 0.0020325 k( 90) = ( 0.5000000 0.4868421 0.0000000), wk = 0.0020325 k( 91) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020325 k( 92) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020325 k( 93) = ( 0.4901961 0.5000000 -0.0000000), wk = 0.0020325 k( 94) = ( 0.4803922 0.5000000 -0.0000000), wk = 0.0020325 k( 95) = ( 0.4705882 0.5000000 -0.0000000), wk = 0.0020325 k( 96) = ( 0.4607843 0.5000000 0.0000000), wk = 0.0020325 k( 97) = ( 0.4509804 0.5000000 -0.0000000), wk = 0.0020325 k( 98) = ( 0.4411765 0.5000000 0.0000000), wk = 0.0020325 k( 99) = ( 0.4313726 0.5000000 -0.0000000), wk = 0.0020325 k( 100) = ( 0.4215686 0.5000000 0.0000000), wk = 0.0020325 k( 101) = ( 0.4117647 0.5000000 0.0000000), wk = 0.0020325 k( 102) = ( 0.4019608 0.5000000 0.0000000), wk = 0.0020325 k( 103) = ( 0.3921569 0.5000000 0.0000000), wk = 0.0020325 k( 104) = ( 0.3823529 0.5000000 0.0000000), wk = 0.0020325 k( 105) = ( 0.3725490 0.5000000 0.0000000), wk = 0.0020325 k( 106) = ( 0.3627451 0.5000000 0.0000000), wk = 0.0020325 k( 107) = ( 0.3529412 0.5000000 0.0000000), wk = 0.0020325 k( 108) = ( 0.3431373 0.5000000 0.0000000), wk = 0.0020325 k( 109) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0020325 k( 110) = ( 0.3235294 0.5000000 -0.0000000), wk = 0.0020325 k( 111) = ( 0.3137255 0.5000000 -0.0000000), wk = 0.0020325 k( 112) = ( 0.3039216 0.5000000 0.0000000), wk = 0.0020325 k( 113) = ( 0.2941177 0.5000000 -0.0000000), wk = 0.0020325 k( 114) = ( 0.2843137 0.5000000 0.0000000), wk = 0.0020325 k( 115) = ( 0.2745098 0.5000000 0.0000000), wk = 0.0020325 k( 116) = ( 0.2647059 0.5000000 0.0000000), wk = 0.0020325 k( 117) = ( 0.2549020 0.5000000 -0.0000000), wk = 0.0020325 k( 118) = ( 0.2450980 0.5000000 -0.0000000), wk = 0.0020325 k( 119) = ( 0.2352941 0.5000000 0.0000000), wk = 0.0020325 k( 120) = ( 0.2254902 0.5000000 -0.0000000), wk = 0.0020325 k( 121) = ( 0.2156863 0.5000000 0.0000000), wk = 0.0020325 k( 122) = ( 0.2058823 0.5000000 0.0000000), wk = 0.0020325 k( 123) = ( 0.1960784 0.5000000 0.0000000), wk = 0.0020325 k( 124) = ( 0.1862745 0.5000000 0.0000000), wk = 0.0020325 k( 125) = ( 0.1764706 0.5000000 0.0000000), wk = 0.0020325 k( 126) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0020325 k( 127) = ( 0.1568627 0.5000000 0.0000000), wk = 0.0020325 k( 128) = ( 0.1470588 0.5000000 0.0000000), wk = 0.0020325 k( 129) = ( 0.1372549 0.5000000 0.0000000), wk = 0.0020325 k( 130) = ( 0.1274510 0.5000000 0.0000000), wk = 0.0020325 k( 131) = ( 0.1176471 0.5000000 0.0000000), wk = 0.0020325 k( 132) = ( 0.1078431 0.5000000 0.0000000), wk = 0.0020325 k( 133) = ( 0.0980392 0.5000000 0.0000000), wk = 0.0020325 k( 134) = ( 0.0882353 0.5000000 0.0000000), wk = 0.0020325 k( 135) = ( 0.0784314 0.5000000 0.0000000), wk = 0.0020325 k( 136) = ( 0.0686275 0.5000000 0.0000000), wk = 0.0020325 k( 137) = ( 0.0588235 0.5000000 0.0000000), wk = 0.0020325 k( 138) = ( 0.0490196 0.5000000 0.0000000), wk = 0.0020325 k( 139) = ( 0.0392157 0.5000000 0.0000000), wk = 0.0020325 k( 140) = ( 0.0294118 0.5000000 0.0000000), wk = 0.0020325 k( 141) = ( 0.0196078 0.5000000 0.0000000), wk = 0.0020325 k( 142) = ( 0.0098039 0.5000000 0.0000000), wk = 0.0020325 k( 143) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020325 k( 144) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020325 k( 145) = ( 0.0000000 0.4868421 0.0000000), wk = 0.0020325 k( 146) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0020325 k( 147) = ( 0.0000000 0.4605263 0.0000000), wk = 0.0020325 k( 148) = ( 0.0000000 0.4473684 0.0000000), wk = 0.0020325 k( 149) = ( 0.0000000 0.4342105 0.0000000), wk = 0.0020325 k( 150) = ( 0.0000000 0.4210526 0.0000000), wk = 0.0020325 k( 151) = ( 0.0000000 0.4078947 0.0000000), wk = 0.0020325 k( 152) = ( 0.0000000 0.3947368 0.0000000), wk = 0.0020325 k( 153) = ( 0.0000000 0.3815789 0.0000000), wk = 0.0020325 k( 154) = ( 0.0000000 0.3684211 0.0000000), wk = 0.0020325 k( 155) = ( 0.0000000 0.3552632 0.0000000), wk = 0.0020325 k( 156) = ( 0.0000000 0.3421053 0.0000000), wk = 0.0020325 k( 157) = ( 0.0000000 0.3289474 0.0000000), wk = 0.0020325 k( 158) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0020325 k( 159) = ( 0.0000000 0.3026316 0.0000000), wk = 0.0020325 k( 160) = ( 0.0000000 0.2894737 0.0000000), wk = 0.0020325 k( 161) = ( 0.0000000 0.2763158 0.0000000), wk = 0.0020325 k( 162) = ( 0.0000000 0.2631579 0.0000000), wk = 0.0020325 k( 163) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0020325 k( 164) = ( 0.0000000 0.2368421 0.0000000), wk = 0.0020325 k( 165) = ( 0.0000000 0.2236842 0.0000000), wk = 0.0020325 k( 166) = ( 0.0000000 0.2105263 0.0000000), wk = 0.0020325 k( 167) = ( 0.0000000 0.1973684 0.0000000), wk = 0.0020325 k( 168) = ( 0.0000000 0.1842105 0.0000000), wk = 0.0020325 k( 169) = ( 0.0000000 0.1710526 0.0000000), wk = 0.0020325 k( 170) = ( 0.0000000 0.1578947 0.0000000), wk = 0.0020325 k( 171) = ( 0.0000000 0.1447368 0.0000000), wk = 0.0020325 k( 172) = ( 0.0000000 0.1315790 0.0000000), wk = 0.0020325 k( 173) = ( 0.0000000 0.1184211 0.0000000), wk = 0.0020325 k( 174) = ( 0.0000000 0.1052632 0.0000000), wk = 0.0020325 k( 175) = ( 0.0000000 0.0921053 0.0000000), wk = 0.0020325 k( 176) = ( 0.0000000 0.0789474 0.0000000), wk = 0.0020325 k( 177) = ( 0.0000000 0.0657895 0.0000000), wk = 0.0020325 k( 178) = ( 0.0000000 0.0526316 0.0000000), wk = 0.0020325 k( 179) = ( 0.0000000 0.0394737 0.0000000), wk = 0.0020325 k( 180) = ( 0.0000000 0.0263158 0.0000000), wk = 0.0020325 k( 181) = ( 0.0000000 0.0131579 0.0000000), wk = 0.0020325 k( 182) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 183) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020325 k( 184) = ( 0.0000000 0.0000000 0.0161290), wk = 0.0020325 k( 185) = ( 0.0000000 0.0000000 0.0322581), wk = 0.0020325 k( 186) = ( 0.0000000 0.0000000 0.0483871), wk = 0.0020325 k( 187) = ( 0.0000000 0.0000000 0.0645161), wk = 0.0020325 k( 188) = ( 0.0000000 0.0000000 0.0806452), wk = 0.0020325 k( 189) = ( 0.0000000 0.0000000 0.0967742), wk = 0.0020325 k( 190) = ( 0.0000000 0.0000000 0.1129032), wk = 0.0020325 k( 191) = ( 0.0000000 0.0000000 0.1290323), wk = 0.0020325 k( 192) = ( 0.0000000 0.0000000 0.1451613), wk = 0.0020325 k( 193) = ( 0.0000000 0.0000000 0.1612903), wk = 0.0020325 k( 194) = ( 0.0000000 0.0000000 0.1774194), wk = 0.0020325 k( 195) = ( 0.0000000 0.0000000 0.1935484), wk = 0.0020325 k( 196) = ( 0.0000000 0.0000000 0.2096774), wk = 0.0020325 k( 197) = ( 0.0000000 0.0000000 0.2258065), wk = 0.0020325 k( 198) = ( 0.0000000 0.0000000 0.2419355), wk = 0.0020325 k( 199) = ( 0.0000000 0.0000000 0.2580645), wk = 0.0020325 k( 200) = ( 0.0000000 0.0000000 0.2741936), wk = 0.0020325 k( 201) = ( 0.0000000 0.0000000 0.2903226), wk = 0.0020325 k( 202) = ( 0.0000000 0.0000000 0.3064516), wk = 0.0020325 k( 203) = ( 0.0000000 0.0000000 0.3225807), wk = 0.0020325 k( 204) = ( 0.0000000 0.0000000 0.3387097), wk = 0.0020325 k( 205) = ( 0.0000000 0.0000000 0.3548387), wk = 0.0020325 k( 206) = ( 0.0000000 0.0000000 0.3709677), wk = 0.0020325 k( 207) = ( 0.0000000 0.0000000 0.3870968), wk = 0.0020325 k( 208) = ( 0.0000000 0.0000000 0.4032258), wk = 0.0020325 k( 209) = ( 0.0000000 0.0000000 0.4193548), wk = 0.0020325 k( 210) = ( 0.0000000 0.0000000 0.4354839), wk = 0.0020325 k( 211) = ( 0.0000000 0.0000000 0.4516129), wk = 0.0020325 k( 212) = ( 0.0000000 0.0000000 0.4677419), wk = 0.0020325 k( 213) = ( 0.0000000 0.0000000 0.4838710), wk = 0.0020325 k( 214) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020325 k( 215) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020325 k( 216) = ( 0.0098039 -0.0000000 0.5000000), wk = 0.0020325 k( 217) = ( 0.0196078 -0.0000000 0.5000000), wk = 0.0020325 k( 218) = ( 0.0294118 -0.0000000 0.5000000), wk = 0.0020325 k( 219) = ( 0.0392157 -0.0000000 0.5000000), wk = 0.0020325 k( 220) = ( 0.0490196 -0.0000000 0.5000000), wk = 0.0020325 k( 221) = ( 0.0588235 0.0000000 0.5000000), wk = 0.0020325 k( 222) = ( 0.0686275 -0.0000000 0.5000000), wk = 0.0020325 k( 223) = ( 0.0784314 -0.0000000 0.5000000), wk = 0.0020325 k( 224) = ( 0.0882353 -0.0000000 0.5000000), wk = 0.0020325 k( 225) = ( 0.0980392 -0.0000000 0.5000000), wk = 0.0020325 k( 226) = ( 0.1078431 0.0000000 0.5000000), wk = 0.0020325 k( 227) = ( 0.1176471 0.0000000 0.5000000), wk = 0.0020325 k( 228) = ( 0.1274510 -0.0000000 0.5000000), wk = 0.0020325 k( 229) = ( 0.1372549 -0.0000000 0.5000000), wk = 0.0020325 k( 230) = ( 0.1470588 0.0000000 0.5000000), wk = 0.0020325 k( 231) = ( 0.1568627 -0.0000000 0.5000000), wk = 0.0020325 k( 232) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0020325 k( 233) = ( 0.1764706 0.0000000 0.5000000), wk = 0.0020325 k( 234) = ( 0.1862745 0.0000000 0.5000000), wk = 0.0020325 k( 235) = ( 0.1960784 0.0000000 0.5000000), wk = 0.0020325 k( 236) = ( 0.2058823 -0.0000000 0.5000000), wk = 0.0020325 k( 237) = ( 0.2156863 -0.0000000 0.5000000), wk = 0.0020325 k( 238) = ( 0.2254902 0.0000000 0.5000000), wk = 0.0020325 k( 239) = ( 0.2352941 0.0000000 0.5000000), wk = 0.0020325 k( 240) = ( 0.2450980 0.0000000 0.5000000), wk = 0.0020325 k( 241) = ( 0.2549020 -0.0000000 0.5000000), wk = 0.0020325 k( 242) = ( 0.2647059 -0.0000000 0.5000000), wk = 0.0020325 k( 243) = ( 0.2745098 -0.0000000 0.5000000), wk = 0.0020325 k( 244) = ( 0.2843137 -0.0000000 0.5000000), wk = 0.0020325 k( 245) = ( 0.2941177 0.0000000 0.5000000), wk = 0.0020325 k( 246) = ( 0.3039216 -0.0000000 0.5000000), wk = 0.0020325 k( 247) = ( 0.3137255 0.0000000 0.5000000), wk = 0.0020325 k( 248) = ( 0.3235294 -0.0000000 0.5000000), wk = 0.0020325 k( 249) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0020325 k( 250) = ( 0.3431373 -0.0000000 0.5000000), wk = 0.0020325 k( 251) = ( 0.3529412 0.0000000 0.5000000), wk = 0.0020325 k( 252) = ( 0.3627451 -0.0000000 0.5000000), wk = 0.0020325 k( 253) = ( 0.3725490 0.0000000 0.5000000), wk = 0.0020325 k( 254) = ( 0.3823529 -0.0000000 0.5000000), wk = 0.0020325 k( 255) = ( 0.3921569 0.0000000 0.5000000), wk = 0.0020325 k( 256) = ( 0.4019608 -0.0000000 0.5000000), wk = 0.0020325 k( 257) = ( 0.4117647 0.0000000 0.5000000), wk = 0.0020325 k( 258) = ( 0.4215686 -0.0000000 0.5000000), wk = 0.0020325 k( 259) = ( 0.4313726 0.0000000 0.5000000), wk = 0.0020325 k( 260) = ( 0.4411765 0.0000000 0.5000000), wk = 0.0020325 k( 261) = ( 0.4509804 0.0000000 0.5000000), wk = 0.0020325 k( 262) = ( 0.4607843 0.0000000 0.5000000), wk = 0.0020325 k( 263) = ( 0.4705882 0.0000000 0.5000000), wk = 0.0020325 k( 264) = ( 0.4803922 -0.0000000 0.5000000), wk = 0.0020325 k( 265) = ( 0.4901961 0.0000000 0.5000000), wk = 0.0020325 k( 266) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0020325 k( 267) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0020325 k( 268) = ( 0.5000000 0.0131579 0.5000000), wk = 0.0020325 k( 269) = ( 0.5000000 0.0263158 0.5000000), wk = 0.0020325 k( 270) = ( 0.5000000 0.0394737 0.5000000), wk = 0.0020325 k( 271) = ( 0.5000000 0.0526316 0.5000000), wk = 0.0020325 k( 272) = ( 0.5000000 0.0657895 0.5000000), wk = 0.0020325 k( 273) = ( 0.5000000 0.0789474 0.5000000), wk = 0.0020325 k( 274) = ( 0.5000000 0.0921053 0.5000000), wk = 0.0020325 k( 275) = ( 0.5000000 0.1052632 0.5000000), wk = 0.0020325 k( 276) = ( 0.5000000 0.1184211 0.5000000), wk = 0.0020325 k( 277) = ( 0.5000000 0.1315790 0.5000000), wk = 0.0020325 k( 278) = ( 0.5000000 0.1447368 0.5000000), wk = 0.0020325 k( 279) = ( 0.5000000 0.1578947 0.5000000), wk = 0.0020325 k( 280) = ( 0.5000000 0.1710526 0.5000000), wk = 0.0020325 k( 281) = ( 0.5000000 0.1842105 0.5000000), wk = 0.0020325 k( 282) = ( 0.5000000 0.1973684 0.5000000), wk = 0.0020325 k( 283) = ( 0.5000000 0.2105263 0.5000000), wk = 0.0020325 k( 284) = ( 0.5000000 0.2236842 0.5000000), wk = 0.0020325 k( 285) = ( 0.5000000 0.2368421 0.5000000), wk = 0.0020325 k( 286) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0020325 k( 287) = ( 0.5000000 0.2631579 0.5000000), wk = 0.0020325 k( 288) = ( 0.5000000 0.2763158 0.5000000), wk = 0.0020325 k( 289) = ( 0.5000000 0.2894737 0.5000000), wk = 0.0020325 k( 290) = ( 0.5000000 0.3026316 0.5000000), wk = 0.0020325 k( 291) = ( 0.5000000 0.3157895 0.5000000), wk = 0.0020325 k( 292) = ( 0.5000000 0.3289474 0.5000000), wk = 0.0020325 k( 293) = ( 0.5000000 0.3421053 0.5000000), wk = 0.0020325 k( 294) = ( 0.5000000 0.3552632 0.5000000), wk = 0.0020325 k( 295) = ( 0.5000000 0.3684211 0.5000000), wk = 0.0020325 k( 296) = ( 0.5000000 0.3815789 0.5000000), wk = 0.0020325 k( 297) = ( 0.5000000 0.3947368 0.5000000), wk = 0.0020325 k( 298) = ( 0.5000000 0.4078947 0.5000000), wk = 0.0020325 k( 299) = ( 0.5000000 0.4210526 0.5000000), wk = 0.0020325 k( 300) = ( 0.5000000 0.4342105 0.5000000), wk = 0.0020325 k( 301) = ( 0.5000000 0.4473684 0.5000000), wk = 0.0020325 k( 302) = ( 0.5000000 0.4605263 0.5000000), wk = 0.0020325 k( 303) = ( 0.5000000 0.4736842 0.5000000), wk = 0.0020325 k( 304) = ( 0.5000000 0.4868421 0.5000000), wk = 0.0020325 k( 305) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020325 k( 306) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020325 k( 307) = ( 0.4901961 0.5000000 0.5000000), wk = 0.0020325 k( 308) = ( 0.4803922 0.5000000 0.5000000), wk = 0.0020325 k( 309) = ( 0.4705882 0.5000000 0.5000000), wk = 0.0020325 k( 310) = ( 0.4607843 0.5000000 0.5000000), wk = 0.0020325 k( 311) = ( 0.4509804 0.5000000 0.5000000), wk = 0.0020325 k( 312) = ( 0.4411765 0.5000000 0.5000000), wk = 0.0020325 k( 313) = ( 0.4313726 0.5000000 0.5000000), wk = 0.0020325 k( 314) = ( 0.4215686 0.5000000 0.5000000), wk = 0.0020325 k( 315) = ( 0.4117647 0.5000000 0.5000000), wk = 0.0020325 k( 316) = ( 0.4019608 0.5000000 0.5000000), wk = 0.0020325 k( 317) = ( 0.3921569 0.5000000 0.5000000), wk = 0.0020325 k( 318) = ( 0.3823529 0.5000000 0.5000000), wk = 0.0020325 k( 319) = ( 0.3725490 0.5000000 0.5000000), wk = 0.0020325 k( 320) = ( 0.3627451 0.5000000 0.5000000), wk = 0.0020325 k( 321) = ( 0.3529412 0.5000000 0.5000000), wk = 0.0020325 k( 322) = ( 0.3431373 0.5000000 0.5000000), wk = 0.0020325 k( 323) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0020325 k( 324) = ( 0.3235294 0.5000000 0.5000000), wk = 0.0020325 k( 325) = ( 0.3137255 0.5000000 0.5000000), wk = 0.0020325 k( 326) = ( 0.3039216 0.5000000 0.5000000), wk = 0.0020325 k( 327) = ( 0.2941177 0.5000000 0.5000000), wk = 0.0020325 k( 328) = ( 0.2843137 0.5000000 0.5000000), wk = 0.0020325 k( 329) = ( 0.2745098 0.5000000 0.5000000), wk = 0.0020325 k( 330) = ( 0.2647059 0.5000000 0.5000000), wk = 0.0020325 k( 331) = ( 0.2549020 0.5000000 0.5000000), wk = 0.0020325 k( 332) = ( 0.2450980 0.5000000 0.5000000), wk = 0.0020325 k( 333) = ( 0.2352941 0.5000000 0.5000000), wk = 0.0020325 k( 334) = ( 0.2254902 0.5000000 0.5000000), wk = 0.0020325 k( 335) = ( 0.2156863 0.5000000 0.5000000), wk = 0.0020325 k( 336) = ( 0.2058823 0.5000000 0.5000000), wk = 0.0020325 k( 337) = ( 0.1960784 0.5000000 0.5000000), wk = 0.0020325 k( 338) = ( 0.1862745 0.5000000 0.5000000), wk = 0.0020325 k( 339) = ( 0.1764706 0.5000000 0.5000000), wk = 0.0020325 k( 340) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0020325 k( 341) = ( 0.1568627 0.5000000 0.5000000), wk = 0.0020325 k( 342) = ( 0.1470588 0.5000000 0.5000000), wk = 0.0020325 k( 343) = ( 0.1372549 0.5000000 0.5000000), wk = 0.0020325 k( 344) = ( 0.1274510 0.5000000 0.5000000), wk = 0.0020325 k( 345) = ( 0.1176471 0.5000000 0.5000000), wk = 0.0020325 k( 346) = ( 0.1078431 0.5000000 0.5000000), wk = 0.0020325 k( 347) = ( 0.0980392 0.5000000 0.5000000), wk = 0.0020325 k( 348) = ( 0.0882353 0.5000000 0.5000000), wk = 0.0020325 k( 349) = ( 0.0784314 0.5000000 0.5000000), wk = 0.0020325 k( 350) = ( 0.0686275 0.5000000 0.5000000), wk = 0.0020325 k( 351) = ( 0.0588235 0.5000000 0.5000000), wk = 0.0020325 k( 352) = ( 0.0490196 0.5000000 0.5000000), wk = 0.0020325 k( 353) = ( 0.0392157 0.5000000 0.5000000), wk = 0.0020325 k( 354) = ( 0.0294118 0.5000000 0.5000000), wk = 0.0020325 k( 355) = ( 0.0196078 0.5000000 0.5000000), wk = 0.0020325 k( 356) = ( 0.0098039 0.5000000 0.5000000), wk = 0.0020325 k( 357) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020325 k( 358) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020325 k( 359) = ( 0.0000000 0.4868421 0.5000000), wk = 0.0020325 k( 360) = ( 0.0000000 0.4736842 0.5000000), wk = 0.0020325 k( 361) = ( 0.0000000 0.4605263 0.5000000), wk = 0.0020325 k( 362) = ( 0.0000000 0.4473684 0.5000000), wk = 0.0020325 k( 363) = ( 0.0000000 0.4342105 0.5000000), wk = 0.0020325 k( 364) = ( 0.0000000 0.4210526 0.5000000), wk = 0.0020325 k( 365) = ( 0.0000000 0.4078947 0.5000000), wk = 0.0020325 k( 366) = ( 0.0000000 0.3947368 0.5000000), wk = 0.0020325 k( 367) = ( 0.0000000 0.3815789 0.5000000), wk = 0.0020325 k( 368) = ( 0.0000000 0.3684211 0.5000000), wk = 0.0020325 k( 369) = ( 0.0000000 0.3552632 0.5000000), wk = 0.0020325 k( 370) = ( 0.0000000 0.3421053 0.5000000), wk = 0.0020325 k( 371) = ( 0.0000000 0.3289474 0.5000000), wk = 0.0020325 k( 372) = ( 0.0000000 0.3157895 0.5000000), wk = 0.0020325 k( 373) = ( 0.0000000 0.3026316 0.5000000), wk = 0.0020325 k( 374) = ( 0.0000000 0.2894737 0.5000000), wk = 0.0020325 k( 375) = ( 0.0000000 0.2763158 0.5000000), wk = 0.0020325 k( 376) = ( 0.0000000 0.2631579 0.5000000), wk = 0.0020325 k( 377) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0020325 k( 378) = ( 0.0000000 0.2368421 0.5000000), wk = 0.0020325 k( 379) = ( 0.0000000 0.2236842 0.5000000), wk = 0.0020325 k( 380) = ( 0.0000000 0.2105263 0.5000000), wk = 0.0020325 k( 381) = ( 0.0000000 0.1973684 0.5000000), wk = 0.0020325 k( 382) = ( 0.0000000 0.1842105 0.5000000), wk = 0.0020325 k( 383) = ( 0.0000000 0.1710526 0.5000000), wk = 0.0020325 k( 384) = ( 0.0000000 0.1578947 0.5000000), wk = 0.0020325 k( 385) = ( 0.0000000 0.1447368 0.5000000), wk = 0.0020325 k( 386) = ( 0.0000000 0.1315790 0.5000000), wk = 0.0020325 k( 387) = ( 0.0000000 0.1184211 0.5000000), wk = 0.0020325 k( 388) = ( 0.0000000 0.1052632 0.5000000), wk = 0.0020325 k( 389) = ( 0.0000000 0.0921053 0.5000000), wk = 0.0020325 k( 390) = ( 0.0000000 0.0789474 0.5000000), wk = 0.0020325 k( 391) = ( 0.0000000 0.0657895 0.5000000), wk = 0.0020325 k( 392) = ( 0.0000000 0.0526316 0.5000000), wk = 0.0020325 k( 393) = ( 0.0000000 0.0394737 0.5000000), wk = 0.0020325 k( 394) = ( 0.0000000 0.0263158 0.5000000), wk = 0.0020325 k( 395) = ( 0.0000000 0.0131579 0.5000000), wk = 0.0020325 k( 396) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020325 k( 397) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020325 k( 398) = ( 0.0000000 0.5000000 0.0161290), wk = 0.0020325 k( 399) = ( 0.0000000 0.5000000 0.0322581), wk = 0.0020325 k( 400) = ( 0.0000000 0.5000000 0.0483871), wk = 0.0020325 k( 401) = ( 0.0000000 0.5000000 0.0645161), wk = 0.0020325 k( 402) = ( 0.0000000 0.5000000 0.0806452), wk = 0.0020325 k( 403) = ( 0.0000000 0.5000000 0.0967742), wk = 0.0020325 k( 404) = ( 0.0000000 0.5000000 0.1129032), wk = 0.0020325 k( 405) = ( 0.0000000 0.5000000 0.1290323), wk = 0.0020325 k( 406) = ( 0.0000000 0.5000000 0.1451613), wk = 0.0020325 k( 407) = ( 0.0000000 0.5000000 0.1612903), wk = 0.0020325 k( 408) = ( 0.0000000 0.5000000 0.1774194), wk = 0.0020325 k( 409) = ( 0.0000000 0.5000000 0.1935484), wk = 0.0020325 k( 410) = ( 0.0000000 0.5000000 0.2096774), wk = 0.0020325 k( 411) = ( 0.0000000 0.5000000 0.2258065), wk = 0.0020325 k( 412) = ( 0.0000000 0.5000000 0.2419355), wk = 0.0020325 k( 413) = ( 0.0000000 0.5000000 0.2580645), wk = 0.0020325 k( 414) = ( 0.0000000 0.5000000 0.2741936), wk = 0.0020325 k( 415) = ( 0.0000000 0.5000000 0.2903226), wk = 0.0020325 k( 416) = ( 0.0000000 0.5000000 0.3064516), wk = 0.0020325 k( 417) = ( 0.0000000 0.5000000 0.3225807), wk = 0.0020325 k( 418) = ( 0.0000000 0.5000000 0.3387097), wk = 0.0020325 k( 419) = ( 0.0000000 0.5000000 0.3548387), wk = 0.0020325 k( 420) = ( 0.0000000 0.5000000 0.3709677), wk = 0.0020325 k( 421) = ( 0.0000000 0.5000000 0.3870968), wk = 0.0020325 k( 422) = ( 0.0000000 0.5000000 0.4032258), wk = 0.0020325 k( 423) = ( 0.0000000 0.5000000 0.4193548), wk = 0.0020325 k( 424) = ( 0.0000000 0.5000000 0.4354839), wk = 0.0020325 k( 425) = ( 0.0000000 0.5000000 0.4516129), wk = 0.0020325 k( 426) = ( 0.0000000 0.5000000 0.4677419), wk = 0.0020325 k( 427) = ( 0.0000000 0.5000000 0.4838710), wk = 0.0020325 k( 428) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020325 k( 429) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0020325 k( 430) = ( 0.5000000 -0.0000000 0.4838710), wk = 0.0020325 k( 431) = ( 0.5000000 -0.0000000 0.4677419), wk = 0.0020325 k( 432) = ( 0.5000000 -0.0000000 0.4516129), wk = 0.0020325 k( 433) = ( 0.5000000 -0.0000000 0.4354839), wk = 0.0020325 k( 434) = ( 0.5000000 -0.0000000 0.4193548), wk = 0.0020325 k( 435) = ( 0.5000000 -0.0000000 0.4032258), wk = 0.0020325 k( 436) = ( 0.5000000 -0.0000000 0.3870968), wk = 0.0020325 k( 437) = ( 0.5000000 -0.0000000 0.3709677), wk = 0.0020325 k( 438) = ( 0.5000000 -0.0000000 0.3548387), wk = 0.0020325 k( 439) = ( 0.5000000 -0.0000000 0.3387097), wk = 0.0020325 k( 440) = ( 0.5000000 -0.0000000 0.3225807), wk = 0.0020325 k( 441) = ( 0.5000000 -0.0000000 0.3064516), wk = 0.0020325 k( 442) = ( 0.5000000 -0.0000000 0.2903226), wk = 0.0020325 k( 443) = ( 0.5000000 -0.0000000 0.2741936), wk = 0.0020325 k( 444) = ( 0.5000000 -0.0000000 0.2580645), wk = 0.0020325 k( 445) = ( 0.5000000 -0.0000000 0.2419355), wk = 0.0020325 k( 446) = ( 0.5000000 -0.0000000 0.2258065), wk = 0.0020325 k( 447) = ( 0.5000000 -0.0000000 0.2096774), wk = 0.0020325 k( 448) = ( 0.5000000 -0.0000000 0.1935484), wk = 0.0020325 k( 449) = ( 0.5000000 -0.0000000 0.1774194), wk = 0.0020325 k( 450) = ( 0.5000000 -0.0000000 0.1612903), wk = 0.0020325 k( 451) = ( 0.5000000 -0.0000000 0.1451613), wk = 0.0020325 k( 452) = ( 0.5000000 -0.0000000 0.1290323), wk = 0.0020325 k( 453) = ( 0.5000000 -0.0000000 0.1129032), wk = 0.0020325 k( 454) = ( 0.5000000 -0.0000000 0.0967742), wk = 0.0020325 k( 455) = ( 0.5000000 -0.0000000 0.0806452), wk = 0.0020325 k( 456) = ( 0.5000000 -0.0000000 0.0645161), wk = 0.0020325 k( 457) = ( 0.5000000 -0.0000000 0.0483871), wk = 0.0020325 k( 458) = ( 0.5000000 -0.0000000 0.0322581), wk = 0.0020325 k( 459) = ( 0.5000000 -0.0000000 0.0161290), wk = 0.0020325 k( 460) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020325 k( 461) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020325 k( 462) = ( 0.5000000 0.5000000 0.0161290), wk = 0.0020325 k( 463) = ( 0.5000000 0.5000000 0.0322581), wk = 0.0020325 k( 464) = ( 0.5000000 0.5000000 0.0483871), wk = 0.0020325 k( 465) = ( 0.5000000 0.5000000 0.0645161), wk = 0.0020325 k( 466) = ( 0.5000000 0.5000000 0.0806452), wk = 0.0020325 k( 467) = ( 0.5000000 0.5000000 0.0967742), wk = 0.0020325 k( 468) = ( 0.5000000 0.5000000 0.1129032), wk = 0.0020325 k( 469) = ( 0.5000000 0.5000000 0.1290323), wk = 0.0020325 k( 470) = ( 0.5000000 0.5000000 0.1451613), wk = 0.0020325 k( 471) = ( 0.5000000 0.5000000 0.1612903), wk = 0.0020325 k( 472) = ( 0.5000000 0.5000000 0.1774194), wk = 0.0020325 k( 473) = ( 0.5000000 0.5000000 0.1935484), wk = 0.0020325 k( 474) = ( 0.5000000 0.5000000 0.2096774), wk = 0.0020325 k( 475) = ( 0.5000000 0.5000000 0.2258065), wk = 0.0020325 k( 476) = ( 0.5000000 0.5000000 0.2419355), wk = 0.0020325 k( 477) = ( 0.5000000 0.5000000 0.2580645), wk = 0.0020325 k( 478) = ( 0.5000000 0.5000000 0.2741936), wk = 0.0020325 k( 479) = ( 0.5000000 0.5000000 0.2903226), wk = 0.0020325 k( 480) = ( 0.5000000 0.5000000 0.3064516), wk = 0.0020325 k( 481) = ( 0.5000000 0.5000000 0.3225807), wk = 0.0020325 k( 482) = ( 0.5000000 0.5000000 0.3387097), wk = 0.0020325 k( 483) = ( 0.5000000 0.5000000 0.3548387), wk = 0.0020325 k( 484) = ( 0.5000000 0.5000000 0.3709677), wk = 0.0020325 k( 485) = ( 0.5000000 0.5000000 0.3870968), wk = 0.0020325 k( 486) = ( 0.5000000 0.5000000 0.4032258), wk = 0.0020325 k( 487) = ( 0.5000000 0.5000000 0.4193548), wk = 0.0020325 k( 488) = ( 0.5000000 0.5000000 0.4354839), wk = 0.0020325 k( 489) = ( 0.5000000 0.5000000 0.4516129), wk = 0.0020325 k( 490) = ( 0.5000000 0.5000000 0.4677419), wk = 0.0020325 k( 491) = ( 0.5000000 0.5000000 0.4838710), wk = 0.0020325 k( 492) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020325 Dense grid: 27793 G-vectors FFT dimensions: ( 30, 40, 48) Smooth grid: 16715 G-vectors FFT dimensions: ( 25, 36, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 156, 52) NL pseudopotentials 0.24 Mb ( 78, 204) Each V/rho on FFT grid 0.04 Mb ( 2400) Each G-vector array 0.01 Mb ( 872) G-vector shells 0.00 Mb ( 450) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.50 Mb ( 156, 208) Each subspace H/S matrix 0.66 Mb ( 208, 208) Each matrix 0.32 Mb ( 204, 2, 52) The potential is recalculated from file : ./NiS2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 4.6 secs Computing kpt #: 3 total cpu time spent up to now is 5.4 secs Computing kpt #: 4 total cpu time spent up to now is 6.2 secs Computing kpt #: 5 total cpu time spent up to now is 7.0 secs Computing kpt #: 6 total cpu time spent up to now is 7.9 secs Computing kpt #: 7 total cpu time spent up to now is 8.7 secs Computing kpt #: 8 total cpu time spent up to now is 9.4 secs Computing kpt #: 9 total cpu time spent up to now is 10.2 secs Computing kpt #: 10 total cpu time spent up to now is 11.0 secs Computing kpt #: 11 total cpu time spent up to now is 11.8 secs Computing kpt #: 12 total cpu time spent up to now is 12.5 secs Computing kpt #: 13 total cpu time spent up to now is 13.3 secs Computing kpt #: 14 total cpu time spent up to now is 14.0 secs Computing kpt #: 15 total cpu time spent up to now is 14.7 secs Computing kpt #: 16 total cpu time spent up to now is 15.4 secs Computing kpt #: 17 total cpu time spent up to now is 16.1 secs Computing kpt #: 18 total cpu time spent up to now is 16.9 secs Computing kpt #: 19 total cpu time spent up to now is 17.6 secs Computing kpt #: 20 total cpu time spent up to now is 18.3 secs Computing kpt #: 21 total cpu time spent up to now is 19.0 secs Computing kpt #: 22 total cpu time spent up to now is 19.6 secs Computing kpt #: 23 total cpu time spent up to now is 20.3 secs Computing kpt #: 24 total cpu time spent up to now is 20.9 secs Computing kpt #: 25 total cpu time spent up to now is 21.6 secs Computing kpt #: 26 total cpu time spent up to now is 22.3 secs Computing kpt #: 27 total cpu time spent up to now is 22.9 secs Computing kpt #: 28 total cpu time spent up to now is 23.6 secs Computing kpt #: 29 total cpu time spent up to now is 24.4 secs Computing kpt #: 30 total cpu time spent up to now is 25.0 secs Computing kpt #: 31 total cpu time spent up to now is 25.6 secs Computing kpt #: 32 total cpu time spent up to now is 26.3 secs Computing kpt #: 33 total cpu time spent up to now is 27.0 secs Computing kpt #: 34 total cpu time spent up to now is 27.6 secs Computing kpt #: 35 total cpu time spent up to now is 28.3 secs Computing kpt #: 36 total cpu time spent up to now is 28.9 secs Computing kpt #: 37 total cpu time spent up to now is 29.6 secs Computing kpt #: 38 total cpu time spent up to now is 30.2 secs Computing kpt #: 39 total cpu time spent up to now is 30.8 secs Computing kpt #: 40 total cpu time spent up to now is 31.5 secs Computing kpt #: 41 total cpu time spent up to now is 32.2 secs Computing kpt #: 42 total cpu time spent up to now is 32.9 secs Computing kpt #: 43 total cpu time spent up to now is 33.6 secs Computing kpt #: 44 total cpu time spent up to now is 34.2 secs Computing kpt #: 45 total cpu time spent up to now is 34.8 secs Computing kpt #: 46 total cpu time spent up to now is 35.5 secs Computing kpt #: 47 total cpu time spent up to now is 36.1 secs Computing kpt #: 48 total cpu time spent up to now is 36.8 secs Computing kpt #: 49 total cpu time spent up to now is 37.5 secs Computing kpt #: 50 total cpu time spent up to now is 38.1 secs Computing kpt #: 51 total cpu time spent up to now is 38.7 secs Computing kpt #: 52 total cpu time spent up to now is 39.5 secs Computing kpt #: 53 total cpu time spent up to now is 40.1 secs Computing kpt #: 54 total cpu time spent up to now is 40.8 secs Computing kpt #: 55 total cpu time spent up to now is 41.5 secs Computing kpt #: 56 total cpu time spent up to now is 42.1 secs Computing kpt #: 57 total cpu time spent up to now is 42.8 secs Computing kpt #: 58 total cpu time spent up to now is 43.4 secs Computing kpt #: 59 total cpu time spent up to now is 44.1 secs Computing kpt #: 60 total cpu time spent up to now is 44.8 secs Computing kpt #: 61 total cpu time spent up to now is 45.5 secs Computing kpt #: 62 total cpu time spent up to now is 46.2 secs Computing kpt #: 63 total cpu time spent up to now is 47.0 secs Computing kpt #: 64 total cpu time spent up to now is 47.7 secs Computing kpt #: 65 total cpu time spent up to now is 48.4 secs Computing kpt #: 66 total cpu time spent up to now is 49.1 secs Computing kpt #: 67 total cpu time spent up to now is 49.8 secs Computing kpt #: 68 total cpu time spent up to now is 50.5 secs Computing kpt #: 69 total cpu time spent up to now is 51.3 secs Computing kpt #: 70 total cpu time spent up to now is 52.0 secs Computing kpt #: 71 total cpu time spent up to now is 52.7 secs Computing kpt #: 72 total cpu time spent up to now is 53.4 secs Computing kpt #: 73 total cpu time spent up to now is 54.1 secs Computing kpt #: 74 total cpu time spent up to now is 54.9 secs Computing kpt #: 75 total cpu time spent up to now is 55.6 secs Computing kpt #: 76 total cpu time spent up to now is 56.3 secs Computing kpt #: 77 total cpu time spent up to now is 57.0 secs Computing kpt #: 78 total cpu time spent up to now is 57.7 secs Computing kpt #: 79 total cpu time spent up to now is 58.4 secs Computing kpt #: 80 total cpu time spent up to now is 59.1 secs Computing kpt #: 81 total cpu time spent up to now is 59.7 secs Computing kpt #: 82 total cpu time spent up to now is 60.4 secs Computing kpt #: 83 total cpu time spent up to now is 61.0 secs Computing kpt #: 84 total cpu time spent up to now is 61.7 secs Computing kpt #: 85 total cpu time spent up to now is 62.4 secs Computing kpt #: 86 total cpu time spent up to now is 63.1 secs Computing kpt #: 87 total cpu time spent up to now is 63.9 secs Computing kpt #: 88 total cpu time spent up to now is 64.6 secs Computing kpt #: 89 total cpu time spent up to now is 65.3 secs Computing kpt #: 90 total cpu time spent up to now is 66.1 secs Computing kpt #: 91 total cpu time spent up to now is 66.8 secs Computing kpt #: 92 total cpu time spent up to now is 67.5 secs Computing kpt #: 93 total cpu time spent up to now is 68.2 secs Computing kpt #: 94 total cpu time spent up to now is 68.9 secs Computing kpt #: 95 total cpu time spent up to now is 69.7 secs Computing kpt #: 96 total cpu time spent up to now is 70.4 secs Computing kpt #: 97 total cpu time spent up to now is 71.1 secs Computing kpt #: 98 total cpu time spent up to now is 71.9 secs Computing kpt #: 99 total cpu time spent up to now is 72.6 secs Computing kpt #: 100 total cpu time spent up to now is 73.3 secs Computing kpt #: 101 total cpu time spent up to now is 74.1 secs Computing kpt #: 102 total cpu time spent up to now is 74.8 secs Computing kpt #: 103 total cpu time spent up to now is 75.6 secs Computing kpt #: 104 total cpu time spent up to now is 76.3 secs Computing kpt #: 105 total cpu time spent up to now is 77.0 secs Computing kpt #: 106 total cpu time spent up to now is 77.7 secs Computing kpt #: 107 total cpu time spent up to now is 78.4 secs Computing kpt #: 108 total cpu time spent up to now is 79.2 secs Computing kpt #: 109 total cpu time spent up to now is 79.9 secs Computing kpt #: 110 total cpu time spent up to now is 80.5 secs Computing kpt #: 111 total cpu time spent up to now is 81.2 secs Computing kpt #: 112 total cpu time spent up to now is 81.8 secs Computing kpt #: 113 total cpu time spent up to now is 82.4 secs Computing kpt #: 114 total cpu time spent up to now is 83.0 secs Computing kpt #: 115 total cpu time spent up to now is 83.7 secs Computing kpt #: 116 total cpu time spent up to now is 84.3 secs Computing kpt #: 117 total cpu time spent up to now is 84.9 secs Computing kpt #: 118 total cpu time spent up to now is 85.6 secs Computing kpt #: 119 total cpu time spent up to now is 86.2 secs Computing kpt #: 120 total cpu time spent up to now is 86.9 secs Computing kpt #: 121 total cpu time spent up to now is 87.6 secs Computing kpt #: 122 total cpu time spent up to now is 88.3 secs Computing kpt #: 123 total cpu time spent up to now is 89.0 secs Computing kpt #: 124 total cpu time spent up to now is 89.8 secs Computing kpt #: 125 total cpu time spent up to now is 90.5 secs Computing kpt #: 126 total cpu time spent up to now is 91.2 secs Computing kpt #: 127 total cpu time spent up to now is 91.9 secs Computing kpt #: 128 total cpu time spent up to now is 92.6 secs Computing kpt #: 129 total cpu time spent up to now is 93.3 secs Computing kpt #: 130 total cpu time spent up to now is 94.1 secs Computing kpt #: 131 total cpu time spent up to now is 94.8 secs Computing kpt #: 132 total cpu time spent up to now is 95.5 secs Computing kpt #: 133 total cpu time spent up to now is 96.3 secs Computing kpt #: 134 total cpu time spent up to now is 97.0 secs Computing kpt #: 135 total cpu time spent up to now is 97.7 secs Computing kpt #: 136 total cpu time spent up to now is 98.4 secs Computing kpt #: 137 total cpu time spent up to now is 99.2 secs Computing kpt #: 138 total cpu time spent up to now is 99.9 secs Computing kpt #: 139 total cpu time spent up to now is 100.6 secs Computing kpt #: 140 total cpu time spent up to now is 101.4 secs Computing kpt #: 141 total cpu time spent up to now is 102.1 secs Computing kpt #: 142 total cpu time spent up to now is 102.8 secs Computing kpt #: 143 total cpu time spent up to now is 103.5 secs Computing kpt #: 144 total cpu time spent up to now is 104.2 secs Computing kpt #: 145 total cpu time spent up to now is 105.0 secs Computing kpt #: 146 total cpu time spent up to now is 105.7 secs Computing kpt #: 147 total cpu time spent up to now is 106.4 secs Computing kpt #: 148 total cpu time spent up to now is 107.2 secs Computing kpt #: 149 total cpu time spent up to now is 107.9 secs Computing kpt #: 150 total cpu time spent up to now is 108.6 secs Computing kpt #: 151 total cpu time spent up to now is 109.4 secs Computing kpt #: 152 total cpu time spent up to now is 110.1 secs Computing kpt #: 153 total cpu time spent up to now is 110.8 secs Computing kpt #: 154 total cpu time spent up to now is 111.6 secs Computing kpt #: 155 total cpu time spent up to now is 112.4 secs Computing kpt #: 156 total cpu time spent up to now is 113.1 secs Computing kpt #: 157 total cpu time spent up to now is 113.8 secs Computing kpt #: 158 total cpu time spent up to now is 114.6 secs Computing kpt #: 159 total cpu time spent up to now is 115.3 secs Computing kpt #: 160 total cpu time spent up to now is 116.1 secs Computing kpt #: 161 total cpu time spent up to now is 116.8 secs Computing kpt #: 162 total cpu time spent up to now is 117.5 secs Computing kpt #: 163 total cpu time spent up to now is 118.3 secs Computing kpt #: 164 total cpu time spent up to now is 119.0 secs Computing kpt #: 165 total cpu time spent up to now is 119.8 secs Computing kpt #: 166 total cpu time spent up to now is 120.6 secs Computing kpt #: 167 total cpu time spent up to now is 121.4 secs Computing kpt #: 168 total cpu time spent up to now is 122.2 secs Computing kpt #: 169 total cpu time spent up to now is 122.9 secs Computing kpt #: 170 total cpu time spent up to now is 123.8 secs Computing kpt #: 171 total cpu time spent up to now is 124.5 secs Computing kpt #: 172 total cpu time spent up to now is 125.4 secs Computing kpt #: 173 total cpu time spent up to now is 126.2 secs Computing kpt #: 174 total cpu time spent up to now is 127.0 secs Computing kpt #: 175 total cpu time spent up to now is 127.8 secs Computing kpt #: 176 total cpu time spent up to now is 128.7 secs Computing kpt #: 177 total cpu time spent up to now is 129.5 secs Computing kpt #: 178 total cpu time spent up to now is 130.4 secs Computing kpt #: 179 total cpu time spent up to now is 131.2 secs Computing kpt #: 180 total cpu time spent up to now is 132.1 secs Computing kpt #: 181 total cpu time spent up to now is 132.8 secs Computing kpt #: 182 total cpu time spent up to now is 133.7 secs Computing kpt #: 183 total cpu time spent up to now is 134.5 secs Computing kpt #: 184 total cpu time spent up to now is 135.5 secs Computing kpt #: 185 total cpu time spent up to now is 136.4 secs Computing kpt #: 186 total cpu time spent up to now is 137.3 secs Computing kpt #: 187 total cpu time spent up to now is 138.1 secs Computing kpt #: 188 total cpu time spent up to now is 139.0 secs Computing kpt #: 189 total cpu time spent up to now is 139.8 secs Computing kpt #: 190 total cpu time spent up to now is 140.6 secs Computing kpt #: 191 total cpu time spent up to now is 141.5 secs Computing kpt #: 192 total cpu time spent up to now is 142.3 secs Computing kpt #: 193 total cpu time spent up to now is 143.0 secs Computing kpt #: 194 total cpu time spent up to now is 143.8 secs Computing kpt #: 195 total cpu time spent up to now is 144.6 secs Computing kpt #: 196 total cpu time spent up to now is 145.4 secs Computing kpt #: 197 total cpu time spent up to now is 146.2 secs Computing kpt #: 198 total cpu time spent up to now is 146.9 secs Computing kpt #: 199 total cpu time spent up to now is 147.7 secs Computing kpt #: 200 total cpu time spent up to now is 148.5 secs Computing kpt #: 201 total cpu time spent up to now is 149.2 secs Computing kpt #: 202 total cpu time spent up to now is 150.0 secs Computing kpt #: 203 total cpu time spent up to now is 150.7 secs Computing kpt #: 204 total cpu time spent up to now is 151.4 secs Computing kpt #: 205 total cpu time spent up to now is 152.2 secs Computing kpt #: 206 total cpu time spent up to now is 152.9 secs Computing kpt #: 207 total cpu time spent up to now is 153.5 secs Computing kpt #: 208 total cpu time spent up to now is 154.2 secs Computing kpt #: 209 total cpu time spent up to now is 154.8 secs Computing kpt #: 210 total cpu time spent up to now is 155.5 secs Computing kpt #: 211 total cpu time spent up to now is 156.1 secs Computing kpt #: 212 total cpu time spent up to now is 156.8 secs Computing kpt #: 213 total cpu time spent up to now is 157.4 secs Computing kpt #: 214 total cpu time spent up to now is 158.0 secs Computing kpt #: 215 total cpu time spent up to now is 158.7 secs Computing kpt #: 216 total cpu time spent up to now is 159.3 secs Computing kpt #: 217 total cpu time spent up to now is 159.9 secs Computing kpt #: 218 total cpu time spent up to now is 160.6 secs Computing kpt #: 219 total cpu time spent up to now is 161.2 secs Computing kpt #: 220 total cpu time spent up to now is 161.8 secs Computing kpt #: 221 total cpu time spent up to now is 162.5 secs Computing kpt #: 222 total cpu time spent up to now is 163.1 secs Computing kpt #: 223 total cpu time spent up to now is 163.7 secs Computing kpt #: 224 total cpu time spent up to now is 164.4 secs Computing kpt #: 225 total cpu time spent up to now is 165.0 secs Computing kpt #: 226 total cpu time spent up to now is 165.7 secs Computing kpt #: 227 total cpu time spent up to now is 166.3 secs Computing kpt #: 228 total cpu time spent up to now is 166.9 secs Computing kpt #: 229 total cpu time spent up to now is 167.5 secs Computing kpt #: 230 total cpu time spent up to now is 168.2 secs Computing kpt #: 231 total cpu time spent up to now is 168.8 secs Computing kpt #: 232 total cpu time spent up to now is 169.4 secs Computing kpt #: 233 total cpu time spent up to now is 170.0 secs Computing kpt #: 234 total cpu time spent up to now is 170.6 secs Computing kpt #: 235 total cpu time spent up to now is 171.6 secs Computing kpt #: 236 total cpu time spent up to now is 173.9 secs Computing kpt #: 237 total cpu time spent up to now is 175.7 secs Computing kpt #: 238 total cpu time spent up to now is 176.4 secs Computing kpt #: 239 total cpu time spent up to now is 177.0 secs Computing kpt #: 240 total cpu time spent up to now is 177.7 secs Computing kpt #: 241 total cpu time spent up to now is 178.3 secs Computing kpt #: 242 total cpu time spent up to now is 179.0 secs Computing kpt #: 243 total cpu time spent up to now is 179.7 secs Computing kpt #: 244 total cpu time spent up to now is 180.4 secs Computing kpt #: 245 total cpu time spent up to now is 181.1 secs Computing kpt #: 246 total cpu time spent up to now is 181.8 secs Computing kpt #: 247 total cpu time spent up to now is 182.5 secs Computing kpt #: 248 total cpu time spent up to now is 183.3 secs Computing kpt #: 249 total cpu time spent up to now is 184.0 secs Computing kpt #: 250 total cpu time spent up to now is 184.7 secs Computing kpt #: 251 total cpu time spent up to now is 185.5 secs Computing kpt #: 252 total cpu time spent up to now is 186.2 secs Computing kpt #: 253 total cpu time spent up to now is 187.0 secs Computing kpt #: 254 total cpu time spent up to now is 187.7 secs Computing kpt #: 255 total cpu time spent up to now is 188.5 secs Computing kpt #: 256 total cpu time spent up to now is 189.2 secs Computing kpt #: 257 total cpu time spent up to now is 190.0 secs Computing kpt #: 258 total cpu time spent up to now is 190.8 secs Computing kpt #: 259 total cpu time spent up to now is 191.5 secs Computing kpt #: 260 total cpu time spent up to now is 192.2 secs Computing kpt #: 261 total cpu time spent up to now is 193.0 secs Computing kpt #: 262 total cpu time spent up to now is 193.7 secs Computing kpt #: 263 total cpu time spent up to now is 194.4 secs Computing kpt #: 264 total cpu time spent up to now is 195.2 secs Computing kpt #: 265 total cpu time spent up to now is 195.9 secs Computing kpt #: 266 total cpu time spent up to now is 196.6 secs Computing kpt #: 267 total cpu time spent up to now is 197.3 secs Computing kpt #: 268 total cpu time spent up to now is 198.0 secs Computing kpt #: 269 total cpu time spent up to now is 198.8 secs Computing kpt #: 270 total cpu time spent up to now is 199.5 secs Computing kpt #: 271 total cpu time spent up to now is 200.3 secs Computing kpt #: 272 total cpu time spent up to now is 201.1 secs Computing kpt #: 273 total cpu time spent up to now is 201.8 secs Computing kpt #: 274 total cpu time spent up to now is 202.6 secs Computing kpt #: 275 total cpu time spent up to now is 203.3 secs Computing kpt #: 276 total cpu time spent up to now is 204.1 secs Computing kpt #: 277 total cpu time spent up to now is 204.9 secs Computing kpt #: 278 total cpu time spent up to now is 205.6 secs Computing kpt #: 279 total cpu time spent up to now is 206.4 secs Computing kpt #: 280 total cpu time spent up to now is 207.1 secs Computing kpt #: 281 total cpu time spent up to now is 207.9 secs Computing kpt #: 282 total cpu time spent up to now is 208.6 secs Computing kpt #: 283 total cpu time spent up to now is 209.4 secs Computing kpt #: 284 total cpu time spent up to now is 210.1 secs Computing kpt #: 285 total cpu time spent up to now is 210.8 secs Computing kpt #: 286 total cpu time spent up to now is 211.5 secs Computing kpt #: 287 total cpu time spent up to now is 212.2 secs Computing kpt #: 288 total cpu time spent up to now is 213.0 secs Computing kpt #: 289 total cpu time spent up to now is 213.7 secs Computing kpt #: 290 total cpu time spent up to now is 214.4 secs Computing kpt #: 291 total cpu time spent up to now is 215.2 secs Computing kpt #: 292 total cpu time spent up to now is 215.9 secs Computing kpt #: 293 total cpu time spent up to now is 216.6 secs Computing kpt #: 294 total cpu time spent up to now is 217.4 secs Computing kpt #: 295 total cpu time spent up to now is 218.1 secs Computing kpt #: 296 total cpu time spent up to now is 218.8 secs Computing kpt #: 297 total cpu time spent up to now is 219.5 secs Computing kpt #: 298 total cpu time spent up to now is 220.2 secs Computing kpt #: 299 total cpu time spent up to now is 221.0 secs Computing kpt #: 300 total cpu time spent up to now is 221.7 secs Computing kpt #: 301 total cpu time spent up to now is 222.4 secs Computing kpt #: 302 total cpu time spent up to now is 223.1 secs Computing kpt #: 303 total cpu time spent up to now is 223.8 secs Computing kpt #: 304 total cpu time spent up to now is 224.6 secs Computing kpt #: 305 total cpu time spent up to now is 225.3 secs Computing kpt #: 306 total cpu time spent up to now is 226.0 secs Computing kpt #: 307 total cpu time spent up to now is 226.7 secs Computing kpt #: 308 total cpu time spent up to now is 227.3 secs Computing kpt #: 309 total cpu time spent up to now is 228.0 secs Computing kpt #: 310 total cpu time spent up to now is 228.7 secs Computing kpt #: 311 total cpu time spent up to now is 229.4 secs Computing kpt #: 312 total cpu time spent up to now is 230.1 secs Computing kpt #: 313 total cpu time spent up to now is 230.7 secs Computing kpt #: 314 total cpu time spent up to now is 231.3 secs Computing kpt #: 315 total cpu time spent up to now is 232.0 secs Computing kpt #: 316 total cpu time spent up to now is 232.7 secs Computing kpt #: 317 total cpu time spent up to now is 233.4 secs Computing kpt #: 318 total cpu time spent up to now is 234.1 secs Computing kpt #: 319 total cpu time spent up to now is 234.8 secs Computing kpt #: 320 total cpu time spent up to now is 235.5 secs Computing kpt #: 321 total cpu time spent up to now is 236.2 secs Computing kpt #: 322 total cpu time spent up to now is 236.9 secs Computing kpt #: 323 total cpu time spent up to now is 237.6 secs Computing kpt #: 324 total cpu time spent up to now is 238.3 secs Computing kpt #: 325 total cpu time spent up to now is 239.0 secs Computing kpt #: 326 total cpu time spent up to now is 239.7 secs Computing kpt #: 327 total cpu time spent up to now is 240.4 secs Computing kpt #: 328 total cpu time spent up to now is 241.1 secs Computing kpt #: 329 total cpu time spent up to now is 241.8 secs Computing kpt #: 330 total cpu time spent up to now is 242.5 secs Computing kpt #: 331 total cpu time spent up to now is 243.2 secs Computing kpt #: 332 total cpu time spent up to now is 243.9 secs Computing kpt #: 333 total cpu time spent up to now is 244.6 secs Computing kpt #: 334 total cpu time spent up to now is 245.4 secs Computing kpt #: 335 total cpu time spent up to now is 246.1 secs Computing kpt #: 336 total cpu time spent up to now is 246.7 secs Computing kpt #: 337 total cpu time spent up to now is 247.4 secs Computing kpt #: 338 total cpu time spent up to now is 248.1 secs Computing kpt #: 339 total cpu time spent up to now is 248.8 secs Computing kpt #: 340 total cpu time spent up to now is 249.5 secs Computing kpt #: 341 total cpu time spent up to now is 250.2 secs Computing kpt #: 342 total cpu time spent up to now is 250.9 secs Computing kpt #: 343 total cpu time spent up to now is 251.6 secs Computing kpt #: 344 total cpu time spent up to now is 252.3 secs Computing kpt #: 345 total cpu time spent up to now is 253.0 secs Computing kpt #: 346 total cpu time spent up to now is 253.7 secs Computing kpt #: 347 total cpu time spent up to now is 254.4 secs Computing kpt #: 348 total cpu time spent up to now is 255.2 secs Computing kpt #: 349 total cpu time spent up to now is 255.9 secs Computing kpt #: 350 total cpu time spent up to now is 256.7 secs Computing kpt #: 351 total cpu time spent up to now is 257.4 secs Computing kpt #: 352 total cpu time spent up to now is 258.1 secs Computing kpt #: 353 total cpu time spent up to now is 258.8 secs Computing kpt #: 354 total cpu time spent up to now is 259.5 secs Computing kpt #: 355 total cpu time spent up to now is 260.1 secs Computing kpt #: 356 total cpu time spent up to now is 260.8 secs Computing kpt #: 357 total cpu time spent up to now is 261.5 secs Computing kpt #: 358 total cpu time spent up to now is 262.2 secs Computing kpt #: 359 total cpu time spent up to now is 263.0 secs Computing kpt #: 360 total cpu time spent up to now is 263.7 secs Computing kpt #: 361 total cpu time spent up to now is 264.5 secs Computing kpt #: 362 total cpu time spent up to now is 265.3 secs Computing kpt #: 363 total cpu time spent up to now is 266.1 secs Computing kpt #: 364 total cpu time spent up to now is 266.9 secs Computing kpt #: 365 total cpu time spent up to now is 267.7 secs Computing kpt #: 366 total cpu time spent up to now is 268.5 secs Computing kpt #: 367 total cpu time spent up to now is 269.3 secs Computing kpt #: 368 total cpu time spent up to now is 270.0 secs Computing kpt #: 369 total cpu time spent up to now is 270.8 secs Computing kpt #: 370 total cpu time spent up to now is 271.6 secs Computing kpt #: 371 total cpu time spent up to now is 272.4 secs Computing kpt #: 372 total cpu time spent up to now is 273.1 secs Computing kpt #: 373 total cpu time spent up to now is 273.9 secs Computing kpt #: 374 total cpu time spent up to now is 274.6 secs Computing kpt #: 375 total cpu time spent up to now is 275.4 secs Computing kpt #: 376 total cpu time spent up to now is 276.1 secs Computing kpt #: 377 total cpu time spent up to now is 276.9 secs Computing kpt #: 378 total cpu time spent up to now is 277.6 secs Computing kpt #: 379 total cpu time spent up to now is 278.3 secs Computing kpt #: 380 total cpu time spent up to now is 279.0 secs Computing kpt #: 381 total cpu time spent up to now is 279.7 secs Computing kpt #: 382 total cpu time spent up to now is 280.4 secs Computing kpt #: 383 total cpu time spent up to now is 281.1 secs Computing kpt #: 384 total cpu time spent up to now is 281.8 secs Computing kpt #: 385 total cpu time spent up to now is 282.5 secs Computing kpt #: 386 total cpu time spent up to now is 283.2 secs Computing kpt #: 387 total cpu time spent up to now is 283.9 secs Computing kpt #: 388 total cpu time spent up to now is 284.5 secs Computing kpt #: 389 total cpu time spent up to now is 285.2 secs Computing kpt #: 390 total cpu time spent up to now is 285.9 secs Computing kpt #: 391 total cpu time spent up to now is 286.6 secs Computing kpt #: 392 total cpu time spent up to now is 287.2 secs Computing kpt #: 393 total cpu time spent up to now is 287.8 secs Computing kpt #: 394 total cpu time spent up to now is 288.4 secs Computing kpt #: 395 total cpu time spent up to now is 289.1 secs Computing kpt #: 396 total cpu time spent up to now is 289.7 secs Computing kpt #: 397 total cpu time spent up to now is 290.4 secs Computing kpt #: 398 total cpu time spent up to now is 291.2 secs Computing kpt #: 399 total cpu time spent up to now is 291.9 secs Computing kpt #: 400 total cpu time spent up to now is 292.6 secs Computing kpt #: 401 total cpu time spent up to now is 293.3 secs Computing kpt #: 402 total cpu time spent up to now is 294.0 secs Computing kpt #: 403 total cpu time spent up to now is 294.7 secs Computing kpt #: 404 total cpu time spent up to now is 295.5 secs Computing kpt #: 405 total cpu time spent up to now is 296.2 secs Computing kpt #: 406 total cpu time spent up to now is 296.9 secs Computing kpt #: 407 total cpu time spent up to now is 297.7 secs Computing kpt #: 408 total cpu time spent up to now is 298.4 secs Computing kpt #: 409 total cpu time spent up to now is 299.2 secs Computing kpt #: 410 total cpu time spent up to now is 299.9 secs Computing kpt #: 411 total cpu time spent up to now is 300.7 secs Computing kpt #: 412 total cpu time spent up to now is 301.4 secs Computing kpt #: 413 total cpu time spent up to now is 302.2 secs Computing kpt #: 414 total cpu time spent up to now is 303.0 secs Computing kpt #: 415 total cpu time spent up to now is 303.8 secs Computing kpt #: 416 total cpu time spent up to now is 304.6 secs Computing kpt #: 417 total cpu time spent up to now is 305.4 secs Computing kpt #: 418 total cpu time spent up to now is 306.1 secs Computing kpt #: 419 total cpu time spent up to now is 306.9 secs Computing kpt #: 420 total cpu time spent up to now is 307.7 secs Computing kpt #: 421 total cpu time spent up to now is 308.5 secs Computing kpt #: 422 total cpu time spent up to now is 309.3 secs Computing kpt #: 423 total cpu time spent up to now is 310.1 secs Computing kpt #: 424 total cpu time spent up to now is 310.9 secs Computing kpt #: 425 total cpu time spent up to now is 311.6 secs Computing kpt #: 426 total cpu time spent up to now is 312.4 secs Computing kpt #: 427 total cpu time spent up to now is 313.1 secs Computing kpt #: 428 total cpu time spent up to now is 313.9 secs Computing kpt #: 429 total cpu time spent up to now is 314.6 secs Computing kpt #: 430 total cpu time spent up to now is 315.4 secs Computing kpt #: 431 total cpu time spent up to now is 316.1 secs Computing kpt #: 432 total cpu time spent up to now is 316.8 secs Computing kpt #: 433 total cpu time spent up to now is 317.5 secs Computing kpt #: 434 total cpu time spent up to now is 318.3 secs Computing kpt #: 435 total cpu time spent up to now is 319.0 secs Computing kpt #: 436 total cpu time spent up to now is 319.8 secs Computing kpt #: 437 total cpu time spent up to now is 320.5 secs Computing kpt #: 438 total cpu time spent up to now is 321.2 secs Computing kpt #: 439 total cpu time spent up to now is 321.9 secs Computing kpt #: 440 total cpu time spent up to now is 322.6 secs Computing kpt #: 441 total cpu time spent up to now is 323.3 secs Computing kpt #: 442 total cpu time spent up to now is 324.1 secs Computing kpt #: 443 total cpu time spent up to now is 324.8 secs Computing kpt #: 444 total cpu time spent up to now is 325.5 secs Computing kpt #: 445 total cpu time spent up to now is 326.2 secs Computing kpt #: 446 total cpu time spent up to now is 327.0 secs Computing kpt #: 447 total cpu time spent up to now is 327.7 secs Computing kpt #: 448 total cpu time spent up to now is 328.5 secs Computing kpt #: 449 total cpu time spent up to now is 329.2 secs Computing kpt #: 450 total cpu time spent up to now is 329.9 secs Computing kpt #: 451 total cpu time spent up to now is 330.6 secs Computing kpt #: 452 total cpu time spent up to now is 331.3 secs Computing kpt #: 453 total cpu time spent up to now is 332.0 secs Computing kpt #: 454 total cpu time spent up to now is 332.7 secs Computing kpt #: 455 total cpu time spent up to now is 333.4 secs Computing kpt #: 456 total cpu time spent up to now is 334.1 secs Computing kpt #: 457 total cpu time spent up to now is 334.8 secs Computing kpt #: 458 total cpu time spent up to now is 335.4 secs Computing kpt #: 459 total cpu time spent up to now is 336.0 secs Computing kpt #: 460 total cpu time spent up to now is 336.6 secs Computing kpt #: 461 total cpu time spent up to now is 337.3 secs Computing kpt #: 462 total cpu time spent up to now is 338.1 secs Computing kpt #: 463 total cpu time spent up to now is 338.8 secs Computing kpt #: 464 total cpu time spent up to now is 339.5 secs Computing kpt #: 465 total cpu time spent up to now is 340.3 secs Computing kpt #: 466 total cpu time spent up to now is 341.0 secs Computing kpt #: 467 total cpu time spent up to now is 341.7 secs Computing kpt #: 468 total cpu time spent up to now is 342.5 secs Computing kpt #: 469 total cpu time spent up to now is 343.2 secs Computing kpt #: 470 total cpu time spent up to now is 343.9 secs Computing kpt #: 471 total cpu time spent up to now is 344.6 secs Computing kpt #: 472 total cpu time spent up to now is 345.4 secs Computing kpt #: 473 total cpu time spent up to now is 346.1 secs Computing kpt #: 474 total cpu time spent up to now is 346.8 secs Computing kpt #: 475 total cpu time spent up to now is 347.5 secs Computing kpt #: 476 total cpu time spent up to now is 348.1 secs Computing kpt #: 477 total cpu time spent up to now is 348.8 secs Computing kpt #: 478 total cpu time spent up to now is 349.5 secs Computing kpt #: 479 total cpu time spent up to now is 350.2 secs Computing kpt #: 480 total cpu time spent up to now is 351.0 secs Computing kpt #: 481 total cpu time spent up to now is 351.7 secs Computing kpt #: 482 total cpu time spent up to now is 352.4 secs Computing kpt #: 483 total cpu time spent up to now is 353.0 secs Computing kpt #: 484 total cpu time spent up to now is 353.8 secs Computing kpt #: 485 total cpu time spent up to now is 354.4 secs Computing kpt #: 486 total cpu time spent up to now is 355.1 secs Computing kpt #: 487 total cpu time spent up to now is 355.8 secs Computing kpt #: 488 total cpu time spent up to now is 356.6 secs Computing kpt #: 489 total cpu time spent up to now is 357.3 secs Computing kpt #: 490 total cpu time spent up to now is 357.9 secs Computing kpt #: 491 total cpu time spent up to now is 358.6 secs Computing kpt #: 492 total cpu time spent up to now is 359.4 secs ethr = 2.27E-11, avg # of iterations = 23.8 total cpu time spent up to now is 359.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2087 PWs) bands (ev): -4.4315 -4.4315 -1.7478 -1.7478 1.2997 1.2997 2.3485 2.3485 5.5122 5.5122 7.2370 7.2370 7.3279 7.3279 8.3562 8.3562 9.1185 9.1185 9.7988 9.7988 9.9477 9.9477 10.0710 10.0710 10.1177 10.1177 11.3770 11.3770 11.8366 11.8366 11.9276 11.9276 12.1102 12.1102 12.2383 12.2383 12.3797 12.3797 12.7714 12.7714 14.9931 14.9931 16.7900 16.7900 17.3780 17.3780 17.8985 17.8985 18.0000 18.0000 18.8151 18.8151 k = 0.0098-0.0000-0.0000 ( 2087 PWs) bands (ev): -4.4304 -4.4304 -1.7474 -1.7474 1.3005 1.3005 2.3489 2.3489 5.5135 5.5135 7.2375 7.2375 7.3282 7.3282 8.3540 8.3540 9.1187 9.1187 9.7982 9.7982 9.9362 9.9362 10.0709 10.0709 10.1203 10.1203 11.3831 11.3831 11.8356 11.8356 11.9182 11.9182 12.1102 12.1102 12.2379 12.2379 12.3814 12.3814 12.7772 12.7772 14.9937 14.9937 16.7831 16.7831 17.3829 17.3829 17.8906 17.8906 17.9980 17.9980 18.8150 18.8150 k = 0.0196-0.0000-0.0000 ( 2083 PWs) bands (ev): -4.4272 -4.4272 -1.7462 -1.7462 1.3029 1.3029 2.3500 2.3500 5.5172 5.5172 7.2390 7.2390 7.3291 7.3291 8.3474 8.3474 9.1193 9.1193 9.7961 9.7961 9.9030 9.9030 10.0703 10.0703 10.1285 10.1285 11.4006 11.4006 11.8326 11.8326 11.8908 11.8908 12.1103 12.1103 12.2366 12.2366 12.3867 12.3867 12.7938 12.7938 14.9952 14.9952 16.7632 16.7632 17.3970 17.3970 17.8669 17.8669 17.9923 17.9923 18.8149 18.8149 k = 0.0294-0.0000-0.0000 ( 2091 PWs) bands (ev): -4.4217 -4.4217 -1.7443 -1.7443 1.3068 1.3068 2.3519 2.3519 5.5233 5.5233 7.2414 7.2414 7.3304 7.3304 8.3366 8.3366 9.1203 9.1203 9.7903 9.7903 9.8527 9.8527 10.0686 10.0686 10.1419 10.1419 11.4273 11.4273 11.8266 11.8266 11.8484 11.8484 12.1104 12.1104 12.2344 12.2344 12.3956 12.3956 12.8192 12.8192 14.9977 14.9977 16.7322 16.7322 17.4184 17.4184 17.8282 17.8282 17.9827 17.9827 18.8143 18.8143 k = 0.0392-0.0000-0.0000 ( 2094 PWs) bands (ev): -4.4142 -4.4142 -1.7415 -1.7415 1.3122 1.3122 2.3546 2.3546 5.5319 5.5319 7.2448 7.2448 7.3323 7.3323 8.3218 8.3218 9.1216 9.1216 9.7598 9.7598 9.8093 9.8093 10.0654 10.0654 10.1611 10.1611 11.4603 11.4603 11.7882 11.7882 11.8233 11.8233 12.1104 12.1104 12.2314 12.2314 12.4084 12.4084 12.8507 12.8507 15.0012 15.0012 16.6923 16.6923 17.4448 17.4448 17.7755 17.7755 17.9691 17.9691 18.8132 18.8132 k = 0.0490-0.0000-0.0000 ( 2094 PWs) bands (ev): -4.4044 -4.4044 -1.7381 -1.7381 1.3192 1.3192 2.3580 2.3580 5.5428 5.5428 7.2489 7.2489 7.3346 7.3346 8.3033 8.3033 9.1234 9.1234 9.6831 9.6831 9.7979 9.7979 10.0606 10.0606 10.1856 10.1856 11.4965 11.4965 11.7213 11.7213 11.8148 11.8148 12.1101 12.1101 12.2275 12.2275 12.4251 12.4251 12.8861 12.8861 15.0055 15.0055 16.6458 16.6458 17.4740 17.4740 17.7103 17.7103 17.9515 17.9515 18.8112 18.8112 k = 0.0588-0.0000-0.0000 ( 2090 PWs) bands (ev): -4.3926 -4.3926 -1.7339 -1.7339 1.3278 1.3278 2.3621 2.3621 5.5562 5.5562 7.2537 7.2537 7.3373 7.3373 8.2814 8.2814 9.1257 9.1257 9.5890 9.5890 9.7926 9.7926 10.0541 10.0541 10.2151 10.2151 11.5324 11.5324 11.6464 11.6464 11.8056 11.8056 12.1096 12.1096 12.2229 12.2229 12.4457 12.4457 12.9233 12.9233 15.0106 15.0106 16.5944 16.5944 17.5041 17.5041 17.6345 17.6345 17.9297 17.9297 18.8080 18.8080 k = 0.0686-0.0000-0.0000 ( 2094 PWs) bands (ev): -4.3786 -4.3786 -1.7291 -1.7291 1.3378 1.3378 2.3670 2.3670 5.5719 5.5719 7.2591 7.2591 7.3402 7.3402 8.2565 8.2565 9.1282 9.1282 9.4855 9.4855 9.7879 9.7879 10.0455 10.0455 10.2491 10.2491 11.5450 11.5450 11.5867 11.5867 11.7956 11.7956 12.1084 12.1084 12.2172 12.2172 12.4696 12.4696 12.9610 12.9610 15.0164 15.0164 16.5396 16.5396 17.5251 17.5251 17.5580 17.5580 17.9035 17.9035 18.8034 18.8034 k = 0.0784-0.0000-0.0000 ( 2094 PWs) bands (ev): -4.3624 -4.3624 -1.7236 -1.7236 1.3494 1.3494 2.3725 2.3725 5.5899 5.5899 7.2649 7.2649 7.3433 7.3433 8.2290 8.2290 9.1312 9.1312 9.3758 9.3758 9.7831 9.7831 10.0348 10.0348 10.2872 10.2872 11.4668 11.4668 11.6099 11.6099 11.7853 11.7853 12.1066 12.1066 12.2107 12.2107 12.4968 12.4968 12.9981 12.9981 15.0227 15.0227 16.4824 16.4824 17.4491 17.4491 17.5694 17.5694 17.8727 17.8727 18.7972 18.7972 k = 0.0882-0.0000-0.0000 ( 2092 PWs) bands (ev): -4.3442 -4.3442 -1.7175 -1.7175 1.3624 1.3624 2.3788 2.3788 5.6102 5.6102 7.2709 7.2709 7.3464 7.3464 8.1992 8.1992 9.1344 9.1344 9.2619 9.2619 9.7779 9.7779 10.0219 10.0219 10.3291 10.3291 11.3742 11.3742 11.6399 11.6399 11.7750 11.7750 12.1041 12.1041 12.2033 12.2033 12.5266 12.5266 13.0340 13.0340 15.0295 15.0295 16.4237 16.4237 17.3484 17.3484 17.5969 17.5969 17.8371 17.8371 18.7892 18.7892 k = 0.0980-0.0000-0.0000 ( 2092 PWs) bands (ev): -4.3239 -4.3239 -1.7109 -1.7109 1.3769 1.3769 2.3857 2.3857 5.6327 5.6327 7.2767 7.2767 7.3495 7.3495 8.1676 8.1676 9.1372 9.1372 9.1463 9.1463 9.7723 9.7723 10.0066 10.0066 10.3741 10.3741 11.2773 11.2773 11.6668 11.6668 11.7654 11.7654 12.1009 12.1009 12.1951 12.1951 12.5583 12.5583 13.0682 13.0682 15.0366 15.0366 16.3641 16.3641 17.2413 17.2413 17.6231 17.6231 17.7967 17.7967 18.7793 18.7793 k = 0.1078-0.0000-0.0000 ( 2088 PWs) bands (ev): -4.3014 -4.3014 -1.7038 -1.7038 1.3929 1.3929 2.3932 2.3932 5.6574 5.6574 7.2820 7.2820 7.3522 7.3522 8.1344 8.1344 9.0282 9.0282 9.1420 9.1420 9.7660 9.7660 9.9889 9.9889 10.4220 10.4220 11.1776 11.1776 11.6891 11.6891 11.7577 11.7577 12.0970 12.0970 12.1861 12.1861 12.5911 12.5911 13.1003 13.1003 15.0440 15.0440 16.3042 16.3042 17.1295 17.1295 17.6469 17.6469 17.7514 17.7514 18.7674 18.7674 k = 0.1176-0.0000-0.0000 ( 2084 PWs) bands (ev): -4.2770 -4.2770 -1.6963 -1.6963 1.4103 1.4103 2.4013 2.4013 5.6841 5.6841 7.2864 7.2864 7.3543 7.3543 8.0999 8.0999 8.9118 8.9118 9.1462 9.1462 9.7587 9.7587 9.9691 9.9691 10.4723 10.4723 11.0759 11.0759 11.7049 11.7049 11.7546 11.7546 12.0921 12.0921 12.1764 12.1764 12.6242 12.6242 13.1301 13.1301 15.0514 15.0514 16.2445 16.2445 17.0141 17.0141 17.6674 17.6674 17.7016 17.7016 18.7534 18.7534 k = 0.1275-0.0000-0.0000 ( 2084 PWs) bands (ev): -4.2504 -4.2504 -1.6884 -1.6884 1.4291 1.4291 2.4100 2.4100 5.7127 5.7127 7.2891 7.2891 7.3557 7.3557 8.0645 8.0645 8.7976 8.7976 9.1505 9.1505 9.7499 9.7499 9.9474 9.9474 10.5246 10.5246 10.9732 10.9732 11.7114 11.7114 11.7589 11.7589 12.0865 12.0865 12.1659 12.1659 12.6572 12.6572 13.1576 13.1576 15.0587 15.0587 16.1854 16.1854 16.8962 16.8962 17.6442 17.6442 17.6873 17.6873 18.7372 18.7372 k = 0.1373-0.0000-0.0000 ( 2088 PWs) bands (ev): -4.2219 -4.2219 -1.6803 -1.6803 1.4492 1.4492 2.4191 2.4191 5.7430 5.7430 7.2897 7.2897 7.3560 7.3560 8.0284 8.0284 8.6871 8.6871 9.1551 9.1551 9.7385 9.7385 9.9248 9.9248 10.5780 10.5780 10.8705 10.8705 11.7109 11.7109 11.7689 11.7689 12.0800 12.0800 12.1547 12.1547 12.6890 12.6890 13.1826 13.1826 15.0660 15.0660 16.1273 16.1273 16.7765 16.7765 17.5842 17.5842 17.7015 17.7015 18.7187 18.7187 k = 0.1471-0.0000-0.0000 ( 2086 PWs) bands (ev): -4.1914 -4.1914 -1.6721 -1.6721 1.4707 1.4707 2.4288 2.4288 5.7751 5.7751 7.2871 7.2871 7.3548 7.3548 7.9917 7.9917 8.5822 8.5822 9.1599 9.1599 9.7233 9.7233 9.9027 9.9027 10.6293 10.6293 10.7713 10.7713 11.7083 11.7083 11.7808 11.7808 12.0728 12.0728 12.1429 12.1429 12.7195 12.7195 13.2050 13.2050 15.0730 15.0730 16.0703 16.0703 16.6559 16.6559 17.5190 17.5190 17.7125 17.7125 18.6978 18.6978 k = 0.1569-0.0000-0.0000 ( 2088 PWs) bands (ev): -4.1589 -4.1589 -1.6637 -1.6637 1.4934 1.4934 2.4390 2.4390 5.8085 5.8085 7.2801 7.2801 7.3519 7.3519 7.9549 7.9549 8.4845 8.4845 9.1649 9.1649 9.7027 9.7027 9.8824 9.8824 10.6364 10.6364 10.7182 10.7182 11.7059 11.7059 11.7922 11.7922 12.0647 12.0647 12.1306 12.1306 12.7481 12.7481 13.2250 13.2250 15.0797 15.0797 16.0148 16.0148 16.5351 16.5351 17.4491 17.4491 17.7198 17.7198 18.6743 18.6743 k = 0.1667-0.0000-0.0000 ( 2076 PWs) bands (ev): -4.1245 -4.1245 -1.6554 -1.6554 1.5174 1.5174 2.4495 2.4495 5.8432 5.8432 7.2677 7.2677 7.3470 7.3470 7.9181 7.9181 8.3961 8.3961 9.1699 9.1699 9.6749 9.6749 9.8662 9.8662 10.5484 10.5484 10.7624 10.7624 11.7052 11.7052 11.8026 11.8026 12.0560 12.0560 12.1179 12.1179 12.7748 12.7748 13.2425 13.2425 15.0862 15.0862 15.9610 15.9610 16.4147 16.4147 17.3749 17.3749 17.7233 17.7233 18.6483 18.6483 k = 0.1765-0.0000-0.0000 ( 2074 PWs) bands (ev): -4.0881 -4.0881 -1.6471 -1.6471 1.5426 1.5426 2.4604 2.4604 5.8786 5.8786 7.2484 7.2484 7.3399 7.3399 7.8815 7.8815 8.3189 8.3189 9.1750 9.1750 9.6395 9.6395 9.8544 9.8544 10.4496 10.4496 10.8197 10.8197 11.7059 11.7059 11.8115 11.8115 12.0465 12.0465 12.1048 12.1048 12.7990 12.7990 13.2574 13.2574 15.0922 15.0922 15.9090 15.9090 16.2953 16.2953 17.2967 17.2967 17.7227 17.7227 18.6197 18.6197 k = 0.1863-0.0000-0.0000 ( 2070 PWs) bands (ev): -4.0500 -4.0500 -1.6392 -1.6392 1.5690 1.5690 2.4716 2.4716 5.9143 5.9143 7.2215 7.2215 7.3303 7.3303 7.8451 7.8451 8.2544 8.2544 9.1802 9.1802 9.5967 9.5967 9.8470 9.8470 10.3511 10.3511 10.8792 10.8792 11.7085 11.7085 11.8193 11.8193 12.0364 12.0364 12.0915 12.0915 12.8209 12.8209 13.2699 13.2699 15.0976 15.0976 15.8589 15.8589 16.1775 16.1775 17.2149 17.2149 17.7180 17.7180 18.5884 18.5884 k = 0.1961-0.0000-0.0000 ( 2072 PWs) bands (ev): -4.0099 -4.0099 -1.6316 -1.6316 1.5965 1.5965 2.4830 2.4830 5.9499 5.9499 7.1866 7.1866 7.3180 7.3180 7.8092 7.8092 8.2035 8.2035 9.1852 9.1852 9.5475 9.5475 9.8433 9.8433 10.2545 10.2545 10.9394 10.9394 11.7131 11.7131 11.8255 11.8255 12.0259 12.0259 12.0780 12.0780 12.8401 12.8401 13.2798 13.2798 15.1026 15.1026 15.8108 15.8108 16.0619 16.0619 17.1300 17.1300 17.7091 17.7091 18.5543 18.5543 k = 0.2059-0.0000-0.0000 ( 2072 PWs) bands (ev): -3.9681 -3.9681 -1.6244 -1.6244 1.6250 1.6250 2.4946 2.4946 5.9844 5.9844 7.1448 7.1448 7.3027 7.3027 7.7739 7.7739 8.1664 8.1664 9.1902 9.1902 9.4928 9.4928 9.8428 9.8428 10.1607 10.1607 10.9998 10.9998 11.7195 11.7195 11.8303 11.8303 12.0151 12.0151 12.0644 12.0644 12.8569 12.8569 13.2873 13.2873 15.1071 15.1071 15.7646 15.7646 15.9493 15.9493 17.0425 17.0425 17.6960 17.6960 18.5175 18.5175 k = 0.2157-0.0000-0.0000 ( 2070 PWs) bands (ev): -3.9246 -3.9246 -1.6180 -1.6180 1.6545 1.6545 2.5064 2.5064 6.0169 6.0169 7.0982 7.0982 7.2840 7.2840 7.7395 7.7395 8.1423 8.1423 9.1950 9.1950 9.4337 9.4337 9.8448 9.8448 10.0702 10.0702 11.0599 11.0599 11.7277 11.7277 11.8334 11.8334 12.0046 12.0046 12.0509 12.0509 12.8710 12.8710 13.2924 13.2924 15.1111 15.1111 15.7195 15.7195 15.8409 15.8409 16.9530 16.9530 17.6787 17.6787 18.4778 18.4778 k = 0.2255-0.0000-0.0000 ( 2070 PWs) bands (ev): -3.8794 -3.8794 -1.6122 -1.6122 1.6850 1.6850 2.5182 2.5182 6.0459 6.0459 7.0498 7.0498 7.2616 7.2616 7.7058 7.7058 8.1299 8.1299 9.1993 9.1993 9.3709 9.3709 9.8490 9.8490 9.9834 9.9834 11.1192 11.1192 11.7374 11.7374 11.8348 11.8348 11.9946 11.9946 12.0376 12.0376 12.8826 12.8826 13.2951 13.2951 15.1145 15.1145 15.6722 15.6722 15.7406 15.7406 16.8619 16.8619 17.6572 17.6572 18.4355 18.4355 k = 0.2353-0.0000-0.0000 ( 2076 PWs) bands (ev): -3.8325 -3.8325 -1.6074 -1.6074 1.7163 1.7163 2.5299 2.5299 6.0696 6.0696 7.0031 7.0031 7.2352 7.2352 7.6732 7.6732 8.1274 8.1274 9.2026 9.2026 9.3055 9.3055 9.8548 9.8548 9.9008 9.9008 11.1773 11.1773 11.7483 11.7483 11.8342 11.8342 11.9859 11.9859 12.0244 12.0244 12.8918 12.8918 13.2952 13.2952 15.1174 15.1174 15.6057 15.6057 15.6657 15.6657 16.7698 16.7698 17.6317 17.6317 18.3904 18.3904 k = 0.2451-0.0000-0.0000 ( 2078 PWs) bands (ev): -3.7840 -3.7840 -1.6036 -1.6036 1.7485 1.7485 2.5417 2.5417 6.0859 6.0859 6.9623 6.9623 7.2046 7.2046 7.6416 7.6416 8.1333 8.1333 9.2003 9.2003 9.2428 9.2428 9.8213 9.8213 9.8638 9.8638 11.2334 11.2334 11.7599 11.7599 11.8322 11.8322 11.9788 11.9788 12.0115 12.0115 12.8984 12.8984 13.2930 13.2930 15.1197 15.1197 15.5161 15.5161 15.6207 15.6207 16.6774 16.6774 17.6023 17.6023 18.3427 18.3427 k = 0.2549-0.0000-0.0000 ( 2074 PWs) bands (ev): -3.7340 -3.7340 -1.6011 -1.6011 1.7813 1.7813 2.5532 2.5532 6.0926 6.0926 6.9312 6.9312 7.1697 7.1697 7.6114 7.6114 8.1460 8.1460 9.1557 9.1557 9.2196 9.2196 9.7476 9.7476 9.8734 9.8734 11.2868 11.2868 11.7711 11.7711 11.8299 11.8299 11.9737 11.9737 11.9990 11.9990 12.9028 12.9028 13.2885 13.2885 15.1214 15.1214 15.4242 15.4242 15.5853 15.5853 16.5851 16.5851 17.5691 17.5691 18.2924 18.2924 k = 0.2647-0.0000-0.0000 ( 2082 PWs) bands (ev): -3.6825 -3.6825 -1.5999 -1.5999 1.8148 1.8148 2.5646 2.5646 6.0880 6.0880 6.9129 6.9129 7.1303 7.1303 7.5824 7.5824 8.1642 8.1642 9.0852 9.0852 9.2197 9.2197 9.6782 9.6782 9.8849 9.8849 11.3362 11.3362 11.7800 11.7800 11.8297 11.8297 11.9706 11.9706 11.9870 11.9870 12.9049 12.9049 13.2814 13.2814 15.1224 15.1224 15.3359 15.3359 15.5540 15.5540 16.4935 16.4935 17.5324 17.5324 18.2397 18.2397 k = 0.2745-0.0000-0.0000 ( 2086 PWs) bands (ev): -3.6296 -3.6296 -1.6002 -1.6002 1.8489 1.8489 2.5756 2.5756 6.0715 6.0715 6.9090 6.9090 7.0866 7.0866 7.5549 7.5549 8.1871 8.1871 9.0112 9.0112 9.2210 9.2210 9.6137 9.6137 9.8981 9.8981 11.3800 11.3800 11.7848 11.7848 11.8350 11.8350 11.9684 11.9684 11.9770 11.9770 12.9049 12.9049 13.2719 13.2719 15.1220 15.1220 15.2533 15.2533 15.5258 15.5258 16.4031 16.4031 17.4925 17.4925 18.1847 18.1847 k = 0.2843-0.0000-0.0000 ( 2084 PWs) bands (ev): -3.5753 -3.5753 -1.6021 -1.6021 1.8835 1.8835 2.5862 2.5862 6.0441 6.0441 6.9194 6.9194 7.0388 7.0388 7.5289 7.5289 8.2136 8.2136 8.9356 8.9356 9.2216 9.2216 9.5539 9.5539 9.9131 9.9131 11.4161 11.4161 11.7871 11.7871 11.8461 11.8461 11.9618 11.9618 11.9739 11.9739 12.9029 12.9029 13.2601 13.2601 15.1169 15.1169 15.1804 15.1804 15.5004 15.5004 16.3144 16.3144 17.4495 17.4495 18.1275 18.1275 k = 0.2941-0.0000-0.0000 ( 2088 PWs) bands (ev): -3.5198 -3.5198 -1.6059 -1.6059 1.9184 1.9184 2.5964 2.5964 6.0080 6.0080 6.9409 6.9409 6.9888 6.9888 7.5046 7.5046 8.2433 8.2433 8.8591 8.8591 9.2205 9.2205 9.4993 9.4993 9.9296 9.9296 11.4419 11.4419 11.7912 11.7912 11.8603 11.8603 11.9525 11.9525 11.9761 11.9761 12.8989 12.8989 13.2459 13.2459 15.0838 15.0838 15.1412 15.1412 15.4775 15.4775 16.2279 16.2279 17.4040 17.4040 18.0683 18.0683 k = 0.3039-0.0000-0.0000 ( 2088 PWs) bands (ev): -3.4631 -3.4631 -1.6116 -1.6116 1.9537 1.9537 2.6061 2.6061 5.9657 5.9657 6.9258 6.9258 6.9825 6.9825 7.4821 7.4821 8.2755 8.2755 8.7822 8.7822 9.2169 9.2169 9.4501 9.4501 9.9480 9.9480 11.4555 11.4555 11.8009 11.8009 11.8757 11.8757 11.9443 11.9443 11.9803 11.9803 12.8932 12.8932 13.2296 13.2296 15.0240 15.0240 15.1346 15.1346 15.4569 15.4569 16.1440 16.1440 17.3563 17.3563 18.0073 18.0073 k = 0.3137-0.0000-0.0000 ( 2082 PWs) bands (ev): -3.4053 -3.4053 -1.6194 -1.6194 1.9891 1.9891 2.6151 2.6151 5.9199 5.9199 6.8682 6.8682 7.0242 7.0242 7.4615 7.4615 8.3099 8.3099 8.7053 8.7053 9.2095 9.2095 9.4071 9.4071 9.9680 9.9680 11.4563 11.4563 11.8171 11.8171 11.8903 11.8903 11.9388 11.9388 11.9863 11.9863 12.8859 12.8859 13.2111 13.2111 14.9653 14.9653 15.1332 15.1332 15.4384 15.4384 16.0630 16.0630 17.3068 17.3068 17.9448 17.9448 k = 0.3235-0.0000-0.0000 ( 2082 PWs) bands (ev): -3.3465 -3.3465 -1.6294 -1.6294 2.0247 2.0247 2.6233 2.6233 5.8728 5.8728 6.8060 6.8060 7.0744 7.0744 7.4429 7.4429 8.3459 8.3459 8.6286 8.6286 9.1966 9.1966 9.3712 9.3712 9.9897 9.9897 11.4455 11.4455 11.8378 11.8378 11.9013 11.9013 11.9387 11.9387 11.9939 11.9939 12.8770 12.8770 13.1905 13.1905 14.9123 14.9123 15.1329 15.1329 15.4218 15.4218 15.9854 15.9854 17.2560 17.2560 17.8809 17.8809 k = 0.3333-0.0000-0.0000 ( 2078 PWs) bands (ev): -3.2867 -3.2867 -1.6418 -1.6418 2.0602 2.0602 2.6308 2.6308 5.8261 5.8261 6.7410 6.7410 7.1304 7.1304 7.4263 7.4263 8.3832 8.3832 8.5527 8.5527 9.1768 9.1768 9.3434 9.3434 10.0132 10.0132 11.4253 11.4253 11.8594 11.8594 11.9074 11.9074 11.9465 11.9465 12.0039 12.0039 12.8669 12.8669 13.1680 13.1680 14.8659 14.8659 15.1329 15.1329 15.4070 15.4070 15.9113 15.9113 17.2044 17.2044 17.8159 17.8159 k = 0.3431-0.0000-0.0000 ( 2070 PWs) bands (ev): -3.2262 -3.2262 -1.6566 -1.6566 2.0956 2.0956 2.6373 2.6373 5.7813 5.7813 6.6739 6.6739 7.1908 7.1908 7.4120 7.4120 8.4210 8.4210 8.4782 8.4782 9.1499 9.1499 9.3230 9.3230 10.0384 10.0384 11.3982 11.3982 11.8752 11.8752 11.9152 11.9152 11.9591 11.9591 12.0166 12.0166 12.8556 12.8556 13.1438 13.1438 14.8265 14.8265 15.1331 15.1331 15.3934 15.3934 15.8409 15.8409 17.1527 17.1527 17.7501 17.7501 k = 0.3529-0.0000-0.0000 ( 2078 PWs) bands (ev): -3.1649 -3.1649 -1.6739 -1.6739 2.1308 2.1308 2.6429 2.6429 5.7394 5.7394 6.6052 6.6052 7.2545 7.2545 7.4000 7.4000 8.4014 8.4014 8.4632 8.4632 9.1171 9.1171 9.3082 9.3082 10.0652 10.0652 11.3655 11.3655 11.8808 11.8808 11.9300 11.9300 11.9733 11.9733 12.0320 12.0320 12.8433 12.8433 13.1180 13.1180 14.7941 14.7941 15.1336 15.1336 15.3808 15.3808 15.7744 15.7744 17.1015 17.1015 17.6837 17.6837 k = 0.3627-0.0000-0.0000 ( 2078 PWs) bands (ev): -3.1029 -3.1029 -1.6939 -1.6939 2.1657 2.1657 2.6473 2.6473 5.7011 5.7011 6.5355 6.5355 7.3207 7.3207 7.3908 7.3908 8.3293 8.3293 8.5028 8.5028 9.0801 9.0801 9.2967 9.2967 10.0938 10.0938 11.3288 11.3288 11.8814 11.8814 11.9464 11.9464 11.9888 11.9888 12.0500 12.0500 12.8304 12.8304 13.0908 13.0908 14.7692 14.7692 15.1343 15.1343 15.3689 15.3689 15.7120 15.7120 17.0514 17.0514 17.6171 17.6171 k = 0.3725-0.0000-0.0000 ( 2078 PWs) bands (ev): -3.0405 -3.0405 -1.7165 -1.7165 2.2001 2.2001 2.6506 2.6506 5.6671 5.6671 6.4652 6.4652 7.3773 7.3773 7.3958 7.3958 8.2582 8.2582 8.5434 8.5434 9.0401 9.0401 9.2866 9.2866 10.1241 10.1241 11.2887 11.2887 11.8811 11.8811 11.9600 11.9600 12.0056 12.0056 12.0695 12.0695 12.8169 12.8169 13.0627 13.0627 14.7515 14.7515 15.1353 15.1353 15.3572 15.3572 15.6537 15.6537 17.0032 17.0032 17.5504 17.5504 k = 0.3824-0.0000-0.0000 ( 2080 PWs) bands (ev): -2.9778 -2.9778 -1.7419 -1.7419 2.2339 2.2339 2.6526 2.6526 5.6377 5.6377 6.3950 6.3950 7.3772 7.3772 7.4619 7.4619 8.1888 8.1888 8.5844 8.5844 8.9978 8.9978 9.2768 9.2768 10.1560 10.1560 11.2461 11.2461 11.8813 11.8813 11.9702 11.9702 12.0235 12.0235 12.0894 12.0894 12.8033 12.8033 13.0337 13.0337 14.7410 14.7410 15.1368 15.1368 15.3451 15.3451 15.5994 15.5994 16.9577 16.9577 17.4841 17.4841 k = 0.3922-0.0000-0.0000 ( 2080 PWs) bands (ev): -2.9147 -2.9147 -1.7700 -1.7700 2.2671 2.2671 2.6534 2.6534 5.6134 5.6134 6.3252 6.3252 7.3757 7.3757 7.5334 7.5334 8.1214 8.1214 8.6256 8.6256 8.9535 8.9535 9.2665 9.2665 10.1896 10.1896 11.2013 11.2013 11.8826 11.8826 11.9778 11.9778 12.0413 12.0413 12.1085 12.1085 12.7898 12.7898 13.0043 13.0043 14.7374 14.7374 15.1386 15.1386 15.3321 15.3321 15.5492 15.5492 16.9155 16.9155 17.4185 17.4185 k = 0.4020-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.8516 -2.8516 -1.8009 -1.8009 2.2994 2.2994 2.6527 2.6527 5.5944 5.5944 6.2563 6.2563 7.3767 7.3767 7.6061 7.6061 8.0562 8.0562 8.6666 8.6666 8.9073 8.9073 9.2550 9.2550 10.2248 10.2248 11.1548 11.1548 11.8852 11.8852 11.9834 11.9834 12.0587 12.0587 12.1261 12.1261 12.7768 12.7768 12.9747 12.9747 14.7405 14.7405 15.1409 15.1409 15.3178 15.3178 15.5029 15.5029 16.8777 16.8777 17.3538 17.3538 k = 0.4118-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.7885 -2.7885 -1.8344 -1.8344 2.3308 2.3308 2.6505 2.6505 5.5808 5.5808 6.1888 6.1888 7.3805 7.3805 7.6794 7.6794 7.9935 7.9935 8.7071 8.7071 8.8594 8.8594 9.2421 9.2421 10.2617 10.2617 11.1069 11.1069 11.8892 11.8892 11.9876 11.9876 12.0754 12.0754 12.1417 12.1417 12.7647 12.7647 12.9453 12.9453 14.7500 14.7500 15.1438 15.1438 15.3016 15.3016 15.4606 15.4606 16.8448 16.8448 17.2904 17.2904 k = 0.4216-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.7255 -2.7255 -1.8707 -1.8707 2.3612 2.3612 2.6468 2.6468 5.5727 5.5727 6.1231 6.1231 7.3873 7.3873 7.7529 7.7529 7.9335 7.9335 8.7460 8.7460 8.8108 8.8108 9.2275 9.2275 10.3002 10.3002 11.0580 11.0580 11.8945 11.8945 11.9905 11.9905 12.0911 12.0911 12.1551 12.1551 12.7537 12.7537 12.9165 12.9165 14.7653 14.7653 15.1472 15.1472 15.2831 15.2831 15.4219 15.4219 16.8176 16.8176 17.2287 17.2287 k = 0.4314-0.0000-0.0000 ( 2088 PWs) bands (ev): -2.6629 -2.6629 -1.9096 -1.9096 2.3905 2.3905 2.6414 2.6414 5.5702 5.5702 6.0595 6.0595 7.3971 7.3971 7.8248 7.8248 7.8781 7.8781 8.7504 8.7504 8.7939 8.7939 9.2111 9.2111 10.3402 10.3402 11.0083 11.0083 11.9011 11.9011 11.9919 11.9919 12.1059 12.1059 12.1658 12.1658 12.7441 12.7441 12.8886 12.8886 14.7859 14.7859 15.1511 15.1511 15.2620 15.2620 15.3869 15.3869 16.7967 16.7967 17.1691 17.1691 k = 0.4412-0.0000-0.0000 ( 2088 PWs) bands (ev): -2.6007 -2.6007 -1.9510 -1.9510 2.4186 2.4186 2.6345 2.6345 5.5733 5.5733 5.9985 5.9985 7.4101 7.4101 7.8184 7.8184 7.9035 7.9035 8.6992 8.6992 8.8299 8.8299 9.1927 9.1927 10.3816 10.3816 10.9580 10.9580 11.9087 11.9087 11.9921 11.9921 12.1197 12.1197 12.1741 12.1741 12.7366 12.7366 12.8621 12.8621 14.8113 14.8113 15.1552 15.1552 15.2387 15.2387 15.3553 15.3553 16.7826 16.7826 17.1120 17.1120 k = 0.4510-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.5392 -2.5392 -1.9949 -1.9949 2.4453 2.4453 2.6258 2.6258 5.5819 5.5819 5.9403 5.9403 7.4262 7.4262 7.7676 7.7676 7.9759 7.9759 8.6431 8.6431 8.8678 8.8678 9.1724 9.1724 10.4244 10.4244 10.9075 10.9075 11.9172 11.9172 11.9909 11.9909 12.1323 12.1323 12.1800 12.1800 12.7314 12.7314 12.8371 12.8371 14.8407 14.8407 15.1579 15.1579 15.2146 15.2146 15.3269 15.3269 16.7756 16.7756 17.0577 17.0577 k = 0.4608-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.4785 -2.4785 -2.0411 -2.0411 2.4707 2.4707 2.6155 2.6155 5.5960 5.5960 5.8854 5.8854 7.4456 7.4456 7.7190 7.7190 8.0485 8.0485 8.5844 8.5844 8.9049 8.9049 9.1500 9.1500 10.4686 10.4686 10.8567 10.8567 11.9264 11.9264 11.9881 11.9881 12.1438 12.1438 12.1834 12.1834 12.7287 12.7287 12.8142 12.8142 14.8737 14.8737 15.1527 15.1527 15.1966 15.1966 15.3015 15.3015 16.7758 16.7758 17.0067 17.0067 k = 0.4706-0.0000-0.0000 ( 2088 PWs) bands (ev): -2.4187 -2.4187 -2.0896 -2.0896 2.4946 2.4946 2.6034 2.6034 5.6154 5.6154 5.8340 5.8340 7.4682 7.4682 7.6735 7.6735 8.1205 8.1205 8.5236 8.5236 8.9410 8.9410 9.1256 9.1256 10.5140 10.5140 10.8061 10.8061 11.9358 11.9358 11.9839 11.9839 12.1541 12.1541 12.1847 12.1847 12.7289 12.7289 12.7933 12.7933 14.9092 14.9092 15.1305 15.1305 15.1942 15.1942 15.2788 15.2788 16.7831 16.7831 16.9595 16.9595 k = 0.4804-0.0000-0.0000 ( 2092 PWs) bands (ev): -2.3601 -2.3601 -2.1401 -2.1401 2.5169 2.5169 2.5895 2.5895 5.6400 5.6400 5.7865 5.7865 7.4941 7.4941 7.6310 7.6310 8.1914 8.1914 8.4607 8.4607 8.9758 8.9758 9.0992 9.0992 10.5605 10.5605 10.7557 10.7557 11.9454 11.9454 11.9782 11.9782 12.1631 12.1631 12.1839 12.1839 12.7320 12.7320 12.7752 12.7752 14.9466 14.9466 15.0981 15.0981 15.2012 15.2012 15.2586 15.2586 16.7974 16.7974 16.9166 16.9166 k = 0.4902-0.0000-0.0000 ( 2088 PWs) bands (ev): -2.3027 -2.3027 -2.1926 -2.1926 2.5376 2.5376 2.5739 2.5739 5.6696 5.6696 5.7431 5.7431 7.5234 7.5234 7.5919 7.5919 8.2610 8.2610 8.3959 8.3959 9.0091 9.0091 9.0710 9.0710 10.6081 10.6081 10.7059 10.7059 11.9547 11.9547 11.9713 11.9713 12.1707 12.1707 12.1812 12.1812 12.7383 12.7383 12.7599 12.7599 14.9850 14.9850 15.0618 15.0618 15.2120 15.2120 15.2408 15.2408 16.8183 16.8183 16.8784 16.8784 k = 0.5000-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.2468 -2.2468 -2.2468 -2.2468 2.5566 2.5566 2.5566 2.5566 5.7040 5.7040 5.7040 5.7040 7.5560 7.5560 7.5560 7.5560 8.3293 8.3293 8.3293 8.3293 9.0409 9.0409 9.0409 9.0409 10.6566 10.6566 10.6566 10.6566 11.9634 11.9634 11.9634 11.9634 12.1768 12.1768 12.1768 12.1768 12.7476 12.7476 12.7476 12.7476 15.0238 15.0238 15.0238 15.0238 15.2253 15.2253 15.2253 15.2253 16.8455 16.8455 16.8455 16.8455 k = 0.5000-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.2468 -2.2468 -2.2468 -2.2468 2.5566 2.5566 2.5566 2.5566 5.7040 5.7040 5.7040 5.7040 7.5560 7.5560 7.5560 7.5560 8.3293 8.3293 8.3293 8.3293 9.0409 9.0409 9.0409 9.0409 10.6566 10.6566 10.6566 10.6566 11.9634 11.9634 11.9634 11.9634 12.1768 12.1768 12.1768 12.1768 12.7476 12.7476 12.7476 12.7476 15.0238 15.0238 15.0238 15.0238 15.2253 15.2253 15.2253 15.2253 16.8455 16.8455 16.8455 16.8455 k = 0.5000 0.0096-0.0000 ( 2082 PWs) bands (ev): -2.2464 -2.2464 -2.2463 -2.2463 2.5549 2.5549 2.5557 2.5557 5.7049 5.7049 5.7051 5.7051 7.5519 7.5519 7.5558 7.5558 8.3301 8.3301 8.3333 8.3333 9.0398 9.0398 9.0410 9.0410 10.6549 10.6549 10.6576 10.6576 11.9619 11.9619 11.9653 11.9653 12.1711 12.1711 12.1764 12.1764 12.7468 12.7468 12.7485 12.7485 15.0196 15.0196 15.0266 15.0266 15.2218 15.2218 15.2317 15.2317 16.8485 16.8485 16.8507 16.8507 k = 0.5000 0.0192-0.0000 ( 2086 PWs) bands (ev): -2.2449 -2.2449 -2.2449 -2.2449 2.5505 2.5505 2.5522 2.5522 5.7078 5.7078 5.7082 5.7082 7.5438 7.5438 7.5515 7.5515 8.3355 8.3355 8.3418 8.3418 9.0377 9.0377 9.0400 9.0400 10.6523 10.6523 10.6576 10.6576 11.9607 11.9607 11.9672 11.9672 12.1595 12.1595 12.1700 12.1700 12.7459 12.7459 12.7493 12.7493 15.0141 15.0141 15.0279 15.0279 15.2214 15.2214 15.2407 15.2407 16.8597 16.8597 16.8640 16.8640 k = 0.5000 0.0288-0.0000 ( 2090 PWs) bands (ev): -2.2425 -2.2425 -2.2425 -2.2425 2.5436 2.5436 2.5461 2.5461 5.7126 5.7126 5.7132 5.7132 7.5323 7.5323 7.5434 7.5434 8.3450 8.3450 8.3539 8.3539 9.0348 9.0348 9.0383 9.0383 10.6489 10.6489 10.6566 10.6566 11.9597 11.9597 11.9691 11.9691 12.1425 12.1425 12.1579 12.1579 12.7451 12.7451 12.7502 12.7502 15.0078 15.0078 15.0275 15.0275 15.2244 15.2244 15.2523 15.2523 16.8790 16.8790 16.8853 16.8853 k = 0.5000 0.0384-0.0000 ( 2094 PWs) bands (ev): -2.2392 -2.2392 -2.2391 -2.2391 2.5342 2.5342 2.5375 2.5375 5.7195 5.7195 5.7201 5.7201 7.5181 7.5181 7.5323 7.5323 8.3574 8.3574 8.3685 8.3685 9.0315 9.0315 9.0362 9.0362 10.6445 10.6445 10.6545 10.6545 11.9589 11.9589 11.9705 11.9705 12.1209 12.1209 12.1404 12.1404 12.7444 12.7444 12.7510 12.7510 15.0007 15.0007 15.0257 15.0257 15.2308 15.2308 15.2662 15.2662 16.9063 16.9063 16.9143 16.9143 k = 0.5000 0.0480-0.0000 ( 2094 PWs) bands (ev): -2.2349 -2.2349 -2.2348 -2.2348 2.5222 2.5222 2.5263 2.5263 5.7282 5.7282 5.7291 5.7291 7.5022 7.5022 7.5189 7.5189 8.3715 8.3715 8.3841 8.3841 9.0284 9.0284 9.0343 9.0343 10.6389 10.6389 10.6509 10.6509 11.9583 11.9583 11.9707 11.9707 12.0960 12.0960 12.1183 12.1183 12.7439 12.7439 12.7518 12.7518 14.9931 14.9931 15.0224 15.0224 15.2408 15.2408 15.2825 15.2825 16.9413 16.9413 16.9506 16.9506 k = 0.5000 0.0576-0.0000 ( 2094 PWs) bands (ev): -2.2297 -2.2297 -2.2296 -2.2296 2.5079 2.5079 2.5127 2.5127 5.7389 5.7389 5.7399 5.7399 7.4853 7.4853 7.5041 7.5041 8.3855 8.3855 8.3992 8.3992 9.0261 9.0261 9.0332 9.0332 10.6319 10.6319 10.6455 10.6455 11.9575 11.9575 11.9679 11.9679 12.0704 12.0704 12.0926 12.0926 12.7434 12.7434 12.7527 12.7527 14.9853 14.9853 15.0180 15.0180 15.2544 15.2544 15.3011 15.3011 16.9836 16.9836 16.9941 16.9941 k = 0.5000 0.0672-0.0000 ( 2098 PWs) bands (ev): -2.2236 -2.2236 -2.2235 -2.2235 2.4912 2.4912 2.4968 2.4968 5.7515 5.7515 5.7526 5.7526 7.4683 7.4683 7.4888 7.4888 8.3979 8.3979 8.4122 8.4122 9.0253 9.0253 9.0337 9.0337 10.6232 10.6232 10.6381 10.6381 11.9557 11.9557 11.9583 11.9583 12.0485 12.0485 12.0648 12.0648 12.7430 12.7430 12.7535 12.7535 14.9776 14.9776 15.0129 15.0129 15.2714 15.2714 15.3220 15.3220 17.0330 17.0330 17.0442 17.0442 k = 0.5000 0.0768-0.0000 ( 2094 PWs) bands (ev): -2.2167 -2.2167 -2.2165 -2.2165 2.4723 2.4723 2.4787 2.4787 5.7660 5.7660 5.7672 5.7672 7.4519 7.4519 7.4736 7.4736 8.4072 8.4072 8.4216 8.4216 9.0270 9.0270 9.0367 9.0367 10.6124 10.6124 10.6281 10.6281 11.9380 11.9380 11.9516 11.9516 12.0353 12.0353 12.0374 12.0374 12.7427 12.7427 12.7543 12.7543 14.9702 14.9702 15.0074 15.0074 15.2921 15.2921 15.3454 15.3454 17.0890 17.0890 17.1006 17.1006 k = 0.5000 0.0864-0.0000 ( 2090 PWs) bands (ev): -2.2089 -2.2089 -2.2087 -2.2087 2.4514 2.4514 2.4584 2.4584 5.7824 5.7824 5.7837 5.7837 7.4366 7.4366 7.4592 7.4592 8.4119 8.4119 8.4260 8.4260 9.0318 9.0318 9.0427 9.0427 10.5989 10.5989 10.6150 10.6150 11.9079 11.9079 11.9416 11.9416 12.0149 12.0149 12.0307 12.0307 12.7425 12.7425 12.7552 12.7552 14.9633 14.9633 15.0017 15.0017 15.3162 15.3162 15.3715 15.3715 17.1510 17.1510 17.1627 17.1627 k = 0.5000 0.0960-0.0000 ( 2090 PWs) bands (ev): -2.2003 -2.2003 -2.2001 -2.2001 2.4284 2.4284 2.4361 2.4361 5.8005 5.8005 5.8020 5.8020 7.4230 7.4230 7.4462 7.4462 8.4110 8.4110 8.4246 8.4246 9.0402 9.0402 9.0521 9.0521 10.5823 10.5823 10.5983 10.5983 11.8723 11.8723 11.9222 11.9222 12.0017 12.0017 12.0313 12.0313 12.7425 12.7425 12.7561 12.7561 14.9570 14.9570 14.9961 14.9961 15.3440 15.3440 15.4003 15.4003 17.2186 17.2186 17.2301 17.2301 k = 0.5000 0.1056-0.0000 ( 2102 PWs) bands (ev): -2.1910 -2.1910 -2.1908 -2.1908 2.4036 2.4036 2.4119 2.4119 5.8205 5.8205 5.8220 5.8220 7.4114 7.4114 7.4350 7.4350 8.4039 8.4039 8.4169 8.4169 9.0521 9.0521 9.0651 9.0651 10.5619 10.5619 10.5774 10.5774 11.8350 11.8350 11.8955 11.8955 11.9966 11.9966 12.0344 12.0344 12.7423 12.7423 12.7569 12.7569 14.9516 14.9516 14.9909 14.9909 15.3755 15.3755 15.4322 15.4322 17.2911 17.2911 17.3021 17.3021 k = 0.5000 0.1152-0.0000 ( 2102 PWs) bands (ev): -2.1810 -2.1810 -2.1808 -2.1808 2.3772 2.3772 2.3860 2.3860 5.8423 5.8423 5.8438 5.8438 7.4021 7.4021 7.4259 7.4259 8.3906 8.3906 8.4027 8.4027 9.0676 9.0676 9.0813 9.0813 10.5372 10.5372 10.5518 10.5518 11.7982 11.7982 11.8663 11.8663 11.9962 11.9962 12.0391 12.0391 12.7423 12.7423 12.7578 12.7578 14.9471 14.9471 14.9862 14.9862 15.4110 15.4110 15.4673 15.4673 17.3680 17.3680 17.3783 17.3783 k = 0.5000 0.1248-0.0000 ( 2106 PWs) bands (ev): -2.1703 -2.1703 -2.1701 -2.1701 2.3492 2.3492 2.3586 2.3586 5.8657 5.8657 5.8673 5.8673 7.3955 7.3955 7.4192 7.4192 8.3712 8.3712 8.3825 8.3825 9.0861 9.0861 9.1003 9.1003 10.5077 10.5077 10.5212 10.5212 11.7632 11.7632 11.8377 11.8377 11.9980 11.9980 12.0445 12.0445 12.7424 12.7424 12.7587 12.7587 14.9437 14.9437 14.9822 14.9822 15.4505 15.4505 15.5060 15.5060 17.4487 17.4487 17.4580 17.4580 k = 0.5000 0.1345-0.0000 ( 2106 PWs) bands (ev): -2.1591 -2.1591 -2.1588 -2.1588 2.3199 2.3199 2.3298 2.3298 5.8909 5.8909 5.8925 5.8925 7.3915 7.3915 7.4150 7.4150 8.3464 8.3464 8.3568 8.3568 9.1067 9.1067 9.1212 9.1212 10.4729 10.4729 10.4851 10.4851 11.7313 11.7313 11.8113 11.8113 12.0012 12.0012 12.0506 12.0506 12.7426 12.7426 12.7597 12.7597 14.9414 14.9414 14.9789 14.9789 15.4943 15.4943 15.5486 15.5486 17.5324 17.5324 17.5407 17.5407 k = 0.5000 0.1441-0.0000 ( 2114 PWs) bands (ev): -2.1473 -2.1473 -2.1470 -2.1470 2.2895 2.2895 2.2999 2.2999 5.9178 5.9178 5.9193 5.9193 7.3904 7.3904 7.4135 7.4135 8.3167 8.3167 8.3263 8.3263 9.1287 9.1287 9.1433 9.1433 10.4326 10.4326 10.4435 10.4435 11.7032 11.7032 11.7882 11.7882 12.0052 12.0052 12.0569 12.0569 12.7427 12.7427 12.7606 12.7606 14.9401 14.9401 14.9763 14.9763 15.5426 15.5426 15.5953 15.5953 17.6185 17.6185 17.6257 17.6257 k = 0.5000 0.1537-0.0000 ( 2110 PWs) bands (ev): -2.1350 -2.1350 -2.1347 -2.1347 2.2581 2.2581 2.2690 2.2690 5.9463 5.9463 5.9478 5.9478 7.3921 7.3921 7.4146 7.4146 8.2831 8.2831 8.2918 8.2918 9.1513 9.1513 9.1658 9.1658 10.3868 10.3868 10.3963 10.3963 11.6793 11.6793 11.7687 11.7687 12.0099 12.0099 12.0636 12.0636 12.7430 12.7430 12.7617 12.7617 14.9398 14.9398 14.9746 14.9746 15.5956 15.5956 15.6465 15.6465 17.7064 17.7064 17.7123 17.7123 k = 0.5000 0.1633-0.0000 ( 2110 PWs) bands (ev): -2.1224 -2.1224 -2.1220 -2.1220 2.2260 2.2260 2.2373 2.2373 5.9764 5.9764 5.9778 5.9778 7.3965 7.3965 7.4183 7.4183 8.2463 8.2463 8.2542 8.2542 9.1737 9.1737 9.1879 9.1879 10.3357 10.3357 10.3440 10.3440 11.6598 11.6598 11.7532 11.7532 12.0150 12.0150 12.0704 12.0704 12.7434 12.7434 12.7628 12.7628 14.9404 14.9404 14.9736 14.9736 15.6536 15.6536 15.7024 15.7024 17.7952 17.7952 17.7998 17.7998 k = 0.5000 0.1729-0.0000 ( 2110 PWs) bands (ev): -2.1094 -2.1094 -2.1090 -2.1090 2.1934 2.1934 2.2050 2.2050 6.0080 6.0080 6.0094 6.0094 7.4035 7.4035 7.4244 7.4244 8.2071 8.2071 8.2141 8.2141 9.1954 9.1954 9.2091 9.2091 10.2797 10.2797 10.2870 10.2870 11.6447 11.6447 11.7416 11.7416 12.0204 12.0204 12.0772 12.0772 12.7437 12.7437 12.7639 12.7639 14.9419 14.9419 14.9732 14.9732 15.7166 15.7166 15.7633 15.7633 17.8843 17.8843 17.8874 17.8874 k = 0.5000 0.1825-0.0000 ( 2112 PWs) bands (ev): -2.0962 -2.0962 -2.0957 -2.0957 2.1605 2.1605 2.1725 2.1725 6.0412 6.0412 6.0425 6.0425 7.4127 7.4127 7.4326 7.4326 8.1664 8.1664 8.1725 8.1725 9.2156 9.2156 9.2286 9.2286 10.2194 10.2194 10.2258 10.2258 11.6337 11.6337 11.7334 11.7334 12.0260 12.0260 12.0840 12.0840 12.7441 12.7441 12.7651 12.7651 14.9441 14.9441 14.9735 14.9735 15.7849 15.7849 15.8294 15.8294 17.9727 17.9727 17.9744 17.9744 k = 0.5000 0.1921-0.0000 ( 2106 PWs) bands (ev): -2.0828 -2.0828 -2.0823 -2.0823 2.1275 2.1275 2.1398 2.1398 6.0759 6.0759 6.0770 6.0770 7.4236 7.4236 7.4423 7.4423 8.1252 8.1252 8.1303 8.1303 9.2338 9.2338 9.2460 9.2460 10.1557 10.1557 10.1615 10.1615 11.6265 11.6265 11.7286 11.7286 12.0319 12.0319 12.0908 12.0908 12.7446 12.7446 12.7662 12.7662 14.9469 14.9469 14.9743 14.9743 15.8587 15.8587 15.9009 15.9009 18.0595 18.0595 18.0597 18.0597 k = 0.5000 0.2017-0.0000 ( 2102 PWs) bands (ev): -2.0693 -2.0693 -2.0688 -2.0688 2.0947 2.0947 2.1072 2.1072 6.1120 6.1120 6.1131 6.1131 7.4355 7.4355 7.4528 7.4528 8.0846 8.0846 8.0887 8.0887 9.2494 9.2494 9.2606 9.2606 10.0896 10.0896 10.0949 10.0949 11.6225 11.6225 11.7265 11.7265 12.0379 12.0379 12.0974 12.0974 12.7450 12.7450 12.7674 12.7674 14.9502 14.9502 14.9756 14.9756 15.9378 15.9378 15.9778 15.9778 18.1425 18.1425 18.1437 18.1437 k = 0.5000 0.2113-0.0000 ( 2094 PWs) bands (ev): -2.0559 -2.0559 -2.0554 -2.0554 2.0622 2.0622 2.0750 2.0750 6.1496 6.1496 6.1505 6.1505 7.4474 7.4474 7.4630 7.4630 8.0459 8.0459 8.0489 8.0489 9.2616 9.2616 9.2716 9.2716 10.0224 10.0224 10.0272 10.0272 11.6212 11.6212 11.7267 11.7267 12.0439 12.0439 12.1039 12.1039 12.7456 12.7456 12.7686 12.7686 14.9539 14.9539 14.9774 14.9774 16.0224 16.0224 16.0603 16.0603 18.2215 18.2215 18.2242 18.2242 k = 0.5000 0.2209-0.0000 ( 2090 PWs) bands (ev): -2.0426 -2.0426 -2.0420 -2.0420 2.0303 2.0303 2.0433 2.0433 6.1885 6.1885 6.1894 6.1894 7.4577 7.4577 7.4714 7.4714 8.0111 8.0111 8.0127 8.0127 9.2695 9.2695 9.2781 9.2781 9.9555 9.9555 9.9598 9.9598 11.6221 11.6221 11.7288 11.7288 12.0499 12.0499 12.1102 12.1102 12.7461 12.7461 12.7697 12.7697 14.9577 14.9577 14.9794 14.9794 16.1125 16.1125 16.1483 16.1483 18.2955 18.2955 18.2998 18.2998 k = 0.5000 0.2305-0.0000 ( 2090 PWs) bands (ev): -2.0295 -2.0295 -2.0289 -2.0289 1.9992 1.9992 2.0124 2.0124 6.2288 6.2288 6.2296 6.2296 7.4644 7.4644 7.4759 7.4759 7.9822 7.9822 7.9823 7.9823 9.2722 9.2722 9.2790 9.2790 9.8905 9.8905 9.8942 9.8942 11.6247 11.6247 11.7321 11.7321 12.0558 12.0558 12.1161 12.1161 12.7467 12.7467 12.7709 12.7709 14.9617 14.9617 14.9815 14.9815 16.2078 16.2078 16.2418 16.2418 18.3631 18.3631 18.3689 18.3689 k = 0.5000 0.2401-0.0000 ( 2086 PWs) bands (ev): -2.0167 -2.0167 -2.0161 -2.0161 1.9691 1.9691 1.9824 1.9824 6.2704 6.2704 6.2711 6.2711 7.4651 7.4651 7.4744 7.4744 7.9603 7.9603 7.9617 7.9617 9.2681 9.2681 9.2728 9.2728 9.8295 9.8295 9.8325 9.8325 11.6286 11.6286 11.7365 11.7365 12.0615 12.0615 12.1218 12.1218 12.7472 12.7472 12.7720 12.7720 14.9658 14.9658 14.9839 14.9839 16.3084 16.3084 16.3405 16.3405 18.4228 18.4228 18.4301 18.4301 k = 0.5000 0.2497-0.0000 ( 2086 PWs) bands (ev): -2.0043 -2.0043 -2.0037 -2.0037 1.9402 1.9402 1.9537 1.9537 6.3133 6.3133 6.3140 6.3140 7.4575 7.4575 7.4645 7.4645 7.9491 7.9491 7.9519 7.9519 9.2556 9.2556 9.2577 9.2577 9.7748 9.7748 9.7766 9.7766 11.6334 11.6334 11.7416 11.7416 12.0671 12.0671 12.1272 12.1272 12.7477 12.7477 12.7731 12.7731 14.9698 14.9698 14.9863 14.9863 16.4138 16.4138 16.4443 16.4443 18.4728 18.4728 18.4816 18.4816 k = 0.5000 0.2593-0.0000 ( 2082 PWs) bands (ev): -1.9925 -1.9925 -1.9918 -1.9918 1.9128 1.9128 1.9265 1.9265 6.3575 6.3575 6.3581 6.3581 7.4403 7.4403 7.4453 7.4453 7.9502 7.9502 7.9540 7.9540 9.2323 9.2323 9.2333 9.2333 9.7283 9.7283 9.7288 9.7288 11.6387 11.6387 11.7471 11.7471 12.0725 12.0725 12.1322 12.1322 12.7482 12.7482 12.7740 12.7740 14.9737 14.9737 14.9887 14.9887 16.5239 16.5239 16.5528 16.5528 18.5114 18.5114 18.5216 18.5216 k = 0.5000 0.2689-0.0000 ( 2086 PWs) bands (ev): -1.9813 -1.9813 -1.9806 -1.9806 1.8870 1.8870 1.9008 1.9008 6.4029 6.4029 6.4034 6.4034 7.4136 7.4136 7.4169 7.4169 7.9635 7.9635 7.9677 7.9677 9.1958 9.1958 9.2001 9.2001 9.6902 9.6902 9.6913 9.6913 11.6443 11.6443 11.7526 11.7526 12.0775 12.0775 12.1368 12.1368 12.7487 12.7487 12.7749 12.7749 14.9774 14.9774 14.9911 14.9911 16.6383 16.6383 16.6657 16.6657 18.5369 18.5369 18.5485 18.5485 k = 0.5000 0.2785-0.0000 ( 2086 PWs) bands (ev): -1.9708 -1.9708 -1.9701 -1.9701 1.8630 1.8630 1.8770 1.8770 6.4494 6.4494 6.4499 6.4499 7.3785 7.3785 7.3808 7.3808 7.9878 7.9878 7.9916 7.9916 9.1488 9.1488 9.1565 9.1565 9.6612 9.6612 9.6637 9.6637 11.6499 11.6499 11.7581 11.7581 12.0822 12.0822 12.1410 12.1410 12.7491 12.7491 12.7758 12.7758 14.9809 14.9809 14.9934 14.9934 16.7564 16.7564 16.7825 16.7825 18.5476 18.5476 18.5605 18.5605 k = 0.5000 0.2881-0.0000 ( 2090 PWs) bands (ev): -1.9611 -1.9611 -1.9603 -1.9603 1.8411 1.8411 1.8551 1.8551 6.4970 6.4970 6.4976 6.4976 7.3370 7.3370 7.3387 7.3387 8.0211 8.0211 8.0240 8.0240 9.0931 9.0931 9.1041 9.1041 9.6405 9.6405 9.6441 9.6441 11.6554 11.6554 11.7633 11.7633 12.0865 12.0865 12.1448 12.1448 12.7495 12.7495 12.7765 12.7765 14.9841 14.9841 14.9955 14.9955 16.8777 16.8777 16.9026 16.9026 18.5422 18.5422 18.5565 18.5565 k = 0.5000 0.2977-0.0000 ( 2080 PWs) bands (ev): -1.9523 -1.9523 -1.9515 -1.9515 1.8213 1.8213 1.8354 1.8354 6.5457 6.5457 6.5464 6.5464 7.2908 7.2908 7.2923 7.2923 8.0617 8.0617 8.0629 8.0629 9.0309 9.0309 9.0452 9.0452 9.6265 9.6265 9.6309 9.6309 11.6607 11.6607 11.7683 11.7683 12.0905 12.0905 12.1483 12.1483 12.7500 12.7500 12.7773 12.7773 14.9871 14.9871 14.9976 14.9976 17.0017 17.0017 17.0254 17.0254 18.5202 18.5202 18.5356 18.5356 k = 0.5000 0.3073-0.0000 ( 2084 PWs) bands (ev): -1.9445 -1.9445 -1.9437 -1.9437 1.8038 1.8038 1.8180 1.8180 6.5953 6.5953 6.5961 6.5961 7.2413 7.2413 7.2427 7.2427 8.1068 8.1068 8.1079 8.1079 8.9646 8.9646 8.9824 8.9824 9.6172 9.6172 9.6222 9.6222 11.6653 11.6653 11.7727 11.7727 12.0939 12.0939 12.1513 12.1513 12.7503 12.7503 12.7779 12.7779 14.9896 14.9896 14.9993 14.9993 17.1272 17.1272 17.1499 17.1499 18.4816 18.4816 18.4981 18.4981 k = 0.5000 0.3169-0.0000 ( 2088 PWs) bands (ev): -1.9377 -1.9377 -1.9369 -1.9369 1.7888 1.7888 1.8030 1.8030 6.6457 6.6457 6.6468 6.6468 7.1895 7.1895 7.1912 7.1912 8.1541 8.1541 8.1583 8.1583 8.8963 8.8963 8.9179 8.9179 9.6113 9.6113 9.6166 9.6166 11.6694 11.6694 11.7765 11.7765 12.0968 12.0968 12.1537 12.1537 12.7506 12.7506 12.7784 12.7784 14.9919 14.9919 15.0008 15.0008 17.2534 17.2534 17.2750 17.2750 18.4273 18.4273 18.4449 18.4449 k = 0.5000 0.3265-0.0000 ( 2088 PWs) bands (ev): -1.9321 -1.9321 -1.9313 -1.9313 1.7764 1.7764 1.7906 1.7906 6.6968 6.6968 6.6983 6.6983 7.1364 7.1364 7.1386 7.1386 8.2031 8.2031 8.2113 8.2113 8.8280 8.8280 8.8542 8.8542 9.6075 9.6075 9.6130 9.6130 11.6729 11.6729 11.7797 11.7797 12.0993 12.0993 12.1558 12.1558 12.7508 12.7508 12.7788 12.7788 14.9937 14.9937 15.0021 15.0021 17.3785 17.3785 17.3991 17.3991 18.3593 18.3593 18.3780 18.3780 k = 0.5000 0.3361-0.0000 ( 2088 PWs) bands (ev): -1.9277 -1.9277 -1.9269 -1.9269 1.7666 1.7666 1.7809 1.7809 6.7482 6.7482 6.7504 6.7504 7.0827 7.0827 7.0855 7.0855 8.2515 8.2515 8.2651 8.2651 8.7620 8.7620 8.7940 8.7940 9.6053 9.6053 9.6109 9.6109 11.6757 11.6757 11.7823 11.7823 12.1012 12.1012 12.1574 12.1574 12.7510 12.7510 12.7791 12.7791 14.9952 14.9952 15.0032 15.0032 17.5001 17.5001 17.5195 17.5195 18.2809 18.2809 18.3006 18.3006 k = 0.5000 0.3457-0.0000 ( 2102 PWs) bands (ev): -1.9245 -1.9245 -1.9237 -1.9237 1.7595 1.7595 1.7738 1.7738 6.7990 6.7990 6.8026 6.8026 7.0291 7.0291 7.0333 7.0333 8.2954 8.2954 8.3162 8.3162 8.7021 8.7021 8.7414 8.7414 9.6038 9.6038 9.6094 9.6094 11.6777 11.6777 11.7841 11.7841 12.1025 12.1025 12.1585 12.1585 12.7510 12.7510 12.7793 12.7793 14.9961 14.9961 15.0038 15.0038 17.6132 17.6132 17.6313 17.6313 18.1978 18.1978 18.2188 18.2188 k = 0.5000 0.3553-0.0000 ( 2098 PWs) bands (ev): -1.9226 -1.9226 -1.9217 -1.9217 1.7553 1.7553 1.7696 1.7696 6.8464 6.8464 6.8531 6.8531 6.9776 6.9776 6.9850 6.9850 8.3283 8.3283 8.3573 8.3573 8.6556 8.6556 8.7033 8.7033 9.6031 9.6031 9.6088 9.6088 11.6790 11.6790 11.7853 11.7853 12.1033 12.1033 12.1592 12.1592 12.7512 12.7512 12.7794 12.7794 14.9968 14.9968 15.0043 15.0043 17.7055 17.7055 17.7220 17.7220 18.1231 18.1231 18.1457 18.1457 k = 0.5000 0.3649-0.0000 ( 2104 PWs) bands (ev): -1.9219 -1.9219 -1.9211 -1.9211 1.7538 1.7538 1.7682 1.7682 6.8730 6.8730 6.8856 6.8856 6.9448 6.9448 6.9580 6.9580 8.3409 8.3409 8.3744 8.3744 8.6368 8.6368 8.6889 8.6889 9.6028 9.6028 9.6085 9.6085 11.6794 11.6794 11.7857 11.7857 12.1036 12.1036 12.1594 12.1594 12.7512 12.7512 12.7795 12.7795 14.9970 14.9970 15.0044 15.0044 17.7458 17.7458 17.7613 17.7613 18.0886 18.0886 18.1122 18.1122 k = 0.5000 0.3649-0.0000 ( 2104 PWs) bands (ev): -1.9219 -1.9219 -1.9211 -1.9211 1.7538 1.7538 1.7682 1.7682 6.8730 6.8730 6.8856 6.8856 6.9448 6.9448 6.9580 6.9580 8.3409 8.3409 8.3744 8.3744 8.6368 8.6368 8.6889 8.6889 9.6028 9.6028 9.6085 9.6085 11.6794 11.6794 11.7857 11.7857 12.1036 12.1036 12.1594 12.1594 12.7512 12.7512 12.7795 12.7795 14.9970 14.9970 15.0044 15.0044 17.7458 17.7458 17.7613 17.7613 18.0886 18.0886 18.1122 18.1122 k = 0.4902 0.3649-0.0000 ( 2102 PWs) bands (ev): -1.9232 -1.9232 -1.9223 -1.9223 1.7534 1.7534 1.7677 1.7677 6.8460 6.8460 6.8584 6.8584 6.9723 6.9723 6.9856 6.9856 8.3331 8.3331 8.3668 8.3668 8.6482 8.6482 8.6999 8.6999 9.6046 9.6046 9.6103 9.6103 11.6798 11.6798 11.7860 11.7860 12.1035 12.1035 12.1593 12.1593 12.7513 12.7513 12.7796 12.7796 14.9966 14.9966 15.0041 15.0041 17.7383 17.7383 17.7533 17.7533 18.0949 18.0949 18.1180 18.1180 k = 0.4804 0.3649-0.0000 ( 2098 PWs) bands (ev): -1.9269 -1.9269 -1.9261 -1.9261 1.7519 1.7519 1.7662 1.7662 6.8001 6.8001 6.8121 6.8121 7.0197 7.0197 7.0331 7.0331 8.3130 8.3130 8.3472 8.3472 8.6791 8.6791 8.7298 8.7298 9.6098 9.6098 9.6157 9.6157 11.6811 11.6811 11.7872 11.7872 12.1033 12.1033 12.1589 12.1589 12.7518 12.7518 12.7800 12.7800 14.9956 14.9956 15.0030 15.0030 17.7172 17.7172 17.7309 17.7309 18.1122 18.1122 18.1339 18.1339 k = 0.4706 0.3649-0.0000 ( 2098 PWs) bands (ev): -1.9331 -1.9331 -1.9323 -1.9323 1.7495 1.7495 1.7638 1.7638 6.7517 6.7517 6.7632 6.7632 7.0703 7.0703 7.0836 7.0836 8.2874 8.2874 8.3218 8.3218 8.7228 8.7228 8.7725 8.7725 9.6186 9.6186 9.6247 9.6247 11.6831 11.6831 11.7889 11.7889 12.1028 12.1028 12.1582 12.1582 12.7528 12.7528 12.7808 12.7808 14.9939 14.9939 15.0013 15.0013 17.6856 17.6856 17.6980 17.6980 18.1368 18.1368 18.1570 18.1570 k = 0.4608 0.3649-0.0000 ( 2108 PWs) bands (ev): -1.9417 -1.9417 -1.9409 -1.9409 1.7461 1.7461 1.7603 1.7603 6.7031 6.7031 6.7140 6.7140 7.1214 7.1214 7.1345 7.1345 8.2617 8.2617 8.2959 8.2959 8.7741 8.7741 8.8228 8.8228 9.6312 9.6312 9.6376 9.6376 11.6858 11.6858 11.7913 11.7913 12.1021 12.1021 12.1572 12.1572 12.7539 12.7539 12.7818 12.7818 14.9914 14.9914 14.9988 14.9988 17.6466 17.6466 17.6579 17.6579 18.1652 18.1652 18.1841 18.1841 k = 0.4510 0.3649-0.0000 ( 2110 PWs) bands (ev): -1.9527 -1.9527 -1.9519 -1.9519 1.7416 1.7416 1.7559 1.7559 6.6547 6.6547 6.6650 6.6650 7.1722 7.1722 7.1847 7.1847 8.2395 8.2395 8.2729 8.2729 8.8296 8.8296 8.8773 8.8773 9.6476 9.6476 9.6545 9.6545 11.6896 11.6896 11.7946 11.7946 12.1012 12.1012 12.1559 12.1559 12.7557 12.7557 12.7833 12.7833 14.9881 14.9881 14.9956 14.9956 17.6027 17.6027 17.6133 17.6133 18.1950 18.1950 18.2129 18.2129 k = 0.4412 0.3649-0.0000 ( 2114 PWs) bands (ev): -1.9659 -1.9659 -1.9651 -1.9651 1.7361 1.7361 1.7503 1.7503 6.6067 6.6067 6.6163 6.6163 7.2218 7.2218 7.2336 7.2336 8.2231 8.2231 8.2553 8.2553 8.8871 8.8871 8.9338 8.9338 9.6682 9.6682 9.6757 9.6757 11.6942 11.6942 11.7986 11.7986 12.1001 12.1001 12.1543 12.1543 12.7581 12.7581 12.7853 12.7853 14.9841 14.9841 14.9917 14.9917 17.5555 17.5555 17.5658 17.5658 18.2248 18.2248 18.2419 18.2419 k = 0.4314 0.3649-0.0000 ( 2106 PWs) bands (ev): -1.9812 -1.9812 -1.9805 -1.9805 1.7296 1.7296 1.7437 1.7437 6.5590 6.5590 6.5678 6.5678 7.2698 7.2698 7.2805 7.2805 8.2143 8.2143 8.2448 8.2448 8.9451 8.9451 8.9907 8.9907 9.6932 9.6932 9.7015 9.7015 11.6998 11.6998 11.8034 11.8034 12.0989 12.0989 12.1526 12.1526 12.7613 12.7613 12.7880 12.7880 14.9794 14.9794 14.9870 14.9870 17.5063 17.5063 17.5166 17.5166 18.2535 18.2535 18.2701 18.2701 k = 0.4216 0.3649-0.0000 ( 2110 PWs) bands (ev): -1.9987 -1.9987 -1.9980 -1.9980 1.7219 1.7219 1.7360 1.7360 6.5114 6.5114 6.5194 6.5194 7.3157 7.3157 7.3250 7.3250 8.2142 8.2142 8.2427 8.2427 9.0025 9.0025 9.0466 9.0466 9.7229 9.7229 9.7323 9.7323 11.7060 11.7060 11.8087 11.8087 12.0973 12.0973 12.1505 12.1505 12.7652 12.7652 12.7913 12.7913 14.9738 14.9738 14.9815 14.9815 17.4559 17.4559 17.4664 17.4664 18.2805 18.2805 18.2968 18.2968 k = 0.4118 0.3649-0.0000 ( 2110 PWs) bands (ev): -2.0181 -2.0181 -2.0174 -2.0174 1.7131 1.7131 1.7271 1.7271 6.4639 6.4639 6.4711 6.4711 7.3591 7.3591 7.3667 7.3667 8.2237 8.2237 8.2496 8.2496 9.0582 9.0582 9.1007 9.1007 9.7576 9.7576 9.7683 9.7683 11.7132 11.7132 11.8148 11.8148 12.0956 12.0956 12.1481 12.1481 12.7702 12.7702 12.7956 12.7956 14.9673 14.9673 14.9751 14.9751 17.4051 17.4051 17.4159 17.4159 18.3054 18.3054 18.3215 18.3215 k = 0.4020 0.3649-0.0000 ( 2110 PWs) bands (ev): -2.0393 -2.0393 -2.0386 -2.0386 1.7031 1.7031 1.7171 1.7171 6.4163 6.4163 6.4226 6.4226 7.4000 7.4000 7.4057 7.4057 8.2430 8.2430 8.2662 8.2662 9.1115 9.1115 9.1521 9.1521 9.7975 9.7975 9.8096 9.8096 11.7211 11.7211 11.8215 11.8215 12.0936 12.0936 12.1454 12.1454 12.7763 12.7763 12.8010 12.8010 14.9598 14.9598 14.9678 14.9678 17.3543 17.3543 17.3656 17.3656 18.3280 18.3280 18.3439 18.3439 k = 0.3922 0.3649-0.0000 ( 2102 PWs) bands (ev): -2.0621 -2.0621 -2.0615 -2.0615 1.6920 1.6920 1.7059 1.7059 6.3684 6.3684 6.3739 6.3739 7.4387 7.4387 7.4424 7.4424 8.2719 8.2719 8.2924 8.2924 9.1619 9.1619 9.2004 9.2004 9.8425 9.8425 9.8562 9.8562 11.7300 11.7300 11.8288 11.8288 12.0915 12.0915 12.1427 12.1427 12.7839 12.7839 12.8075 12.8075 14.9515 14.9515 14.9597 14.9597 17.3040 17.3040 17.3160 17.3160 18.3480 18.3480 18.3639 18.3639 k = 0.3824 0.3649-0.0000 ( 2102 PWs) bands (ev): -2.0866 -2.0866 -2.0859 -2.0859 1.6797 1.6797 1.6935 1.6935 6.3203 6.3203 6.3249 6.3249 7.4757 7.4757 7.4773 7.4773 8.3100 8.3100 8.3277 8.3277 9.2092 9.2092 9.2453 9.2453 9.8925 9.8925 9.9078 9.9078 11.7394 11.7394 11.8364 11.8364 12.0891 12.0891 12.1396 12.1396 12.7929 12.7929 12.8155 12.8155 14.9421 14.9421 14.9505 14.9505 17.2547 17.2547 17.2675 17.2675 18.3654 18.3654 18.3812 18.3812 k = 0.3725 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.1123 -2.1123 -2.1117 -2.1117 1.6663 1.6663 1.6800 1.6800 6.2718 6.2718 6.2756 6.2756 7.5114 7.5114 7.5116 7.5116 8.3564 8.3564 8.3716 8.3716 9.2532 9.2532 9.2869 9.2869 9.9471 9.9471 9.9640 9.9640 11.7496 11.7496 11.8446 11.8446 12.0866 12.0866 12.1365 12.1365 12.8037 12.8037 12.8250 12.8250 14.9317 14.9317 14.9404 14.9404 17.2068 17.2068 17.2203 17.2203 18.3800 18.3800 18.3958 18.3958 k = 0.3627 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.1394 -2.1394 -2.1388 -2.1388 1.6518 1.6518 1.6653 1.6653 6.2229 6.2229 6.2258 6.2258 7.5455 7.5455 7.5474 7.5474 8.4100 8.4100 8.4229 8.4229 9.2940 9.2940 9.3253 9.3253 10.0059 10.0059 10.0242 10.0242 11.7604 11.7604 11.8530 11.8530 12.0841 12.0841 12.1333 12.1333 12.8162 12.8162 12.8361 12.8361 14.9202 14.9202 14.9294 14.9294 17.1605 17.1605 17.1749 17.1749 18.3919 18.3919 18.4077 18.4077 k = 0.3529 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.1675 -2.1675 -2.1669 -2.1669 1.6362 1.6362 1.6495 1.6495 6.1736 6.1736 6.1758 6.1758 7.5805 7.5805 7.5837 7.5837 8.4698 8.4698 8.4808 8.4808 9.3319 9.3319 9.3607 9.3607 10.0682 10.0682 10.0876 10.0876 11.7717 11.7717 11.8617 11.8617 12.0818 12.0818 12.1303 12.1303 12.8308 12.8308 12.8491 12.8491 14.9077 14.9077 14.9173 14.9173 17.1161 17.1161 17.1315 17.1315 18.4009 18.4009 18.4168 18.4168 k = 0.3431 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.1965 -2.1965 -2.1960 -2.1960 1.6195 1.6195 1.6327 1.6327 6.1240 6.1240 6.1255 6.1255 7.6170 7.6170 7.6214 7.6214 8.5348 8.5348 8.5442 8.5442 9.3674 9.3674 9.3937 9.3937 10.1331 10.1331 10.1534 10.1534 11.7835 11.7835 11.8705 11.8705 12.0796 12.0796 12.1275 12.1275 12.8476 12.8476 12.8641 12.8641 14.8941 14.8941 14.9043 14.9043 17.0740 17.0740 17.0904 17.0904 18.4071 18.4071 18.4231 18.4231 k = 0.3333 0.3649-0.0000 ( 2106 PWs) bands (ev): -2.2264 -2.2264 -2.2259 -2.2259 1.6018 1.6018 1.6148 1.6148 6.0743 6.0743 6.0750 6.0750 7.6557 7.6557 7.6609 7.6609 8.6039 8.6039 8.6123 8.6123 9.4005 9.4005 9.4245 9.4245 10.2001 10.2001 10.2208 10.2208 11.7955 11.7955 11.8791 11.8791 12.0779 12.0779 12.1251 12.1251 12.8666 12.8666 12.8813 12.8813 14.8795 14.8795 14.8903 14.8903 17.0343 17.0343 17.0517 17.0517 18.4106 18.4106 18.4267 18.4267 k = 0.3235 0.3649-0.0000 ( 2106 PWs) bands (ev): -2.2569 -2.2569 -2.2564 -2.2564 1.5832 1.5832 1.5960 1.5960 6.0244 6.0244 6.0245 6.0245 7.6968 7.6968 7.7027 7.7027 8.6765 8.6765 8.6841 8.6841 9.4320 9.4320 9.4535 9.4535 10.2683 10.2683 10.2891 10.2891 11.8079 11.8079 11.8877 11.8877 12.0768 12.0768 12.1233 12.1233 12.8881 12.8881 12.9008 12.9008 14.8640 14.8640 14.8756 14.8756 16.9973 16.9973 17.0158 17.0158 18.4112 18.4112 18.4274 18.4274 k = 0.3137 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.2878 -2.2878 -2.2874 -2.2874 1.5637 1.5637 1.5763 1.5763 5.9741 5.9741 5.9746 5.9746 7.7407 7.7407 7.7470 7.7470 8.7517 8.7517 8.7591 8.7591 9.4622 9.4622 9.4813 9.4813 10.3370 10.3370 10.3576 10.3576 11.8205 11.8205 11.8960 11.8960 12.0765 12.0765 12.1222 12.1222 12.9122 12.9122 12.9228 12.9228 14.8478 14.8478 14.8601 14.8601 16.9631 16.9631 16.9826 16.9826 18.4091 18.4091 18.4254 18.4254 k = 0.3039 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.3191 -2.3191 -2.3187 -2.3187 1.5435 1.5435 1.5558 1.5558 5.9239 5.9239 5.9249 5.9249 7.7873 7.7873 7.7939 7.7939 8.8288 8.8288 8.8364 8.8364 9.4915 9.4915 9.5079 9.5079 10.4056 10.4056 10.4255 10.4255 11.8330 11.8330 11.9039 11.9039 12.0772 12.0772 12.1221 12.1221 12.9388 12.9388 12.9473 12.9473 14.8309 14.8309 14.8441 14.8441 16.9318 16.9318 16.9523 16.9523 18.4043 18.4043 18.4207 18.4207 k = 0.2941 0.3649-0.0000 ( 2094 PWs) bands (ev): -2.3507 -2.3507 -2.3503 -2.3503 1.5226 1.5226 1.5347 1.5347 5.8741 5.8741 5.8755 5.8755 7.8366 7.8366 7.8434 7.8434 8.9072 8.9072 8.9154 8.9154 9.5202 9.5202 9.5339 9.5339 10.4732 10.4732 10.4921 10.4921 11.8455 11.8455 11.9114 11.9114 12.0791 12.0791 12.1231 12.1231 12.9681 12.9681 12.9745 12.9745 14.8135 14.8135 14.8277 14.8277 16.9035 16.9035 16.9251 16.9251 18.3967 18.3967 18.4133 18.4133 k = 0.2843 0.3649-0.0000 ( 2098 PWs) bands (ev): -2.3823 -2.3823 -2.3820 -2.3820 1.5012 1.5012 1.5129 1.5129 5.8248 5.8248 5.8266 5.8266 7.8885 7.8885 7.8954 7.8954 8.9859 8.9859 8.9954 8.9954 9.5491 9.5491 9.5596 9.5596 10.5393 10.5393 10.5569 10.5569 11.8578 11.8578 11.9184 11.9184 12.0821 12.0821 12.1253 12.1253 13.0000 13.0000 13.0044 13.0044 14.7960 14.7960 14.8113 14.8113 16.8783 16.8783 16.9008 16.9008 18.3864 18.3864 18.4031 18.4031 k = 0.2745 0.3649-0.0000 ( 2094 PWs) bands (ev): -2.4139 -2.4139 -2.4136 -2.4136 1.4792 1.4792 1.4907 1.4907 5.7761 5.7761 5.7783 5.7783 7.9429 7.9429 7.9497 7.9497 9.0643 9.0643 9.0756 9.0756 9.5787 9.5787 9.5857 9.5857 10.6034 10.6034 10.6192 10.6192 11.8700 11.8700 11.9253 11.9253 12.0864 12.0864 12.1289 12.1289 13.0346 13.0346 13.0371 13.0371 14.7786 14.7786 14.7950 14.7950 16.8560 16.8560 16.8794 16.8794 18.3734 18.3734 18.3902 18.3902 k = 0.2647 0.3649-0.0000 ( 2088 PWs) bands (ev): -2.4454 -2.4454 -2.4451 -2.4451 1.4570 1.4570 1.4681 1.4681 5.7282 5.7282 5.7307 5.7307 7.9994 7.9994 8.0061 8.0061 9.1412 9.1412 9.1551 9.1551 9.6101 9.6101 9.6130 9.6130 10.6647 10.6647 10.6786 10.6786 11.8823 11.8823 11.9322 11.9322 12.0919 12.0919 12.1337 12.1337 13.0716 13.0716 13.0724 13.0724 14.7618 14.7618 14.7795 14.7795 16.8367 16.8367 16.8609 16.8609 18.3577 18.3577 18.3746 18.3746 k = 0.2549 0.3649-0.0000 ( 2092 PWs) bands (ev): -2.4766 -2.4766 -2.4763 -2.4763 1.4344 1.4344 1.4453 1.4453 5.6812 5.6812 5.6839 5.6839 8.0577 8.0577 8.0642 8.0642 9.2152 9.2152 9.2324 9.2324 9.6423 9.6423 9.6442 9.6442 10.7228 10.7228 10.7345 10.7345 11.8945 11.8945 11.9392 11.9392 12.0983 12.0983 12.1398 12.1398 13.1102 13.1102 13.1108 13.1108 14.7460 14.7460 14.7649 14.7649 16.8202 16.8202 16.8451 16.8451 18.3391 18.3391 18.3562 18.3562 k = 0.2451 0.3649-0.0000 ( 2086 PWs) bands (ev): -2.5074 -2.5074 -2.5072 -2.5072 1.4118 1.4118 1.4223 1.4223 5.6352 5.6352 5.6381 5.6381 8.1177 8.1177 8.1240 8.1240 9.2846 9.2846 9.3058 9.3058 9.6756 9.6756 9.6827 9.6827 10.7773 10.7773 10.7866 10.7866 11.9071 11.9071 11.9469 11.9469 12.1056 12.1056 12.1471 12.1471 13.1503 13.1503 13.1523 13.1523 14.7319 14.7319 14.7520 14.7520 16.8064 16.8064 16.8320 16.8320 18.3177 18.3177 18.3349 18.3349 k = 0.2353 0.3649-0.0000 ( 2090 PWs) bands (ev): -2.5378 -2.5378 -2.5376 -2.5376 1.3891 1.3891 1.3992 1.3992 5.5904 5.5904 5.5934 5.5934 8.1789 8.1789 8.1849 8.1849 9.3475 9.3475 9.3729 9.3729 9.7146 9.7146 9.7272 9.7272 10.8276 10.8276 10.8344 10.8344 11.9201 11.9201 11.9553 11.9553 12.1136 12.1136 12.1554 12.1554 13.1924 13.1924 13.1954 13.1954 14.7198 14.7198 14.7413 14.7413 16.7950 16.7950 16.8211 16.8211 18.2935 18.2935 18.3108 18.3108 k = 0.2255 0.3649-0.0000 ( 2090 PWs) bands (ev): -2.5676 -2.5676 -2.5674 -2.5674 1.3665 1.3665 1.3762 1.3762 5.5468 5.5468 5.5499 5.5499 8.2411 8.2411 8.2468 8.2468 9.4023 9.4023 9.4315 9.4315 9.7616 9.7616 9.7791 9.7791 10.8737 10.8737 10.8779 10.8779 11.9337 11.9337 11.9648 11.9648 12.1221 12.1221 12.1645 12.1645 13.2361 13.2361 13.2399 13.2399 14.7107 14.7107 14.7334 14.7334 16.7860 16.7860 16.8124 16.8124 18.2663 18.2663 18.2837 18.2837 k = 0.2157 0.3649-0.0000 ( 2094 PWs) bands (ev): -2.5967 -2.5967 -2.5965 -2.5965 1.3440 1.3440 1.3534 1.3534 5.5045 5.5045 5.5077 5.5077 8.3039 8.3039 8.3093 8.3093 9.4482 9.4482 9.4798 9.4798 9.8178 9.8178 9.8389 9.8389 10.9153 10.9153 10.9169 10.9169 11.9479 11.9479 11.9753 11.9753 12.1309 12.1309 12.1742 12.1742 13.2809 13.2809 13.2853 13.2853 14.7052 14.7052 14.7291 14.7291 16.7789 16.7789 16.8056 16.8056 18.2360 18.2360 18.2536 18.2536 k = 0.2059 0.3649-0.0000 ( 2090 PWs) bands (ev): -2.6251 -2.6251 -2.6249 -2.6249 1.3219 1.3219 1.3309 1.3309 5.4636 5.4636 5.4669 5.4669 8.3670 8.3670 8.3721 8.3721 9.4857 9.4857 9.5182 9.5182 9.8828 9.8828 9.9058 9.9058 10.9517 10.9517 10.9526 10.9526 11.9628 11.9628 11.9869 11.9869 12.1399 12.1399 12.1842 12.1842 13.3262 13.3262 13.3311 13.3311 14.7042 14.7042 14.7290 14.7290 16.7735 16.7735 16.8003 16.8003 18.2026 18.2026 18.2203 18.2203 k = 0.1961 0.3649-0.0000 ( 2086 PWs) bands (ev): -2.6526 -2.6526 -2.6525 -2.6525 1.3001 1.3001 1.3087 1.3087 5.4243 5.4243 5.4275 5.4275 8.4302 8.4302 8.4349 8.4349 9.5160 9.5160 9.5480 9.5480 9.9547 9.9547 9.9783 9.9783 10.9824 10.9824 10.9858 10.9858 11.9782 11.9782 11.9994 11.9994 12.1491 12.1491 12.1945 12.1945 13.3715 13.3715 13.3768 13.3768 14.7083 14.7083 14.7339 14.7339 16.7695 16.7695 16.7963 16.7963 18.1659 18.1659 18.1837 18.1837 k = 0.1863 0.3649-0.0000 ( 2082 PWs) bands (ev): -2.6793 -2.6793 -2.6792 -2.6792 1.2788 1.2788 1.2871 1.2871 5.3864 5.3864 5.3897 5.3897 8.4930 8.4930 8.4974 8.4974 9.5405 9.5405 9.5712 9.5712 10.0311 10.0311 10.0543 10.0543 11.0094 11.0094 11.0152 11.0152 11.9940 11.9940 12.0125 12.0125 12.1583 12.1583 12.2048 12.2048 13.4161 13.4161 13.4218 13.4218 14.7183 14.7183 14.7445 14.7445 16.7666 16.7666 16.7933 16.7933 18.1258 18.1258 18.1438 18.1438 k = 0.1765 0.3649-0.0000 ( 2078 PWs) bands (ev): -2.7050 -2.7050 -2.7048 -2.7048 1.2581 1.2581 1.2659 1.2659 5.3502 5.3502 5.3534 5.3534 8.5552 8.5552 8.5593 8.5593 9.5604 9.5604 9.5895 9.5895 10.1096 10.1096 10.1320 10.1320 11.0334 11.0334 11.0416 11.0416 12.0098 12.0098 12.0256 12.0256 12.1677 12.1677 12.2150 12.2150 13.4593 13.4593 13.4656 13.4656 14.7350 14.7350 14.7614 14.7614 16.7646 16.7646 16.7909 16.7909 18.0823 18.0823 18.1003 18.1003 k = 0.1667 0.3649-0.0000 ( 2082 PWs) bands (ev): -2.7296 -2.7296 -2.7295 -2.7295 1.2380 1.2380 1.2454 1.2454 5.3157 5.3157 5.3188 5.3188 8.6166 8.6166 8.6204 8.6204 9.5768 9.5768 9.6041 9.6041 10.1882 10.1882 10.2096 10.2096 11.0552 11.0552 11.0657 11.0657 12.0252 12.0252 12.0383 12.0383 12.1770 12.1770 12.2248 12.2248 13.5007 13.5007 13.5076 13.5076 14.7587 14.7587 14.7849 14.7849 16.7629 16.7629 16.7888 16.7888 18.0352 18.0352 18.0533 18.0533 k = 0.1569 0.3649-0.0000 ( 2086 PWs) bands (ev): -2.7531 -2.7531 -2.7530 -2.7530 1.2187 1.2187 1.2257 1.2257 5.2829 5.2829 5.2859 5.2859 8.6768 8.6768 8.6803 8.6803 9.5904 9.5904 9.6159 9.6159 10.2654 10.2654 10.2856 10.2856 11.0758 11.0758 11.0886 11.0886 12.0399 12.0399 12.0501 12.0501 12.1865 12.1865 12.2342 12.2342 13.5399 13.5399 13.5476 13.5476 14.7896 14.7896 14.8152 14.8152 16.7615 16.7615 16.7868 16.7868 17.9846 17.9846 18.0027 18.0027 k = 0.1471 0.3649-0.0000 ( 2082 PWs) bands (ev): -2.7755 -2.7755 -2.7754 -2.7754 1.2001 1.2001 1.2067 1.2067 5.2519 5.2519 5.2548 5.2548 8.7357 8.7357 8.7388 8.7388 9.6017 9.6017 9.6254 9.6254 10.3394 10.3394 10.3582 10.3582 11.0962 11.0962 11.1114 11.1114 12.0536 12.0536 12.0604 12.0604 12.1962 12.1962 12.2432 12.2432 13.5768 13.5768 13.5855 13.5855 14.8278 14.8278 14.8524 14.8524 16.7599 16.7599 16.7845 16.7845 17.9305 17.9305 17.9486 17.9486 k = 0.1373 0.3649-0.0000 ( 2082 PWs) bands (ev): -2.7967 -2.7967 -2.7966 -2.7966 1.1825 1.1825 1.1887 1.1887 5.2227 5.2227 5.2255 5.2255 8.7929 8.7929 8.7957 8.7957 9.6111 9.6111 9.6331 9.6331 10.4089 10.4089 10.4261 10.4261 11.1177 11.1177 11.1355 11.1355 12.0657 12.0657 12.0687 12.0687 12.2060 12.2060 12.2517 12.2517 13.6114 13.6114 13.6213 13.6213 14.8729 14.8729 14.8961 14.8961 16.7578 16.7578 16.7817 16.7817 17.8731 17.8731 17.8911 17.8911 k = 0.1275 0.3649-0.0000 ( 2086 PWs) bands (ev): -2.8166 -2.8166 -2.8165 -2.8165 1.1658 1.1658 1.1716 1.1716 5.1954 5.1954 5.1981 5.1981 8.8481 8.8481 8.8506 8.8506 9.6190 9.6190 9.6392 9.6392 10.4721 10.4721 10.4876 10.4876 11.1417 11.1417 11.1620 11.1620 12.0747 12.0747 12.0759 12.0759 12.2158 12.2158 12.2594 12.2594 13.6439 13.6439 13.6550 13.6550 14.9242 14.9242 14.9457 14.9457 16.7552 16.7552 16.7781 16.7781 17.8126 17.8126 17.8304 17.8304 k = 0.1176 0.3649-0.0000 ( 2090 PWs) bands (ev): -2.8352 -2.8352 -2.8351 -2.8351 1.1501 1.1501 1.1554 1.1554 5.1700 5.1700 5.1725 5.1725 8.9011 8.9011 8.9034 8.9034 9.6254 9.6254 9.6440 9.6440 10.5279 10.5279 10.5414 10.5414 11.1691 11.1691 11.1922 11.1922 12.0782 12.0782 12.0838 12.0838 12.2255 12.2255 12.2665 12.2665 13.6748 13.6748 13.6870 13.6870 14.9808 14.9808 15.0003 15.0003 16.7516 16.7516 16.7736 16.7736 17.7495 17.7495 17.7671 17.7671 k = 0.1078 0.3649-0.0000 ( 2090 PWs) bands (ev): -2.8524 -2.8524 -2.8524 -2.8524 1.1355 1.1355 1.1404 1.1404 5.1465 5.1465 5.1488 5.1488 8.9518 8.9518 8.9537 8.9537 9.6306 9.6306 9.6477 9.6477 10.5752 10.5752 10.5867 10.5867 11.2010 11.2010 11.2267 11.2267 12.0790 12.0790 12.0892 12.0892 12.2351 12.2351 12.2729 12.2729 13.7043 13.7043 13.7175 13.7175 15.0416 15.0416 15.0590 15.0590 16.7471 16.7471 16.7680 16.7680 17.6843 17.6843 17.7015 17.7015 k = 0.0980 0.3649-0.0000 ( 2082 PWs) bands (ev): -2.8683 -2.8683 -2.8683 -2.8683 1.1220 1.1220 1.1265 1.1265 5.1250 5.1250 5.1272 5.1272 8.9997 8.9997 9.0013 9.0013 9.6348 9.6348 9.6503 9.6503 10.6137 10.6137 10.6233 10.6233 11.2376 11.2376 11.2658 11.2658 12.0773 12.0773 12.0919 12.0919 12.2443 12.2443 12.2786 12.2786 13.7328 13.7328 13.7467 13.7467 15.1053 15.1053 15.1205 15.1205 16.7415 16.7415 16.7612 16.7612 17.6178 17.6178 17.6346 17.6346 k = 0.0882 0.3649-0.0000 ( 2070 PWs) bands (ev): -2.8828 -2.8828 -2.8827 -2.8827 1.1097 1.1097 1.1137 1.1137 5.1055 5.1055 5.1075 5.1075 9.0446 9.0446 9.0460 9.0460 9.6381 9.6381 9.6521 9.6521 10.6436 10.6436 10.6515 10.6515 11.2783 11.2783 11.3086 11.3086 12.0732 12.0732 12.0919 12.0919 12.2529 12.2529 12.2835 12.2835 13.7604 13.7604 13.7747 13.7747 15.1706 15.1706 15.1836 15.1836 16.7348 16.7348 16.7532 16.7532 17.5510 17.5510 17.5672 17.5672 k = 0.0784 0.3649-0.0000 ( 2066 PWs) bands (ev): -2.8958 -2.8958 -2.8957 -2.8957 1.0986 1.0986 1.1022 1.1022 5.0880 5.0880 5.0897 5.0897 9.0862 9.0862 9.0874 9.0874 9.6405 9.6405 9.6529 9.6529 10.6660 10.6660 10.6723 10.6723 11.3221 11.3221 11.3538 11.3538 12.0667 12.0667 12.0889 12.0889 12.2608 12.2608 12.2877 12.2877 13.7872 13.7872 13.8015 13.8015 15.2359 15.2359 15.2469 15.2469 16.7271 16.7271 16.7441 16.7441 17.4851 17.4851 17.5005 17.5005 k = 0.0686 0.3649-0.0000 ( 2066 PWs) bands (ev): -2.9073 -2.9073 -2.9073 -2.9073 1.0887 1.0887 1.0918 1.0918 5.0725 5.0725 5.0741 5.0741 9.1241 9.1241 9.1251 9.1251 9.6421 9.6421 9.6530 9.6530 10.6819 10.6819 10.6870 10.6870 11.3675 11.3675 11.3999 11.3999 12.0582 12.0582 12.0831 12.0831 12.2680 12.2680 12.2911 12.2911 13.8129 13.8129 13.8267 13.8267 15.2997 15.2997 15.3087 15.3087 16.7185 16.7185 16.7340 16.7340 17.4214 17.4214 17.4359 17.4359 k = 0.0588 0.3649-0.0000 ( 2070 PWs) bands (ev): -2.9174 -2.9174 -2.9173 -2.9173 1.0801 1.0801 1.0828 1.0828 5.0591 5.0591 5.0604 5.0604 9.1580 9.1580 9.1587 9.1587 9.6431 9.6431 9.6525 9.6525 10.6928 10.6928 10.6969 10.6969 11.4128 11.4128 11.4450 11.4450 12.0482 12.0482 12.0747 12.0747 12.2743 12.2743 12.2938 12.2938 13.8371 13.8371 13.8501 13.8501 15.3605 15.3605 15.3676 15.3676 16.7094 16.7094 16.7232 16.7232 17.3615 17.3615 17.3749 17.3749 k = 0.0490 0.3649-0.0000 ( 2070 PWs) bands (ev): -2.9259 -2.9259 -2.9259 -2.9259 1.0729 1.0729 1.0751 1.0751 5.0477 5.0477 5.0488 5.0488 9.1876 9.1876 9.1882 9.1882 9.6437 9.6437 9.6515 9.6515 10.7000 10.7000 10.7032 10.7032 11.4565 11.4565 11.4875 11.4875 12.0374 12.0374 12.0641 12.0641 12.2799 12.2799 12.2958 12.2958 13.8595 13.8595 13.8711 13.8711 15.4164 15.4164 15.4219 15.4219 16.7002 16.7002 16.7121 16.7121 17.3071 17.3071 17.3189 17.3189 k = 0.0392 0.3649-0.0000 ( 2070 PWs) bands (ev): -2.9329 -2.9329 -2.9329 -2.9329 1.0669 1.0669 1.0687 1.0687 5.0384 5.0384 5.0393 5.0393 9.2126 9.2126 9.2129 9.2129 9.6439 9.6439 9.6503 9.6503 10.7045 10.7045 10.7069 10.7069 11.4970 11.4970 11.5253 11.5253 12.0267 12.0267 12.0520 12.0520 12.2847 12.2847 12.2972 12.2972 13.8794 13.8794 13.8893 13.8893 15.4657 15.4657 15.4698 15.4698 16.6914 16.6914 16.7013 16.7013 17.2598 17.2598 17.2698 17.2698 k = 0.0294 0.3649-0.0000 ( 2070 PWs) bands (ev): -2.9384 -2.9384 -2.9384 -2.9384 1.0623 1.0623 1.0637 1.0637 5.0312 5.0312 5.0319 5.0319 9.2324 9.2324 9.2327 9.2327 9.6441 9.6441 9.6488 9.6488 10.7072 10.7072 10.7090 10.7090 11.5325 11.5325 11.5564 11.5564 12.0173 12.0173 12.0392 12.0392 12.2887 12.2887 12.2980 12.2980 13.8961 13.8961 13.9038 13.9038 15.5067 15.5067 15.5095 15.5095 16.6837 16.6837 16.6914 16.6914 17.2213 17.2213 17.2292 17.2292 k = 0.0196 0.3649-0.0000 ( 2076 PWs) bands (ev): -2.9423 -2.9423 -2.9423 -2.9423 1.0591 1.0591 1.0600 1.0600 5.0260 5.0260 5.0265 5.0265 9.2468 9.2468 9.2470 9.2470 9.6442 9.6442 9.6474 9.6474 10.7087 10.7087 10.7099 10.7099 11.5614 11.5614 11.5789 11.5789 12.0106 12.0106 12.0270 12.0270 12.2919 12.2919 12.2981 12.2981 13.9090 13.9090 13.9143 13.9143 15.5376 15.5376 15.5393 15.5393 16.6779 16.6779 16.6831 16.6831 17.1931 17.1931 17.1985 17.1985 k = 0.0098 0.3649-0.0000 ( 2076 PWs) bands (ev): -2.9446 -2.9446 -2.9446 -2.9446 1.0572 1.0572 1.0577 1.0577 5.0230 5.0230 5.0232 5.0232 9.2556 9.2556 9.2557 9.2557 9.6445 9.6445 9.6461 9.6461 10.7096 10.7096 10.7102 10.7102 11.5818 11.5818 11.5912 11.5912 12.0080 12.0080 12.0168 12.0168 12.2945 12.2945 12.2975 12.2975 13.9176 13.9176 13.9202 13.9202 15.5569 15.5569 15.5577 15.5577 16.6746 16.6746 16.6773 16.6773 17.1762 17.1762 17.1790 17.1790 k = 0.0000 0.3649-0.0000 ( 2072 PWs) bands (ev): -2.9454 -2.9454 -2.9454 -2.9454 1.0568 1.0568 1.0568 1.0568 5.0221 5.0221 5.0221 5.0221 9.2586 9.2586 9.2586 9.2586 9.6452 9.6452 9.6452 9.6452 10.7101 10.7101 10.7101 10.7101 11.5921 11.5921 11.5921 11.5921 12.0101 12.0101 12.0101 12.0101 12.2964 12.2964 12.2964 12.2964 13.9214 13.9214 13.9214 13.9214 15.5637 15.5637 15.5637 15.5637 16.6743 16.6743 16.6743 16.6743 17.1715 17.1715 17.1715 17.1715 k = 0.0000 0.3649-0.0000 ( 2072 PWs) bands (ev): -2.9454 -2.9454 -2.9454 -2.9454 1.0568 1.0568 1.0568 1.0568 5.0221 5.0221 5.0221 5.0221 9.2586 9.2586 9.2586 9.2586 9.6452 9.6452 9.6452 9.6452 10.7101 10.7101 10.7101 10.7101 11.5921 11.5921 11.5921 11.5921 12.0101 12.0101 12.0101 12.0101 12.2964 12.2964 12.2964 12.2964 13.9214 13.9214 13.9214 13.9214 15.5637 15.5637 15.5637 15.5637 16.6743 16.6743 16.6743 16.6743 17.1715 17.1715 17.1715 17.1715 k = 0.0000 0.3553-0.0000 ( 2072 PWs) bands (ev): -3.0117 -3.0117 -2.8790 -2.8790 1.0377 1.0377 1.0767 1.0767 4.9990 4.9990 5.0499 5.0499 9.2493 9.2493 9.2694 9.2694 9.6380 9.6380 9.6469 9.6469 10.6123 10.6123 10.8075 10.8075 11.5645 11.5645 11.6191 11.6191 11.9888 11.9888 12.0262 12.0262 12.2887 12.2887 12.3048 12.3048 13.8169 13.8169 14.0272 14.0272 15.4730 15.4730 15.6538 15.6538 16.5847 16.5847 16.7629 16.7629 17.1651 17.1651 17.1812 17.1812 k = 0.0000 0.3457-0.0000 ( 2072 PWs) bands (ev): -3.0777 -3.0777 -2.8127 -2.8127 1.0199 1.0199 1.0973 1.0973 4.9808 4.9808 5.0821 5.0821 9.2416 9.2416 9.2817 9.2817 9.6266 9.6266 9.6407 9.6407 10.5167 10.5167 10.9029 10.9029 11.5363 11.5363 11.6455 11.6455 11.9619 11.9619 12.0373 12.0373 12.2818 12.2818 12.3137 12.3137 13.7141 13.7141 14.1340 14.1340 15.3821 15.3821 15.7430 15.7430 16.4948 16.4948 16.8493 16.8493 17.1615 17.1615 17.1952 17.1952 k = 0.0000 0.3361-0.0000 ( 2076 PWs) bands (ev): -3.1432 -3.1432 -2.7466 -2.7466 1.0038 1.0038 1.1181 1.1181 4.9676 4.9676 5.1187 5.1187 9.2354 9.2354 9.2955 9.2955 9.6121 9.6121 9.6240 9.6240 10.4264 10.4264 10.9952 10.9952 11.5074 11.5074 11.6713 11.6713 11.9292 11.9292 12.0439 12.0439 12.2756 12.2756 12.3229 12.3229 13.6131 13.6131 14.2414 14.2414 15.2916 15.2916 15.8310 15.8310 16.4053 16.4053 16.9321 16.9321 17.1600 17.1600 17.2148 17.2148 k = 0.0000 0.3265-0.0000 ( 2080 PWs) bands (ev): -3.2081 -3.2081 -2.6811 -2.6811 0.9897 0.9897 1.1389 1.1389 4.9598 4.9598 5.1592 5.1592 9.2308 9.2308 9.3107 9.3107 9.5906 9.5906 9.5977 9.5977 10.3451 10.3451 11.0833 11.0833 11.4779 11.4779 11.6965 11.6965 11.8907 11.8907 12.0466 12.0466 12.2701 12.2701 12.3320 12.3320 13.5141 13.5141 14.3483 14.3483 15.2026 15.2026 15.9176 15.9176 16.3165 16.3165 17.0089 17.0089 17.1603 17.1603 17.2420 17.2420 k = 0.0000 0.3169-0.0000 ( 2076 PWs) bands (ev): -3.2721 -3.2721 -2.6163 -2.6163 0.9779 0.9779 1.1593 1.1593 4.9575 4.9575 5.2036 5.2036 9.2279 9.2279 9.3273 9.3273 9.5427 9.5427 9.5784 9.5784 10.2767 10.2767 11.1668 11.1668 11.4477 11.4477 11.7210 11.7210 11.8463 11.8463 12.0458 12.0458 12.2652 12.2652 12.3408 12.3408 13.4172 13.4172 14.4528 14.4528 15.1171 15.1171 16.0026 16.0026 16.2291 16.2291 17.0771 17.0771 17.1620 17.1620 17.2792 17.2792 k = 0.0000 0.3073-0.0000 ( 2074 PWs) bands (ev): -3.3353 -3.3353 -2.5526 -2.5526 0.9689 0.9689 1.1792 1.1792 4.9607 4.9607 5.2515 5.2515 9.2263 9.2263 9.3453 9.3453 9.4739 9.4739 9.5589 9.5589 10.2234 10.2234 11.2453 11.2453 11.4168 11.4168 11.7449 11.7449 11.7962 11.7962 12.0420 12.0420 12.2606 12.2606 12.3490 12.3490 13.3224 13.3224 14.5499 14.5499 15.0401 15.0401 16.0855 16.0855 16.1434 16.1434 17.1339 17.1339 17.1655 17.1655 17.3278 17.3278 k = 0.0000 0.2977-0.0000 ( 2074 PWs) bands (ev): -3.3973 -3.3973 -2.4902 -2.4902 0.9631 0.9631 1.1983 1.1983 4.9697 4.9697 5.3028 5.3028 9.2261 9.2261 9.3643 9.3643 9.3860 9.3860 9.5388 9.5388 10.1853 10.1853 11.3183 11.3183 11.3852 11.3852 11.7400 11.7400 11.7683 11.7683 12.0356 12.0356 12.2561 12.2561 12.3563 12.3563 13.2300 13.2300 14.6261 14.6261 14.9854 14.9854 16.0591 16.0591 16.1672 16.1672 17.1633 17.1633 17.1881 17.1881 17.3861 17.3861 k = 0.0000 0.2881-0.0000 ( 2076 PWs) bands (ev): -3.4582 -3.4582 -2.4293 -2.4293 0.9608 0.9608 1.2163 1.2163 4.9846 4.9846 5.3572 5.3572 9.2257 9.2257 9.2820 9.2820 9.3855 9.3855 9.5180 9.5180 10.1599 10.1599 11.3526 11.3526 11.3859 11.3859 11.6782 11.6782 11.7907 11.7907 12.0268 12.0268 12.2517 12.2517 12.3625 12.3625 13.1401 13.1401 14.6515 14.6515 14.9828 14.9828 15.9775 15.9775 16.2463 16.2463 17.1680 17.1680 17.2302 17.2302 17.4500 17.4500 k = 0.0000 0.2785-0.0000 ( 2066 PWs) bands (ev): -3.5179 -3.5179 -2.3703 -2.3703 0.9623 0.9623 1.2332 1.2332 5.0054 5.0054 5.4144 5.4144 9.1572 9.1572 9.2348 9.2348 9.4075 9.4075 9.4970 9.4970 10.1441 10.1441 11.3195 11.3195 11.4474 11.4474 11.6109 11.6109 11.8123 11.8123 12.0162 12.0162 12.2474 12.2474 12.3678 12.3678 13.0528 13.0528 14.6148 14.6148 15.0436 15.0436 15.8985 15.8985 16.3231 16.3231 17.1710 17.1710 17.2721 17.2721 17.5153 17.5153 k = 0.0000 0.2689-0.0000 ( 2062 PWs) bands (ev): -3.5761 -3.5761 -2.3133 -2.3133 0.9680 0.9680 1.2488 1.2488 5.0321 5.0321 5.4743 5.4743 9.0291 9.0291 9.2384 9.2384 9.4304 9.4304 9.4761 9.4761 10.1349 10.1349 11.2854 11.2854 11.4981 11.4981 11.5434 11.5434 11.8330 11.8330 12.0038 12.0038 12.2428 12.2428 12.3719 12.3719 12.9682 12.9682 14.5452 14.5452 15.1390 15.1390 15.8222 15.8222 16.3976 16.3976 17.1733 17.1733 17.3147 17.3147 17.5794 17.5794 k = 0.0000 0.2593-0.0000 ( 2068 PWs) bands (ev): -3.6329 -3.6329 -2.2587 -2.2587 0.9781 0.9781 1.2630 1.2630 5.0648 5.0648 5.5365 5.5365 8.8922 8.8922 9.2446 9.2446 9.4485 9.4485 9.4610 9.4610 10.1299 10.1299 11.2503 11.2503 11.4520 11.4520 11.5614 11.5614 11.8524 11.8524 11.9900 11.9900 12.2379 12.2379 12.3747 12.3747 12.8864 12.8864 14.4630 14.4630 15.2483 15.2483 15.7490 15.7490 16.4696 16.4696 17.1746 17.1746 17.3590 17.3590 17.6407 17.6407 k = 0.0000 0.2497-0.0000 ( 2068 PWs) bands (ev): -3.6881 -3.6881 -2.2067 -2.2067 0.9931 0.9931 1.2756 1.2756 5.1035 5.1035 5.6009 5.6009 8.7496 8.7496 9.2528 9.2528 9.4316 9.4316 9.4820 9.4820 10.1274 10.1274 11.2141 11.2141 11.3680 11.3680 11.6065 11.6065 11.8698 11.8698 11.9758 11.9758 12.2330 12.2330 12.3764 12.3764 12.8077 12.8077 14.3759 14.3759 15.3639 15.3639 15.6792 15.6792 16.5390 16.5390 17.1747 17.1747 17.4056 17.4056 17.6982 17.6982 k = 0.0000 0.2401-0.0000 ( 2072 PWs) bands (ev): -3.7418 -3.7418 -2.1575 -2.1575 1.0130 1.0130 1.2868 1.2868 5.1481 5.1481 5.6671 5.6671 8.6027 8.6027 9.2626 9.2626 9.4107 9.4107 9.5082 9.5082 10.1261 10.1261 11.1765 11.1765 11.2775 11.2775 11.6480 11.6480 11.8834 11.8834 11.9629 11.9629 12.2279 12.2279 12.3769 12.3769 12.7322 12.7322 14.2868 14.2868 15.4827 15.4827 15.6131 15.6131 16.6057 16.6057 17.1733 17.1733 17.4545 17.4545 17.7516 17.7516 k = 0.0000 0.2305-0.0000 ( 2076 PWs) bands (ev): -3.7937 -3.7937 -2.1112 -2.1112 1.0380 1.0380 1.2965 1.2965 5.1986 5.1986 5.7349 5.7349 8.4530 8.4530 9.2741 9.2741 9.3899 9.3899 9.5356 9.5356 10.1252 10.1252 11.1361 11.1361 11.1830 11.1830 11.6852 11.6852 11.8893 11.8893 11.9555 11.9555 12.2226 12.2226 12.3763 12.3763 12.6602 12.6602 14.1971 14.1971 15.5473 15.5473 15.6071 15.6071 16.6697 16.6697 17.1701 17.1701 17.5054 17.5054 17.8010 17.8010 k = 0.0000 0.2209-0.0000 ( 2076 PWs) bands (ev): -3.8440 -3.8440 -2.0681 -2.0681 1.0684 1.0684 1.3046 1.3046 5.2547 5.2547 5.8039 5.8039 8.3014 8.3014 9.2872 9.2872 9.3693 9.3693 9.5640 9.5640 10.1241 10.1241 11.0703 11.0703 11.1075 11.1075 11.7180 11.7180 11.8829 11.8829 11.9582 11.9582 12.2173 12.2173 12.3745 12.3745 12.5920 12.5920 14.1076 14.1076 15.4895 15.4895 15.7287 15.7287 16.7308 16.7308 17.1649 17.1649 17.5579 17.5579 17.8467 17.8467 k = 0.0000 0.2113-0.0000 ( 2072 PWs) bands (ev): -3.8924 -3.8924 -2.0282 -2.0282 1.1040 1.1040 1.3114 1.3114 5.3165 5.3165 5.8737 5.8737 8.1488 8.1488 9.3020 9.3020 9.3491 9.3491 9.5933 9.5933 10.1223 10.1223 10.9669 10.9669 11.0635 11.0635 11.7465 11.7465 11.8671 11.8671 11.9685 11.9685 12.2118 12.2118 12.3709 12.3709 12.5285 12.5285 14.0188 14.0188 15.4343 15.4343 15.8526 15.8526 16.7891 16.7891 17.1576 17.1576 17.6111 17.6111 17.8895 17.8895 k = 0.0000 0.2017-0.0000 ( 2072 PWs) bands (ev): -3.9389 -3.9389 -1.9915 -1.9915 1.1450 1.1450 1.3168 1.3168 5.3837 5.3837 5.9438 5.9438 7.9961 7.9961 9.3183 9.3183 9.3294 9.3294 9.6233 9.6233 10.1192 10.1192 10.8555 10.8555 11.0215 11.0215 11.7698 11.7698 11.8475 11.8475 11.9817 11.9817 12.2063 12.2063 12.3638 12.3638 12.4716 12.4716 13.9309 13.9309 15.3827 15.3827 15.9772 15.9772 16.8445 16.8445 17.1479 17.1479 17.6640 17.6640 17.9305 17.9305 k = 0.0000 0.1921-0.0000 ( 2069 PWs) bands (ev): -3.9836 -3.9836 -1.9581 -1.9581 1.1912 1.1912 1.3209 1.3209 5.4561 5.4561 6.0138 6.0138 7.8443 7.8443 9.3102 9.3102 9.3363 9.3363 9.6538 9.6538 10.1146 10.1146 10.7393 10.7393 10.9788 10.9788 11.7836 11.7836 11.8313 11.8313 11.9957 11.9957 12.2006 12.2006 12.3483 12.3483 12.4268 12.4268 13.8442 13.8442 15.3351 15.3351 16.1021 16.1021 16.8970 16.8970 17.1358 17.1358 17.7151 17.7151 17.9712 17.9712 k = 0.0000 0.1825-0.0000 ( 2065 PWs) bands (ev): -4.0263 -4.0263 -1.9279 -1.9279 1.2423 1.2423 1.3239 1.3239 5.5335 5.5335 6.0828 6.0828 7.6942 7.6942 9.2917 9.2917 9.3558 9.3558 9.6848 9.6848 10.1084 10.1084 10.6189 10.6189 10.9353 10.9353 11.7757 11.7757 11.8317 11.8317 12.0097 12.0097 12.1942 12.1942 12.3176 12.3176 12.4013 12.4013 13.7591 13.7591 15.2913 15.2913 16.2271 16.2271 16.9465 16.9465 17.1215 17.1215 17.7627 17.7627 18.0133 18.0133 k = 0.0000 0.1729-0.0000 ( 2069 PWs) bands (ev): -4.0670 -4.0670 -1.9009 -1.9009 1.2977 1.2977 1.3262 1.3262 5.6158 5.6158 6.1498 6.1498 7.5473 7.5473 9.2737 9.2737 9.3769 9.3769 9.7161 9.7161 10.1001 10.1001 10.4948 10.4948 10.8906 10.8906 11.7521 11.7521 11.8436 11.8436 12.0231 12.0231 12.1863 12.1863 12.2780 12.2780 12.3902 12.3902 13.6757 13.6757 15.2512 15.2512 16.3518 16.3518 16.9931 16.9931 17.1048 17.1048 17.8054 17.8054 18.0583 18.0583 k = 0.0000 0.1633-0.0000 ( 2067 PWs) bands (ev): -4.1057 -4.1057 -1.8769 -1.8769 1.3256 1.3256 1.3597 1.3597 5.7027 5.7027 6.2133 6.2133 7.4053 7.4053 9.2564 9.2564 9.3995 9.3995 9.7476 9.7476 10.0897 10.0897 10.3676 10.3676 10.8451 10.8451 11.7240 11.7240 11.8569 11.8569 12.0358 12.0358 12.1738 12.1738 12.2414 12.2414 12.3844 12.3844 13.5942 13.5942 15.2149 15.2149 16.4759 16.4759 17.0367 17.0367 17.0863 17.0863 17.8419 17.8419 18.1074 18.1074 k = 0.0000 0.1537-0.0000 ( 2067 PWs) bands (ev): -4.1423 -4.1423 -1.8557 -1.8557 1.3261 1.3261 1.4238 1.4238 5.7939 5.7939 6.2707 6.2707 7.2708 7.2708 9.2398 9.2398 9.4236 9.4236 9.7792 9.7792 10.0768 10.0768 10.2380 10.2380 10.7987 10.7987 11.6940 11.6940 11.8688 11.8688 12.0476 12.0476 12.1512 12.1512 12.2169 12.2169 12.3810 12.3810 13.5150 13.5150 15.1822 15.1822 16.5990 16.5990 17.0639 17.0639 17.0795 17.0795 17.8722 17.8722 18.1606 18.1606 k = 0.0000 0.1441-0.0000 ( 2067 PWs) bands (ev): -4.1769 -4.1769 -1.8372 -1.8372 1.3255 1.3255 1.4918 1.4918 5.8892 5.8892 6.3177 6.3177 7.1483 7.1483 9.2238 9.2238 9.4493 9.4493 9.8106 9.8106 10.0582 10.0582 10.1098 10.1098 10.7514 10.7514 11.6634 11.6634 11.8792 11.8792 12.0585 12.0585 12.1193 12.1193 12.2051 12.2051 12.3786 12.3786 13.4382 13.4382 15.1529 15.1529 16.7207 16.7207 17.0429 17.0429 17.1165 17.1165 17.8968 17.8968 18.2170 18.2170 k = 0.0000 0.1345-0.0000 ( 2071 PWs) bands (ev): -4.2093 -4.2093 -1.8211 -1.8211 1.3243 1.3243 1.5629 1.5629 5.9882 5.9882 6.3476 6.3476 7.0449 7.0449 9.2084 9.2084 9.4764 9.4764 9.8411 9.8411 9.9664 9.9664 10.0514 10.0514 10.7034 10.7034 11.6326 11.6326 11.8883 11.8883 12.0673 12.0673 12.0854 12.0854 12.1996 12.1996 12.3770 12.3770 13.3640 13.3640 15.1269 15.1269 16.8405 16.8405 17.0198 17.0198 17.1518 17.1518 17.9166 17.9166 18.2757 18.2757 k = 0.0000 0.1248-0.0000 ( 2077 PWs) bands (ev): -4.2397 -4.2397 -1.8073 -1.8073 1.3226 1.3226 1.6363 1.6363 6.0908 6.0908 6.3503 6.3503 6.9707 6.9707 9.1937 9.1937 9.5048 9.5048 9.8286 9.8286 9.8756 9.8756 10.0312 10.0312 10.6547 10.6547 11.6021 11.6021 11.8958 11.8958 12.0493 12.0493 12.0782 12.0782 12.1973 12.1973 12.3759 12.3759 13.2927 13.2927 15.1039 15.1039 16.9577 16.9577 16.9959 16.9959 17.1847 17.1847 17.9327 17.9327 18.3352 18.3352 k = 0.0000 0.1152-0.0000 ( 2079 PWs) bands (ev): -4.2678 -4.2678 -1.7956 -1.7956 1.3206 1.3206 1.7115 1.7115 6.1964 6.1964 6.3181 6.3181 6.9337 6.9337 9.1792 9.1792 9.5342 9.5342 9.6957 9.6957 9.9031 9.9031 10.0108 10.0108 10.6055 10.6055 11.5724 11.5724 11.9020 11.9020 12.0180 12.0180 12.0853 12.0853 12.1969 12.1969 12.3753 12.3753 13.2245 13.2245 15.0837 15.0837 16.9716 16.9716 17.0716 17.0716 17.2154 17.2154 17.9458 17.9458 18.3945 18.3945 k = 0.0000 0.1056-0.0000 ( 2081 PWs) bands (ev): -4.2938 -4.2938 -1.7856 -1.7856 1.3183 1.3183 1.7874 1.7874 6.2532 6.2532 6.3048 6.3048 6.9318 6.9318 9.1647 9.1647 9.5475 9.5475 9.5783 9.5783 9.9317 9.9317 9.9892 9.9892 10.5560 10.5560 11.5438 11.5438 11.9072 11.9072 11.9888 11.9888 12.0915 12.0915 12.1981 12.1981 12.3749 12.3749 13.1598 13.1598 15.0663 15.0663 16.9475 16.9475 17.1795 17.1795 17.2457 17.2457 17.9566 17.9566 18.4525 18.4525 k = 0.0000 0.0960-0.0000 ( 2085 PWs) bands (ev): -4.3175 -4.3175 -1.7773 -1.7773 1.3159 1.3159 1.8633 1.8633 6.1672 6.1672 6.4155 6.4155 6.9540 6.9540 9.1485 9.1485 9.4242 9.4242 9.6010 9.6010 9.9586 9.9586 9.9674 9.9674 10.5062 10.5062 11.5167 11.5167 11.9113 11.9113 11.9623 11.9623 12.0965 12.0965 12.2006 12.2006 12.3748 12.3748 13.0988 13.0988 15.0513 15.0513 16.9239 16.9239 17.2554 17.2554 17.3012 17.3012 17.9655 17.9655 18.5084 18.5084 k = 0.0000 0.0864-0.0000 ( 2089 PWs) bands (ev): -4.3391 -4.3391 -1.7704 -1.7704 1.3134 1.3134 1.9382 1.9382 6.0714 6.0714 6.5278 6.5278 6.9892 6.9892 9.1255 9.1255 9.2998 9.2998 9.6344 9.6344 9.9431 9.9431 9.9859 9.9859 10.4564 10.4564 11.4914 11.4914 11.9138 11.9138 11.9392 11.9392 12.1004 12.1004 12.2042 12.2042 12.3750 12.3750 13.0418 13.0418 15.0385 15.0385 16.9012 16.9012 17.2837 17.2837 17.3966 17.3966 17.9730 17.9730 18.5615 18.5615 k = 0.0000 0.0768-0.0000 ( 2091 PWs) bands (ev): -4.3584 -4.3584 -1.7648 -1.7648 1.3109 1.3109 2.0107 2.0107 5.9735 5.9735 6.6412 6.6412 7.0301 7.0301 9.0742 9.0742 9.2057 9.2057 9.6694 9.6694 9.9199 9.9199 10.0102 10.0102 10.4067 10.4067 11.4683 11.4683 11.9102 11.9102 11.9242 11.9242 12.1034 12.1034 12.2085 12.2085 12.3755 12.3755 12.9891 12.9891 15.0277 15.0277 16.8798 16.8798 17.3045 17.3045 17.4908 17.4908 17.9791 17.9791 18.6110 18.6110 k = 0.0000 0.0672-0.0000 ( 2089 PWs) bands (ev): -4.3755 -4.3755 -1.7602 -1.7602 1.3086 1.3086 2.0798 2.0798 5.8786 5.8786 6.7547 6.7547 7.0722 7.0722 8.9735 8.9735 9.1644 9.1644 9.7055 9.7055 9.8974 9.8974 10.0325 10.0325 10.3574 10.3574 11.4475 11.4475 11.8953 11.8953 11.9226 11.9226 12.1057 12.1057 12.2134 12.2134 12.3761 12.3761 12.9411 12.9411 15.0188 15.0188 16.8601 16.8601 17.3222 17.3222 17.5786 17.5786 17.9843 17.9843 18.6562 18.6562 k = 0.0000 0.0576-0.0000 ( 2089 PWs) bands (ev): -4.3903 -4.3903 -1.7565 -1.7565 1.3064 1.3064 2.1441 2.1441 5.7900 5.7900 6.8669 6.8669 7.1128 7.1128 8.8536 8.8536 9.1470 9.1470 9.7423 9.7423 9.8763 9.8763 10.0525 10.0525 10.3084 10.3084 11.4291 11.4291 11.8800 11.8800 11.9237 11.9237 12.1073 12.1073 12.2186 12.2186 12.3768 12.3768 12.8983 12.8983 15.0114 15.0114 16.8423 16.8423 17.3372 17.3372 17.6582 17.6582 17.9885 17.9885 18.6967 18.6967 k = 0.0000 0.0480-0.0000 ( 2093 PWs) bands (ev): -4.4029 -4.4029 -1.7536 -1.7536 1.3045 1.3045 2.2021 2.2021 5.7104 5.7104 6.9759 6.9759 7.1501 7.1501 8.7331 8.7331 9.1367 9.1367 9.7787 9.7787 9.8583 9.8583 10.0699 10.0699 10.2604 10.2604 11.4134 11.4134 11.8667 11.8667 11.9249 11.9249 12.1083 12.1083 12.2236 12.2236 12.3774 12.3774 12.8609 12.8609 15.0055 15.0055 16.8269 16.8269 17.3498 17.3498 17.7284 17.7284 17.9920 17.9920 18.7319 18.7319 k = 0.0000 0.0384-0.0000 ( 2093 PWs) bands (ev): -4.4132 -4.4132 -1.7514 -1.7514 1.3028 1.3028 2.2522 2.2522 5.6420 5.6420 7.0785 7.0785 7.1832 7.1832 8.6189 8.6189 9.1296 9.1296 9.8091 9.8091 9.8494 9.8494 10.0842 10.0842 10.2137 10.2137 11.4004 11.4004 11.8558 11.8558 11.9259 11.9259 12.1091 12.1091 12.2284 12.2284 12.3781 12.3781 12.8295 12.8295 15.0009 15.0009 16.8139 16.8139 17.3600 17.3600 17.7879 17.7879 17.9948 17.9948 18.7613 18.7613 k = 0.0000 0.0288-0.0000 ( 2091 PWs) bands (ev): -4.4212 -4.4212 -1.7497 -1.7497 1.3015 1.3015 2.2932 2.2932 5.5866 5.5866 7.1674 7.1674 7.2141 7.2141 8.5165 8.5165 9.1246 9.1246 9.8137 9.8137 9.8693 9.8693 10.0949 10.0949 10.1695 10.1695 11.3902 11.3902 11.8474 11.8474 11.9266 11.9266 12.1097 12.1097 12.2325 12.2325 12.3787 12.3787 12.8045 12.8045 14.9974 14.9974 16.8036 16.8036 17.3679 17.3679 17.8355 17.8355 17.9970 17.9970 18.7846 18.7846 k = 0.0000 0.0192-0.0000 ( 2091 PWs) bands (ev): -4.4269 -4.4269 -1.7486 -1.7486 1.3005 1.3005 2.3235 2.3235 5.5457 5.5457 7.2166 7.2166 7.2615 7.2615 8.4327 8.4327 9.1211 9.1211 9.8065 9.8065 9.9031 9.9031 10.0993 10.0993 10.1320 10.1320 11.3829 11.3829 11.8414 11.8414 11.9271 11.9271 12.1099 12.1099 12.2356 12.2356 12.3791 12.3791 12.7862 12.7862 14.9950 14.9950 16.7961 16.7961 17.3735 17.3735 17.8703 17.8703 17.9986 17.9986 18.8014 18.8014 k = 0.0000 0.0096-0.0000 ( 2087 PWs) bands (ev): -4.4303 -4.4303 -1.7480 -1.7480 1.2999 1.2999 2.3422 2.3422 5.5207 5.5207 7.2324 7.2324 7.3098 7.3098 8.3763 8.3763 9.1191 9.1191 9.8008 9.8008 9.9337 9.9337 10.0840 10.0840 10.1181 10.1181 11.3785 11.3785 11.8378 11.8378 11.9275 11.9275 12.1101 12.1101 12.2376 12.2376 12.3796 12.3796 12.7751 12.7751 14.9936 14.9936 16.7916 16.7916 17.3769 17.3769 17.8914 17.8914 17.9996 17.9996 18.8117 18.8117 k = 0.0000 0.0000 0.0000 ( 2087 PWs) bands (ev): -4.4315 -4.4315 -1.7478 -1.7478 1.2997 1.2997 2.3485 2.3485 5.5122 5.5122 7.2370 7.2370 7.3279 7.3279 8.3562 8.3562 9.1185 9.1185 9.7988 9.7988 9.9477 9.9477 10.0710 10.0710 10.1177 10.1177 11.3770 11.3770 11.8366 11.8366 11.9276 11.9276 12.1102 12.1102 12.2383 12.2383 12.3797 12.3797 12.7714 12.7714 14.9931 14.9931 16.7900 16.7900 17.3780 17.3780 17.8985 17.8985 18.0000 18.0000 18.8151 18.8151 k = 0.0000 0.0000 0.0000 ( 2087 PWs) bands (ev): -4.4315 -4.4315 -1.7478 -1.7478 1.2997 1.2997 2.3485 2.3485 5.5122 5.5122 7.2370 7.2370 7.3279 7.3279 8.3562 8.3562 9.1185 9.1185 9.7988 9.7988 9.9477 9.9477 10.0710 10.0710 10.1177 10.1177 11.3770 11.3770 11.8366 11.8366 11.9276 11.9276 12.1102 12.1102 12.2383 12.2383 12.3797 12.3797 12.7714 12.7714 14.9931 14.9931 16.7900 16.7900 17.3780 17.3780 17.8985 17.8985 18.0000 18.0000 18.8151 18.8151 k = 0.0000 0.0000 0.0097 ( 2088 PWs) bands (ev): -4.4303 -4.4303 -1.7509 -1.7509 1.3019 1.3019 2.3487 2.3487 5.5122 5.5122 7.2379 7.2379 7.3237 7.3237 8.3585 8.3585 9.1084 9.1084 9.8131 9.8131 9.9473 9.9473 10.0709 10.0709 10.1189 10.1189 11.3788 11.3788 11.8337 11.8337 11.9273 11.9273 12.1101 12.1101 12.2390 12.2390 12.3792 12.3792 12.7736 12.7736 14.9927 14.9927 16.7875 16.7875 17.3770 17.3770 17.8978 17.8978 17.9885 17.9885 18.7939 18.7939 k = 0.0000 0.0000 0.0195 ( 2084 PWs) bands (ev): -4.4268 -4.4268 -1.7601 -1.7601 1.3084 1.3084 2.3492 2.3492 5.5120 5.5120 7.2402 7.2402 7.3113 7.3113 8.3655 8.3655 9.0808 9.0808 9.8526 9.8526 9.9467 9.9467 10.0705 10.0705 10.1225 10.1225 11.3840 11.3840 11.8253 11.8253 11.9267 11.9267 12.1097 12.1097 12.2410 12.2410 12.3776 12.3776 12.7801 12.7801 14.9915 14.9915 16.7797 16.7797 17.3741 17.3741 17.8952 17.8952 17.9553 17.9553 18.7502 18.7502 k = 0.0000 0.0000 0.0292 ( 2086 PWs) bands (ev): -4.4210 -4.4210 -1.7753 -1.7753 1.3190 1.3190 2.3501 2.3501 5.5117 5.5117 7.2426 7.2426 7.2922 7.2922 8.3771 8.3771 9.0414 9.0414 9.9057 9.9057 9.9518 9.9518 10.0697 10.0697 10.1285 10.1285 11.3927 11.3927 11.8116 11.8116 11.9255 11.9255 12.1089 12.1089 12.2446 12.2446 12.3751 12.3751 12.7907 12.7907 14.9893 14.9893 16.7667 16.7667 17.3694 17.3694 17.8863 17.8863 17.9073 17.9073 18.6999 18.6999 k = 0.0000 0.0000 0.0390 ( 2078 PWs) bands (ev): -4.4129 -4.4129 -1.7964 -1.7964 1.3337 1.3337 2.3514 2.3514 5.5111 5.5111 7.2372 7.2372 7.2749 7.2749 8.3931 8.3931 8.9960 8.9960 9.9276 9.9276 10.0012 10.0012 10.0684 10.0684 10.1369 10.1369 11.4048 11.4048 11.7931 11.7931 11.9240 11.9240 12.1077 12.1077 12.2497 12.2497 12.3717 12.3717 12.8047 12.8047 14.9864 14.9864 16.7485 16.7485 17.3630 17.3630 17.8277 17.8277 17.8910 17.8910 18.6475 18.6475 k = 0.0000 0.0000 0.0487 ( 2080 PWs) bands (ev): -4.4024 -4.4024 -1.8230 -1.8230 1.3522 1.3522 2.3529 2.3529 5.5100 5.5100 7.2086 7.2086 7.2754 7.2754 8.4135 8.4135 8.9486 8.9486 9.9263 9.9263 10.0657 10.0657 10.0827 10.0827 10.1482 10.1482 11.4200 11.4200 11.7703 11.7703 11.9220 11.9220 12.1059 12.1059 12.2565 12.2565 12.3674 12.3674 12.8216 12.8216 14.9828 14.9828 16.7249 16.7249 17.3549 17.3549 17.7452 17.7452 17.8843 17.8843 18.5939 18.5939 k = 0.0000 0.0000 0.0584 ( 2082 PWs) bands (ev): -4.3897 -4.3897 -1.8549 -1.8549 1.3743 1.3743 2.3548 2.3548 5.5085 5.5085 7.1650 7.1650 7.2862 7.2862 8.4380 8.4380 8.9019 8.9019 9.9220 9.9220 10.0635 10.0635 10.1510 10.1510 10.1819 10.1819 11.4384 11.4384 11.7438 11.7438 11.9196 11.9196 12.1034 12.1034 12.2651 12.2651 12.3622 12.3622 12.8407 12.8407 14.9785 14.9785 16.6956 16.6956 17.3455 17.3455 17.6529 17.6529 17.8771 17.8771 18.5397 18.5397 k = 0.0000 0.0000 0.0682 ( 2078 PWs) bands (ev): -4.3746 -4.3746 -1.8918 -1.8918 1.3996 1.3996 2.3568 2.3568 5.5064 5.5064 7.1128 7.1128 7.3020 7.3020 8.4665 8.4665 8.8574 8.8574 9.9169 9.9169 10.0603 10.0603 10.1691 10.1691 10.2722 10.2722 11.4596 11.4596 11.7144 11.7144 11.9168 11.9168 12.1001 12.1001 12.2751 12.2751 12.3568 12.3568 12.8614 12.8614 14.9737 14.9737 16.6604 16.6604 17.3349 17.3349 17.5551 17.5551 17.8687 17.8687 18.4851 18.4851 k = 0.0000 0.0000 0.0779 ( 2080 PWs) bands (ev): -4.3573 -4.3573 -1.9332 -1.9332 1.4279 1.4279 2.3591 2.3591 5.5035 5.5035 7.0540 7.0540 7.3216 7.3216 8.4989 8.4989 8.8157 8.8157 9.9116 9.9116 10.0564 10.0564 10.1844 10.1844 10.3684 10.3684 11.4832 11.4832 11.6827 11.6827 11.9138 11.9138 12.0960 12.0960 12.2864 12.2864 12.3515 12.3515 12.8830 12.8830 14.9683 14.9683 16.6189 16.6189 17.3230 17.3230 17.4554 17.4554 17.8591 17.8591 18.4300 18.4300 k = 0.0000 0.0000 0.0877 ( 2086 PWs) bands (ev): -4.3377 -4.3377 -1.9788 -1.9788 1.4588 1.4588 2.3615 2.3615 5.4999 5.4999 6.9896 6.9896 7.3448 7.3448 8.5349 8.5349 8.7773 8.7773 9.9063 9.9063 10.0520 10.0520 10.2003 10.2003 10.4651 10.4651 11.5082 11.5082 11.6500 11.6500 11.9106 11.9106 12.0913 12.0913 12.2974 12.2974 12.3473 12.3473 12.9050 12.9050 14.9626 14.9626 16.5707 16.5707 17.3079 17.3079 17.3592 17.3592 17.8482 17.8482 18.3745 18.3745 k = 0.0000 0.0000 0.0974 ( 2086 PWs) bands (ev): -4.3158 -4.3158 -2.0281 -2.0281 1.4920 1.4920 2.3639 2.3639 5.4954 5.4954 6.9207 6.9207 7.3717 7.3717 8.5746 8.5746 8.7422 8.7422 9.9012 9.9012 10.0471 10.0471 10.2174 10.2174 10.5602 10.5602 11.5317 11.5317 11.6196 11.6196 11.9075 11.9075 12.0859 12.0859 12.3051 12.3051 12.3479 12.3479 12.9268 12.9268 14.9568 14.9568 16.5153 16.5153 17.2530 17.2530 17.3064 17.3064 17.8362 17.8362 18.3185 18.3185 k = 0.0000 0.0000 0.1071 ( 2082 PWs) bands (ev): -4.2917 -4.2917 -2.0809 -2.0809 1.5271 1.5271 2.3664 2.3664 5.4902 5.4902 6.8481 6.8481 7.4023 7.4023 8.6178 8.6178 8.7100 8.7100 9.8963 9.8963 10.0418 10.0418 10.2353 10.2353 10.6520 10.6520 11.5396 11.5396 11.6057 11.6057 11.9049 11.9049 12.0802 12.0802 12.3057 12.3057 12.3570 12.3570 12.9480 12.9480 14.9508 14.9508 16.4525 16.4525 17.1661 17.1661 17.2916 17.2916 17.8229 17.8229 18.2619 18.2619 k = 0.0000 0.0000 0.1169 ( 2082 PWs) bands (ev): -4.2654 -4.2654 -2.1367 -2.1367 1.5640 1.5640 2.3687 2.3687 5.4842 5.4842 6.7728 6.7728 7.4362 7.4362 8.6644 8.6644 8.6808 8.6808 9.8918 9.8918 10.0361 10.0361 10.2544 10.2544 10.7388 10.7388 11.5164 11.5164 11.6236 11.6236 11.9030 11.9030 12.0741 12.0741 12.3004 12.3004 12.3731 12.3731 12.9681 12.9681 14.9450 14.9450 16.3823 16.3823 17.0847 17.0847 17.2796 17.2796 17.8085 17.8085 18.2047 18.2047 k = 0.0000 0.0000 0.1266 ( 2078 PWs) bands (ev): -4.2368 -4.2368 -2.1951 -2.1951 1.6022 1.6022 2.3708 2.3708 5.4777 5.4777 6.6954 6.6954 7.4734 7.4734 8.6536 8.6536 8.7147 8.7147 9.8878 9.8878 10.0300 10.0300 10.2743 10.2743 10.8187 10.8187 11.4809 11.4809 11.6547 11.6547 11.9026 11.9026 12.0679 12.0679 12.2925 12.2925 12.3932 12.3932 12.9868 12.9868 14.9395 14.9395 16.3056 16.3056 17.0116 17.0116 17.2688 17.2688 17.7929 17.7929 18.1467 18.1467 k = 0.0000 0.0000 0.1364 ( 2082 PWs) bands (ev): -4.2061 -4.2061 -2.2559 -2.2559 1.6414 1.6414 2.3727 2.3727 5.4707 5.4707 6.6168 6.6168 7.5135 7.5135 8.6284 8.6284 8.7683 8.7683 9.8842 9.8842 10.0236 10.0236 10.2952 10.2952 10.8895 10.8895 11.4420 11.4420 11.6897 11.6897 11.9045 11.9045 12.0617 12.0617 12.2835 12.2835 12.4157 12.4157 13.0038 13.0038 14.9344 14.9344 16.2235 16.2235 16.9475 16.9475 17.2590 17.2590 17.7761 17.7761 18.0878 18.0878 k = 0.0000 0.0000 0.1461 ( 2082 PWs) bands (ev): -4.1732 -4.1732 -2.3185 -2.3185 1.6814 1.6814 2.3742 2.3742 5.4635 5.4635 6.5377 6.5377 7.5561 7.5561 8.6051 8.6051 8.8256 8.8256 9.8810 9.8810 10.0169 10.0169 10.3168 10.3168 10.9492 10.9492 11.4017 11.4017 11.7266 11.7266 11.9098 11.9098 12.0559 12.0559 12.2742 12.2742 12.4402 12.4402 13.0187 13.0187 14.9299 14.9299 16.1379 16.1379 16.8922 16.8922 17.2507 17.2507 17.7583 17.7583 18.0280 18.0280 k = 0.0000 0.0000 0.1558 ( 2084 PWs) bands (ev): -4.1382 -4.1382 -2.3829 -2.3829 1.7219 1.7219 2.3751 2.3751 5.4563 5.4563 6.4587 6.4587 7.6008 7.6008 8.5830 8.5830 8.8865 8.8865 9.8784 9.8784 10.0099 10.0099 10.3393 10.3393 10.9955 10.9955 11.3608 11.3608 11.7642 11.7642 11.9195 11.9195 12.0508 12.0508 12.2649 12.2649 12.4661 12.4661 13.0314 13.0314 14.9263 14.9263 16.0504 16.0504 16.8452 16.8452 17.2438 17.2438 17.7393 17.7393 17.9671 17.9671 k = 0.0000 0.0000 0.1656 ( 2080 PWs) bands (ev): -4.1011 -4.1011 -2.4485 -2.4485 1.7626 1.7626 2.3755 2.3755 5.4495 5.4495 6.3803 6.3803 7.6471 7.6471 8.5619 8.5619 8.9512 8.9512 9.8763 9.8763 10.0028 10.0028 10.3628 10.3628 11.0266 11.0266 11.3196 11.3196 11.8019 11.8019 11.9344 11.9344 12.0464 12.0464 12.2563 12.2563 12.4934 12.4934 13.0417 13.0417 14.9238 14.9238 15.9629 15.9629 16.8060 16.8060 17.2388 17.2388 17.7194 17.7194 17.9052 17.9052 k = 0.0000 0.0000 0.1753 ( 2084 PWs) bands (ev): -4.0620 -4.0620 -2.5153 -2.5153 1.8034 1.8034 2.3751 2.3751 5.4433 5.4433 6.3031 6.3031 7.6945 7.6945 8.5415 8.5415 9.0197 9.0197 9.8748 9.8748 9.9954 9.9954 10.3869 10.3869 11.0416 11.0416 11.2782 11.2782 11.8385 11.8385 11.9547 11.9547 12.0432 12.0432 12.2487 12.2487 12.5216 12.5216 13.0493 13.0493 14.9224 14.9224 15.8768 15.8768 16.7742 16.7742 17.2356 17.2356 17.6985 17.6985 17.8422 17.8422 k = 0.0000 0.0000 0.1851 ( 2090 PWs) bands (ev): -4.0208 -4.0208 -2.5829 -2.5829 1.8439 1.8439 2.3737 2.3737 5.4381 5.4381 6.2276 6.2276 7.7424 7.7424 8.5213 8.5213 9.0921 9.0921 9.8738 9.8738 9.9879 9.9879 10.4119 10.4119 11.0401 11.0401 11.2369 11.2369 11.8729 11.8729 11.9801 11.9801 12.0413 12.0413 12.2426 12.2426 12.5508 12.5508 13.0541 13.0541 14.9226 14.9226 15.7932 15.7932 16.7496 16.7496 17.2345 17.2345 17.6767 17.6767 17.7781 17.7781 k = 0.0000 0.0000 0.1948 ( 2086 PWs) bands (ev): -3.9776 -3.9776 -2.6510 -2.6510 1.8839 1.8839 2.3714 2.3714 5.4342 5.4342 6.1542 6.1542 7.7905 7.7905 8.5014 8.5014 9.1684 9.1684 9.8734 9.8734 9.9803 9.9803 10.4377 10.4377 11.0231 11.0231 11.1958 11.1958 11.9038 11.9038 12.0087 12.0087 12.0422 12.0422 12.2388 12.2388 12.5807 12.5807 13.0563 13.0563 14.9245 14.9245 15.7130 15.7130 16.7321 16.7321 17.2355 17.2355 17.6540 17.6540 17.7129 17.7129 k = 0.0000 0.0000 0.2045 ( 2088 PWs) bands (ev): -3.9324 -3.9324 -2.7195 -2.7195 1.9233 1.9233 2.3679 2.3679 5.4320 5.4320 6.0832 6.0832 7.8382 7.8382 8.4814 8.4814 9.2485 9.2485 9.8735 9.8735 9.9727 9.9727 10.4644 10.4644 10.9916 10.9916 11.1549 11.1549 11.9298 11.9298 12.0310 12.0310 12.0533 12.0533 12.2378 12.2378 12.6113 12.6113 13.0555 13.0555 14.9283 14.9283 15.6368 15.6368 16.7216 16.7216 17.2387 17.2387 17.6305 17.6305 17.6470 17.6470 k = 0.0000 0.0000 0.2143 ( 2084 PWs) bands (ev): -3.8854 -3.8854 -2.7881 -2.7881 1.9618 1.9618 2.3631 2.3631 5.4317 5.4317 6.0150 6.0150 7.8852 7.8852 8.4612 8.4612 9.3325 9.3325 9.8742 9.8742 9.9652 9.9652 10.4918 10.4918 10.9475 10.9475 11.1144 11.1144 11.9504 11.9504 12.0372 12.0372 12.0831 12.0831 12.2402 12.2402 12.6422 12.6422 13.0521 13.0521 14.9342 14.9342 15.5650 15.5650 16.7182 16.7182 17.2442 17.2442 17.5797 17.5797 17.6070 17.6070 k = 0.0000 0.0000 0.2240 ( 2084 PWs) bands (ev): -3.8365 -3.8365 -2.8567 -2.8567 1.9993 1.9993 2.3569 2.3569 5.4337 5.4337 5.9499 5.9499 7.9311 7.9311 8.4404 8.4404 9.4200 9.4200 9.8755 9.8755 9.9577 9.9577 10.5200 10.5200 10.8921 10.8921 11.0744 11.0744 11.9656 11.9656 12.0399 12.0399 12.1165 12.1165 12.2461 12.2461 12.6732 12.6732 13.0457 13.0457 14.9424 14.9424 15.4977 15.4977 16.7220 16.7220 17.2517 17.2517 17.5124 17.5124 17.5825 17.5825 k = 0.0000 0.0000 0.2338 ( 2084 PWs) bands (ev): -3.7858 -3.7858 -2.9251 -2.9251 2.0354 2.0354 2.3490 2.3490 5.4383 5.4383 5.8881 5.8881 7.9756 7.9756 8.4190 8.4190 9.5108 9.5108 9.8774 9.8774 9.9503 9.9503 10.5490 10.5490 10.8272 10.8272 11.0349 11.0349 11.9766 11.9766 12.0412 12.0412 12.1491 12.1491 12.2548 12.2548 12.7043 12.7043 13.0367 13.0367 14.9531 14.9531 15.4348 15.4348 16.7330 16.7330 17.2611 17.2611 17.4450 17.4450 17.5577 17.5577 k = 0.0000 0.0000 0.2435 ( 2082 PWs) bands (ev): -3.7333 -3.7333 -2.9931 -2.9931 2.0702 2.0702 2.3395 2.3395 5.4458 5.4458 5.8300 5.8300 8.0185 8.0185 8.3967 8.3967 9.6046 9.6046 9.8797 9.8797 9.9431 9.9431 10.5785 10.5785 10.7542 10.7542 10.9959 10.9959 11.9847 11.9847 12.0410 12.0410 12.1796 12.1796 12.2654 12.2654 12.7352 12.7352 13.0251 13.0251 14.9665 14.9665 15.3764 15.3764 16.7511 16.7511 17.2715 17.2715 17.3786 17.3786 17.5327 17.5327 k = 0.0000 0.0000 0.2532 ( 2086 PWs) bands (ev): -3.6791 -3.6791 -3.0605 -3.0605 2.1034 2.1034 2.3282 2.3282 5.4564 5.4564 5.7756 5.7756 8.0596 8.0596 8.3734 8.3734 9.7010 9.7010 9.8826 9.8826 9.9360 9.9360 10.6077 10.6077 10.6754 10.6754 10.9575 10.9575 11.9910 11.9910 12.0392 12.0392 12.2073 12.2073 12.2760 12.2760 12.7657 12.7657 13.0109 13.0109 14.9826 14.9826 15.3222 15.3222 16.7761 16.7761 17.2761 17.2761 17.3205 17.3205 17.5076 17.5076 k = 0.0000 0.0000 0.2630 ( 2084 PWs) bands (ev): -3.6233 -3.6233 -3.1273 -3.1273 2.1349 2.1349 2.3149 2.3149 5.4705 5.4705 5.7252 5.7252 8.0990 8.0990 8.3490 8.3490 9.7994 9.7994 9.8861 9.8861 9.9292 9.9292 10.5843 10.5843 10.6441 10.6441 10.9197 10.9197 11.9965 11.9965 12.0361 12.0361 12.2317 12.2317 12.2854 12.2854 12.7958 12.7958 12.9942 12.9942 15.0017 15.0017 15.2721 15.2721 16.8077 16.8077 17.2341 17.2341 17.3118 17.3118 17.4825 17.4825 k = 0.0000 0.0000 0.2727 ( 2092 PWs) bands (ev): -3.5659 -3.5659 -3.1933 -3.1933 2.1646 2.1646 2.2997 2.2997 5.4882 5.4882 5.6789 5.6789 8.1364 8.1364 8.3233 8.3233 9.8879 9.8879 9.9009 9.9009 9.9232 9.9232 10.4950 10.4950 10.6745 10.6745 10.8825 10.8825 12.0016 12.0016 12.0319 12.0319 12.2525 12.2525 12.2923 12.2923 12.8251 12.8251 12.9753 12.9753 15.0238 15.0238 15.2260 15.2260 16.8456 16.8456 17.1718 17.1718 17.3265 17.3265 17.4578 17.4578 k = 0.0000 0.0000 0.2825 ( 2090 PWs) bands (ev): -3.5071 -3.5071 -3.2583 -3.2583 2.1923 2.1923 2.2824 2.2824 5.5098 5.5098 5.6367 5.6367 8.1719 8.1719 8.2963 8.2963 9.8940 9.8940 9.9157 9.9157 10.0014 10.0014 10.4006 10.4006 10.7071 10.7071 10.8460 10.8460 12.0066 12.0066 12.0271 12.0271 12.2695 12.2695 12.2959 12.2959 12.8537 12.8537 12.9544 12.9544 15.0491 15.0491 15.1836 15.1836 16.8893 16.8893 17.1093 17.1093 17.3450 17.3450 17.4335 17.4335 k = 0.0000 0.0000 0.2922 ( 2090 PWs) bands (ev): -3.4468 -3.4468 -3.3223 -3.3223 2.2179 2.2179 2.2630 2.2630 5.5353 5.5353 5.5987 5.5987 8.2056 8.2056 8.2677 8.2677 9.8989 9.8989 9.9098 9.9098 10.1025 10.1025 10.3030 10.3030 10.7407 10.7407 10.8102 10.8102 12.0117 12.0117 12.0221 12.0221 12.2824 12.2824 12.2956 12.2956 12.8810 12.8810 12.9316 12.9316 15.0777 15.0777 15.1448 15.1448 16.9382 16.9382 17.0489 17.0489 17.3653 17.3653 17.4098 17.4098 k = 0.0000 0.0000 0.3019 ( 2088 PWs) bands (ev): -3.3852 -3.3852 -3.3852 -3.3852 2.2415 2.2415 2.2415 2.2415 5.5649 5.5649 5.5649 5.5649 8.2375 8.2375 8.2375 8.2375 9.9042 9.9042 9.9042 9.9042 10.2034 10.2034 10.2034 10.2034 10.7750 10.7750 10.7750 10.7750 12.0169 12.0169 12.0169 12.0169 12.2911 12.2911 12.2911 12.2911 12.9071 12.9071 12.9071 12.9071 15.1095 15.1095 15.1095 15.1095 16.9916 16.9916 16.9916 16.9916 17.3870 17.3870 17.3870 17.3870 k = 0.0000 0.0000 0.3019 ( 2088 PWs) bands (ev): -3.3852 -3.3852 -3.3852 -3.3852 2.2415 2.2415 2.2415 2.2415 5.5649 5.5649 5.5649 5.5649 8.2375 8.2375 8.2375 8.2375 9.9042 9.9042 9.9042 9.9042 10.2034 10.2034 10.2034 10.2034 10.7750 10.7750 10.7750 10.7750 12.0169 12.0169 12.0169 12.0169 12.2911 12.2911 12.2911 12.2911 12.9071 12.9071 12.9071 12.9071 15.1095 15.1095 15.1095 15.1095 16.9916 16.9916 16.9916 16.9916 17.3870 17.3870 17.3870 17.3870 k = 0.0098-0.0000 0.3019 ( 2088 PWs) bands (ev): -3.3842 -3.3842 -3.3842 -3.3842 2.2415 2.2415 2.2417 2.2417 5.5658 5.5658 5.5658 5.5658 8.2376 8.2376 8.2379 8.2379 9.8969 9.8969 9.9015 9.9015 10.2044 10.2044 10.2051 10.2051 10.7666 10.7666 10.7752 10.7752 12.0147 12.0147 12.0237 12.0237 12.2892 12.2892 12.2908 12.2908 12.9083 12.9083 12.9103 12.9103 15.1097 15.1097 15.1114 15.1114 16.9930 16.9930 16.9932 16.9932 17.3796 17.3796 17.3826 17.3826 k = 0.0196-0.0000 0.3019 ( 2098 PWs) bands (ev): -3.3814 -3.3814 -3.3814 -3.3814 2.2417 2.2417 2.2421 2.2421 5.5684 5.5684 5.5685 5.5685 8.2381 8.2381 8.2386 8.2386 9.8801 9.8801 9.8888 9.8888 10.2075 10.2075 10.2084 10.2084 10.7507 10.7507 10.7676 10.7676 12.0170 12.0170 12.0344 12.0344 12.2851 12.2851 12.2882 12.2882 12.9137 12.9137 12.9176 12.9176 15.1117 15.1117 15.1152 15.1152 16.9973 16.9973 16.9978 16.9978 17.3606 17.3606 17.3667 17.3667 k = 0.0294-0.0000 0.3019 ( 2092 PWs) bands (ev): -3.3767 -3.3767 -3.3767 -3.3767 2.2421 2.2421 2.2427 2.2427 5.5728 5.5728 5.5729 5.5729 8.2390 8.2390 8.2398 8.2398 9.8554 9.8554 9.8675 9.8675 10.2106 10.2106 10.2110 10.2110 10.7296 10.7296 10.7543 10.7543 12.0233 12.0233 12.0483 12.0483 12.2791 12.2791 12.2834 12.2834 12.9233 12.9233 12.9291 12.9291 15.1158 15.1158 15.1209 15.1209 17.0041 17.0041 17.0055 17.0055 17.3303 17.3303 17.3399 17.3399 k = 0.0392-0.0000 0.3019 ( 2098 PWs) bands (ev): -3.3702 -3.3702 -3.3701 -3.3701 2.2427 2.2427 2.2435 2.2435 5.5790 5.5790 5.5791 5.5791 8.2401 8.2401 8.2412 8.2412 9.8239 9.8239 9.8385 9.8385 10.2101 10.2101 10.2108 10.2108 10.7065 10.7065 10.7379 10.7379 12.0325 12.0325 12.0638 12.0638 12.2717 12.2717 12.2768 12.2768 12.9366 12.9366 12.9441 12.9441 15.1216 15.1216 15.1283 15.1283 17.0128 17.0128 17.0158 17.0158 17.2897 17.2897 17.3033 17.3033 k = 0.0490-0.0000 0.3019 ( 2096 PWs) bands (ev): -3.3617 -3.3617 -3.3617 -3.3617 2.2434 2.2434 2.2444 2.2444 5.5869 5.5869 5.5869 5.5869 8.2414 8.2414 8.2427 8.2427 9.7867 9.7867 9.8032 9.8032 10.2031 10.2031 10.2049 10.2049 10.6853 10.6853 10.7222 10.7222 12.0434 12.0434 12.0795 12.0795 12.2632 12.2632 12.2685 12.2685 12.9531 12.9531 12.9621 12.9621 15.1290 15.1290 15.1372 15.1372 17.0219 17.0219 17.0281 17.0281 17.2400 17.2400 17.2591 17.2591 k = 0.0588-0.0000 0.3019 ( 2092 PWs) bands (ev): -3.3514 -3.3514 -3.3514 -3.3514 2.2443 2.2443 2.2455 2.2455 5.5964 5.5964 5.5965 5.5965 8.2427 8.2427 8.2443 8.2443 9.7444 9.7444 9.7619 9.7619 10.1879 10.1879 10.1905 10.1905 10.6697 10.6697 10.7105 10.7105 12.0549 12.0549 12.0940 12.0940 12.2546 12.2546 12.2590 12.2590 12.9722 12.9722 12.9825 12.9825 15.1378 15.1378 15.1475 15.1475 17.0278 17.0278 17.0405 17.0405 17.1841 17.1841 17.2117 17.2117 k = 0.0686-0.0000 0.3019 ( 2088 PWs) bands (ev): -3.3393 -3.3393 -3.3393 -3.3393 2.2453 2.2453 2.2467 2.2467 5.6077 5.6077 5.6078 5.6078 8.2437 8.2437 8.2456 8.2456 9.6970 9.6970 9.7151 9.7151 10.1639 10.1639 10.1667 10.1667 10.6622 10.6622 10.7050 10.7050 12.0658 12.0658 12.1055 12.1055 12.2466 12.2466 12.2487 12.2487 12.9932 12.9932 13.0047 13.0047 15.1478 15.1478 15.1588 15.1588 17.0203 17.0203 17.0429 17.0429 17.1329 17.1329 17.1720 17.1720 k = 0.0784-0.0000 0.3019 ( 2100 PWs) bands (ev): -3.3254 -3.3254 -3.3254 -3.3254 2.2463 2.2463 2.2479 2.2479 5.6206 5.6206 5.6207 5.6207 8.2440 8.2440 8.2461 8.2461 9.6447 9.6447 9.6626 9.6626 10.1321 10.1321 10.1347 10.1347 10.6630 10.6630 10.7065 10.7065 12.0749 12.0749 12.1126 12.1126 12.2381 12.2381 12.2402 12.2402 13.0156 13.0156 13.0279 13.0279 15.1586 15.1586 15.1708 15.1708 16.9842 16.9842 17.0038 17.0038 17.1186 17.1186 17.1561 17.1561 k = 0.0882-0.0000 0.3019 ( 2096 PWs) bands (ev): -3.3097 -3.3097 -3.3097 -3.3097 2.2474 2.2474 2.2492 2.2492 5.6351 5.6351 5.6352 5.6352 8.2434 8.2434 8.2458 8.2458 9.5876 9.5876 9.6048 9.6048 10.0947 10.0947 10.0970 10.0970 10.6716 10.6716 10.7146 10.7146 12.0817 12.0817 12.1145 12.1145 12.2276 12.2276 12.2362 12.2362 13.0388 13.0388 13.0518 13.0518 15.1700 15.1700 15.1833 15.1833 16.9207 16.9207 16.9310 16.9310 17.1342 17.1342 17.1636 17.1636 k = 0.0980-0.0000 0.3019 ( 2092 PWs) bands (ev): -3.2922 -3.2922 -3.2922 -3.2922 2.2485 2.2485 2.2505 2.2505 5.6512 5.6512 5.6513 5.6513 8.2413 8.2413 8.2440 8.2440 9.5261 9.5261 9.5418 9.5418 10.0544 10.0544 10.0567 10.0567 10.6859 10.6859 10.7279 10.7279 12.0852 12.0852 12.1107 12.1107 12.2177 12.2177 12.2347 12.2347 13.0622 13.0622 13.0756 13.0756 15.1818 15.1818 15.1959 15.1959 16.8421 16.8421 16.8465 16.8465 17.1587 17.1587 17.1830 17.1830 k = 0.1078-0.0000 0.3019 ( 2092 PWs) bands (ev): -3.2730 -3.2730 -3.2730 -3.2730 2.2496 2.2496 2.2518 2.2518 5.6687 5.6687 5.6689 5.6689 8.2370 8.2370 8.2401 8.2401 9.4606 9.4606 9.4745 9.4745 10.0135 10.0135 10.0161 10.0161 10.7045 10.7045 10.7453 10.7453 12.0850 12.0850 12.1022 12.1022 12.2089 12.2089 12.2349 12.2349 13.0853 13.0853 13.0990 13.0990 15.1936 15.1936 15.2084 15.2084 16.7550 16.7550 16.7559 16.7559 17.1869 17.1869 17.2083 17.2083 k = 0.1176-0.0000 0.3019 ( 2088 PWs) bands (ev): -3.2521 -3.2521 -3.2520 -3.2520 2.2506 2.2506 2.2529 2.2529 5.6877 5.6877 5.6879 5.6879 8.2300 8.2300 8.2334 8.2334 9.3923 9.3923 9.4040 9.4040 9.9737 9.9737 9.9772 9.9772 10.7259 10.7259 10.7655 10.7655 12.0810 12.0810 12.0901 12.0901 12.2011 12.2011 12.2356 12.2356 13.1078 13.1078 13.1215 13.1215 15.2052 15.2052 15.2205 15.2205 16.6611 16.6611 16.6626 16.6626 17.2177 17.2177 17.2369 17.2369 k = 0.1275-0.0000 0.3019 ( 2090 PWs) bands (ev): -3.2294 -3.2294 -3.2294 -3.2294 2.2513 2.2513 2.2539 2.2539 5.7079 5.7079 5.7084 5.7084 8.2191 8.2191 8.2228 8.2228 9.3226 9.3226 9.3318 9.3318 9.9364 9.9364 9.9411 9.9411 10.7491 10.7491 10.7874 10.7874 12.0734 12.0734 12.0753 12.0753 12.1942 12.1942 12.2357 12.2357 13.1292 13.1292 13.1428 13.1428 15.2162 15.2162 15.2320 15.2320 16.5636 16.5636 16.5666 16.5666 17.2502 17.2502 17.2679 17.2679 k = 0.1373-0.0000 0.3019 ( 2094 PWs) bands (ev): -3.2052 -3.2052 -3.2052 -3.2052 2.2519 2.2519 2.2547 2.2547 5.7295 5.7295 5.7301 5.7301 8.2035 8.2035 8.2075 8.2075 9.2533 9.2533 9.2601 9.2601 9.9021 9.9021 9.9081 9.9081 10.7732 10.7732 10.8103 10.8103 12.0588 12.0588 12.0628 12.0628 12.1876 12.1876 12.2347 12.2347 13.1493 13.1493 13.1626 13.1626 15.2264 15.2264 15.2424 15.2424 16.4641 16.4641 16.4682 16.4682 17.2842 17.2842 17.3005 17.3005 k = 0.1471-0.0000 0.3019 ( 2086 PWs) bands (ev): -3.1794 -3.1794 -3.1794 -3.1794 2.2523 2.2523 2.2552 2.2552 5.7522 5.7522 5.7530 5.7530 8.1821 8.1821 8.1863 8.1863 9.1865 9.1865 9.1910 9.1910 9.8713 9.8713 9.8787 9.8787 10.7979 10.7979 10.8339 10.8339 12.0412 12.0412 12.0498 12.0498 12.1809 12.1809 12.2321 12.2321 13.1680 13.1680 13.1809 13.1809 15.2355 15.2355 15.2517 15.2517 16.3636 16.3636 16.3685 16.3685 17.3192 17.3192 17.3343 17.3343 k = 0.1569-0.0000 0.3019 ( 2092 PWs) bands (ev): -3.1520 -3.1520 -3.1520 -3.1520 2.2522 2.2522 2.2553 2.2553 5.7759 5.7759 5.7770 5.7770 8.1536 8.1536 8.1579 8.1579 9.1239 9.1239 9.1263 9.1263 9.8440 9.8440 9.8528 9.8528 10.8223 10.8223 10.8573 10.8573 12.0226 12.0226 12.0350 12.0350 12.1733 12.1733 12.2277 12.2277 13.1849 13.1849 13.1972 13.1972 15.2432 15.2432 15.2594 15.2594 16.2630 16.2630 16.2684 16.2684 17.3550 17.3550 17.3688 17.3688 k = 0.1667-0.0000 0.3019 ( 2100 PWs) bands (ev): -3.1232 -3.1232 -3.1232 -3.1232 2.2518 2.2518 2.2550 2.2550 5.8005 5.8005 5.8019 5.8019 8.1175 8.1175 8.1217 8.1217 9.0673 9.0673 9.0678 9.0678 9.8203 9.8203 9.8304 9.8304 10.8463 10.8463 10.8803 10.8803 12.0034 12.0034 12.0190 12.0190 12.1646 12.1646 12.2212 12.2212 13.1999 13.1999 13.2116 13.2116 15.2493 15.2493 15.2655 15.2655 16.1629 16.1629 16.1687 16.1687 17.3913 17.3913 17.4038 17.4038 k = 0.1765-0.0000 0.3019 ( 2102 PWs) bands (ev): -3.0929 -3.0929 -3.0929 -3.0929 2.2509 2.2509 2.2543 2.2543 5.8258 5.8258 5.8276 5.8276 8.0733 8.0733 8.0771 8.0771 9.0168 9.0168 9.0178 9.0178 9.8002 9.8002 9.8116 9.8116 10.8697 10.8697 10.9027 10.9027 11.9838 11.9838 12.0021 12.0021 12.1546 12.1546 12.2129 12.2129 13.2130 13.2130 13.2239 13.2239 15.2533 15.2533 15.2694 15.2694 16.0642 16.0642 16.0703 16.0703 17.4279 17.4279 17.4390 17.4390 k = 0.1863-0.0000 0.3019 ( 2102 PWs) bands (ev): -3.0612 -3.0612 -3.0612 -3.0612 2.2495 2.2495 2.2529 2.2529 5.8517 5.8517 5.8538 5.8538 8.0212 8.0212 8.0245 8.0245 8.9737 8.9737 8.9760 8.9760 9.7837 9.7837 9.7962 9.7962 10.8922 10.8922 10.9241 10.9241 11.9640 11.9640 11.9847 11.9847 12.1430 12.1430 12.2026 12.2026 13.2240 13.2240 13.2341 13.2341 15.2548 15.2548 15.2709 15.2709 15.9678 15.9678 15.9742 15.9742 17.4644 17.4644 17.4742 17.4742 k = 0.1961-0.0000 0.3019 ( 2098 PWs) bands (ev): -3.0283 -3.0283 -3.0282 -3.0282 2.2474 2.2474 2.2510 2.2510 5.8779 5.8779 5.8805 5.8805 7.9620 7.9620 7.9645 7.9645 8.9384 8.9384 8.9416 8.9416 9.7707 9.7707 9.7843 9.7843 10.9136 10.9136 10.9445 10.9445 11.9440 11.9440 11.9669 11.9669 12.1299 12.1299 12.1904 12.1904 13.2329 13.2329 13.2421 13.2421 15.2532 15.2532 15.2693 15.2693 15.8748 15.8748 15.8814 15.8814 17.5009 17.5009 17.5092 17.5092 k = 0.2059-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.9941 -2.9941 -2.9940 -2.9940 2.2446 2.2446 2.2483 2.2483 5.9041 5.9041 5.9073 5.9073 7.8972 7.8972 7.8986 7.8986 8.9100 8.9100 8.9139 8.9139 9.7613 9.7613 9.7759 9.7759 10.9337 10.9337 10.9636 10.9636 11.9238 11.9238 11.9488 11.9488 12.1152 12.1152 12.1764 12.1764 13.2396 13.2396 13.2477 13.2477 15.2475 15.2475 15.2639 15.2639 15.7862 15.7862 15.7932 15.7932 17.5370 17.5370 17.5439 17.5439 k = 0.2157-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.9587 -2.9587 -2.9586 -2.9586 2.2410 2.2410 2.2449 2.2449 5.9300 5.9300 5.9338 5.9338 7.8282 7.8282 7.8284 7.8284 8.8875 8.8875 8.8918 8.8918 9.7554 9.7554 9.7709 9.7709 10.9525 10.9525 10.9813 10.9813 11.9036 11.9036 11.9306 11.9306 12.0989 12.0989 12.1606 12.1606 13.2440 13.2440 13.2509 13.2509 15.2365 15.2365 15.2534 15.2534 15.7038 15.7038 15.7114 15.7114 17.5727 17.5727 17.5781 17.5781 k = 0.2255-0.0000 0.3019 ( 2102 PWs) bands (ev): -2.9223 -2.9223 -2.9222 -2.9222 2.2366 2.2366 2.2406 2.2406 5.9553 5.9553 5.9598 5.9598 7.7558 7.7558 7.7571 7.7571 8.8695 8.8695 8.8741 8.8741 9.7530 9.7530 9.7693 9.7693 10.9698 10.9698 10.9974 10.9974 11.8834 11.8834 11.9123 11.9123 12.0810 12.0810 12.1430 12.1430 13.2462 13.2462 13.2519 13.2519 15.2185 15.2185 15.2362 15.2362 15.6295 15.6295 15.6380 15.6380 17.6078 17.6078 17.6116 17.6116 k = 0.2353-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.8849 -2.8849 -2.8848 -2.8848 2.2314 2.2314 2.2354 2.2354 5.9795 5.9795 5.9849 5.9849 7.6827 7.6827 7.6854 7.6854 8.8550 8.8550 8.8597 8.8597 9.7541 9.7541 9.7710 9.7710 10.9856 10.9856 11.0120 11.0120 11.8632 11.8632 11.8940 11.8940 12.0618 12.0618 12.1239 12.1239 13.2462 13.2462 13.2505 13.2505 15.1917 15.1917 15.2105 15.2105 15.5657 15.5657 15.5751 15.5751 17.6422 17.6422 17.6445 17.6445 k = 0.2451-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.8466 -2.8466 -2.8465 -2.8465 2.2251 2.2251 2.2292 2.2292 6.0022 6.0022 6.0084 6.0084 7.6105 7.6105 7.6149 7.6149 8.8429 8.8429 8.8476 8.8476 9.7586 9.7586 9.7760 9.7760 10.9999 10.9999 11.0250 11.0250 11.8431 11.8431 11.8758 11.8758 12.0411 12.0411 12.1033 12.1033 13.2438 13.2438 13.2465 13.2465 15.1549 15.1549 15.1749 15.1749 15.5138 15.5138 15.5243 15.5243 17.6758 17.6758 17.6766 17.6766 k = 0.2549-0.0000 0.3019 ( 2090 PWs) bands (ev): -2.8076 -2.8076 -2.8074 -2.8074 2.2179 2.2179 2.2220 2.2220 6.0227 6.0227 6.0300 6.0300 7.5411 7.5411 7.5472 7.5472 8.8323 8.8323 8.8371 8.8371 9.7662 9.7662 9.7841 9.7841 11.0127 11.0127 11.0364 11.0364 11.8232 11.8232 11.8577 11.8577 12.0192 12.0192 12.0814 12.0814 13.2391 13.2391 13.2402 13.2402 15.1085 15.1085 15.1299 15.1299 15.4740 15.4740 15.4855 15.4855 17.7079 17.7079 17.7086 17.7086 k = 0.2647-0.0000 0.3019 ( 2090 PWs) bands (ev): -2.7679 -2.7679 -2.7677 -2.7677 2.2096 2.2096 2.2138 2.2138 6.0404 6.0404 6.0488 6.0488 7.4758 7.4758 7.4836 7.4836 8.8226 8.8226 8.8273 8.8273 9.7770 9.7770 9.7952 9.7952 11.0240 11.0240 11.0462 11.0462 11.8034 11.8034 11.8398 11.8398 11.9960 11.9960 12.0582 12.0582 13.2314 13.2314 13.2319 13.2319 15.0548 15.0548 15.0776 15.0776 15.4443 15.4443 15.4568 15.4568 17.7382 17.7382 17.7405 17.7405 k = 0.2745-0.0000 0.3019 ( 2090 PWs) bands (ev): -2.7276 -2.7276 -2.7275 -2.7275 2.2002 2.2002 2.2044 2.2044 6.0547 6.0547 6.0642 6.0642 7.4160 7.4160 7.4257 7.4257 8.8131 8.8131 8.8178 8.8178 9.7905 9.7905 9.8090 9.8090 11.0340 11.0340 11.0546 11.0546 11.7839 11.7839 11.8221 11.8221 11.9718 11.9718 12.0338 12.0338 13.2200 13.2200 13.2224 13.2224 14.9966 14.9966 15.0209 15.0209 15.4219 15.4219 15.4354 15.4354 17.7676 17.7676 17.7713 17.7713 k = 0.2843-0.0000 0.3019 ( 2102 PWs) bands (ev): -2.6870 -2.6870 -2.6868 -2.6868 2.1897 2.1897 2.1939 2.1939 6.0648 6.0648 6.0755 6.0755 7.3630 7.3630 7.3744 7.3744 8.8036 8.8036 8.8081 8.8081 9.8066 9.8066 9.8253 9.8253 11.0426 11.0426 11.0617 11.0617 11.7645 11.7645 11.8046 11.8046 11.9465 11.9465 12.0083 12.0083 13.2062 13.2062 13.2104 13.2104 14.9366 14.9366 14.9627 14.9627 15.4044 15.4044 15.4190 15.4190 17.7961 17.7961 17.8012 17.8012 k = 0.2941-0.0000 0.3019 ( 2106 PWs) bands (ev): -2.6461 -2.6461 -2.6459 -2.6459 2.1782 2.1782 2.1824 2.1824 6.0703 6.0703 6.0821 6.0821 7.3178 7.3178 7.3310 7.3310 8.7936 8.7936 8.7981 8.7981 9.8249 9.8249 9.8438 9.8438 11.0502 11.0502 11.0675 11.0675 11.7454 11.7454 11.7874 11.7874 11.9205 11.9205 11.9821 11.9821 13.1900 13.1900 13.1962 13.1962 14.8768 14.8768 14.9049 14.9049 15.3901 15.3901 15.4060 15.4060 17.8236 17.8236 17.8300 17.8300 k = 0.3039-0.0000 0.3019 ( 2102 PWs) bands (ev): -2.6051 -2.6051 -2.6049 -2.6049 2.1656 2.1656 2.1698 2.1698 6.0706 6.0706 6.0835 6.0835 7.2813 7.2813 7.2961 7.2961 8.7830 8.7830 8.7875 8.7875 9.8451 9.8451 9.8641 9.8641 11.0570 11.0570 11.0725 11.0725 11.7268 11.7268 11.7705 11.7705 11.8939 11.8939 11.9552 11.9552 13.1715 13.1715 13.1797 13.1797 14.8185 14.8185 14.8488 14.8488 15.3778 15.3778 15.3951 15.3951 17.8500 17.8500 17.8577 17.8577 k = 0.3137-0.0000 0.3019 ( 2102 PWs) bands (ev): -2.5642 -2.5642 -2.5639 -2.5639 2.1520 2.1520 2.1561 2.1561 6.0655 6.0655 6.0793 6.0793 7.2541 7.2541 7.2703 7.2703 8.7717 8.7717 8.7760 8.7760 9.8669 9.8669 9.8858 9.8858 11.0632 11.0632 11.0768 11.0768 11.7084 11.7084 11.7539 11.7539 11.8667 11.8667 11.9278 11.9278 13.1508 13.1508 13.1610 13.1610 14.7625 14.7625 14.7953 14.7953 15.3668 15.3668 15.3856 15.3856 17.8754 17.8754 17.8843 17.8843 k = 0.3235-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.5235 -2.5235 -2.5231 -2.5231 2.1374 2.1374 2.1415 2.1415 6.0552 6.0552 6.0697 6.0697 7.2362 7.2362 7.2536 7.2536 8.7594 8.7594 8.7637 8.7637 9.8898 9.8898 9.9087 9.9087 11.0690 11.0690 11.0808 11.0808 11.6904 11.6904 11.7377 11.7377 11.8392 11.8392 11.8999 11.8999 13.1281 13.1281 13.1403 13.1403 14.7094 14.7094 14.7447 14.7447 15.3567 15.3567 15.3771 15.3771 17.8998 17.8998 17.9098 17.9098 k = 0.3333-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.4832 -2.4832 -2.4828 -2.4828 2.1220 2.1220 2.1259 2.1259 6.0401 6.0401 6.0550 6.0550 7.2274 7.2274 7.2457 7.2457 8.7461 8.7461 8.7504 8.7504 9.9133 9.9133 9.9322 9.9322 11.0749 11.0749 11.0847 11.0847 11.6726 11.6726 11.7217 11.7217 11.8113 11.8113 11.8718 11.8718 13.1035 13.1035 13.1177 13.1177 14.6595 14.6595 14.6975 14.6975 15.3472 15.3472 15.3692 15.3692 17.9231 17.9231 17.9341 17.9341 k = 0.3431-0.0000 0.3019 ( 2094 PWs) bands (ev): -2.4435 -2.4435 -2.4431 -2.4431 2.1058 2.1058 2.1097 2.1097 6.0207 6.0207 6.0358 6.0358 7.2271 7.2271 7.2461 7.2461 8.7317 8.7317 8.7361 8.7361 9.9372 9.9372 9.9560 9.9560 11.0811 11.0811 11.0889 11.0889 11.6553 11.6553 11.7060 11.7060 11.7835 11.7835 11.8437 11.8437 13.0773 13.0773 13.0934 13.0934 14.6130 14.6130 14.6537 14.6537 15.3382 15.3382 15.3620 15.3620 17.9454 17.9454 17.9573 17.9573 k = 0.3529-0.0000 0.3019 ( 2092 PWs) bands (ev): -2.4045 -2.4045 -2.4041 -2.4041 2.0889 2.0889 2.0927 2.0927 5.9980 5.9980 6.0131 6.0131 7.2343 7.2343 7.2537 7.2537 8.7163 8.7163 8.7207 8.7207 9.9610 9.9610 9.9797 9.9797 11.0880 11.0880 11.0939 11.0939 11.6382 11.6382 11.6906 11.6906 11.7557 11.7557 11.8156 11.8156 13.0497 13.0497 13.0675 13.0675 14.5700 14.5700 14.6134 14.6134 15.3297 15.3297 15.3551 15.3551 17.9665 17.9665 17.9792 17.9792 k = 0.3627-0.0000 0.3019 ( 2088 PWs) bands (ev): -2.3666 -2.3666 -2.3662 -2.3662 2.0717 2.0717 2.0754 2.0754 5.9730 5.9730 5.9878 5.9878 7.2480 7.2480 7.2676 7.2676 8.6998 8.6998 8.7044 8.7044 9.9842 9.9842 10.0028 10.0028 11.0959 11.0959 11.0999 11.0999 11.6215 11.6215 11.6754 11.6754 11.7282 11.7282 11.7878 11.7878 13.0209 13.0209 13.0405 13.0405 14.5305 14.5305 14.5765 14.5765 15.3216 15.3216 15.3487 15.3487 17.9866 17.9866 18.0000 18.0000 k = 0.3725-0.0000 0.3019 ( 2088 PWs) bands (ev): -2.3300 -2.3300 -2.3294 -2.3294 2.0541 2.0541 2.0577 2.0577 5.9464 5.9464 5.9610 5.9610 7.2671 7.2671 7.2867 7.2867 8.6824 8.6824 8.6871 8.6871 10.0066 10.0066 10.0251 10.0251 11.1052 11.1052 11.1073 11.1073 11.6049 11.6049 11.6603 11.6603 11.7011 11.7011 11.7604 11.7604 12.9914 12.9914 13.0126 13.0126 14.4945 14.4945 14.5430 14.5430 15.3140 15.3140 15.3426 15.3426 18.0054 18.0054 18.0194 18.0194 k = 0.3824-0.0000 0.3019 ( 2088 PWs) bands (ev): -2.2947 -2.2947 -2.2942 -2.2942 2.0364 2.0364 2.0399 2.0399 5.9193 5.9193 5.9334 5.9334 7.2904 7.2904 7.3100 7.3100 8.6640 8.6640 8.6688 8.6688 10.0277 10.0277 10.0463 10.0463 11.1160 11.1160 11.1163 11.1163 11.5887 11.5887 11.6453 11.6453 11.6747 11.6747 11.7335 11.7335 12.9615 12.9615 12.9841 12.9841 14.4619 14.4619 14.5128 14.5128 15.3067 15.3067 15.3370 15.3370 18.0232 18.0232 18.0376 18.0376 k = 0.3922-0.0000 0.3019 ( 2094 PWs) bands (ev): -2.2612 -2.2612 -2.2606 -2.2606 2.0189 2.0189 2.0222 2.0222 5.8924 5.8924 5.9060 5.9060 7.3169 7.3169 7.3364 7.3364 8.6448 8.6448 8.6498 8.6498 10.0474 10.0474 10.0660 10.0660 11.1271 11.1271 11.1285 11.1285 11.5728 11.5728 11.6303 11.6303 11.6492 11.6492 11.7074 11.7074 12.9314 12.9314 12.9553 12.9553 14.4325 14.4325 14.4856 14.4856 15.3000 15.3000 15.3317 15.3317 18.0397 18.0397 18.0545 18.0545 k = 0.4020-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.2296 -2.2296 -2.2289 -2.2289 2.0017 2.0017 2.0050 2.0050 5.8663 5.8663 5.8794 5.8794 7.3456 7.3456 7.3649 7.3649 8.6250 8.6250 8.6303 8.6303 10.0655 10.0655 10.0840 10.0840 11.1398 11.1398 11.1429 11.1429 11.5572 11.5572 11.6146 11.6146 11.6254 11.6254 11.6819 11.6819 12.9018 12.9018 12.9267 12.9267 14.4063 14.4063 14.4615 14.4615 15.2937 15.2937 15.3269 15.3269 18.0549 18.0549 18.0701 18.0701 k = 0.4118-0.0000 0.3019 ( 2098 PWs) bands (ev): -2.2001 -2.2001 -2.1994 -2.1994 1.9852 1.9852 1.9883 1.9883 5.8415 5.8415 5.8542 5.8542 7.3756 7.3756 7.3947 7.3947 8.6049 8.6049 8.6104 8.6104 10.0817 10.0817 10.1004 10.1004 11.1544 11.1544 11.1591 11.1591 11.5421 11.5421 11.5961 11.5961 11.6058 11.6058 11.6575 11.6575 12.8730 12.8730 12.8989 12.8989 14.3831 14.3831 14.4401 14.4401 15.2880 15.2880 15.3224 15.3224 18.0689 18.0689 18.0843 18.0843 k = 0.4216-0.0000 0.3019 ( 2092 PWs) bands (ev): -2.1729 -2.1729 -2.1722 -2.1722 1.9695 1.9695 1.9726 1.9726 5.8185 5.8185 5.8308 5.8308 7.4059 7.4059 7.4248 7.4248 8.5848 8.5848 8.5905 8.5905 10.0961 10.0961 10.1149 10.1149 11.1708 11.1708 11.1769 11.1769 11.5275 11.5275 11.5747 11.5747 11.5903 11.5903 11.6340 11.6340 12.8456 12.8456 12.8723 12.8723 14.3628 14.3628 14.4215 14.4215 15.2828 15.2828 15.3184 15.3184 18.0815 18.0815 18.0971 18.0971 k = 0.4314-0.0000 0.3019 ( 2096 PWs) bands (ev): -2.1484 -2.1484 -2.1476 -2.1476 1.9550 1.9550 1.9580 1.9580 5.7977 5.7977 5.8095 5.8095 7.4356 7.4356 7.4544 7.4544 8.5649 8.5649 8.5708 8.5708 10.1086 10.1086 10.1275 10.1275 11.1887 11.1887 11.1960 11.1960 11.5136 11.5136 11.5534 11.5534 11.5763 11.5763 11.6116 11.6116 12.8198 12.8198 12.8473 12.8473 14.3452 14.3452 14.4054 14.4054 15.2782 15.2782 15.3149 15.3149 18.0928 18.0928 18.1084 18.1084 k = 0.4412-0.0000 0.3019 ( 2100 PWs) bands (ev): -2.1266 -2.1266 -2.1259 -2.1259 1.9418 1.9418 1.9447 1.9447 5.7792 5.7792 5.7906 5.7906 7.4639 7.4639 7.4825 7.4825 8.5459 8.5459 8.5520 8.5520 10.1191 10.1191 10.1382 10.1382 11.2078 11.2078 11.2161 11.2161 11.5004 11.5004 11.5331 11.5331 11.5633 11.5633 11.5904 11.5904 12.7963 12.7963 12.8243 12.8243 14.3302 14.3302 14.3916 14.3916 15.2742 15.2742 15.3118 15.3118 18.1026 18.1026 18.1183 18.1183 k = 0.4510-0.0000 0.3019 ( 2104 PWs) bands (ev): -2.1079 -2.1079 -2.1071 -2.1071 1.9303 1.9303 1.9330 1.9330 5.7632 5.7632 5.7744 5.7744 7.4899 7.4899 7.5084 7.5084 8.5283 8.5283 8.5346 8.5346 10.1279 10.1279 10.1471 10.1471 11.2273 11.2273 11.2366 11.2366 11.4882 11.4882 11.5139 11.5139 11.5514 11.5514 11.5706 11.5706 12.7754 12.7754 12.8038 12.8038 14.3177 14.3177 14.3802 14.3802 15.2707 15.2707 15.3091 15.3091 18.1110 18.1110 18.1268 18.1268 k = 0.4608-0.0000 0.3019 ( 2108 PWs) bands (ev): -2.0923 -2.0923 -2.0914 -2.0914 1.9205 1.9205 1.9232 1.9232 5.7500 5.7500 5.7609 5.7609 7.5128 7.5128 7.5311 7.5311 8.5126 8.5126 8.5191 8.5191 10.1349 10.1349 10.1543 10.1543 11.2467 11.2467 11.2568 11.2568 11.4769 11.4769 11.4960 11.4960 11.5409 11.5409 11.5527 11.5527 12.7576 12.7576 12.7864 12.7864 14.3076 14.3076 14.3710 14.3710 15.2679 15.2679 15.3070 15.3070 18.1180 18.1180 18.1337 18.1337 k = 0.4706-0.0000 0.3019 ( 2112 PWs) bands (ev): -2.0800 -2.0800 -2.0791 -2.0791 1.9127 1.9127 1.9153 1.9153 5.7396 5.7396 5.7503 5.7503 7.5316 7.5316 7.5498 7.5498 8.4996 8.4996 8.5062 8.5062 10.1402 10.1402 10.1598 10.1598 11.2648 11.2648 11.2755 11.2755 11.4667 11.4667 11.4798 11.4798 11.5322 11.5322 11.5374 11.5374 12.7434 12.7434 12.7725 12.7725 14.2999 14.2999 14.3639 14.3639 15.2657 15.2657 15.3053 15.3053 18.1234 18.1234 18.1391 18.1391 k = 0.4804-0.0000 0.3019 ( 2112 PWs) bands (ev): -2.0711 -2.0711 -2.0702 -2.0702 1.9070 1.9070 1.9096 1.9096 5.7322 5.7322 5.7428 5.7428 7.5457 7.5457 7.5638 7.5638 8.4897 8.4897 8.4965 8.4965 10.1439 10.1439 10.1637 10.1637 11.2802 11.2802 11.2913 11.2913 11.4581 11.4581 11.4663 11.4663 11.5256 11.5256 11.5258 11.5258 12.7330 12.7330 12.7622 12.7622 14.2944 14.2944 14.3590 14.3590 15.2641 15.2641 15.3041 15.3041 18.1273 18.1273 18.1430 18.1430 k = 0.4902-0.0000 0.3019 ( 2112 PWs) bands (ev): -2.0657 -2.0657 -2.0649 -2.0649 1.9036 1.9036 1.9061 1.9061 5.7277 5.7277 5.7382 5.7382 7.5544 7.5544 7.5725 7.5725 8.4836 8.4836 8.4904 8.4904 10.1462 10.1462 10.1660 10.1660 11.2908 11.2908 11.3022 11.3022 11.4520 11.4520 11.4569 11.4569 11.5181 11.5181 11.5218 11.5218 12.7266 12.7266 12.7559 12.7559 14.2912 14.2912 14.3560 14.3560 15.2632 15.2632 15.3034 15.3034 18.1296 18.1296 18.1453 18.1453 k = 0.5000-0.0000 0.3019 ( 2104 PWs) bands (ev): -2.0639 -2.0639 -2.0631 -2.0631 1.9024 1.9024 1.9050 1.9050 5.7263 5.7263 5.7367 5.7367 7.5573 7.5573 7.5754 7.5754 8.4816 8.4816 8.4884 8.4884 10.1469 10.1469 10.1667 10.1667 11.2947 11.2947 11.3062 11.3062 11.4497 11.4497 11.4536 11.4536 11.5156 11.5156 11.5204 11.5204 12.7246 12.7246 12.7539 12.7539 14.2901 14.2901 14.3551 14.3551 15.2629 15.2629 15.3031 15.3031 18.1304 18.1304 18.1461 18.1461 k = 0.5000-0.0000 0.3019 ( 2104 PWs) bands (ev): -2.0639 -2.0639 -2.0631 -2.0631 1.9024 1.9024 1.9050 1.9050 5.7263 5.7263 5.7367 5.7367 7.5573 7.5573 7.5754 7.5754 8.4816 8.4816 8.4884 8.4884 10.1469 10.1469 10.1667 10.1667 11.2947 11.2947 11.3062 11.3062 11.4497 11.4497 11.4536 11.4536 11.5156 11.5156 11.5204 11.5204 12.7246 12.7246 12.7539 12.7539 14.2901 14.2901 14.3551 14.3551 15.2629 15.2629 15.3031 15.3031 18.1304 18.1304 18.1461 18.1461 k = 0.5000 0.0096 0.3019 ( 2112 PWs) bands (ev): -2.0635 -2.0635 -2.0626 -2.0626 1.9023 1.9023 1.9049 1.9049 5.7229 5.7229 5.7332 5.7332 7.5619 7.5619 7.5799 7.5799 8.4785 8.4785 8.4853 8.4853 10.1443 10.1443 10.1639 10.1639 11.2929 11.2929 11.3039 11.3039 11.4548 11.4548 11.4549 11.4549 11.5164 11.5164 11.5244 11.5244 12.7246 12.7246 12.7538 12.7538 14.2925 14.2925 14.3573 14.3573 15.2653 15.2653 15.3055 15.3055 18.1304 18.1304 18.1461 18.1461 k = 0.5000 0.0192 0.3019 ( 2116 PWs) bands (ev): -2.0622 -2.0622 -2.0613 -2.0613 1.9021 1.9021 1.9046 1.9046 5.7129 5.7129 5.7230 5.7230 7.5756 7.5756 7.5932 7.5932 8.4694 8.4694 8.4761 8.4761 10.1367 10.1367 10.1555 10.1555 11.2878 11.2878 11.2979 11.2979 11.4586 11.4586 11.4692 11.4692 11.5189 11.5189 11.5360 11.5360 12.7248 12.7248 12.7538 12.7538 14.2996 14.2996 14.3641 14.3641 15.2725 15.2725 15.3126 15.3126 18.1306 18.1306 18.1462 18.1462 k = 0.5000 0.0288 0.3019 ( 2120 PWs) bands (ev): -2.0600 -2.0600 -2.0592 -2.0592 1.9017 1.9017 1.9042 1.9042 5.6969 5.6969 5.7064 5.7064 7.5978 7.5978 7.6147 7.6147 8.4544 8.4544 8.4610 8.4610 10.1245 10.1245 10.1423 10.1423 11.2803 11.2803 11.2896 11.2896 11.4642 11.4642 11.4906 11.4906 11.5231 11.5231 11.5545 11.5545 12.7253 12.7253 12.7539 12.7539 14.3114 14.3114 14.3755 14.3755 15.2844 15.2844 15.3243 15.3243 18.1308 18.1308 18.1462 18.1462 k = 0.5000 0.0384 0.3019 ( 2124 PWs) bands (ev): -2.0570 -2.0570 -2.0562 -2.0562 1.9012 1.9012 1.9036 1.9036 5.6754 5.6754 5.6843 5.6843 7.6276 7.6276 7.6437 7.6437 8.4336 8.4336 8.4401 8.4401 10.1086 10.1086 10.1250 10.1250 11.2713 11.2713 11.2803 11.2803 11.4712 11.4712 11.5155 11.5155 11.5306 11.5306 11.5786 11.5786 12.7259 12.7259 12.7540 12.7540 14.3280 14.3280 14.3914 14.3914 15.3010 15.3010 15.3406 15.3406 18.1310 18.1310 18.1461 18.1461 k = 0.5000 0.0480 0.3019 ( 2120 PWs) bands (ev): -2.0531 -2.0531 -2.0523 -2.0523 1.9004 1.9004 1.9027 1.9027 5.6492 5.6492 5.6573 5.6573 7.6640 7.6640 7.6790 7.6790 8.4075 8.4075 8.4140 8.4140 10.0898 10.0898 10.1046 10.1046 11.2614 11.2614 11.2705 11.2705 11.4797 11.4797 11.5317 11.5317 11.5522 11.5522 11.6069 11.6069 12.7266 12.7266 12.7541 12.7541 14.3492 14.3492 14.4118 14.4118 15.3221 15.3221 15.3613 15.3613 18.1310 18.1310 18.1458 18.1458 k = 0.5000 0.0576 0.3019 ( 2116 PWs) bands (ev): -2.0485 -2.0485 -2.0476 -2.0476 1.8994 1.8994 1.9016 1.9016 5.6192 5.6192 5.6265 5.6265 7.7055 7.7055 7.7191 7.7191 8.3766 8.3766 8.3832 8.3832 10.0692 10.0692 10.0822 10.0822 11.2510 11.2510 11.2606 11.2606 11.4895 11.4895 11.5412 11.5412 11.5843 11.5843 11.6381 11.6381 12.7276 12.7276 12.7542 12.7542 14.3749 14.3749 14.4366 14.4366 15.3474 15.3474 15.3862 15.3862 18.1307 18.1307 18.1451 18.1451 k = 0.5000 0.0672 0.3019 ( 2116 PWs) bands (ev): -2.0430 -2.0430 -2.0421 -2.0421 1.8980 1.8980 1.9002 1.9002 5.5864 5.5864 5.5928 5.5928 7.7503 7.7503 7.7622 7.7622 8.3419 8.3419 8.3488 8.3488 10.0475 10.0475 10.0589 10.0589 11.2403 11.2403 11.2507 11.2507 11.5004 11.5004 11.5509 11.5509 11.6188 11.6188 11.6710 11.6710 12.7286 12.7286 12.7543 12.7543 14.4050 14.4050 14.4656 14.4656 15.3768 15.3768 15.4149 15.4149 18.1298 18.1298 18.1438 18.1438 k = 0.5000 0.0768 0.3019 ( 2112 PWs) bands (ev): -2.0367 -2.0367 -2.0359 -2.0359 1.8964 1.8964 1.8984 1.8984 5.5516 5.5516 5.5572 5.5572 7.7958 7.7958 7.8055 7.8055 8.3054 8.3054 8.3131 8.3131 10.0258 10.0258 10.0353 10.0353 11.2294 11.2294 11.2407 11.2407 11.5126 11.5126 11.5618 11.5618 11.6540 11.6540 11.7046 11.7046 12.7297 12.7297 12.7545 12.7545 14.4394 14.4394 14.4988 14.4988 15.4099 15.4099 15.4473 15.4473 18.1282 18.1282 18.1416 18.1416 k = 0.5000 0.0864 0.3019 ( 2104 PWs) bands (ev): -2.0297 -2.0297 -2.0289 -2.0289 1.8944 1.8944 1.8963 1.8963 5.5158 5.5158 5.5204 5.5204 7.8379 7.8379 7.8447 7.8447 8.2705 8.2705 8.2796 8.2796 10.0045 10.0045 10.0123 10.0123 11.2184 11.2184 11.2306 11.2306 11.5257 11.5257 11.5735 11.5735 11.6893 11.6893 11.7383 11.7383 12.7310 12.7310 12.7547 12.7547 14.4780 14.4780 14.5361 14.5361 15.4463 15.4463 15.4828 15.4828 18.1256 18.1256 18.1382 18.1382 k = 0.5000 0.0960 0.3019 ( 2108 PWs) bands (ev): -2.0220 -2.0220 -2.0212 -2.0212 1.8919 1.8919 1.8937 1.8937 5.4796 5.4796 5.4833 5.4833 7.8698 7.8698 7.8730 7.8730 8.2435 8.2435 8.2548 8.2548 9.9842 9.9842 9.9904 9.9904 11.2073 11.2073 11.2204 11.2204 11.5398 11.5398 11.5861 11.5861 11.7237 11.7237 11.7711 11.7711 12.7322 12.7322 12.7548 12.7548 14.5205 14.5205 14.5772 14.5772 15.4856 15.4856 15.5211 15.5211 18.1216 18.1216 18.1333 18.1333 k = 0.5000 0.1056 0.3019 ( 2108 PWs) bands (ev): -2.0137 -2.0137 -2.0128 -2.0128 1.8889 1.8889 1.8906 1.8906 5.4438 5.4438 5.4467 5.4467 7.8811 7.8811 7.8820 7.8820 8.2337 8.2337 8.2477 8.2477 9.9652 9.9652 9.9699 9.9699 11.1962 11.1962 11.2101 11.2101 11.5547 11.5547 11.5996 11.5996 11.7571 11.7571 11.8029 11.8029 12.7335 12.7335 12.7549 12.7549 14.5667 14.5667 14.6219 14.6219 15.5272 15.5272 15.5616 15.5616 18.1160 18.1160 18.1266 18.1266 k = 0.5000 0.1152 0.3019 ( 2104 PWs) bands (ev): -2.0047 -2.0047 -2.0039 -2.0039 1.8854 1.8854 1.8869 1.8869 5.4091 5.4091 5.4111 5.4111 7.8632 7.8632 7.8671 7.8671 8.2483 8.2483 8.2640 8.2640 9.9478 9.9478 9.9511 9.9511 11.1851 11.1851 11.1998 11.1998 11.5705 11.5705 11.6138 11.6138 11.7890 11.7890 11.8331 11.8331 12.7349 12.7349 12.7551 12.7551 14.6165 14.6165 14.6702 14.6702 15.5707 15.5707 15.6037 15.6037 18.1082 18.1082 18.1176 18.1176 k = 0.5000 0.1248 0.3019 ( 2108 PWs) bands (ev): -1.9951 -1.9951 -1.9943 -1.9943 1.8813 1.8813 1.8826 1.8826 5.3760 5.3760 5.3772 5.3772 7.8219 7.8219 7.8273 7.8273 8.2850 8.2850 8.3009 8.3009 9.9319 9.9319 9.9340 9.9340 11.1741 11.1741 11.1893 11.1893 11.5867 11.5867 11.6283 11.6283 11.8194 11.8194 11.8617 11.8617 12.7363 12.7363 12.7553 12.7553 14.6696 14.6696 14.7217 14.7217 15.6155 15.6155 15.6470 15.6470 18.0981 18.0981 18.1062 18.1062 k = 0.5000 0.1345 0.3019 ( 2104 PWs) bands (ev): -1.9850 -1.9850 -1.9842 -1.9842 1.8766 1.8766 1.8777 1.8777 5.3450 5.3450 5.3454 5.3454 7.7641 7.7641 7.7703 7.7703 8.3361 8.3361 8.3514 8.3514 9.9178 9.9178 9.9187 9.9187 11.1631 11.1631 11.1789 11.1789 11.6033 11.6033 11.6432 11.6432 11.8481 11.8481 11.8884 11.8884 12.7377 12.7377 12.7555 12.7555 14.7257 14.7257 14.7762 14.7762 15.6609 15.6609 15.6907 15.6907 18.0853 18.0853 18.0920 18.0920 k = 0.5000 0.1441 0.3019 ( 2104 PWs) bands (ev): -1.9745 -1.9745 -1.9737 -1.9737 1.8712 1.8712 1.8722 1.8722 5.3162 5.3162 5.3166 5.3166 7.6958 7.6958 7.7023 7.7023 8.3954 8.3954 8.4099 8.4099 9.9051 9.9051 9.9052 9.9052 11.1523 11.1523 11.1685 11.1685 11.6202 11.6202 11.6580 11.6580 11.8751 11.8751 11.9133 11.9133 12.7390 12.7390 12.7556 12.7556 14.7846 14.7846 14.8334 14.8334 15.7063 15.7063 15.7343 15.7343 18.0696 18.0696 18.0748 18.0748 k = 0.5000 0.1537 0.3019 ( 2104 PWs) bands (ev): -1.9635 -1.9635 -1.9627 -1.9627 1.8651 1.8651 1.8659 1.8659 5.2900 5.2900 5.2911 5.2911 7.6204 7.6204 7.6271 7.6271 8.4591 8.4591 8.4728 8.4728 9.8930 9.8930 9.8940 9.8940 11.1416 11.1416 11.1582 11.1582 11.6370 11.6370 11.6727 11.6727 11.9008 11.9008 11.9364 11.9364 12.7403 12.7403 12.7556 12.7556 14.8458 14.8458 14.8930 14.8930 15.7511 15.7511 15.7771 15.7771 18.0508 18.0508 18.0546 18.0546 k = 0.5000 0.1633 0.3019 ( 2104 PWs) bands (ev): -1.9522 -1.9522 -1.9514 -1.9514 1.8583 1.8583 1.8590 1.8590 5.2671 5.2671 5.2689 5.2689 7.5401 7.5401 7.5471 7.5471 8.5251 8.5251 8.5380 8.5380 9.8824 9.8824 9.8842 9.8842 11.1311 11.1311 11.1480 11.1480 11.6535 11.6535 11.6867 11.6867 11.9252 11.9252 11.9581 11.9581 12.7415 12.7415 12.7557 12.7557 14.9090 14.9090 14.9545 14.9545 15.7948 15.7948 15.8187 15.8187 18.0290 18.0290 18.0313 18.0313 k = 0.5000 0.1729 0.3019 ( 2100 PWs) bands (ev): -1.9406 -1.9406 -1.9398 -1.9398 1.8508 1.8508 1.8513 1.8513 5.2478 5.2478 5.2503 5.2503 7.4564 7.4564 7.4636 7.4636 8.5921 8.5921 8.6042 8.6042 9.8731 9.8731 9.8755 9.8755 11.1209 11.1209 11.1379 11.1379 11.6695 11.6695 11.6999 11.6999 11.9486 11.9486 11.9785 11.9785 12.7428 12.7428 12.7558 12.7558 14.9738 14.9738 15.0176 15.0176 15.8369 15.8369 15.8585 15.8585 18.0041 18.0041 18.0050 18.0050 k = 0.5000 0.1825 0.3019 ( 2092 PWs) bands (ev): -1.9288 -1.9288 -1.9280 -1.9280 1.8427 1.8427 1.8431 1.8431 5.2324 5.2324 5.2354 5.2354 7.3703 7.3703 7.3777 7.3777 8.6593 8.6593 8.6707 8.6707 9.8648 9.8648 9.8677 9.8677 11.1110 11.1110 11.1280 11.1280 11.6846 11.6846 11.7119 11.7119 11.9713 11.9713 11.9979 11.9979 12.7440 12.7440 12.7559 12.7559 15.0397 15.0397 15.0817 15.0817 15.8771 15.8771 15.8964 15.8964 17.9760 17.9760 17.9763 17.9763 k = 0.5000 0.1921 0.3019 ( 2092 PWs) bands (ev): -1.9169 -1.9169 -1.9161 -1.9161 1.8340 1.8340 1.8342 1.8342 5.2209 5.2209 5.2245 5.2245 7.2824 7.2824 7.2900 7.2900 8.7260 8.7260 8.7367 8.7367 9.8574 9.8574 9.8607 9.8607 11.1014 11.1014 11.1184 11.1184 11.6983 11.6983 11.7225 11.7225 11.9936 11.9936 12.0166 12.0166 12.7451 12.7451 12.7558 12.7558 15.1061 15.1061 15.1462 15.1462 15.9153 15.9153 15.9322 15.9322 17.9443 17.9443 17.9457 17.9457 k = 0.5000 0.2017 0.3019 ( 2092 PWs) bands (ev): -1.9049 -1.9049 -1.9042 -1.9042 1.8247 1.8247 1.8248 1.8248 5.2136 5.2136 5.2177 5.2177 7.1934 7.1934 7.2012 7.2012 8.7918 8.7918 8.8018 8.8018 9.8506 9.8506 9.8543 9.8543 11.0922 11.0922 11.1091 11.1091 11.7106 11.7106 11.7313 11.7313 12.0157 12.0157 12.0350 12.0350 12.7462 12.7462 12.7558 12.7558 15.1722 15.1722 15.2103 15.2103 15.9516 15.9516 15.9659 15.9659 17.9102 17.9102 17.9125 17.9125 k = 0.5000 0.2113 0.3019 ( 2096 PWs) bands (ev): -1.8930 -1.8930 -1.8923 -1.8923 1.8148 1.8148 1.8149 1.8149 5.2105 5.2105 5.2151 5.2151 7.1038 7.1038 7.1117 7.1117 8.8563 8.8563 8.8657 8.8657 9.8443 9.8443 9.8482 9.8482 11.0835 11.0835 11.1000 11.1000 11.7210 11.7210 11.7383 11.7383 12.0378 12.0378 12.0533 12.0533 12.7471 12.7471 12.7558 12.7558 15.2373 15.2373 15.2734 15.2734 15.9864 15.9864 15.9981 15.9981 17.8738 17.8738 17.8769 17.8769 k = 0.5000 0.2209 0.3019 ( 2096 PWs) bands (ev): -1.8811 -1.8811 -1.8805 -1.8805 1.8045 1.8045 1.8046 1.8046 5.2117 5.2117 5.2168 5.2168 7.0140 7.0140 7.0221 7.0221 8.9192 8.9192 8.9280 8.9280 9.8383 9.8383 9.8425 9.8425 11.0751 11.0751 11.0914 11.0914 11.7296 11.7296 11.7435 11.7435 12.0598 12.0598 12.0718 12.0718 12.7480 12.7480 12.7557 12.7557 15.3005 15.3005 15.3343 15.3343 16.0203 16.0203 16.0294 16.0294 17.8353 17.8353 17.8389 17.8389 k = 0.5000 0.2305 0.3019 ( 2100 PWs) bands (ev): -1.8695 -1.8695 -1.8689 -1.8689 1.7939 1.7939 1.7942 1.7942 5.2172 5.2172 5.2228 5.2228 6.9245 6.9245 6.9326 6.9326 8.9803 8.9803 8.9885 8.9885 9.8325 9.8325 9.8367 9.8367 11.0673 11.0673 11.0831 11.0831 11.7360 11.7360 11.7468 11.7468 12.0819 12.0819 12.0905 12.0905 12.7488 12.7488 12.7556 12.7556 15.3606 15.3606 15.3919 15.3919 16.0542 16.0542 16.0606 16.0606 17.7947 17.7947 17.7987 17.7987 k = 0.5000 0.2401 0.3019 ( 2104 PWs) bands (ev): -1.8582 -1.8582 -1.8576 -1.8576 1.7832 1.7832 1.7835 1.7835 5.2270 5.2270 5.2330 5.2330 6.8354 6.8354 6.8437 6.8437 9.0393 9.0393 9.0469 9.0469 9.8267 9.8267 9.8309 9.8309 11.0600 11.0600 11.0752 11.0752 11.7405 11.7405 11.7483 11.7483 12.1039 12.1039 12.1094 12.1094 12.7496 12.7496 12.7555 12.7555 15.4164 15.4164 15.4451 15.4451 16.0892 16.0892 16.0929 16.0929 17.7520 17.7520 17.7563 17.7563 k = 0.5000 0.2497 0.3019 ( 2104 PWs) bands (ev): -1.8473 -1.8473 -1.8467 -1.8467 1.7724 1.7724 1.7728 1.7728 5.2411 5.2411 5.2475 5.2475 6.7473 6.7473 6.7557 6.7557 9.0961 9.0961 9.1031 9.1031 9.8207 9.8207 9.8248 9.8248 11.0533 11.0533 11.0679 11.0679 11.7430 11.7430 11.7483 11.7483 12.1258 12.1258 12.1286 12.1286 12.7503 12.7503 12.7554 12.7554 15.4669 15.4669 15.4927 15.4927 16.1266 16.1266 16.1276 16.1276 17.7073 17.7073 17.7119 17.7119 k = 0.5000 0.2593 0.3019 ( 2100 PWs) bands (ev): -1.8368 -1.8368 -1.8363 -1.8363 1.7618 1.7618 1.7622 1.7622 5.2594 5.2594 5.2661 5.2661 6.6604 6.6604 6.6689 6.6689 9.1504 9.1504 9.1569 9.1569 9.8144 9.8144 9.8185 9.8185 11.0471 11.0471 11.0610 11.0610 11.7439 11.7439 11.7471 11.7471 12.1472 12.1472 12.1477 12.1477 12.7510 12.7510 12.7553 12.7553 15.5109 15.5109 15.5338 15.5338 16.1658 16.1658 16.1673 16.1673 17.6607 17.6607 17.6655 17.6655 k = 0.5000 0.2689 0.3019 ( 2100 PWs) bands (ev): -1.8269 -1.8269 -1.8264 -1.8264 1.7515 1.7515 1.7519 1.7519 5.2817 5.2817 5.2887 5.2887 6.5750 6.5750 6.5835 6.5835 9.2021 9.2021 9.2080 9.2080 9.8077 9.8077 9.8116 9.8116 11.0416 11.0416 11.0546 11.0546 11.7432 11.7432 11.7447 11.7447 12.1666 12.1666 12.1679 12.1679 12.7516 12.7516 12.7551 12.7551 15.5478 15.5478 15.5677 15.5677 16.2081 16.2081 16.2120 16.2120 17.6123 17.6123 17.6172 17.6172 k = 0.5000 0.2785 0.3019 ( 2104 PWs) bands (ev): -1.8177 -1.8177 -1.8172 -1.8172 1.7416 1.7416 1.7420 1.7420 5.3079 5.3079 5.3150 5.3150 6.4916 6.4916 6.5000 6.5000 9.2509 9.2509 9.2562 9.2562 9.8006 9.8006 9.8042 9.8042 11.0366 11.0366 11.0487 11.0487 11.7414 11.7414 11.7415 11.7415 12.1850 12.1850 12.1875 12.1875 12.7521 12.7521 12.7550 12.7550 15.5774 15.5774 15.5945 15.5945 16.2550 16.2550 16.2609 16.2609 17.5623 17.5623 17.5674 17.5674 k = 0.5000 0.2881 0.3019 ( 2104 PWs) bands (ev): -1.8091 -1.8091 -1.8087 -1.8087 1.7322 1.7322 1.7326 1.7326 5.3376 5.3376 5.3449 5.3449 6.4103 6.4103 6.4188 6.4188 9.2967 9.2967 9.3015 9.3015 9.7928 9.7928 9.7961 9.7961 11.0323 11.0323 11.0433 11.0433 11.7378 11.7378 11.7386 11.7386 12.2026 12.2026 12.2060 12.2060 12.7526 12.7526 12.7550 12.7550 15.6002 15.6002 15.6147 15.6147 16.3061 16.3061 16.3135 16.3135 17.5110 17.5110 17.5162 17.5162 k = 0.5000 0.2977 0.3019 ( 2108 PWs) bands (ev): -1.8014 -1.8014 -1.8010 -1.8010 1.7236 1.7236 1.7240 1.7240 5.3706 5.3706 5.3780 5.3780 6.3318 6.3318 6.3402 6.3402 9.3393 9.3393 9.3435 9.3435 9.7845 9.7845 9.7874 9.7874 11.0286 11.0286 11.0384 11.0384 11.7338 11.7338 11.7352 11.7352 12.2191 12.2191 12.2230 12.2230 12.7530 12.7530 12.7548 12.7548 15.6170 15.6170 15.6291 15.6291 16.3604 16.3604 16.3688 16.3688 17.4589 17.4589 17.4641 17.4641 k = 0.5000 0.3073 0.3019 ( 2104 PWs) bands (ev): -1.7945 -1.7945 -1.7942 -1.7942 1.7158 1.7158 1.7162 1.7162 5.4064 5.4064 5.4137 5.4137 6.2566 6.2566 6.2647 6.2647 9.3784 9.3784 9.3820 9.3820 9.7756 9.7756 9.7782 9.7782 11.0255 11.0255 11.0342 11.0342 11.7299 11.7299 11.7316 11.7316 12.2342 12.2342 12.2383 12.2383 12.7533 12.7533 12.7547 12.7547 15.6289 15.6289 15.6388 15.6388 16.4166 16.4166 16.4255 16.4255 17.4066 17.4066 17.4119 17.4119 k = 0.5000 0.3169 0.3019 ( 2096 PWs) bands (ev): -1.7885 -1.7885 -1.7883 -1.7883 1.7090 1.7090 1.7094 1.7094 5.4442 5.4442 5.4514 5.4514 6.1854 6.1854 6.1933 6.1933 9.4136 9.4136 9.4167 9.4167 9.7665 9.7665 9.7687 9.7687 11.0231 11.0231 11.0304 11.0304 11.7263 11.7263 11.7281 11.7281 12.2476 12.2476 12.2515 12.2515 12.7536 12.7536 12.7546 12.7546 15.6370 15.6370 15.6449 15.6449 16.4729 16.4729 16.4819 16.4819 17.3552 17.3552 17.3605 17.3605 k = 0.5000 0.3265 0.3019 ( 2096 PWs) bands (ev): -1.7836 -1.7836 -1.7834 -1.7834 1.7033 1.7033 1.7036 1.7036 5.4829 5.4829 5.4898 5.4898 6.1196 6.1196 6.1270 6.1270 9.4444 9.4444 9.4469 9.4469 9.7573 9.7573 9.7590 9.7590 11.0212 11.0212 11.0272 11.0272 11.7230 11.7230 11.7247 11.7247 12.2591 12.2591 12.2625 12.2625 12.7537 12.7537 12.7545 12.7545 15.6422 15.6422 15.6484 15.6484 16.5274 16.5274 16.5358 16.5358 17.3060 17.3060 17.3111 17.3111 k = 0.5000 0.3361 0.3019 ( 2104 PWs) bands (ev): -1.7797 -1.7797 -1.7795 -1.7795 1.6988 1.6988 1.6990 1.6990 5.5208 5.5208 5.5270 5.5270 6.0610 6.0610 6.0675 6.0675 9.4701 9.4701 9.4720 9.4720 9.7485 9.7485 9.7498 9.7498 11.0200 11.0200 11.0245 11.0245 11.7202 11.7202 11.7217 11.7217 12.2683 12.2683 12.2711 12.2711 12.7539 12.7539 12.7544 12.7544 15.6456 15.6456 15.6501 15.6501 16.5771 16.5771 16.5844 16.5844 17.2615 17.2615 17.2661 17.2661 k = 0.5000 0.3457 0.3019 ( 2100 PWs) bands (ev): -1.7769 -1.7769 -1.7767 -1.7767 1.6955 1.6955 1.6957 1.6957 5.5548 5.5548 5.5597 5.5597 6.0130 6.0130 6.0182 6.0182 9.4899 9.4899 9.4912 9.4912 9.7412 9.7412 9.7421 9.7421 11.0193 11.0193 11.0224 11.0224 11.7184 11.7184 11.7194 11.7194 12.2753 12.2753 12.2772 12.2772 12.7540 12.7540 12.7543 12.7543 15.6477 15.6477 15.6507 15.6507 16.6185 16.6185 16.6241 16.6241 17.2249 17.2249 17.2285 17.2285 k = 0.5000 0.3553 0.3019 ( 2100 PWs) bands (ev): -1.7751 -1.7751 -1.7751 -1.7751 1.6935 1.6935 1.6936 1.6936 5.5800 5.5800 5.5828 5.5828 5.9808 5.9808 5.9837 5.9837 9.5025 9.5025 9.5032 9.5032 9.7363 9.7363 9.7367 9.7367 11.0192 11.0192 11.0208 11.0208 11.7173 11.7173 11.7178 11.7178 12.2797 12.2797 12.2807 12.2807 12.7541 12.7541 12.7543 12.7543 15.6491 15.6491 15.6506 15.6506 16.6471 16.6471 16.6502 16.6502 17.2006 17.2006 17.2026 17.2026 k = 0.5000 0.3649 0.3019 ( 2096 PWs) bands (ev): -1.7746 -1.7746 -1.7746 -1.7746 1.6929 1.6929 1.6929 1.6929 5.5905 5.5905 5.5905 5.5905 5.9701 5.9701 5.9701 5.9701 9.5072 9.5072 9.5072 9.5072 9.7346 9.7346 9.7346 9.7346 11.0198 11.0198 11.0198 11.0198 11.7171 11.7171 11.7171 11.7171 12.2816 12.2816 12.2816 12.2816 12.7542 12.7542 12.7542 12.7542 15.6500 15.6500 15.6500 15.6500 16.6584 16.6584 16.6584 16.6584 17.1926 17.1926 17.1926 17.1926 k = 0.5000 0.3649 0.3019 ( 2096 PWs) bands (ev): -1.7746 -1.7746 -1.7746 -1.7746 1.6929 1.6929 1.6929 1.6929 5.5905 5.5905 5.5905 5.5905 5.9701 5.9701 5.9701 5.9701 9.5072 9.5072 9.5072 9.5072 9.7346 9.7346 9.7346 9.7346 11.0198 11.0198 11.0198 11.0198 11.7171 11.7171 11.7171 11.7171 12.2816 12.2816 12.2816 12.2816 12.7542 12.7542 12.7542 12.7542 15.6500 15.6500 15.6500 15.6500 16.6584 16.6584 16.6584 16.6584 17.1926 17.1926 17.1926 17.1926 k = 0.4902 0.3649 0.3019 ( 2100 PWs) bands (ev): -1.7755 -1.7755 -1.7755 -1.7755 1.6903 1.6903 1.6903 1.6903 5.5928 5.5928 5.5928 5.5928 5.9732 5.9732 5.9732 5.9732 9.5076 9.5076 9.5076 9.5076 9.7347 9.7347 9.7347 9.7347 11.0198 11.0198 11.0198 11.0198 11.7170 11.7170 11.7170 11.7170 12.2815 12.2815 12.2815 12.2815 12.7540 12.7540 12.7540 12.7540 15.6494 15.6494 15.6494 15.6494 16.6562 16.6562 16.6562 16.6562 17.1950 17.1950 17.1950 17.1950 k = 0.4804 0.3649 0.3019 ( 2100 PWs) bands (ev): -1.7784 -1.7784 -1.7784 -1.7784 1.6827 1.6827 1.6827 1.6827 5.5997 5.5997 5.5997 5.5997 5.9823 5.9823 5.9823 5.9823 9.5091 9.5091 9.5091 9.5091 9.7351 9.7351 9.7351 9.7351 11.0202 11.0202 11.0202 11.0202 11.7167 11.7167 11.7167 11.7167 12.2814 12.2814 12.2814 12.2814 12.7535 12.7535 12.7535 12.7535 15.6478 15.6478 15.6478 15.6478 16.6496 16.6496 16.6496 16.6496 17.2021 17.2021 17.2021 17.2021 k = 0.4706 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.7832 -1.7832 -1.7832 -1.7832 1.6700 1.6700 1.6700 1.6700 5.6112 5.6112 5.6112 5.6112 5.9974 5.9974 5.9974 5.9974 9.5116 9.5116 9.5116 9.5116 9.7360 9.7360 9.7360 9.7360 11.0210 11.0210 11.0210 11.0210 11.7162 11.7162 11.7162 11.7162 12.2813 12.2813 12.2813 12.2813 12.7528 12.7528 12.7528 12.7528 15.6451 15.6451 15.6451 15.6451 16.6386 16.6386 16.6386 16.6386 17.2138 17.2138 17.2138 17.2138 k = 0.4608 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.7899 -1.7899 -1.7899 -1.7899 1.6525 1.6525 1.6525 1.6525 5.6272 5.6272 5.6272 5.6272 6.0182 6.0182 6.0182 6.0182 9.5149 9.5149 9.5149 9.5149 9.7372 9.7372 9.7372 9.7372 11.0220 11.0220 11.0220 11.0220 11.7154 11.7154 11.7154 11.7154 12.2812 12.2812 12.2812 12.2812 12.7517 12.7517 12.7517 12.7517 15.6414 15.6414 15.6414 15.6414 16.6232 16.6232 16.6232 16.6232 17.2302 17.2302 17.2302 17.2302 k = 0.4510 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.7985 -1.7985 -1.7985 -1.7985 1.6304 1.6304 1.6304 1.6304 5.6476 5.6476 5.6476 5.6476 6.0443 6.0443 6.0443 6.0443 9.5191 9.5191 9.5191 9.5191 9.7390 9.7390 9.7390 9.7390 11.0234 11.0234 11.0234 11.0234 11.7143 11.7143 11.7143 11.7143 12.2810 12.2810 12.2810 12.2810 12.7504 12.7504 12.7504 12.7504 15.6368 15.6368 15.6368 15.6368 16.6036 16.6036 16.6036 16.6036 17.2509 17.2509 17.2509 17.2509 k = 0.4412 0.3649 0.3019 ( 2084 PWs) bands (ev): -1.8088 -1.8088 -1.8088 -1.8088 1.6039 1.6039 1.6039 1.6039 5.6724 5.6724 5.6724 5.6724 6.0755 6.0755 6.0755 6.0755 9.5242 9.5242 9.5242 9.5242 9.7416 9.7416 9.7416 9.7416 11.0253 11.0253 11.0253 11.0253 11.7129 11.7129 11.7129 11.7129 12.2809 12.2809 12.2809 12.2809 12.7490 12.7490 12.7490 12.7490 15.6313 15.6313 15.6313 15.6313 16.5798 16.5798 16.5798 16.5798 17.2759 17.2759 17.2759 17.2759 k = 0.4314 0.3649 0.3019 ( 2088 PWs) bands (ev): -1.8208 -1.8208 -1.8208 -1.8208 1.5734 1.5734 1.5734 1.5734 5.7015 5.7015 5.7015 5.7015 6.1112 6.1112 6.1112 6.1112 9.5299 9.5299 9.5299 9.5299 9.7451 9.7451 9.7451 9.7451 11.0277 11.0277 11.0277 11.0277 11.7109 11.7109 11.7109 11.7109 12.2809 12.2809 12.2809 12.2809 12.7473 12.7473 12.7473 12.7473 15.6249 15.6249 15.6249 15.6249 16.5519 16.5519 16.5519 16.5519 17.3050 17.3050 17.3050 17.3050 k = 0.4216 0.3649 0.3019 ( 2084 PWs) bands (ev): -1.8345 -1.8345 -1.8345 -1.8345 1.5392 1.5392 1.5392 1.5392 5.7348 5.7348 5.7348 5.7348 6.1509 6.1509 6.1509 6.1509 9.5363 9.5363 9.5363 9.5363 9.7499 9.7499 9.7499 9.7499 11.0307 11.0307 11.0307 11.0307 11.7086 11.7086 11.7086 11.7086 12.2810 12.2810 12.2810 12.2810 12.7455 12.7455 12.7455 12.7455 15.6178 15.6178 15.6178 15.6178 16.5202 16.5202 16.5202 16.5202 17.3378 17.3378 17.3378 17.3378 k = 0.4118 0.3649 0.3019 ( 2096 PWs) bands (ev): -1.8497 -1.8497 -1.8497 -1.8497 1.5016 1.5016 1.5016 1.5016 5.7721 5.7721 5.7721 5.7721 6.1941 6.1941 6.1941 6.1941 9.5430 9.5430 9.5430 9.5430 9.7563 9.7563 9.7563 9.7563 11.0345 11.0345 11.0345 11.0345 11.7056 11.7056 11.7056 11.7056 12.2812 12.2812 12.2812 12.2812 12.7437 12.7437 12.7437 12.7437 15.6100 15.6100 15.6100 15.6100 16.4846 16.4846 16.4846 16.4846 17.3743 17.3743 17.3743 17.3743 k = 0.4020 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.8664 -1.8664 -1.8664 -1.8664 1.4610 1.4610 1.4610 1.4610 5.8132 5.8132 5.8132 5.8132 6.2402 6.2402 6.2402 6.2402 9.5503 9.5503 9.5503 9.5503 9.7645 9.7645 9.7645 9.7645 11.0392 11.0392 11.0392 11.0392 11.7022 11.7022 11.7022 11.7022 12.2816 12.2816 12.2816 12.2816 12.7420 12.7420 12.7420 12.7420 15.6017 15.6017 15.6017 15.6017 16.4455 16.4455 16.4455 16.4455 17.4140 17.4140 17.4140 17.4140 k = 0.3922 0.3649 0.3019 ( 2088 PWs) bands (ev): -1.8844 -1.8844 -1.8844 -1.8844 1.4178 1.4178 1.4178 1.4178 5.8581 5.8581 5.8581 5.8581 6.2886 6.2886 6.2886 6.2886 9.5578 9.5578 9.5578 9.5578 9.7751 9.7751 9.7751 9.7751 11.0450 11.0450 11.0450 11.0450 11.6981 11.6981 11.6981 11.6981 12.2823 12.2823 12.2823 12.2823 12.7403 12.7403 12.7403 12.7403 15.5929 15.5929 15.5929 15.5929 16.4031 16.4031 16.4031 16.4031 17.4567 17.4567 17.4567 17.4567 k = 0.3824 0.3649 0.3019 ( 2088 PWs) bands (ev): -1.9038 -1.9038 -1.9038 -1.9038 1.3723 1.3723 1.3723 1.3723 5.9065 5.9065 5.9065 5.9065 6.3387 6.3387 6.3387 6.3387 9.5654 9.5654 9.5654 9.5654 9.7881 9.7881 9.7881 9.7881 11.0519 11.0519 11.0519 11.0519 11.6934 11.6934 11.6934 11.6934 12.2833 12.2833 12.2833 12.2833 12.7388 12.7388 12.7388 12.7388 15.5835 15.5835 15.5835 15.5835 16.3575 16.3575 16.3575 16.3575 17.5021 17.5021 17.5021 17.5021 k = 0.3725 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.9242 -1.9242 -1.9242 -1.9242 1.3248 1.3248 1.3248 1.3248 5.9583 5.9583 5.9583 5.9583 6.3898 6.3898 6.3898 6.3898 9.5730 9.5730 9.5730 9.5730 9.8040 9.8040 9.8040 9.8040 11.0602 11.0602 11.0602 11.0602 11.6879 11.6879 11.6879 11.6879 12.2845 12.2845 12.2845 12.2845 12.7375 12.7375 12.7375 12.7375 15.5738 15.5738 15.5738 15.5738 16.3091 16.3091 16.3091 16.3091 17.5499 17.5499 17.5499 17.5499 k = 0.3627 0.3649 0.3019 ( 2092 PWs) bands (ev): -1.9457 -1.9457 -1.9457 -1.9457 1.2757 1.2757 1.2757 1.2757 6.0133 6.0133 6.0133 6.0133 6.4413 6.4413 6.4413 6.4413 9.5803 9.5803 9.5803 9.5803 9.8232 9.8232 9.8232 9.8232 11.0701 11.0701 11.0701 11.0701 11.6816 11.6816 11.6816 11.6816 12.2862 12.2862 12.2862 12.2862 12.7366 12.7366 12.7366 12.7366 15.5637 15.5637 15.5637 15.5637 16.2581 16.2581 16.2581 16.2581 17.5997 17.5997 17.5997 17.5997 k = 0.3529 0.3649 0.3019 ( 2088 PWs) bands (ev): -1.9682 -1.9682 -1.9682 -1.9682 1.2253 1.2253 1.2253 1.2253 6.0713 6.0713 6.0713 6.0713 6.4927 6.4927 6.4927 6.4927 9.5872 9.5872 9.5872 9.5872 9.8461 9.8461 9.8461 9.8461 11.0816 11.0816 11.0816 11.0816 11.6746 11.6746 11.6746 11.6746 12.2885 12.2885 12.2885 12.2885 12.7363 12.7363 12.7363 12.7363 15.5532 15.5532 15.5532 15.5532 16.2048 16.2048 16.2048 16.2048 17.6512 17.6512 17.6512 17.6512 k = 0.3431 0.3649 0.3019 ( 2096 PWs) bands (ev): -1.9914 -1.9914 -1.9914 -1.9914 1.1739 1.1739 1.1739 1.1739 6.1320 6.1320 6.1320 6.1320 6.5433 6.5433 6.5433 6.5433 9.5934 9.5934 9.5934 9.5934 9.8728 9.8728 9.8728 9.8728 11.0950 11.0950 11.0950 11.0950 11.6668 11.6668 11.6668 11.6668 12.2911 12.2911 12.2911 12.2911 12.7362 12.7362 12.7362 12.7362 15.5424 15.5424 15.5424 15.5424 16.1496 16.1496 16.1496 16.1496 17.7041 17.7041 17.7041 17.7041 k = 0.3333 0.3649 0.3019 ( 2096 PWs) bands (ev): -2.0154 -2.0154 -2.0154 -2.0154 1.1218 1.1218 1.1218 1.1218 6.1953 6.1953 6.1953 6.1953 6.5927 6.5927 6.5927 6.5927 9.5989 9.5989 9.5989 9.5989 9.9038 9.9038 9.9038 9.9038 11.1104 11.1104 11.1104 11.1104 11.6583 11.6583 11.6583 11.6583 12.2944 12.2944 12.2944 12.2944 12.7368 12.7368 12.7368 12.7368 15.5312 15.5312 15.5312 15.5312 16.0927 16.0927 16.0927 16.0927 17.7579 17.7579 17.7579 17.7579 k = 0.3235 0.3649 0.3019 ( 2096 PWs) bands (ev): -2.0399 -2.0399 -2.0399 -2.0399 1.0692 1.0692 1.0692 1.0692 6.2610 6.2610 6.2610 6.2610 6.6403 6.6403 6.6403 6.6403 9.6035 9.6035 9.6035 9.6035 9.9393 9.9393 9.9393 9.9393 11.1279 11.1279 11.1279 11.1279 11.6490 11.6490 11.6490 11.6490 12.2983 12.2983 12.2983 12.2983 12.7379 12.7379 12.7379 12.7379 15.5197 15.5197 15.5197 15.5197 16.0345 16.0345 16.0345 16.0345 17.8123 17.8123 17.8123 17.8123 k = 0.3137 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.0649 -2.0649 -2.0649 -2.0649 1.0164 1.0164 1.0164 1.0164 6.3288 6.3288 6.3288 6.3288 6.6857 6.6857 6.6857 6.6857 9.6070 9.6070 9.6070 9.6070 9.9795 9.9795 9.9795 9.9795 11.1478 11.1478 11.1478 11.1478 11.6390 11.6390 11.6390 11.6390 12.3029 12.3029 12.3029 12.3029 12.7399 12.7399 12.7399 12.7399 15.5079 15.5079 15.5079 15.5079 15.9754 15.9754 15.9754 15.9754 17.8670 17.8670 17.8670 17.8670 k = 0.3039 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.0903 -2.0903 -2.0903 -2.0903 0.9637 0.9637 0.9637 0.9637 6.3986 6.3986 6.3986 6.3986 6.7286 6.7286 6.7286 6.7286 9.6092 9.6092 9.6092 9.6092 10.0245 10.0245 10.0245 10.0245 11.1700 11.1700 11.1700 11.1700 11.6284 11.6284 11.6284 11.6284 12.3082 12.3082 12.3082 12.3082 12.7425 12.7425 12.7425 12.7425 15.4957 15.4957 15.4957 15.4957 15.9155 15.9155 15.9155 15.9155 17.9215 17.9215 17.9215 17.9215 k = 0.2941 0.3649 0.3019 ( 2084 PWs) bands (ev): -2.1159 -2.1159 -2.1159 -2.1159 0.9111 0.9111 0.9111 0.9111 6.4700 6.4700 6.4700 6.4700 6.7685 6.7685 6.7685 6.7685 9.6101 9.6101 9.6101 9.6101 10.0744 10.0744 10.0744 10.0744 11.1947 11.1947 11.1947 11.1947 11.6173 11.6173 11.6173 11.6173 12.3143 12.3143 12.3143 12.3143 12.7460 12.7460 12.7460 12.7460 15.4831 15.4831 15.4831 15.4831 15.8554 15.8554 15.8554 15.8554 17.9754 17.9754 17.9754 17.9754 k = 0.2843 0.3649 0.3019 ( 2084 PWs) bands (ev): -2.1416 -2.1416 -2.1416 -2.1416 0.8589 0.8589 0.8589 0.8589 6.5429 6.5429 6.5429 6.5429 6.8054 6.8054 6.8054 6.8054 9.6094 9.6094 9.6094 9.6094 10.1291 10.1291 10.1291 10.1291 11.2217 11.2217 11.2217 11.2217 11.6056 11.6056 11.6056 11.6056 12.3212 12.3212 12.3212 12.3212 12.7504 12.7504 12.7504 12.7504 15.4701 15.4701 15.4701 15.4701 15.7954 15.7954 15.7954 15.7954 18.0284 18.0284 18.0284 18.0284 k = 0.2745 0.3649 0.3019 ( 2084 PWs) bands (ev): -2.1674 -2.1674 -2.1674 -2.1674 0.8073 0.8073 0.8073 0.8073 6.6171 6.6171 6.6171 6.6171 6.8390 6.8390 6.8390 6.8390 9.6073 9.6073 9.6073 9.6073 10.1885 10.1885 10.1885 10.1885 11.2511 11.2511 11.2511 11.2511 11.5935 11.5935 11.5935 11.5935 12.3289 12.3289 12.3289 12.3289 12.7557 12.7557 12.7557 12.7557 15.4566 15.4566 15.4566 15.4566 15.7359 15.7359 15.7359 15.7359 18.0802 18.0802 18.0802 18.0802 k = 0.2647 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.1932 -2.1932 -2.1932 -2.1932 0.7565 0.7565 0.7565 0.7565 6.6923 6.6923 6.6923 6.6923 6.8693 6.8693 6.8693 6.8693 9.6034 9.6034 9.6034 9.6034 10.2523 10.2523 10.2523 10.2523 11.2828 11.2828 11.2828 11.2828 11.5811 11.5811 11.5811 11.5811 12.3374 12.3374 12.3374 12.3374 12.7623 12.7623 12.7623 12.7623 15.4425 15.4425 15.4425 15.4425 15.6771 15.6771 15.6771 15.6771 18.1303 18.1303 18.1303 18.1303 k = 0.2549 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.2188 -2.2188 -2.2188 -2.2188 0.7065 0.7065 0.7065 0.7065 6.7683 6.7683 6.7683 6.7683 6.8962 6.8962 6.8962 6.8962 9.5979 9.5979 9.5979 9.5979 10.3203 10.3203 10.3203 10.3203 11.3166 11.3166 11.3166 11.3166 11.5685 11.5685 11.5685 11.5685 12.3470 12.3470 12.3470 12.3470 12.7701 12.7701 12.7701 12.7701 15.4277 15.4277 15.4277 15.4277 15.6196 15.6196 15.6196 15.6196 18.1785 18.1785 18.1785 18.1785 k = 0.2451 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.2441 -2.2441 -2.2441 -2.2441 0.6576 0.6576 0.6576 0.6576 6.8448 6.8448 6.8448 6.8448 6.9200 6.9200 6.9200 6.9200 9.5907 9.5907 9.5907 9.5907 10.3921 10.3921 10.3921 10.3921 11.3522 11.3522 11.3522 11.3522 11.5560 11.5560 11.5560 11.5560 12.3575 12.3575 12.3575 12.3575 12.7793 12.7793 12.7793 12.7793 15.4121 15.4121 15.4121 15.4121 15.5638 15.5638 15.5638 15.5638 18.2245 18.2245 18.2245 18.2245 k = 0.2353 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.2691 -2.2691 -2.2691 -2.2691 0.6098 0.6098 0.6098 0.6098 6.9211 6.9211 6.9211 6.9211 6.9410 6.9410 6.9410 6.9410 9.5818 9.5818 9.5818 9.5818 10.4671 10.4671 10.4671 10.4671 11.3893 11.3893 11.3893 11.3893 11.5438 11.5438 11.5438 11.5438 12.3691 12.3691 12.3691 12.3691 12.7900 12.7900 12.7900 12.7900 15.3955 15.3955 15.3955 15.3955 15.5104 15.5104 15.5104 15.5104 18.2678 18.2678 18.2678 18.2678 k = 0.2255 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.2937 -2.2937 -2.2937 -2.2937 0.5632 0.5632 0.5632 0.5632 6.9574 6.9574 6.9574 6.9574 6.9994 6.9994 6.9994 6.9994 9.5713 9.5713 9.5713 9.5713 10.5447 10.5447 10.5447 10.5447 11.4270 11.4270 11.4270 11.4270 11.5327 11.5327 11.5327 11.5327 12.3816 12.3816 12.3816 12.3816 12.8023 12.8023 12.8023 12.8023 15.3771 15.3771 15.3771 15.3771 15.4602 15.4602 15.4602 15.4602 18.3085 18.3085 18.3085 18.3085 k = 0.2157 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.3178 -2.3178 -2.3178 -2.3178 0.5180 0.5180 0.5180 0.5180 6.9722 6.9722 6.9722 6.9722 7.0761 7.0761 7.0761 7.0761 9.5593 9.5593 9.5593 9.5593 10.6243 10.6243 10.6243 10.6243 11.4627 11.4627 11.4627 11.4627 11.5251 11.5251 11.5251 11.5251 12.3952 12.3952 12.3952 12.3952 12.8165 12.8165 12.8165 12.8165 15.3558 15.3558 15.3558 15.3558 15.4148 15.4148 15.4148 15.4148 18.3461 18.3461 18.3461 18.3461 k = 0.2059 0.3649 0.3019 ( 2096 PWs) bands (ev): -2.3414 -2.3414 -2.3414 -2.3414 0.4743 0.4743 0.4743 0.4743 6.9842 6.9842 6.9842 6.9842 7.1528 7.1528 7.1528 7.1528 9.5457 9.5457 9.5457 9.5457 10.7051 10.7051 10.7051 10.7051 11.4844 11.4844 11.4844 11.4844 11.5328 11.5328 11.5328 11.5328 12.4097 12.4097 12.4097 12.4097 12.8328 12.8328 12.8328 12.8328 15.3292 15.3292 15.3292 15.3292 15.3768 15.3768 15.3768 15.3768 18.3806 18.3806 18.3806 18.3806 k = 0.1961 0.3649 0.3019 ( 2100 PWs) bands (ev): -2.3643 -2.3643 -2.3643 -2.3643 0.4322 0.4322 0.4322 0.4322 6.9939 6.9939 6.9939 6.9939 7.2290 7.2290 7.2290 7.2290 9.5306 9.5306 9.5306 9.5306 10.7861 10.7861 10.7861 10.7861 11.4836 11.4836 11.4836 11.4836 11.5643 11.5643 11.5643 11.5643 12.4253 12.4253 12.4253 12.4253 12.8514 12.8514 12.8514 12.8514 15.2965 15.2965 15.2965 15.2965 15.3475 15.3475 15.3475 15.3475 18.4119 18.4119 18.4119 18.4119 k = 0.1863 0.3649 0.3019 ( 2096 PWs) bands (ev): -2.3864 -2.3864 -2.3864 -2.3864 0.3916 0.3916 0.3916 0.3916 7.0014 7.0014 7.0014 7.0014 7.3045 7.3045 7.3045 7.3045 9.5141 9.5141 9.5141 9.5141 10.8663 10.8663 10.8663 10.8663 11.4763 11.4763 11.4763 11.4763 11.6035 11.6035 11.6035 11.6035 12.4418 12.4418 12.4418 12.4418 12.8725 12.8725 12.8725 12.8725 15.2616 15.2616 15.2616 15.2616 15.3232 15.3232 15.3232 15.3232 18.4399 18.4399 18.4399 18.4399 k = 0.1765 0.3649 0.3019 ( 2092 PWs) bands (ev): -2.4078 -2.4078 -2.4078 -2.4078 0.3528 0.3528 0.3528 0.3528 7.0069 7.0069 7.0069 7.0069 7.3791 7.3791 7.3791 7.3791 9.4964 9.4964 9.4964 9.4964 10.9446 10.9446 10.9446 10.9446 11.4690 11.4690 11.4690 11.4690 11.6442 11.6442 11.6442 11.6442 12.4592 12.4592 12.4592 12.4592 12.8965 12.8965 12.8965 12.8965 15.2282 15.2282 15.2282 15.2282 15.3005 15.3005 15.3005 15.3005 18.4646 18.4646 18.4646 18.4646 k = 0.1667 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.4284 -2.4284 -2.4284 -2.4284 0.3157 0.3157 0.3157 0.3157 7.0108 7.0108 7.0108 7.0108 7.4526 7.4526 7.4526 7.4526 9.4775 9.4775 9.4775 9.4775 11.0194 11.0194 11.0194 11.0194 11.4635 11.4635 11.4635 11.4635 11.6847 11.6847 11.6847 11.6847 12.4771 12.4771 12.4771 12.4771 12.9234 12.9234 12.9234 12.9234 15.1980 15.1980 15.1980 15.1980 15.2780 15.2780 15.2780 15.2780 18.4860 18.4860 18.4860 18.4860 k = 0.1569 0.3649 0.3019 ( 2076 PWs) bands (ev): -2.4480 -2.4480 -2.4480 -2.4480 0.2805 0.2805 0.2805 0.2805 7.0134 7.0134 7.0134 7.0134 7.5247 7.5247 7.5247 7.5247 9.4575 9.4575 9.4575 9.4575 11.0888 11.0888 11.0888 11.0888 11.4613 11.4613 11.4613 11.4613 11.7246 11.7246 11.7246 11.7246 12.4956 12.4956 12.4956 12.4956 12.9537 12.9537 12.9537 12.9537 15.1719 15.1719 15.1719 15.1719 15.2552 15.2552 15.2552 15.2552 18.5041 18.5041 18.5041 18.5041 k = 0.1471 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.4668 -2.4668 -2.4668 -2.4668 0.2472 0.2472 0.2472 0.2472 7.0146 7.0146 7.0146 7.0146 7.5953 7.5953 7.5953 7.5953 9.4365 9.4365 9.4365 9.4365 11.1502 11.1502 11.1502 11.1502 11.4642 11.4642 11.4642 11.4642 11.7632 11.7632 11.7632 11.7632 12.5143 12.5143 12.5143 12.5143 12.9873 12.9873 12.9873 12.9873 15.1501 15.1501 15.1501 15.1501 15.2319 15.2319 15.2319 15.2319 18.5192 18.5192 18.5192 18.5192 k = 0.1373 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.4845 -2.4845 -2.4845 -2.4845 0.2157 0.2157 0.2157 0.2157 7.0148 7.0148 7.0148 7.0148 7.6640 7.6640 7.6640 7.6640 9.4147 9.4147 9.4147 9.4147 11.2006 11.2006 11.2006 11.2006 11.4748 11.4748 11.4748 11.4748 11.8003 11.8003 11.8003 11.8003 12.5329 12.5329 12.5329 12.5329 13.0244 13.0244 13.0244 13.0244 15.1326 15.1326 15.1326 15.1326 15.2083 15.2083 15.2083 15.2083 18.5313 18.5313 18.5313 18.5313 k = 0.1275 0.3649 0.3019 ( 2076 PWs) bands (ev): -2.5012 -2.5012 -2.5012 -2.5012 0.1863 0.1863 0.1863 0.1863 7.0142 7.0142 7.0142 7.0142 7.7307 7.7307 7.7307 7.7307 9.3921 9.3921 9.3921 9.3921 11.2376 11.2376 11.2376 11.2376 11.4949 11.4949 11.4949 11.4949 11.8355 11.8355 11.8355 11.8355 12.5512 12.5512 12.5512 12.5512 13.0651 13.0651 13.0651 13.0651 15.1188 15.1188 15.1188 15.1188 15.1852 15.1852 15.1852 15.1852 18.5406 18.5406 18.5406 18.5406 k = 0.1176 0.3649 0.3019 ( 2076 PWs) bands (ev): -2.5168 -2.5168 -2.5168 -2.5168 0.1589 0.1589 0.1589 0.1589 7.0130 7.0130 7.0130 7.0130 7.7951 7.7951 7.7951 7.7951 9.3690 9.3690 9.3690 9.3690 11.2609 11.2609 11.2609 11.2609 11.5244 11.5244 11.5244 11.5244 11.8688 11.8688 11.8688 11.8688 12.5688 12.5688 12.5688 12.5688 13.1090 13.1090 13.1090 13.1090 15.1067 15.1067 15.1067 15.1067 15.1644 15.1644 15.1644 15.1644 18.5475 18.5475 18.5475 18.5475 k = 0.1078 0.3649 0.3019 ( 2072 PWs) bands (ev): -2.5313 -2.5313 -2.5313 -2.5313 0.1336 0.1336 0.1336 0.1336 7.0113 7.0113 7.0113 7.0113 7.8570 7.8570 7.8570 7.8570 9.3456 9.3456 9.3456 9.3456 11.2734 11.2734 11.2734 11.2734 11.5599 11.5599 11.5599 11.5599 11.8998 11.8998 11.8998 11.8998 12.5855 12.5855 12.5855 12.5855 13.1559 13.1559 13.1559 13.1559 15.0924 15.0924 15.0924 15.0924 15.1501 15.1501 15.1501 15.1501 18.5520 18.5520 18.5520 18.5520 k = 0.0980 0.3649 0.3019 ( 2072 PWs) bands (ev): -2.5447 -2.5447 -2.5447 -2.5447 0.1103 0.1103 0.1103 0.1103 7.0093 7.0093 7.0093 7.0093 7.9160 7.9160 7.9160 7.9160 9.3220 9.3220 9.3220 9.3220 11.2789 11.2789 11.2789 11.2789 11.5975 11.5975 11.5975 11.5975 11.9286 11.9286 11.9286 11.9286 12.6009 12.6009 12.6009 12.6009 13.2051 13.2051 13.2051 13.2051 15.0721 15.0721 15.0721 15.0721 15.1455 15.1455 15.1455 15.1455 18.5546 18.5546 18.5546 18.5546 k = 0.0882 0.3649 0.3019 ( 2072 PWs) bands (ev): -2.5569 -2.5569 -2.5569 -2.5569 0.0892 0.0892 0.0892 0.0892 7.0070 7.0070 7.0070 7.0070 7.9717 7.9717 7.9717 7.9717 9.2985 9.2985 9.2985 9.2985 11.2801 11.2801 11.2801 11.2801 11.6342 11.6342 11.6342 11.6342 11.9550 11.9550 11.9550 11.9550 12.6149 12.6149 12.6149 12.6149 13.2560 13.2560 13.2560 13.2560 15.0470 15.0470 15.0470 15.0470 15.1494 15.1494 15.1494 15.1494 18.5556 18.5556 18.5556 18.5556 k = 0.0784 0.3649 0.3019 ( 2068 PWs) bands (ev): -2.5678 -2.5678 -2.5678 -2.5678 0.0702 0.0702 0.0702 0.0702 7.0047 7.0047 7.0047 7.0047 8.0239 8.0239 8.0239 8.0239 9.2755 9.2755 9.2755 9.2755 11.2791 11.2791 11.2791 11.2791 11.6683 11.6683 11.6683 11.6683 11.9789 11.9789 11.9789 11.9789 12.6274 12.6274 12.6274 12.6274 13.3075 13.3075 13.3075 13.3075 15.0196 15.0196 15.0196 15.0196 15.1590 15.1590 15.1590 15.1590 18.5552 18.5552 18.5552 18.5552 k = 0.0686 0.3649 0.3019 ( 2072 PWs) bands (ev): -2.5776 -2.5776 -2.5776 -2.5776 0.0535 0.0535 0.0535 0.0535 7.0025 7.0025 7.0025 7.0025 8.0720 8.0720 8.0720 8.0720 9.2532 9.2532 9.2532 9.2532 11.2769 11.2769 11.2769 11.2769 11.6988 11.6988 11.6988 11.6988 12.0001 12.0001 12.0001 12.0001 12.6382 12.6382 12.6382 12.6382 13.3585 13.3585 13.3585 13.3585 14.9914 14.9914 14.9914 14.9914 15.1721 15.1721 15.1721 15.1721 18.5538 18.5538 18.5538 18.5538 k = 0.0588 0.3649 0.3019 ( 2076 PWs) bands (ev): -2.5860 -2.5860 -2.5860 -2.5860 0.0389 0.0389 0.0389 0.0389 7.0003 7.0003 7.0003 7.0003 8.1155 8.1155 8.1155 8.1155 9.2322 9.2322 9.2322 9.2322 11.2743 11.2743 11.2743 11.2743 11.7251 11.7251 11.7251 11.7251 12.0188 12.0188 12.0188 12.0188 12.6472 12.6472 12.6472 12.6472 13.4075 13.4075 13.4075 13.4075 14.9636 14.9636 14.9636 14.9636 15.1873 15.1873 15.1873 15.1873 18.5518 18.5518 18.5518 18.5518 k = 0.0490 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.5933 -2.5933 -2.5933 -2.5933 0.0265 0.0265 0.0265 0.0265 6.9983 6.9983 6.9983 6.9983 8.1539 8.1539 8.1539 8.1539 9.2129 9.2129 9.2129 9.2129 11.2716 11.2716 11.2716 11.2716 11.7472 11.7472 11.7472 11.7472 12.0347 12.0347 12.0347 12.0347 12.6547 12.6547 12.6547 12.6547 13.4531 13.4531 13.4531 13.4531 14.9372 14.9372 14.9372 14.9372 15.2031 15.2031 15.2031 15.2031 18.5495 18.5495 18.5495 18.5495 k = 0.0392 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.5992 -2.5992 -2.5992 -2.5992 0.0163 0.0163 0.0163 0.0163 6.9966 6.9966 6.9966 6.9966 8.1866 8.1866 8.1866 8.1866 9.1959 9.1959 9.1959 9.1959 11.2690 11.2690 11.2690 11.2690 11.7651 11.7651 11.7651 11.7651 12.0478 12.0478 12.0478 12.0478 12.6606 12.6606 12.6606 12.6606 13.4935 13.4935 13.4935 13.4935 14.9135 14.9135 14.9135 14.9135 15.2182 15.2182 15.2182 15.2182 18.5471 18.5471 18.5471 18.5471 k = 0.0294 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.6038 -2.6038 -2.6038 -2.6038 0.0084 0.0084 0.0084 0.0084 6.9952 6.9952 6.9952 6.9952 8.2129 8.2129 8.2129 8.2129 9.1819 9.1819 9.1819 9.1819 11.2670 11.2670 11.2670 11.2670 11.7788 11.7788 11.7788 11.7788 12.0581 12.0581 12.0581 12.0581 12.6650 12.6650 12.6650 12.6650 13.5272 13.5272 13.5272 13.5272 14.8934 14.8934 14.8934 14.8934 15.2315 15.2315 15.2315 15.2315 18.5449 18.5449 18.5449 18.5449 k = 0.0196 0.3649 0.3019 ( 2088 PWs) bands (ev): -2.6071 -2.6071 -2.6071 -2.6071 0.0028 0.0028 0.0028 0.0028 6.9942 6.9942 6.9942 6.9942 8.2322 8.2322 8.2322 8.2322 9.1714 9.1714 9.1714 9.1714 11.2654 11.2654 11.2654 11.2654 11.7886 11.7886 11.7886 11.7886 12.0655 12.0655 12.0655 12.0655 12.6681 12.6681 12.6681 12.6681 13.5527 13.5527 13.5527 13.5527 14.8780 14.8780 14.8780 14.8780 15.2419 15.2419 15.2419 15.2419 18.5432 18.5432 18.5432 18.5432 k = 0.0098 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.6091 -2.6091 -2.6091 -2.6091 -0.0006 -0.0006 -0.0006 -0.0006 6.9936 6.9936 6.9936 6.9936 8.2440 8.2440 8.2440 8.2440 9.1649 9.1649 9.1649 9.1649 11.2644 11.2644 11.2644 11.2644 11.7944 11.7944 11.7944 11.7944 12.0701 12.0701 12.0701 12.0701 12.6699 12.6699 12.6699 12.6699 13.5685 13.5685 13.5685 13.5685 14.8684 14.8684 14.8684 14.8684 15.2485 15.2485 15.2485 15.2485 18.5421 18.5421 18.5421 18.5421 k = 0.0000 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.6097 -2.6097 -2.6097 -2.6097 -0.0017 -0.0017 -0.0017 -0.0017 6.9934 6.9934 6.9934 6.9934 8.2480 8.2480 8.2480 8.2480 9.1627 9.1627 9.1627 9.1627 11.2641 11.2641 11.2641 11.2641 11.7963 11.7963 11.7963 11.7963 12.0716 12.0716 12.0716 12.0716 12.6705 12.6705 12.6705 12.6705 13.5739 13.5739 13.5739 13.5739 14.8651 14.8651 14.8651 14.8651 15.2508 15.2508 15.2508 15.2508 18.5417 18.5417 18.5417 18.5417 k = 0.0000 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.6097 -2.6097 -2.6097 -2.6097 -0.0017 -0.0017 -0.0017 -0.0017 6.9934 6.9934 6.9934 6.9934 8.2480 8.2480 8.2480 8.2480 9.1627 9.1627 9.1627 9.1627 11.2641 11.2641 11.2641 11.2641 11.7963 11.7963 11.7963 11.7963 12.0716 12.0716 12.0716 12.0716 12.6705 12.6705 12.6705 12.6705 13.5739 13.5739 13.5739 13.5739 14.8651 14.8651 14.8651 14.8651 15.2508 15.2508 15.2508 15.2508 18.5417 18.5417 18.5417 18.5417 k = 0.0000 0.3553 0.3019 ( 2080 PWs) bands (ev): -2.6118 -2.6118 -2.6118 -2.6118 0.0021 0.0021 0.0021 0.0021 6.9903 6.9903 6.9903 6.9903 8.2510 8.2510 8.2510 8.2510 9.1635 9.1635 9.1635 9.1635 11.2614 11.2614 11.2614 11.2614 11.7958 11.7958 11.7958 11.7958 12.0702 12.0702 12.0702 12.0702 12.6679 12.6679 12.6679 12.6679 13.5706 13.5706 13.5706 13.5706 14.8666 14.8666 14.8666 14.8666 15.2560 15.2560 15.2560 15.2560 18.5374 18.5374 18.5374 18.5374 k = 0.0000 0.3457 0.3019 ( 2080 PWs) bands (ev): -2.6178 -2.6178 -2.6178 -2.6178 0.0135 0.0135 0.0135 0.0135 6.9810 6.9810 6.9810 6.9810 8.2597 8.2597 8.2597 8.2597 9.1657 9.1657 9.1657 9.1657 11.2534 11.2534 11.2534 11.2534 11.7944 11.7944 11.7944 11.7944 12.0658 12.0658 12.0658 12.0658 12.6603 12.6603 12.6603 12.6603 13.5608 13.5608 13.5608 13.5608 14.8712 14.8712 14.8712 14.8712 15.2716 15.2716 15.2716 15.2716 18.5246 18.5246 18.5246 18.5246 k = 0.0000 0.3361 0.3019 ( 2086 PWs) bands (ev): -2.6278 -2.6278 -2.6278 -2.6278 0.0323 0.0323 0.0323 0.0323 6.9658 6.9658 6.9658 6.9658 8.2738 8.2738 8.2738 8.2738 9.1694 9.1694 9.1694 9.1694 11.2397 11.2397 11.2397 11.2397 11.7921 11.7921 11.7921 11.7921 12.0586 12.0586 12.0586 12.0586 12.6481 12.6481 12.6481 12.6481 13.5450 13.5450 13.5450 13.5450 14.8785 14.8785 14.8785 14.8785 15.2970 15.2970 15.2970 15.2970 18.5044 18.5044 18.5044 18.5044 k = 0.0000 0.3265 0.3019 ( 2082 PWs) bands (ev): -2.6415 -2.6415 -2.6415 -2.6415 0.0583 0.0583 0.0583 0.0583 6.9451 6.9451 6.9451 6.9451 8.2927 8.2927 8.2927 8.2927 9.1748 9.1748 9.1748 9.1748 11.2203 11.2203 11.2203 11.2203 11.7894 11.7894 11.7894 11.7894 12.0485 12.0485 12.0485 12.0485 12.6319 12.6319 12.6319 12.6319 13.5240 13.5240 13.5240 13.5240 14.8883 14.8883 14.8883 14.8883 15.3316 15.3316 15.3316 15.3316 18.4779 18.4779 18.4779 18.4779 k = 0.0000 0.3169 0.3019 ( 2082 PWs) bands (ev): -2.6586 -2.6586 -2.6586 -2.6586 0.0912 0.0912 0.0912 0.0912 6.9196 6.9196 6.9196 6.9196 8.3159 8.3159 8.3159 8.3159 9.1816 9.1816 9.1816 9.1816 11.1947 11.1947 11.1947 11.1947 11.7865 11.7865 11.7865 11.7865 12.0357 12.0357 12.0357 12.0357 12.6123 12.6123 12.6123 12.6123 13.4985 13.4985 13.4985 13.4985 14.9000 14.9000 14.9000 14.9000 15.3746 15.3746 15.3746 15.3746 18.4462 18.4462 18.4462 18.4462 k = 0.0000 0.3073 0.3019 ( 2080 PWs) bands (ev): -2.6788 -2.6788 -2.6788 -2.6788 0.1307 0.1307 0.1307 0.1307 6.8898 6.8898 6.8898 6.8898 8.3426 8.3426 8.3426 8.3426 9.1899 9.1899 9.1899 9.1899 11.1630 11.1630 11.1630 11.1630 11.7838 11.7838 11.7838 11.7838 12.0199 12.0199 12.0199 12.0199 12.5900 12.5900 12.5900 12.5900 13.4696 13.4696 13.4696 13.4696 14.9134 14.9134 14.9134 14.9134 15.4250 15.4250 15.4250 15.4250 18.4103 18.4103 18.4103 18.4103 k = 0.0000 0.2977 0.3019 ( 2080 PWs) bands (ev): -2.7017 -2.7017 -2.7017 -2.7017 0.1764 0.1764 0.1764 0.1764 6.8562 6.8562 6.8562 6.8562 8.3720 8.3720 8.3720 8.3720 9.1996 9.1996 9.1996 9.1996 11.1249 11.1249 11.1249 11.1249 11.7815 11.7815 11.7815 11.7815 12.0015 12.0015 12.0015 12.0015 12.5660 12.5660 12.5660 12.5660 13.4382 13.4382 13.4382 13.4382 14.9278 14.9278 14.9278 14.9278 15.4819 15.4819 15.4819 15.4819 18.3710 18.3710 18.3710 18.3710 k = 0.0000 0.2881 0.3019 ( 2076 PWs) bands (ev): -2.7271 -2.7271 -2.7271 -2.7271 0.2278 0.2278 0.2278 0.2278 6.8194 6.8194 6.8194 6.8194 8.4033 8.4033 8.4033 8.4033 9.2109 9.2109 9.2109 9.2109 11.0808 11.0808 11.0808 11.0808 11.7798 11.7798 11.7798 11.7798 11.9806 11.9806 11.9806 11.9806 12.5409 12.5409 12.5409 12.5409 13.4050 13.4050 13.4050 13.4050 14.9428 14.9428 14.9428 14.9428 15.5444 15.5444 15.5444 15.5444 18.3288 18.3288 18.3288 18.3288 k = 0.0000 0.2785 0.3019 ( 2070 PWs) bands (ev): -2.7544 -2.7544 -2.7544 -2.7544 0.2846 0.2846 0.2846 0.2846 6.7800 6.7800 6.7800 6.7800 8.4358 8.4358 8.4358 8.4358 9.2237 9.2237 9.2237 9.2237 11.0307 11.0307 11.0307 11.0307 11.7785 11.7785 11.7785 11.7785 11.9575 11.9575 11.9575 11.9575 12.5153 12.5153 12.5153 12.5153 13.3710 13.3710 13.3710 13.3710 14.9582 14.9582 14.9582 14.9582 15.6117 15.6117 15.6117 15.6117 18.2840 18.2840 18.2840 18.2840 k = 0.0000 0.2689 0.3019 ( 2070 PWs) bands (ev): -2.7835 -2.7835 -2.7835 -2.7835 0.3462 0.3462 0.3462 0.3462 6.7381 6.7381 6.7381 6.7381 8.4686 8.4686 8.4686 8.4686 9.2378 9.2378 9.2378 9.2378 10.9756 10.9756 10.9756 10.9756 11.7773 11.7773 11.7773 11.7773 11.9328 11.9328 11.9328 11.9328 12.4898 12.4898 12.4898 12.4898 13.3368 13.3368 13.3368 13.3368 14.9733 14.9733 14.9733 14.9733 15.6829 15.6829 15.6829 15.6829 18.2371 18.2371 18.2371 18.2371 k = 0.0000 0.2593 0.3019 ( 2070 PWs) bands (ev): -2.8138 -2.8138 -2.8138 -2.8138 0.4122 0.4122 0.4122 0.4122 6.6945 6.6945 6.6945 6.6945 8.5011 8.5011 8.5011 8.5011 9.2533 9.2533 9.2533 9.2533 10.9159 10.9159 10.9159 10.9159 11.7750 11.7750 11.7750 11.7750 11.9077 11.9077 11.9077 11.9077 12.4647 12.4647 12.4647 12.4647 13.3028 13.3028 13.3028 13.3028 14.9882 14.9882 14.9882 14.9882 15.7575 15.7575 15.7575 15.7575 18.1882 18.1882 18.1882 18.1882 k = 0.0000 0.2497 0.3019 ( 2068 PWs) bands (ev): -2.8451 -2.8451 -2.8451 -2.8451 0.4823 0.4823 0.4823 0.4823 6.6492 6.6492 6.6492 6.6492 8.5325 8.5325 8.5325 8.5325 9.2703 9.2703 9.2703 9.2703 10.8526 10.8526 10.8526 10.8526 11.7694 11.7694 11.7694 11.7694 11.8848 11.8848 11.8848 11.8848 12.4405 12.4405 12.4405 12.4405 13.2697 13.2697 13.2697 13.2697 15.0024 15.0024 15.0024 15.0024 15.8347 15.8347 15.8347 15.8347 18.1375 18.1375 18.1375 18.1375 k = 0.0000 0.2401 0.3019 ( 2072 PWs) bands (ev): -2.8770 -2.8770 -2.8770 -2.8770 0.5559 0.5559 0.5559 0.5559 6.6026 6.6026 6.6026 6.6026 8.5619 8.5619 8.5619 8.5619 9.2886 9.2886 9.2886 9.2886 10.7870 10.7870 10.7870 10.7870 11.7566 11.7566 11.7566 11.7566 11.8678 11.8678 11.8678 11.8678 12.4171 12.4171 12.4171 12.4171 13.2377 13.2377 13.2377 13.2377 15.0158 15.0158 15.0158 15.0158 15.9141 15.9141 15.9141 15.9141 18.0851 18.0851 18.0851 18.0851 k = 0.0000 0.2305 0.3019 ( 2072 PWs) bands (ev): -2.9094 -2.9094 -2.9094 -2.9094 0.6328 0.6328 0.6328 0.6328 6.5549 6.5549 6.5549 6.5549 8.5888 8.5888 8.5888 8.5888 9.3083 9.3083 9.3083 9.3083 10.7202 10.7202 10.7202 10.7202 11.7338 11.7338 11.7338 11.7338 11.8598 11.8598 11.8598 11.8598 12.3948 12.3948 12.3948 12.3948 13.2071 13.2071 13.2071 13.2071 15.0284 15.0284 15.0284 15.0284 15.9951 15.9951 15.9951 15.9951 18.0312 18.0312 18.0312 18.0312 k = 0.0000 0.2209 0.3019 ( 2072 PWs) bands (ev): -2.9418 -2.9418 -2.9418 -2.9418 0.7124 0.7124 0.7124 0.7124 6.5062 6.5062 6.5062 6.5062 8.6123 8.6123 8.6123 8.6123 9.3293 9.3293 9.3293 9.3293 10.6534 10.6534 10.6534 10.6534 11.7019 11.7019 11.7019 11.7019 11.8599 11.8599 11.8599 11.8599 12.3737 12.3737 12.3737 12.3737 13.1781 13.1781 13.1781 13.1781 15.0400 15.0400 15.0400 15.0400 16.0772 16.0772 16.0772 16.0772 17.9759 17.9759 17.9759 17.9759 k = 0.0000 0.2113 0.3019 ( 2072 PWs) bands (ev): -2.9741 -2.9741 -2.9741 -2.9741 0.7944 0.7944 0.7944 0.7944 6.4567 6.4567 6.4567 6.4567 8.6316 8.6316 8.6316 8.6316 9.3516 9.3516 9.3516 9.3516 10.5880 10.5880 10.5880 10.5880 11.6637 11.6637 11.6637 11.6637 11.8654 11.8654 11.8654 11.8654 12.3538 12.3538 12.3538 12.3538 13.1508 13.1508 13.1508 13.1508 15.0506 15.0506 15.0506 15.0506 16.1601 16.1601 16.1601 16.1601 17.9195 17.9195 17.9195 17.9195 k = 0.0000 0.2017 0.3019 ( 2074 PWs) bands (ev): -3.0061 -3.0061 -3.0061 -3.0061 0.8784 0.8784 0.8784 0.8784 6.4066 6.4066 6.4066 6.4066 8.6462 8.6462 8.6462 8.6462 9.3751 9.3751 9.3751 9.3751 10.5251 10.5251 10.5251 10.5251 11.6213 11.6213 11.6213 11.6213 11.8742 11.8742 11.8742 11.8742 12.3352 12.3352 12.3352 12.3352 13.1253 13.1253 13.1253 13.1253 15.0601 15.0601 15.0601 15.0601 16.2433 16.2433 16.2433 16.2433 17.8621 17.8621 17.8621 17.8621 k = 0.0000 0.1921 0.3019 ( 2070 PWs) bands (ev): -3.0375 -3.0375 -3.0375 -3.0375 0.9640 0.9640 0.9640 0.9640 6.3559 6.3559 6.3559 6.3559 8.6555 8.6555 8.6555 8.6555 9.3999 9.3999 9.3999 9.3999 10.4660 10.4660 10.4660 10.4660 11.5759 11.5759 11.5759 11.5759 11.8854 11.8854 11.8854 11.8854 12.3179 12.3179 12.3179 12.3179 13.1015 13.1015 13.1015 13.1015 15.0687 15.0687 15.0687 15.0687 16.3263 16.3263 16.3263 16.3263 17.8039 17.8039 17.8039 17.8039 k = 0.0000 0.1825 0.3019 ( 2074 PWs) bands (ev): -3.0682 -3.0682 -3.0682 -3.0682 1.0508 1.0508 1.0508 1.0508 6.3048 6.3048 6.3048 6.3048 8.6589 8.6589 8.6589 8.6589 9.4258 9.4258 9.4258 9.4258 10.4117 10.4117 10.4117 10.4117 11.5283 11.5283 11.5283 11.5283 11.8980 11.8980 11.8980 11.8980 12.3018 12.3018 12.3018 12.3018 13.0795 13.0795 13.0795 13.0795 15.0763 15.0763 15.0763 15.0763 16.4089 16.4089 16.4089 16.4089 17.7453 17.7453 17.7453 17.7453 k = 0.0000 0.1729 0.3019 ( 2070 PWs) bands (ev): -3.0981 -3.0981 -3.0981 -3.0981 1.1385 1.1385 1.1385 1.1385 6.2532 6.2532 6.2532 6.2532 8.6560 8.6560 8.6560 8.6560 9.4528 9.4528 9.4528 9.4528 10.3630 10.3630 10.3630 10.3630 11.4790 11.4790 11.4790 11.4790 11.9116 11.9116 11.9116 11.9116 12.2873 12.2873 12.2873 12.2873 13.0592 13.0592 13.0592 13.0592 15.0829 15.0829 15.0829 15.0829 16.4907 16.4907 16.4907 16.4907 17.6864 17.6864 17.6864 17.6864 k = 0.0000 0.1633 0.3019 ( 2066 PWs) bands (ev): -3.1269 -3.1269 -3.1269 -3.1269 1.2265 1.2265 1.2265 1.2265 6.2015 6.2015 6.2015 6.2015 8.6469 8.6469 8.6469 8.6469 9.4808 9.4808 9.4808 9.4808 10.3207 10.3207 10.3207 10.3207 11.4286 11.4286 11.4286 11.4286 11.9259 11.9259 11.9259 11.9259 12.2743 12.2743 12.2743 12.2743 13.0405 13.0405 13.0405 13.0405 15.0886 15.0886 15.0886 15.0886 16.5712 16.5712 16.5712 16.5712 17.6276 17.6276 17.6276 17.6276 k = 0.0000 0.1537 0.3019 ( 2066 PWs) bands (ev): -3.1547 -3.1547 -3.1547 -3.1547 1.3145 1.3145 1.3145 1.3145 6.1496 6.1496 6.1496 6.1496 8.6316 8.6316 8.6316 8.6316 9.5097 9.5097 9.5097 9.5097 10.2848 10.2848 10.2848 10.2848 11.3774 11.3774 11.3774 11.3774 11.9403 11.9403 11.9403 11.9403 12.2629 12.2629 12.2629 12.2629 13.0233 13.0233 13.0233 13.0233 15.0935 15.0935 15.0935 15.0935 16.6501 16.6501 16.6501 16.6501 17.5693 17.5693 17.5693 17.5693 k = 0.0000 0.1441 0.3019 ( 2066 PWs) bands (ev): -3.1812 -3.1812 -3.1812 -3.1812 1.4020 1.4020 1.4020 1.4020 6.0977 6.0977 6.0977 6.0977 8.6107 8.6107 8.6107 8.6107 9.5394 9.5394 9.5394 9.5394 10.2555 10.2555 10.2555 10.2555 11.3257 11.3257 11.3257 11.3257 11.9544 11.9544 11.9544 11.9544 12.2535 12.2535 12.2535 12.2535 13.0076 13.0076 13.0076 13.0076 15.0976 15.0976 15.0976 15.0976 16.7269 16.7269 16.7269 16.7269 17.5116 17.5116 17.5116 17.5116 k = 0.0000 0.1345 0.3019 ( 2062 PWs) bands (ev): -3.2063 -3.2063 -3.2063 -3.2063 1.4885 1.4885 1.4885 1.4885 6.0461 6.0461 6.0461 6.0461 8.5850 8.5850 8.5850 8.5850 9.5698 9.5698 9.5698 9.5698 10.2324 10.2324 10.2324 10.2324 11.2739 11.2739 11.2739 11.2739 11.9679 11.9679 11.9679 11.9679 12.2460 12.2460 12.2460 12.2460 12.9934 12.9934 12.9934 12.9934 15.1010 15.1010 15.1010 15.1010 16.8014 16.8014 16.8014 16.8014 17.4552 17.4552 17.4552 17.4552 k = 0.0000 0.1248 0.3019 ( 2072 PWs) bands (ev): -3.2301 -3.2301 -3.2301 -3.2301 1.5734 1.5734 1.5734 1.5734 5.9948 5.9948 5.9948 5.9948 8.5551 8.5551 8.5551 8.5551 9.6008 9.6008 9.6008 9.6008 10.2151 10.2151 10.2151 10.2151 11.2222 11.2222 11.2222 11.2222 11.9801 11.9801 11.9801 11.9801 12.2407 12.2407 12.2407 12.2407 12.9804 12.9804 12.9804 12.9804 15.1037 15.1037 15.1037 15.1037 16.8731 16.8731 16.8731 16.8731 17.4003 17.4003 17.4003 17.4003 k = 0.0000 0.1152 0.3019 ( 2072 PWs) bands (ev): -3.2523 -3.2523 -3.2523 -3.2523 1.6563 1.6563 1.6563 1.6563 5.9443 5.9443 5.9443 5.9443 8.5224 8.5224 8.5224 8.5224 9.6322 9.6322 9.6322 9.6322 10.2028 10.2028 10.2028 10.2028 11.1711 11.1711 11.1711 11.1711 11.9909 11.9909 11.9909 11.9909 12.2379 12.2379 12.2379 12.2379 12.9688 12.9688 12.9688 12.9688 15.1059 15.1059 15.1059 15.1059 16.9415 16.9415 16.9415 16.9415 17.3473 17.3473 17.3473 17.3473 k = 0.0000 0.1056 0.3019 ( 2080 PWs) bands (ev): -3.2730 -3.2730 -3.2730 -3.2730 1.7365 1.7365 1.7365 1.7365 5.8947 5.8947 5.8947 5.8947 8.4878 8.4878 8.4878 8.4878 9.6637 9.6637 9.6637 9.6637 10.1947 10.1947 10.1947 10.1947 11.1210 11.1210 11.1210 11.1210 11.9999 11.9999 11.9999 11.9999 12.2375 12.2375 12.2375 12.2375 12.9583 12.9583 12.9583 12.9583 15.1075 15.1075 15.1075 15.1075 17.0063 17.0063 17.0063 17.0063 17.2968 17.2968 17.2968 17.2968 k = 0.0000 0.0960 0.3019 ( 2080 PWs) bands (ev): -3.2921 -3.2921 -3.2921 -3.2921 1.8134 1.8134 1.8134 1.8134 5.8466 5.8466 5.8466 5.8466 8.4524 8.4524 8.4524 8.4524 9.6951 9.6951 9.6951 9.6951 10.1901 10.1901 10.1901 10.1901 11.0721 11.0721 11.0721 11.0721 12.0070 12.0070 12.0070 12.0070 12.2395 12.2395 12.2395 12.2395 12.9489 12.9489 12.9489 12.9489 15.1087 15.1087 15.1087 15.1087 17.0666 17.0666 17.0666 17.0666 17.2495 17.2495 17.2495 17.2495 k = 0.0000 0.0864 0.3019 ( 2080 PWs) bands (ev): -3.3095 -3.3095 -3.3095 -3.3095 1.8863 1.8863 1.8863 1.8863 5.8004 5.8004 5.8004 5.8004 8.4174 8.4174 8.4174 8.4174 9.7263 9.7263 9.7263 9.7263 10.1882 10.1882 10.1882 10.1882 11.0250 11.0250 11.0250 11.0250 12.0122 12.0122 12.0122 12.0122 12.2436 12.2436 12.2436 12.2436 12.9406 12.9406 12.9406 12.9406 15.1094 15.1094 15.1094 15.1094 17.1207 17.1207 17.1207 17.1207 17.2072 17.2072 17.2072 17.2072 k = 0.0000 0.0768 0.3019 ( 2076 PWs) bands (ev): -3.3252 -3.3252 -3.3252 -3.3252 1.9545 1.9545 1.9545 1.9545 5.7566 5.7566 5.7566 5.7566 8.3837 8.3837 8.3837 8.3837 9.7567 9.7567 9.7567 9.7567 10.1884 10.1884 10.1884 10.1884 10.9800 10.9800 10.9800 10.9800 12.0157 12.0157 12.0157 12.0157 12.2494 12.2494 12.2494 12.2494 12.9334 12.9334 12.9334 12.9334 15.1099 15.1099 15.1099 15.1099 17.1472 17.1472 17.1472 17.1472 17.1913 17.1913 17.1913 17.1913 k = 0.0000 0.0672 0.3019 ( 2074 PWs) bands (ev): -3.3391 -3.3391 -3.3391 -3.3391 2.0172 2.0172 2.0172 2.0172 5.7158 5.7158 5.7158 5.7158 8.3521 8.3521 8.3521 8.3521 9.7859 9.7859 9.7859 9.7859 10.1899 10.1899 10.1899 10.1899 10.9376 10.9376 10.9376 10.9376 12.0177 12.0177 12.0177 12.0177 12.2564 12.2564 12.2564 12.2564 12.9270 12.9270 12.9270 12.9270 15.1102 15.1102 15.1102 15.1102 17.1190 17.1190 17.1190 17.1190 17.2288 17.2288 17.2288 17.2288 k = 0.0000 0.0576 0.3019 ( 2074 PWs) bands (ev): -3.3513 -3.3513 -3.3513 -3.3513 2.0736 2.0736 2.0736 2.0736 5.6785 5.6785 5.6785 5.6785 8.3234 8.3234 8.3234 8.3234 9.8134 9.8134 9.8134 9.8134 10.1922 10.1922 10.1922 10.1922 10.8986 10.8986 10.8986 10.8986 12.0186 12.0186 12.0186 12.0186 12.2637 12.2637 12.2637 12.2637 12.9216 12.9216 12.9216 12.9216 15.1102 15.1102 15.1102 15.1102 17.0871 17.0871 17.0871 17.0871 17.2688 17.2688 17.2688 17.2688 k = 0.0000 0.0480 0.3019 ( 2086 PWs) bands (ev): -3.3616 -3.3616 -3.3616 -3.3616 2.1230 2.1230 2.1230 2.1230 5.6456 5.6456 5.6456 5.6456 8.2981 8.2981 8.2981 8.2981 9.8384 9.8384 9.8384 9.8384 10.1949 10.1949 10.1949 10.1949 10.8635 10.8635 10.8635 10.8635 12.0186 12.0186 12.0186 12.0186 12.2710 12.2710 12.2710 12.2710 12.9171 12.9171 12.9171 12.9171 15.1101 15.1101 15.1101 15.1101 17.0588 17.0588 17.0588 17.0588 17.3040 17.3040 17.3040 17.3040 k = 0.0000 0.0384 0.3019 ( 2090 PWs) bands (ev): -3.3700 -3.3700 -3.3700 -3.3700 2.1646 2.1646 2.1646 2.1646 5.6175 5.6175 5.6175 5.6175 8.2768 8.2768 8.2768 8.2768 9.8606 9.8606 9.8606 9.8606 10.1976 10.1976 10.1976 10.1976 10.8332 10.8332 10.8332 10.8332 12.0183 12.0183 12.0183 12.0183 12.2777 12.2777 12.2777 12.2777 12.9134 12.9134 12.9134 12.9134 15.1100 15.1100 15.1100 15.1100 17.0350 17.0350 17.0350 17.0350 17.3335 17.3335 17.3335 17.3335 k = 0.0000 0.0288 0.3019 ( 2086 PWs) bands (ev): -3.3767 -3.3767 -3.3767 -3.3767 2.1978 2.1978 2.1978 2.1978 5.5950 5.5950 5.5950 5.5950 8.2598 8.2598 8.2598 8.2598 9.8789 9.8789 9.8789 9.8789 10.2000 10.2000 10.2000 10.2000 10.8086 10.8086 10.8086 10.8086 12.0178 12.0178 12.0178 12.0178 12.2833 12.2833 12.2833 12.2833 12.9106 12.9106 12.9106 12.9106 15.1098 15.1098 15.1098 15.1098 17.0162 17.0162 17.0162 17.0162 17.3567 17.3567 17.3567 17.3567 k = 0.0000 0.0192 0.3019 ( 2086 PWs) bands (ev): -3.3814 -3.3814 -3.3814 -3.3814 2.2219 2.2219 2.2219 2.2219 5.5784 5.5784 5.5784 5.5784 8.2475 8.2475 8.2475 8.2475 9.8927 9.8927 9.8927 9.8927 10.2018 10.2018 10.2018 10.2018 10.7902 10.7902 10.7902 10.7902 12.0174 12.0174 12.0174 12.0174 12.2876 12.2876 12.2876 12.2876 12.9086 12.9086 12.9086 12.9086 15.1097 15.1097 15.1097 15.1097 17.0026 17.0026 17.0026 17.0026 17.3735 17.3735 17.3735 17.3735 k = 0.0000 0.0096 0.3019 ( 2086 PWs) bands (ev): -3.3842 -3.3842 -3.3842 -3.3842 2.2366 2.2366 2.2366 2.2366 5.5683 5.5683 5.5683 5.5683 8.2400 8.2400 8.2400 8.2400 9.9013 9.9013 9.9013 9.9013 10.2030 10.2030 10.2030 10.2030 10.7789 10.7789 10.7789 10.7789 12.0171 12.0171 12.0171 12.0171 12.2902 12.2902 12.2902 12.2902 12.9075 12.9075 12.9075 12.9075 15.1096 15.1096 15.1096 15.1096 16.9944 16.9944 16.9944 16.9944 17.3836 17.3836 17.3836 17.3836 k = 0.0000 0.0000 0.3019 ( 2088 PWs) bands (ev): -3.3852 -3.3852 -3.3852 -3.3852 2.2415 2.2415 2.2415 2.2415 5.5649 5.5649 5.5649 5.5649 8.2375 8.2375 8.2375 8.2375 9.9042 9.9042 9.9042 9.9042 10.2034 10.2034 10.2034 10.2034 10.7750 10.7750 10.7750 10.7750 12.0169 12.0169 12.0169 12.0169 12.2911 12.2911 12.2911 12.2911 12.9071 12.9071 12.9071 12.9071 15.1095 15.1095 15.1095 15.1095 16.9916 16.9916 16.9916 16.9916 17.3870 17.3870 17.3870 17.3870 k = 0.0000 0.3649-0.0000 ( 2072 PWs) bands (ev): -2.9454 -2.9454 -2.9454 -2.9454 1.0568 1.0568 1.0568 1.0568 5.0221 5.0221 5.0221 5.0221 9.2586 9.2586 9.2586 9.2586 9.6452 9.6452 9.6452 9.6452 10.7101 10.7101 10.7101 10.7101 11.5921 11.5921 11.5921 11.5921 12.0101 12.0101 12.0101 12.0101 12.2964 12.2964 12.2964 12.2964 13.9214 13.9214 13.9214 13.9214 15.5637 15.5637 15.5637 15.5637 16.6743 16.6743 16.6743 16.6743 17.1715 17.1715 17.1715 17.1715 k = 0.0000 0.3649 0.0097 ( 2072 PWs) bands (ev): -2.9447 -2.9447 -2.9447 -2.9447 1.0536 1.0536 1.0536 1.0536 5.0265 5.0265 5.0265 5.0265 9.2583 9.2583 9.2583 9.2583 9.6417 9.6417 9.6417 9.6417 10.7136 10.7136 10.7136 10.7136 11.5931 11.5931 11.5931 11.5931 12.0098 12.0098 12.0098 12.0098 12.2953 12.2953 12.2953 12.2953 13.9207 13.9207 13.9207 13.9207 15.5628 15.5628 15.5628 15.5628 16.6655 16.6655 16.6655 16.6655 17.1797 17.1797 17.1797 17.1797 k = 0.0000 0.3649 0.0195 ( 2074 PWs) bands (ev): -2.9426 -2.9426 -2.9426 -2.9426 1.0441 1.0441 1.0441 1.0441 5.0398 5.0398 5.0398 5.0398 9.2575 9.2575 9.2575 9.2575 9.6310 9.6310 9.6310 9.6310 10.7242 10.7242 10.7242 10.7242 11.5961 11.5961 11.5961 11.5961 12.0086 12.0086 12.0086 12.0086 12.2922 12.2922 12.2922 12.2922 13.9189 13.9189 13.9189 13.9189 15.5599 15.5599 15.5599 15.5599 16.6403 16.6403 16.6403 16.6403 17.2027 17.2027 17.2027 17.2027 k = 0.0000 0.3649 0.0292 ( 2078 PWs) bands (ev): -2.9390 -2.9390 -2.9390 -2.9390 1.0286 1.0286 1.0286 1.0286 5.0616 5.0616 5.0616 5.0616 9.2562 9.2562 9.2562 9.2562 9.6137 9.6137 9.6137 9.6137 10.7414 10.7414 10.7414 10.7414 11.6011 11.6011 11.6011 11.6011 12.0066 12.0066 12.0066 12.0066 12.2873 12.2873 12.2873 12.2873 13.9158 13.9158 13.9158 13.9158 15.5552 15.5552 15.5552 15.5552 16.6023 16.6023 16.6023 16.6023 17.2372 17.2372 17.2372 17.2372 k = 0.0000 0.3649 0.0390 ( 2076 PWs) bands (ev): -2.9341 -2.9341 -2.9341 -2.9341 1.0072 1.0072 1.0072 1.0072 5.0919 5.0919 5.0919 5.0919 9.2544 9.2544 9.2544 9.2544 9.5904 9.5904 9.5904 9.5904 10.7646 10.7646 10.7646 10.7646 11.6081 11.6081 11.6081 11.6081 12.0036 12.0036 12.0036 12.0036 12.2810 12.2810 12.2810 12.2810 13.9114 13.9114 13.9114 13.9114 15.5486 15.5486 15.5486 15.5486 16.5547 16.5547 16.5547 16.5547 17.2798 17.2798 17.2798 17.2798 k = 0.0000 0.3649 0.0487 ( 2080 PWs) bands (ev): -2.9278 -2.9278 -2.9278 -2.9278 0.9803 0.9803 0.9803 0.9803 5.1301 5.1301 5.1301 5.1301 9.2521 9.2521 9.2521 9.2521 9.5615 9.5615 9.5615 9.5615 10.7928 10.7928 10.7928 10.7928 11.6169 11.6169 11.6169 11.6169 11.9993 11.9993 11.9993 11.9993 12.2737 12.2737 12.2737 12.2737 13.9059 13.9059 13.9059 13.9059 15.5404 15.5404 15.5404 15.5404 16.5003 16.5003 16.5003 16.5003 17.3277 17.3277 17.3277 17.3277 k = 0.0000 0.3649 0.0584 ( 2088 PWs) bands (ev): -2.9202 -2.9202 -2.9202 -2.9202 0.9484 0.9484 0.9484 0.9484 5.1759 5.1759 5.1759 5.1759 9.2493 9.2493 9.2493 9.2493 9.5277 9.5277 9.5277 9.5277 10.8254 10.8254 10.8254 10.8254 11.6275 11.6275 11.6275 11.6275 11.9934 11.9934 11.9934 11.9934 12.2660 12.2660 12.2660 12.2660 13.8990 13.8990 13.8990 13.8990 15.5306 15.5306 15.5306 15.5306 16.4408 16.4408 16.4408 16.4408 17.3792 17.3792 17.3792 17.3792 k = 0.0000 0.3649 0.0682 ( 2088 PWs) bands (ev): -2.9114 -2.9114 -2.9114 -2.9114 0.9121 0.9121 0.9121 0.9121 5.2287 5.2287 5.2287 5.2287 9.2461 9.2461 9.2461 9.2461 9.4899 9.4899 9.4899 9.4899 10.8614 10.8614 10.8614 10.8614 11.6400 11.6400 11.6400 11.6400 11.9857 11.9857 11.9857 11.9857 12.2587 12.2587 12.2587 12.2587 13.8910 13.8910 13.8910 13.8910 15.5194 15.5194 15.5194 15.5194 16.3772 16.3772 16.3772 16.3772 17.4331 17.4331 17.4331 17.4331 k = 0.0000 0.3649 0.0779 ( 2092 PWs) bands (ev): -2.9013 -2.9013 -2.9013 -2.9013 0.8717 0.8717 0.8717 0.8717 5.2879 5.2879 5.2879 5.2879 9.2425 9.2425 9.2425 9.2425 9.4485 9.4485 9.4485 9.4485 10.9001 10.9001 10.9001 10.9001 11.6540 11.6540 11.6540 11.6540 11.9759 11.9759 11.9759 11.9759 12.2525 12.2525 12.2525 12.2525 13.8818 13.8818 13.8818 13.8818 15.5069 15.5069 15.5069 15.5069 16.3104 16.3104 16.3104 16.3104 17.4886 17.4886 17.4886 17.4886 k = 0.0000 0.3649 0.0877 ( 2084 PWs) bands (ev): -2.8900 -2.8900 -2.8900 -2.8900 0.8279 0.8279 0.8279 0.8279 5.3531 5.3531 5.3531 5.3531 9.2386 9.2386 9.2386 9.2386 9.4039 9.4039 9.4039 9.4039 10.9406 10.9406 10.9406 10.9406 11.6697 11.6697 11.6697 11.6697 11.9639 11.9639 11.9639 11.9639 12.2481 12.2481 12.2481 12.2481 13.8714 13.8714 13.8714 13.8714 15.4933 15.4933 15.4933 15.4933 16.2408 16.2408 16.2408 16.2408 17.5453 17.5453 17.5453 17.5453 k = 0.0000 0.3649 0.0974 ( 2092 PWs) bands (ev): -2.8777 -2.8777 -2.8777 -2.8777 0.7813 0.7813 0.7813 0.7813 5.4236 5.4236 5.4236 5.4236 9.2344 9.2344 9.2344 9.2344 9.3564 9.3564 9.3564 9.3564 10.9821 10.9821 10.9821 10.9821 11.6866 11.6866 11.6866 11.6866 11.9497 11.9497 11.9497 11.9497 12.2461 12.2461 12.2461 12.2461 13.8599 13.8599 13.8599 13.8599 15.4787 15.4787 15.4787 15.4787 16.1688 16.1688 16.1688 16.1688 17.6027 17.6027 17.6027 17.6027 k = 0.0000 0.3649 0.1071 ( 2090 PWs) bands (ev): -2.8643 -2.8643 -2.8643 -2.8643 0.7324 0.7324 0.7324 0.7324 5.4988 5.4988 5.4988 5.4988 9.2298 9.2298 9.2298 9.2298 9.3066 9.3066 9.3066 9.3066 11.0239 11.0239 11.0239 11.0239 11.7049 11.7049 11.7049 11.7049 11.9335 11.9335 11.9335 11.9335 12.2469 12.2469 12.2469 12.2469 13.8472 13.8472 13.8472 13.8472 15.4635 15.4635 15.4635 15.4635 16.0947 16.0947 16.0947 16.0947 17.6605 17.6605 17.6605 17.6605 k = 0.0000 0.3649 0.1169 ( 2088 PWs) bands (ev): -2.8501 -2.8501 -2.8501 -2.8501 0.6817 0.6817 0.6817 0.6817 5.5783 5.5783 5.5783 5.5783 9.2244 9.2244 9.2244 9.2244 9.2551 9.2551 9.2551 9.2551 11.0652 11.0652 11.0652 11.0652 11.7241 11.7241 11.7241 11.7241 11.9160 11.9160 11.9160 11.9160 12.2508 12.2508 12.2508 12.2508 13.8335 13.8335 13.8335 13.8335 15.4477 15.4477 15.4477 15.4477 16.0188 16.0188 16.0188 16.0188 17.7185 17.7185 17.7185 17.7185 k = 0.0000 0.3649 0.1266 ( 2088 PWs) bands (ev): -2.8350 -2.8350 -2.8350 -2.8350 0.6299 0.6299 0.6299 0.6299 5.6613 5.6613 5.6613 5.6613 9.1978 9.1978 9.1978 9.1978 9.2226 9.2226 9.2226 9.2226 11.1053 11.1053 11.1053 11.1053 11.7438 11.7438 11.7438 11.7438 11.8980 11.8980 11.8980 11.8980 12.2579 12.2579 12.2579 12.2579 13.8188 13.8188 13.8188 13.8188 15.4315 15.4315 15.4315 15.4315 15.9415 15.9415 15.9415 15.9415 17.7765 17.7765 17.7765 17.7765 k = 0.0000 0.3649 0.1364 ( 2078 PWs) bands (ev): -2.8193 -2.8193 -2.8193 -2.8193 0.5774 0.5774 0.5774 0.5774 5.7473 5.7473 5.7473 5.7473 9.1428 9.1428 9.1428 9.1428 9.2167 9.2167 9.2167 9.2167 11.1433 11.1433 11.1433 11.1433 11.7636 11.7636 11.7636 11.7636 11.8809 11.8809 11.8809 11.8809 12.2685 12.2685 12.2685 12.2685 13.8032 13.8032 13.8032 13.8032 15.4152 15.4152 15.4152 15.4152 15.8630 15.8630 15.8630 15.8630 17.8343 17.8343 17.8343 17.8343 k = 0.0000 0.3649 0.1461 ( 2078 PWs) bands (ev): -2.8030 -2.8030 -2.8030 -2.8030 0.5248 0.5248 0.5248 0.5248 5.8359 5.8359 5.8359 5.8359 9.0850 9.0850 9.0850 9.0850 9.2116 9.2116 9.2116 9.2116 11.1783 11.1783 11.1783 11.1783 11.7818 11.7818 11.7818 11.7818 11.8665 11.8665 11.8665 11.8665 12.2822 12.2822 12.2822 12.2822 13.7868 13.7868 13.7868 13.7868 15.3988 15.3988 15.3988 15.3988 15.7836 15.7836 15.7836 15.7836 17.8917 17.8917 17.8917 17.8917 k = 0.0000 0.3649 0.1558 ( 2078 PWs) bands (ev): -2.7862 -2.7862 -2.7862 -2.7862 0.4724 0.4724 0.4724 0.4724 5.9264 5.9264 5.9264 5.9264 9.0256 9.0256 9.0256 9.0256 9.2066 9.2066 9.2066 9.2066 11.2095 11.2095 11.2095 11.2095 11.7948 11.7948 11.7948 11.7948 11.8592 11.8592 11.8592 11.8592 12.2993 12.2993 12.2993 12.2993 13.7698 13.7698 13.7698 13.7698 15.3826 15.3826 15.3826 15.3826 15.7039 15.7039 15.7039 15.7039 17.9486 17.9486 17.9486 17.9486 k = 0.0000 0.3649 0.1656 ( 2074 PWs) bands (ev): -2.7693 -2.7693 -2.7693 -2.7693 0.4209 0.4209 0.4209 0.4209 6.0183 6.0183 6.0183 6.0183 8.9646 8.9646 8.9646 8.9646 9.2018 9.2018 9.2018 9.2018 11.2364 11.2364 11.2364 11.2364 11.7977 11.7977 11.7977 11.7977 11.8645 11.8645 11.8645 11.8645 12.3196 12.3196 12.3196 12.3196 13.7522 13.7522 13.7522 13.7522 15.3665 15.3665 15.3665 15.3665 15.6241 15.6241 15.6241 15.6241 18.0049 18.0049 18.0049 18.0049 k = 0.0000 0.3649 0.1753 ( 2074 PWs) bands (ev): -2.7522 -2.7522 -2.7522 -2.7522 0.3705 0.3705 0.3705 0.3705 6.1111 6.1111 6.1111 6.1111 8.9023 8.9023 8.9023 8.9023 9.1971 9.1971 9.1971 9.1971 11.2582 11.2582 11.2582 11.2582 11.7930 11.7930 11.7930 11.7930 11.8802 11.8802 11.8802 11.8802 12.3432 12.3432 12.3432 12.3432 13.7342 13.7342 13.7342 13.7342 15.3507 15.3507 15.3507 15.3507 15.5451 15.5451 15.5451 15.5451 18.0603 18.0603 18.0603 18.0603 k = 0.0000 0.3649 0.1851 ( 2074 PWs) bands (ev): -2.7352 -2.7352 -2.7352 -2.7352 0.3219 0.3219 0.3219 0.3219 6.2042 6.2042 6.2042 6.2042 8.8389 8.8389 8.8389 8.8389 9.1925 9.1925 9.1925 9.1925 11.2747 11.2747 11.2747 11.2747 11.7868 11.7868 11.7868 11.7868 11.9003 11.9003 11.9003 11.9003 12.3696 12.3696 12.3696 12.3696 13.7161 13.7161 13.7161 13.7161 15.3349 15.3349 15.3349 15.3349 15.4676 15.4676 15.4676 15.4676 18.1146 18.1146 18.1146 18.1146 k = 0.0000 0.3649 0.1948 ( 2082 PWs) bands (ev): -2.7185 -2.7185 -2.7185 -2.7185 0.2753 0.2753 0.2753 0.2753 6.2969 6.2969 6.2969 6.2969 8.7747 8.7747 8.7747 8.7747 9.1882 9.1882 9.1882 9.1882 11.2859 11.2859 11.2859 11.2859 11.7819 11.7819 11.7819 11.7819 11.9218 11.9218 11.9218 11.9218 12.3986 12.3986 12.3986 12.3986 13.6980 13.6980 13.6980 13.6980 15.3173 15.3173 15.3173 15.3173 15.3941 15.3941 15.3941 15.3941 18.1677 18.1677 18.1677 18.1677 k = 0.0000 0.3649 0.2045 ( 2086 PWs) bands (ev): -2.7023 -2.7023 -2.7023 -2.7023 0.2312 0.2312 0.2312 0.2312 6.3887 6.3887 6.3887 6.3887 8.7100 8.7100 8.7100 8.7100 9.1841 9.1841 9.1841 9.1841 11.2922 11.2922 11.2922 11.2922 11.7792 11.7792 11.7792 11.7792 11.9435 11.9435 11.9435 11.9435 12.4299 12.4299 12.4299 12.4299 13.6801 13.6801 13.6801 13.6801 15.2876 15.2876 15.2876 15.2876 15.3359 15.3359 15.3359 15.3359 18.2193 18.2193 18.2193 18.2193 k = 0.0000 0.3649 0.2143 ( 2090 PWs) bands (ev): -2.6868 -2.6868 -2.6868 -2.6868 0.1899 0.1899 0.1899 0.1899 6.4786 6.4786 6.4786 6.4786 8.6454 8.6454 8.6454 8.6454 9.1802 9.1802 9.1802 9.1802 11.2944 11.2944 11.2944 11.2944 11.7786 11.7786 11.7786 11.7786 11.9645 11.9645 11.9645 11.9645 12.4627 12.4627 12.4627 12.4627 13.6628 13.6628 13.6628 13.6628 15.2298 15.2298 15.2298 15.2298 15.3095 15.3095 15.3095 15.3095 18.2692 18.2692 18.2692 18.2692 k = 0.0000 0.3649 0.2240 ( 2090 PWs) bands (ev): -2.6721 -2.6721 -2.6721 -2.6721 0.1518 0.1518 0.1518 0.1518 6.5660 6.5660 6.5660 6.5660 8.5814 8.5814 8.5814 8.5814 9.1767 9.1767 9.1767 9.1767 11.2934 11.2934 11.2934 11.2934 11.7796 11.7796 11.7796 11.7796 11.9847 11.9847 11.9847 11.9847 12.4963 12.4963 12.4963 12.4963 13.6463 13.6463 13.6463 13.6463 15.1646 15.1646 15.1646 15.1646 15.2953 15.2953 15.2953 15.2953 18.3169 18.3169 18.3169 18.3169 k = 0.0000 0.3649 0.2338 ( 2084 PWs) bands (ev): -2.6586 -2.6586 -2.6586 -2.6586 0.1174 0.1174 0.1174 0.1174 6.6497 6.6497 6.6497 6.6497 8.5189 8.5189 8.5189 8.5189 9.1736 9.1736 9.1736 9.1736 11.2901 11.2901 11.2901 11.2901 11.7820 11.7820 11.7820 11.7820 12.0034 12.0034 12.0034 12.0034 12.5297 12.5297 12.5297 12.5297 13.6308 13.6308 13.6308 13.6308 15.1019 15.1019 15.1019 15.1019 15.2844 15.2844 15.2844 15.2844 18.3621 18.3621 18.3621 18.3621 k = 0.0000 0.3649 0.2435 ( 2088 PWs) bands (ev): -2.6463 -2.6463 -2.6463 -2.6463 0.0867 0.0867 0.0867 0.0867 6.7285 6.7285 6.7285 6.7285 8.4589 8.4589 8.4589 8.4589 9.1708 9.1708 9.1708 9.1708 11.2853 11.2853 11.2853 11.2853 11.7848 11.7848 11.7848 11.7848 12.0204 12.0204 12.0204 12.0204 12.5619 12.5619 12.5619 12.5619 13.6168 13.6168 13.6168 13.6168 15.0440 15.0440 15.0440 15.0440 15.2754 15.2754 15.2754 15.2754 18.4041 18.4041 18.4041 18.4041 k = 0.0000 0.3649 0.2532 ( 2084 PWs) bands (ev): -2.6356 -2.6356 -2.6356 -2.6356 0.0603 0.0603 0.0603 0.0603 6.8009 6.8009 6.8009 6.8009 8.4027 8.4027 8.4027 8.4027 9.1684 9.1684 9.1684 9.1684 11.2801 11.2801 11.2801 11.2801 11.7877 11.7877 11.7877 11.7877 12.0354 12.0354 12.0354 12.0354 12.5918 12.5918 12.5918 12.5918 13.6043 13.6043 13.6043 13.6043 14.9925 14.9925 14.9925 14.9925 15.2678 15.2678 15.2678 15.2678 18.4422 18.4422 18.4422 18.4422 k = 0.0000 0.3649 0.2630 ( 2092 PWs) bands (ev): -2.6265 -2.6265 -2.6265 -2.6265 0.0383 0.0383 0.0383 0.0383 6.8650 6.8650 6.8650 6.8650 8.3522 8.3522 8.3522 8.3522 9.1663 9.1663 9.1663 9.1663 11.2749 11.2749 11.2749 11.2749 11.7905 11.7905 11.7905 11.7905 12.0479 12.0479 12.0479 12.0479 12.6183 12.6183 12.6183 12.6183 13.5937 13.5937 13.5937 13.5937 14.9483 14.9483 14.9483 14.9483 15.2617 15.2617 15.2617 15.2617 18.4757 18.4757 18.4757 18.4757 k = 0.0000 0.3649 0.2727 ( 2088 PWs) bands (ev): -2.6193 -2.6193 -2.6193 -2.6193 0.0209 0.0209 0.0209 0.0209 6.9185 6.9185 6.9185 6.9185 8.3092 8.3092 8.3092 8.3092 9.1647 9.1647 9.1647 9.1647 11.2705 11.2705 11.2705 11.2705 11.7929 11.7929 11.7929 11.7929 12.0581 12.0581 12.0581 12.0581 12.6403 12.6403 12.6403 12.6403 13.5852 13.5852 13.5852 13.5852 14.9127 14.9127 14.9127 14.9127 15.2569 15.2569 15.2569 15.2569 18.5034 18.5034 18.5034 18.5034 k = 0.0000 0.3649 0.2825 ( 2082 PWs) bands (ev): -2.6140 -2.6140 -2.6140 -2.6140 0.0084 0.0084 0.0084 0.0084 6.9592 6.9592 6.9592 6.9592 8.2762 8.2762 8.2762 8.2762 9.1636 9.1636 9.1636 9.1636 11.2670 11.2670 11.2670 11.2670 11.7948 11.7948 11.7948 11.7948 12.0656 12.0656 12.0656 12.0656 12.6568 12.6568 12.6568 12.6568 13.5790 13.5790 13.5790 13.5790 14.8865 14.8865 14.8865 14.8865 15.2535 15.2535 15.2535 15.2535 18.5243 18.5243 18.5243 18.5243 k = 0.0000 0.3649 0.2922 ( 2080 PWs) bands (ev): -2.6108 -2.6108 -2.6108 -2.6108 0.0008 0.0008 0.0008 0.0008 6.9847 6.9847 6.9847 6.9847 8.2552 8.2552 8.2552 8.2552 9.1629 9.1629 9.1629 9.1629 11.2648 11.2648 11.2648 11.2648 11.7959 11.7959 11.7959 11.7959 12.0701 12.0701 12.0701 12.0701 12.6670 12.6670 12.6670 12.6670 13.5752 13.5752 13.5752 13.5752 14.8705 14.8705 14.8705 14.8705 15.2515 15.2515 15.2515 15.2515 18.5373 18.5373 18.5373 18.5373 k = 0.0000 0.3649 0.3019 ( 2080 PWs) bands (ev): -2.6097 -2.6097 -2.6097 -2.6097 -0.0017 -0.0017 -0.0017 -0.0017 6.9934 6.9934 6.9934 6.9934 8.2480 8.2480 8.2480 8.2480 9.1627 9.1627 9.1627 9.1627 11.2641 11.2641 11.2641 11.2641 11.7963 11.7963 11.7963 11.7963 12.0716 12.0716 12.0716 12.0716 12.6705 12.6705 12.6705 12.6705 13.5739 13.5739 13.5739 13.5739 14.8651 14.8651 14.8651 14.8651 15.2508 15.2508 15.2508 15.2508 18.5417 18.5417 18.5417 18.5417 k = 0.5000-0.0000 0.3019 ( 2104 PWs) bands (ev): -2.0639 -2.0639 -2.0631 -2.0631 1.9024 1.9024 1.9050 1.9050 5.7263 5.7263 5.7367 5.7367 7.5573 7.5573 7.5754 7.5754 8.4816 8.4816 8.4884 8.4884 10.1469 10.1469 10.1667 10.1667 11.2947 11.2947 11.3062 11.3062 11.4497 11.4497 11.4536 11.4536 11.5156 11.5156 11.5204 11.5204 12.7246 12.7246 12.7539 12.7539 14.2901 14.2901 14.3551 14.3551 15.2629 15.2629 15.3031 15.3031 18.1304 18.1304 18.1461 18.1461 k = 0.5000-0.0000 0.2922 ( 2112 PWs) bands (ev): -2.0644 -2.0644 -2.0636 -2.0636 1.9040 1.9040 1.9066 1.9066 5.7262 5.7262 5.7366 5.7366 7.5565 7.5565 7.5745 7.5745 8.4824 8.4824 8.4892 8.4892 10.1477 10.1477 10.1675 10.1675 11.2642 11.2642 11.2682 11.2682 11.4543 11.4543 11.4863 11.4863 11.5221 11.5221 11.5379 11.5379 12.7246 12.7246 12.7538 12.7538 14.2925 14.2925 14.3572 14.3572 15.2632 15.2632 15.3034 15.3034 18.1284 18.1284 18.1441 18.1441 k = 0.5000-0.0000 0.2825 ( 2112 PWs) bands (ev): -2.0660 -2.0660 -2.0651 -2.0651 1.9087 1.9087 1.9113 1.9113 5.7261 5.7261 5.7364 5.7364 7.5539 7.5539 7.5720 7.5720 8.4849 8.4849 8.4918 8.4918 10.1502 10.1502 10.1699 10.1699 11.1929 11.1929 11.1959 11.1959 11.4612 11.4612 11.5247 11.5247 11.5482 11.5482 11.5884 11.5884 12.7248 12.7248 12.7539 12.7539 14.2995 14.2995 14.3636 14.3636 15.2643 15.2643 15.3044 15.3044 18.1225 18.1225 18.1381 18.1381 k = 0.5000-0.0000 0.2727 ( 2116 PWs) bands (ev): -2.0685 -2.0685 -2.0677 -2.0677 1.9166 1.9166 1.9191 1.9191 5.7258 5.7258 5.7361 5.7361 7.5497 7.5497 7.5678 7.5678 8.4890 8.4890 8.4960 8.4960 10.1542 10.1542 10.1739 10.1739 11.1059 11.1059 11.1121 11.1121 11.4692 11.4692 11.5322 11.5322 11.6100 11.6100 11.6462 11.6462 12.7251 12.7251 12.7540 12.7540 14.3110 14.3110 14.3742 14.3742 15.2661 15.2661 15.3060 15.3060 18.1122 18.1122 18.1278 18.1278 k = 0.5000-0.0000 0.2630 ( 2104 PWs) bands (ev): -2.0720 -2.0720 -2.0712 -2.0712 1.9275 1.9275 1.9300 1.9300 5.7256 5.7256 5.7357 5.7357 7.5440 7.5440 7.5623 7.5623 8.4946 8.4946 8.5017 8.5017 10.1599 10.1599 10.1794 10.1794 11.0127 11.0127 11.0204 11.0204 11.4795 11.4795 11.5418 11.5418 11.6695 11.6695 11.7035 11.7035 12.7256 12.7256 12.7542 12.7542 14.3268 14.3268 14.3886 14.3886 15.2686 15.2686 15.3082 15.3082 18.0973 18.0973 18.1128 18.1128 k = 0.5000-0.0000 0.2532 ( 2104 PWs) bands (ev): -2.0764 -2.0764 -2.0756 -2.0756 1.9413 1.9413 1.9438 1.9438 5.7253 5.7253 5.7352 5.7352 7.5371 7.5371 7.5555 7.5555 8.5013 8.5013 8.5086 8.5086 10.1672 10.1672 10.1865 10.1865 10.9152 10.9152 10.9233 10.9233 11.4920 11.4920 11.5540 11.5540 11.7244 11.7244 11.7573 11.7573 12.7261 12.7261 12.7543 12.7543 14.3463 14.3463 14.4065 14.4065 15.2717 15.2717 15.3109 15.3109 18.0772 18.0772 18.0925 18.0925 k = 0.5000-0.0000 0.2435 ( 2100 PWs) bands (ev): -2.0817 -2.0817 -2.0809 -2.0809 1.9579 1.9579 1.9604 1.9604 5.7249 5.7249 5.7345 5.7345 7.5292 7.5292 7.5477 7.5477 8.5089 8.5089 8.5165 8.5165 10.1760 10.1760 10.1951 10.1951 10.8145 10.8145 10.8227 10.8227 11.5070 11.5070 11.5685 11.5685 11.7746 11.7746 11.8068 11.8068 12.7268 12.7268 12.7545 12.7545 14.3691 14.3691 14.4274 14.4274 15.2753 15.2753 15.3142 15.3142 18.0513 18.0513 18.0665 18.0665 k = 0.5000-0.0000 0.2338 ( 2104 PWs) bands (ev): -2.0878 -2.0878 -2.0870 -2.0870 1.9773 1.9773 1.9797 1.9797 5.7244 5.7244 5.7338 5.7338 7.5206 7.5206 7.5392 7.5392 8.5170 8.5170 8.5250 8.5250 10.1861 10.1861 10.2049 10.2049 10.7116 10.7116 10.7194 10.7194 11.5241 11.5241 11.5852 11.5852 11.8199 11.8199 11.8517 11.8517 12.7275 12.7275 12.7546 12.7546 14.3946 14.3946 14.4508 14.4508 15.2795 15.2795 15.3179 15.3179 18.0194 18.0194 18.0344 18.0344 k = 0.5000-0.0000 0.2240 ( 2108 PWs) bands (ev): -2.0946 -2.0946 -2.0939 -2.0939 1.9990 1.9990 2.0015 2.0015 5.7238 5.7238 5.7329 5.7329 7.5116 7.5116 7.5303 7.5303 8.5254 8.5254 8.5337 8.5337 10.1972 10.1972 10.2156 10.2156 10.6076 10.6076 10.6149 10.6149 11.5434 11.5434 11.6040 11.6040 11.8604 11.8604 11.8920 11.8920 12.7283 12.7283 12.7548 12.7548 14.4225 14.4225 14.4763 14.4763 15.2840 15.2840 15.3220 15.3220 17.9811 17.9811 17.9958 17.9958 k = 0.5000-0.0000 0.2143 ( 2108 PWs) bands (ev): -2.1021 -2.1021 -2.1014 -2.1014 2.0231 2.0231 2.0255 2.0255 5.7231 5.7231 5.7319 5.7319 7.5023 7.5023 7.5212 7.5212 8.5339 8.5339 8.5425 8.5425 10.2083 10.2083 10.2259 10.2259 10.5045 10.5045 10.5107 10.5107 11.5646 11.5646 11.6247 11.6247 11.8964 11.8964 11.9278 11.9278 12.7291 12.7291 12.7550 12.7550 14.4520 14.4520 14.5034 14.5034 15.2888 15.2888 15.3263 15.3263 17.9365 17.9365 17.9510 17.9510 k = 0.5000-0.0000 0.2045 ( 2116 PWs) bands (ev): -2.1101 -2.1101 -2.1094 -2.1094 2.0493 2.0493 2.0516 2.0516 5.7224 5.7224 5.7308 5.7308 7.4932 7.4932 7.5122 7.5122 8.5419 8.5419 8.5509 8.5509 10.2160 10.2160 10.2313 10.2313 10.4071 10.4071 10.4110 10.4110 11.5875 11.5875 11.6471 11.6471 11.9280 11.9280 11.9594 11.9594 12.7300 12.7300 12.7551 12.7551 14.4827 14.4827 14.5315 14.5315 15.2937 15.2937 15.3307 15.3307 17.8857 17.8857 17.9000 17.9000 k = 0.5000-0.0000 0.1948 ( 2114 PWs) bands (ev): -2.1185 -2.1185 -2.1178 -2.1178 2.0772 2.0772 2.0796 2.0796 5.7216 5.7216 5.7296 5.7296 7.4846 7.4846 7.5037 7.5037 8.5493 8.5493 8.5589 8.5589 10.2048 10.2048 10.2121 10.2121 10.3318 10.3318 10.3360 10.3360 11.6120 11.6120 11.6709 11.6709 11.9558 11.9558 11.9871 11.9871 12.7309 12.7309 12.7552 12.7552 14.5142 14.5142 14.5605 14.5605 15.2986 15.2986 15.3352 15.3352 17.8294 17.8294 17.8435 17.8435 k = 0.5000-0.0000 0.1851 ( 2112 PWs) bands (ev): -2.1273 -2.1273 -2.1267 -2.1267 2.1068 2.1068 2.1091 2.1091 5.7207 5.7207 5.7284 5.7284 7.4766 7.4766 7.4959 7.4959 8.5558 8.5558 8.5658 8.5658 10.1404 10.1404 10.1421 10.1421 10.3063 10.3063 10.3196 10.3196 11.6376 11.6376 11.6958 11.6958 11.9799 11.9799 12.0112 12.0112 12.7318 12.7318 12.7553 12.7553 14.5460 14.5460 14.5897 14.5897 15.3033 15.3033 15.3396 15.3396 17.7683 17.7683 17.7823 17.7823 k = 0.5000-0.0000 0.1753 ( 2100 PWs) bands (ev): -2.1364 -2.1364 -2.1358 -2.1358 2.1377 2.1377 2.1399 2.1399 5.7198 5.7198 5.7270 5.7270 7.4695 7.4695 7.4889 7.4889 8.5611 8.5611 8.5717 8.5717 10.0445 10.0445 10.0482 10.0482 10.3146 10.3146 10.3301 10.3301 11.6644 11.6644 11.7218 11.7218 12.0009 12.0009 12.0321 12.0321 12.7328 12.7328 12.7555 12.7555 14.5778 14.5778 14.6191 14.6191 15.3077 15.3077 15.3436 15.3436 17.7033 17.7033 17.7172 17.7172 k = 0.5000-0.0000 0.1656 ( 2104 PWs) bands (ev): -2.1456 -2.1456 -2.1450 -2.1450 2.1695 2.1695 2.1717 2.1717 5.7188 5.7188 5.7256 5.7256 7.4635 7.4635 7.4830 7.4830 8.5647 8.5647 8.5758 8.5758 9.9440 9.9440 9.9481 9.9481 10.3324 10.3324 10.3482 10.3482 11.6916 11.6916 11.7480 11.7480 12.0190 12.0190 12.0500 12.0500 12.7337 12.7337 12.7555 12.7555 14.6094 14.6094 14.6484 14.6484 15.3114 15.3114 15.3471 15.3471 17.6353 17.6353 17.6492 17.6492 k = 0.5000-0.0000 0.1558 ( 2104 PWs) bands (ev): -2.1549 -2.1549 -2.1543 -2.1543 2.2020 2.2020 2.2041 2.2041 5.7178 5.7178 5.7241 5.7241 7.4588 7.4588 7.4785 7.4785 8.5665 8.5665 8.5782 8.5782 9.8440 9.8440 9.8481 9.8481 10.3540 10.3540 10.3696 10.3696 11.7192 11.7192 11.7744 11.7744 12.0346 12.0346 12.0654 12.0654 12.7346 12.7346 12.7556 12.7556 14.6405 14.6405 14.6773 14.6773 15.3143 15.3143 15.3499 15.3499 17.5653 17.5653 17.5793 17.5793 k = 0.5000-0.0000 0.1461 ( 2108 PWs) bands (ev): -2.1641 -2.1641 -2.1636 -2.1636 2.2350 2.2350 2.2370 2.2370 5.7166 5.7166 5.7225 5.7225 7.4557 7.4557 7.4753 7.4753 8.5661 8.5661 8.5785 8.5785 9.7464 9.7464 9.7504 9.7504 10.3775 10.3775 10.3927 10.3927 11.7466 11.7466 11.8005 11.8005 12.0481 12.0481 12.0785 12.0785 12.7355 12.7355 12.7555 12.7555 14.6710 14.6710 14.7059 14.7059 15.3163 15.3163 15.3518 15.3518 17.4945 17.4945 17.5086 17.5086 k = 0.5000-0.0000 0.1364 ( 2104 PWs) bands (ev): -2.1732 -2.1732 -2.1727 -2.1727 2.2679 2.2679 2.2699 2.2699 5.7155 5.7155 5.7209 5.7209 7.4542 7.4542 7.4738 7.4738 8.5633 8.5633 8.5763 8.5763 9.6523 9.6523 9.6563 9.6563 10.4024 10.4024 10.4170 10.4170 11.7738 11.7738 11.8260 11.8260 12.0600 12.0600 12.0898 12.0898 12.7363 12.7363 12.7554 12.7554 14.7009 14.7009 14.7341 14.7341 15.3171 15.3171 15.3526 15.3526 17.4238 17.4238 17.4380 17.4380 k = 0.5000-0.0000 0.1266 ( 2100 PWs) bands (ev): -2.1821 -2.1821 -2.1817 -2.1817 2.3006 2.3006 2.3025 2.3025 5.7143 5.7143 5.7192 5.7192 7.4544 7.4544 7.4740 7.4740 8.5576 8.5576 8.5713 8.5713 9.5629 9.5629 9.5668 9.5668 10.4279 10.4279 10.4420 10.4420 11.8002 11.8002 11.8503 11.8503 12.0707 12.0707 12.0996 12.0996 12.7372 12.7372 12.7553 12.7553 14.7302 14.7302 14.7618 14.7618 15.3166 15.3166 15.3522 15.3522 17.3541 17.3541 17.3684 17.3684 k = 0.5000-0.0000 0.1169 ( 2096 PWs) bands (ev): -2.1907 -2.1907 -2.1903 -2.1903 2.3327 2.3327 2.3345 2.3345 5.7131 5.7131 5.7176 5.7176 7.4565 7.4565 7.4759 7.4759 8.5488 8.5488 8.5631 8.5631 9.4789 9.4789 9.4828 9.4828 10.4538 10.4538 10.4672 10.4672 11.8254 11.8254 11.8730 11.8730 12.0806 12.0806 12.1082 12.1082 12.7379 12.7379 12.7551 12.7551 14.7588 14.7588 14.7892 14.7892 15.3145 15.3145 15.3502 15.3502 17.2863 17.2863 17.3007 17.3007 k = 0.5000-0.0000 0.1071 ( 2096 PWs) bands (ev): -2.1989 -2.1989 -2.1985 -2.1985 2.3639 2.3639 2.3655 2.3655 5.7119 5.7119 5.7159 5.7159 7.4605 7.4605 7.4795 7.4795 8.5367 8.5367 8.5514 8.5514 9.4013 9.4013 9.4053 9.4053 10.4796 10.4796 10.4923 10.4923 11.8490 11.8490 11.8935 11.8935 12.0902 12.0902 12.1161 12.1161 12.7387 12.7387 12.7548 12.7548 14.7868 14.7868 14.8161 14.8161 15.3109 15.3109 15.3467 15.3467 17.2213 17.2213 17.2356 17.2356 k = 0.5000-0.0000 0.0974 ( 2092 PWs) bands (ev): -2.2067 -2.2067 -2.2063 -2.2063 2.3937 2.3937 2.3952 2.3952 5.7107 5.7107 5.7143 5.7143 7.4662 7.4662 7.4849 7.4849 8.5210 8.5210 8.5361 8.5361 9.3310 9.3310 9.3351 9.3351 10.5050 10.5050 10.5169 10.5169 11.8707 11.8707 11.9116 11.9116 12.0999 12.0999 12.1234 12.1234 12.7395 12.7395 12.7545 12.7545 14.8142 14.8142 14.8426 14.8426 15.3055 15.3055 15.3413 15.3413 17.1597 17.1597 17.1739 17.1739 k = 0.5000-0.0000 0.0877 ( 2092 PWs) bands (ev): -2.2139 -2.2139 -2.2135 -2.2135 2.4219 2.4219 2.4233 2.4233 5.7096 5.7096 5.7127 5.7127 7.4737 7.4737 7.4918 7.4918 8.5017 8.5017 8.5170 8.5170 9.2686 9.2686 9.2727 9.2727 10.5296 10.5296 10.5405 10.5405 11.8901 11.8901 11.9268 11.9268 12.1098 12.1098 12.1305 12.1305 12.7402 12.7402 12.7541 12.7541 14.8410 14.8410 14.8687 14.8687 15.2984 15.2984 15.3342 15.3342 17.1023 17.1023 17.1161 17.1161 k = 0.5000-0.0000 0.0779 ( 2094 PWs) bands (ev): -2.2205 -2.2205 -2.2202 -2.2202 2.4481 2.4481 2.4494 2.4494 5.7084 5.7084 5.7112 5.7112 7.4828 7.4828 7.5001 7.5001 8.4793 8.4793 8.4945 8.4945 9.2144 9.2144 9.2184 9.2184 10.5529 10.5529 10.5629 10.5629 11.9070 11.9070 11.9390 11.9390 12.1200 12.1200 12.1376 12.1376 12.7410 12.7410 12.7536 12.7536 14.8672 14.8672 14.8943 14.8943 15.2897 15.2897 15.3252 15.3252 17.0496 17.0496 17.0628 17.0628 k = 0.5000-0.0000 0.0682 ( 2096 PWs) bands (ev): -2.2265 -2.2265 -2.2262 -2.2262 2.4721 2.4721 2.4733 2.4733 5.7074 5.7074 5.7097 5.7097 7.4931 7.4931 7.5094 7.5094 8.4544 8.4544 8.4691 8.4691 9.1687 9.1687 9.1725 9.1725 10.5747 10.5747 10.5837 10.5837 11.9212 11.9212 11.9483 11.9483 12.1304 12.1304 12.1447 12.1447 12.7417 12.7417 12.7530 12.7530 14.8928 14.8928 14.9193 14.9193 15.2795 15.2795 15.3143 15.3143 17.0022 17.0022 17.0146 17.0146 k = 0.5000-0.0000 0.0584 ( 2094 PWs) bands (ev): -2.2318 -2.2318 -2.2315 -2.2315 2.4936 2.4936 2.4946 2.4946 5.7065 5.7065 5.7084 5.7084 7.5043 7.5043 7.5193 7.5193 8.4281 8.4281 8.4420 8.4420 9.1311 9.1311 9.1346 9.1346 10.5946 10.5946 10.6025 10.6025 11.9329 11.9329 11.9552 11.9552 12.1407 12.1407 12.1517 12.1517 12.7424 12.7424 12.7524 12.7524 14.9177 14.9177 14.9435 14.9435 15.2682 15.2682 15.3019 15.3019 16.9604 16.9604 16.9718 16.9718 k = 0.5000-0.0000 0.0487 ( 2090 PWs) bands (ev): -2.2363 -2.2363 -2.2361 -2.2361 2.5122 2.5122 2.5131 2.5131 5.7057 5.7057 5.7073 5.7073 7.5160 7.5160 7.5293 7.5293 8.4019 8.4019 8.4145 8.4145 9.1011 9.1011 9.1042 9.1042 10.6122 10.6122 10.6189 10.6189 11.9422 11.9422 11.9599 11.9599 12.1504 12.1504 12.1586 12.1586 12.7432 12.7432 12.7517 12.7517 14.9416 14.9416 14.9663 14.9663 15.2562 15.2562 15.2881 15.2881 16.9248 16.9248 16.9348 16.9348 k = 0.5000-0.0000 0.0390 ( 2090 PWs) bands (ev): -2.2401 -2.2401 -2.2399 -2.2399 2.5279 2.5279 2.5285 2.5285 5.7050 5.7050 5.7062 5.7062 7.5274 7.5274 7.5387 7.5387 8.3775 8.3775 8.3883 8.3883 9.0780 9.0780 9.0805 9.0805 10.6272 10.6272 10.6327 10.6327 11.9494 11.9494 11.9628 11.9628 12.1591 12.1591 12.1648 12.1648 12.7440 12.7440 12.7509 12.7509 14.9642 14.9642 14.9870 14.9870 15.2444 15.2444 15.2734 15.2734 16.8956 16.8956 16.9039 16.9039 k = 0.5000-0.0000 0.0292 ( 2090 PWs) bands (ev): -2.2430 -2.2430 -2.2429 -2.2429 2.5402 2.5402 2.5408 2.5408 5.7045 5.7045 5.7054 5.7054 7.5378 7.5378 7.5467 7.5467 8.3566 8.3566 8.3652 8.3652 9.0609 9.0609 9.0629 9.0629 10.6394 10.6394 10.6435 10.6435 11.9547 11.9547 11.9643 11.9643 12.1663 12.1663 12.1700 12.1700 12.7449 12.7449 12.7502 12.7502 14.9848 14.9848 15.0046 15.0046 15.2338 15.2338 15.2586 15.2586 16.8729 16.8729 16.8794 16.8794 k = 0.5000-0.0000 0.0195 ( 2084 PWs) bands (ev): -2.2451 -2.2451 -2.2451 -2.2451 2.5492 2.5492 2.5496 2.5496 5.7041 5.7041 5.7047 5.7047 7.5465 7.5465 7.5527 7.5527 8.3408 8.3408 8.3468 8.3468 9.0494 9.0494 9.0507 9.0507 10.6484 10.6484 10.6512 10.6512 11.9587 11.9587 11.9649 11.9649 12.1717 12.1717 12.1740 12.1740 12.7459 12.7459 12.7494 12.7494 15.0026 15.0026 15.0176 15.0176 15.2261 15.2261 15.2446 15.2446 16.8569 16.8569 16.8614 16.8614 k = 0.5000-0.0000 0.0097 ( 2084 PWs) bands (ev): -2.2464 -2.2464 -2.2464 -2.2464 2.5547 2.5547 2.5549 2.5549 5.7040 5.7040 5.7043 5.7043 7.5527 7.5527 7.5559 7.5559 8.3314 8.3314 8.3345 8.3345 9.0428 9.0428 9.0435 9.0435 10.6542 10.6542 10.6556 10.6556 11.9615 11.9615 11.9646 11.9646 12.1753 12.1753 12.1763 12.1763 12.7467 12.7467 12.7485 12.7485 15.0161 15.0161 15.0244 15.0244 15.2229 15.2229 15.2329 15.2329 16.8478 16.8478 16.8501 16.8501 k = 0.5000-0.0000-0.0000 ( 2084 PWs) bands (ev): -2.2468 -2.2468 -2.2468 -2.2468 2.5566 2.5566 2.5566 2.5566 5.7040 5.7040 5.7040 5.7040 7.5560 7.5560 7.5560 7.5560 8.3293 8.3293 8.3293 8.3293 9.0409 9.0409 9.0409 9.0409 10.6566 10.6566 10.6566 10.6566 11.9634 11.9634 11.9634 11.9634 12.1768 12.1768 12.1768 12.1768 12.7476 12.7476 12.7476 12.7476 15.0238 15.0238 15.0238 15.0238 15.2253 15.2253 15.2253 15.2253 16.8455 16.8455 16.8455 16.8455 k = 0.5000 0.3649-0.0000 ( 2104 PWs) bands (ev): -1.9219 -1.9219 -1.9211 -1.9211 1.7538 1.7538 1.7682 1.7682 6.8730 6.8730 6.8856 6.8856 6.9448 6.9448 6.9580 6.9580 8.3409 8.3409 8.3744 8.3744 8.6368 8.6368 8.6889 8.6889 9.6028 9.6028 9.6085 9.6085 11.6794 11.6794 11.7857 11.7857 12.1036 12.1036 12.1594 12.1594 12.7512 12.7512 12.7795 12.7795 14.9970 14.9970 15.0044 15.0044 17.7458 17.7458 17.7613 17.7613 18.0886 18.0886 18.1122 18.1122 k = 0.5000 0.3649 0.0097 ( 2100 PWs) bands (ev): -1.9216 -1.9216 -1.9207 -1.9207 1.7538 1.7538 1.7681 1.7681 6.8329 6.8329 6.8446 6.8446 6.9784 6.9784 6.9923 6.9923 8.3327 8.3327 8.3668 8.3668 8.6536 8.6536 8.7049 8.7049 9.6039 9.6039 9.6095 9.6095 11.6801 11.6801 11.7864 11.7864 12.1033 12.1033 12.1591 12.1591 12.7512 12.7512 12.7795 12.7795 14.9973 14.9973 15.0047 15.0047 17.7421 17.7421 17.7573 17.7573 18.0907 18.0907 18.1141 18.1141 k = 0.5000 0.3649 0.0195 ( 2096 PWs) bands (ev): -1.9205 -1.9205 -1.9197 -1.9197 1.7535 1.7535 1.7677 1.7677 6.7662 6.7662 6.7769 6.7769 7.0250 7.0250 7.0396 7.0396 8.3145 8.3145 8.3498 8.3498 8.6980 8.6980 8.7475 8.7475 9.6070 9.6070 9.6127 9.6127 11.6822 11.6822 11.7885 11.7885 12.1025 12.1025 12.1580 12.1580 12.7511 12.7511 12.7795 12.7795 14.9982 14.9982 15.0054 15.0054 17.7311 17.7311 17.7456 17.7456 18.0966 18.0966 18.1194 18.1194 k = 0.5000 0.3649 0.0292 ( 2096 PWs) bands (ev): -1.9187 -1.9187 -1.9179 -1.9179 1.7530 1.7530 1.7672 1.7672 6.6939 6.6939 6.7036 6.7036 7.0628 7.0628 7.0776 7.0776 8.2979 8.2979 8.3339 8.3339 8.7593 8.7593 8.8071 8.8071 9.6124 9.6124 9.6181 9.6181 11.6857 11.6857 11.7919 11.7919 12.1011 12.1011 12.1562 12.1562 12.7510 12.7510 12.7795 12.7795 14.9998 14.9998 15.0066 15.0066 17.7137 17.7137 17.7272 17.7272 18.1052 18.1052 18.1272 18.1272 k = 0.5000 0.3649 0.0390 ( 2100 PWs) bands (ev): -1.9163 -1.9163 -1.9155 -1.9155 1.7523 1.7523 1.7663 1.7663 6.6194 6.6194 6.6280 6.6280 7.0875 7.0875 7.1017 7.1017 8.2912 8.2912 8.3268 8.3268 8.8300 8.8300 8.8765 8.8765 9.6201 9.6201 9.6258 9.6258 11.6906 11.6906 11.7968 11.7968 12.0990 12.0990 12.1535 12.1535 12.7507 12.7507 12.7794 12.7794 15.0022 15.0022 15.0085 15.0085 17.6909 17.6909 17.7033 17.7033 18.1151 18.1151 18.1363 18.1363 k = 0.5000 0.3649 0.0487 ( 2092 PWs) bands (ev): -1.9132 -1.9132 -1.9124 -1.9124 1.7514 1.7514 1.7653 1.7653 6.5442 6.5442 6.5519 6.5519 7.0969 7.0969 7.1099 7.1099 8.2990 8.2990 8.3332 8.3332 8.9057 8.9057 8.9511 8.9511 9.6306 9.6306 9.6364 9.6364 11.6972 11.6972 11.8033 11.8033 12.0964 12.0964 12.1503 12.1503 12.7506 12.7506 12.7795 12.7795 15.0053 15.0053 15.0110 15.0110 17.6637 17.6637 17.6751 17.6751 18.1250 18.1250 18.1455 18.1455 k = 0.5000 0.3649 0.0584 ( 2096 PWs) bands (ev): -1.9094 -1.9094 -1.9087 -1.9087 1.7502 1.7502 1.7640 1.7640 6.4693 6.4693 6.4762 6.4762 7.0905 7.0905 7.1016 7.1016 8.3227 8.3227 8.3545 8.3545 8.9835 8.9835 9.0280 9.0280 9.6442 9.6442 9.6502 9.6502 11.7053 11.7053 11.8113 11.8113 12.0930 12.0930 12.1461 12.1461 12.7503 12.7503 12.7794 12.7794 15.0094 15.0094 15.0142 15.0142 17.6329 17.6329 17.6434 17.6434 18.1335 18.1335 18.1537 18.1537 k = 0.5000 0.3649 0.0682 ( 2096 PWs) bands (ev): -1.9051 -1.9051 -1.9043 -1.9043 1.7489 1.7489 1.7625 1.7625 6.3955 6.3955 6.4017 6.4017 7.0694 7.0694 7.0783 7.0783 8.3616 8.3616 8.3905 8.3905 9.0614 9.0614 9.1050 9.1050 9.6616 9.6616 9.6679 9.6679 11.7151 11.7151 11.8209 11.8209 12.0891 12.0891 12.1412 12.1412 12.7499 12.7499 12.7793 12.7793 15.0144 15.0144 15.0184 15.0184 17.5993 17.5993 17.6090 17.6090 18.1397 18.1397 18.1597 18.1597 k = 0.5000 0.3649 0.0779 ( 2088 PWs) bands (ev): -1.9002 -1.9002 -1.8995 -1.8995 1.7474 1.7474 1.7607 1.7607 6.3234 6.3234 6.3290 6.3290 7.0357 7.0357 7.0422 7.0422 8.4134 8.4134 8.4392 8.4392 9.1374 9.1374 9.1799 9.1799 9.6836 9.6836 9.6906 9.6906 11.7267 11.7267 11.8324 11.8324 12.0845 12.0845 12.1356 12.1356 12.7496 12.7496 12.7793 12.7793 15.0208 15.0208 15.0237 15.0237 17.5632 17.5632 17.5724 17.5724 18.1426 18.1426 18.1626 18.1626 k = 0.5000 0.3649 0.0877 ( 2080 PWs) bands (ev): -1.8948 -1.8948 -1.8940 -1.8940 1.7456 1.7456 1.7587 1.7587 6.2535 6.2535 6.2586 6.2586 6.9918 6.9918 6.9961 6.9961 8.4753 8.4753 8.4981 8.4981 9.2097 9.2097 9.2508 9.2508 9.7114 9.7114 9.7195 9.7195 11.7401 11.7401 11.8456 11.8456 12.0792 12.0792 12.1291 12.1291 12.7492 12.7492 12.7792 12.7792 15.0284 15.0284 15.0302 15.0302 17.5253 17.5253 17.5340 17.5340 18.1413 18.1413 18.1617 18.1617 k = 0.5000 0.3649 0.0974 ( 2080 PWs) bands (ev): -1.8889 -1.8889 -1.8882 -1.8882 1.7436 1.7436 1.7564 1.7564 6.1861 6.1861 6.1907 6.1907 6.9404 6.9404 6.9426 6.9426 8.5447 8.5447 8.5645 8.5645 9.2764 9.2764 9.3156 9.3156 9.7459 9.7459 9.7556 9.7556 11.7553 11.7553 11.8606 11.8606 12.0730 12.0730 12.1217 12.1217 12.7487 12.7487 12.7791 12.7791 15.0376 15.0376 15.0381 15.0381 17.4856 17.4856 17.4941 17.4941 18.1352 18.1352 18.1560 18.1560 k = 0.5000 0.3649 0.1071 ( 2080 PWs) bands (ev): -1.8826 -1.8826 -1.8819 -1.8819 1.7414 1.7414 1.7538 1.7538 6.1217 6.1217 6.1259 6.1259 6.8834 6.8834 6.8839 6.8839 8.6189 8.6189 8.6359 8.6359 9.3362 9.3362 9.3729 9.3729 9.7882 9.7882 9.8002 9.8002 11.7725 11.7725 11.8775 11.8775 12.0659 12.0659 12.1133 12.1133 12.7482 12.7482 12.7789 12.7789 15.0477 15.0477 15.0486 15.0486 17.4446 17.4446 17.4529 17.4529 18.1235 18.1235 18.1450 18.1450 k = 0.5000 0.3649 0.1169 ( 2080 PWs) bands (ev): -1.8759 -1.8759 -1.8752 -1.8752 1.7389 1.7389 1.7510 1.7510 6.0605 6.0605 6.0644 6.0644 6.8219 6.8219 6.8228 6.8228 8.6959 8.6959 8.7104 8.7104 9.3881 9.3881 9.4219 9.4219 9.8388 9.8388 9.8534 9.8534 11.7915 11.7915 11.8963 11.8963 12.0580 12.0580 12.1041 12.1041 12.7477 12.7477 12.7787 12.7787 15.0592 15.0592 15.0616 15.0616 17.4023 17.4023 17.4106 17.4106 18.1056 18.1056 18.1280 18.1280 k = 0.5000 0.3649 0.1266 ( 2084 PWs) bands (ev): -1.8689 -1.8689 -1.8683 -1.8683 1.7363 1.7363 1.7480 1.7480 6.0028 6.0028 6.0064 6.0064 6.7578 6.7578 6.7598 6.7598 8.7739 8.7739 8.7861 8.7861 9.4323 9.4323 9.4632 9.4632 9.8973 9.8973 9.9146 9.9146 11.8122 11.8122 11.9168 11.9168 12.0491 12.0491 12.0940 12.0940 12.7470 12.7470 12.7784 12.7784 15.0728 15.0728 15.0767 15.0767 17.3591 17.3591 17.3674 17.3674 18.0811 18.0811 18.1045 18.1045 k = 0.5000 0.3649 0.1364 ( 2084 PWs) bands (ev): -1.8617 -1.8617 -1.8611 -1.8611 1.7335 1.7335 1.7447 1.7447 5.9487 5.9487 5.9520 5.9520 6.6928 6.6928 6.6958 6.6958 8.8514 8.8514 8.8615 8.8615 9.4698 9.4698 9.4978 9.4978 9.9624 9.9624 9.9822 9.9822 11.8346 11.8346 11.9387 11.9387 12.0396 12.0396 12.0831 12.0831 12.7464 12.7464 12.7780 12.7780 15.0888 15.0888 15.0943 15.0943 17.3150 17.3150 17.3234 17.3234 18.0497 18.0497 18.0742 18.0742 k = 0.5000 0.3649 0.1461 ( 2084 PWs) bands (ev): -1.8544 -1.8544 -1.8538 -1.8538 1.7305 1.7305 1.7413 1.7413 5.8984 5.8984 5.9015 5.9015 6.6277 6.6277 6.6315 6.6315 8.9272 8.9272 8.9353 8.9353 9.5017 9.5017 9.5273 9.5273 10.0327 10.0327 10.0545 10.0545 11.8580 11.8580 11.9613 11.9613 12.0298 12.0298 12.0718 12.0718 12.7458 12.7458 12.7777 12.7777 15.1074 15.1074 15.1146 15.1146 17.2702 17.2702 17.2788 17.2788 18.0113 18.0113 18.0369 18.0369 k = 0.5000 0.3649 0.1558 ( 2084 PWs) bands (ev): -1.8469 -1.8469 -1.8464 -1.8464 1.7273 1.7273 1.7376 1.7376 5.8520 5.8520 5.8550 5.8550 6.5633 6.5633 6.5676 6.5676 9.0002 9.0002 9.0064 9.0064 9.5295 9.5295 9.5529 9.5529 10.1067 10.1067 10.1301 10.1301 11.8818 11.8818 11.9811 11.9811 12.0231 12.0231 12.0605 12.0605 12.7452 12.7452 12.7772 12.7772 15.1289 15.1289 15.1377 15.1377 17.2248 17.2248 17.2338 17.2338 17.9658 17.9658 17.9926 17.9926 k = 0.5000 0.3649 0.1656 ( 2084 PWs) bands (ev): -1.8395 -1.8395 -1.8390 -1.8390 1.7240 1.7240 1.7338 1.7338 5.8096 5.8096 5.8125 5.8125 6.5000 6.5000 6.5048 6.5048 9.0695 9.0695 9.0741 9.0741 9.5542 9.5542 9.5759 9.5759 10.1831 10.1831 10.2076 10.2076 11.9043 11.9043 11.9859 11.9859 12.0313 12.0313 12.0506 12.0506 12.7446 12.7446 12.7767 12.7767 15.1535 15.1535 15.1638 15.1638 17.1791 17.1791 17.1884 17.1884 17.9138 17.9138 17.9417 17.9417 k = 0.5000 0.3649 0.1753 ( 2084 PWs) bands (ev): -1.8321 -1.8321 -1.8316 -1.8316 1.7207 1.7207 1.7299 1.7299 5.7713 5.7713 5.7741 5.7741 6.4384 6.4384 6.4435 6.4435 9.1343 9.1343 9.1374 9.1374 9.5767 9.5767 9.5967 9.5967 10.2609 10.2609 10.2861 10.2861 11.9224 11.9224 11.9754 11.9754 12.0449 12.0449 12.0542 12.0542 12.7441 12.7441 12.7761 12.7761 15.1812 15.1812 15.1932 15.1932 17.1332 17.1332 17.1429 17.1429 17.8556 17.8556 17.8846 17.8846 k = 0.5000 0.3649 0.1851 ( 2092 PWs) bands (ev): -1.8248 -1.8248 -1.8244 -1.8244 1.7173 1.7173 1.7259 1.7259 5.7371 5.7371 5.7398 5.7398 6.3789 6.3789 6.3841 6.3841 9.1941 9.1941 9.1959 9.1959 9.5973 9.5973 9.6160 9.6160 10.3393 10.3393 10.3648 10.3648 11.9313 11.9313 11.9595 11.9595 12.0475 12.0475 12.0812 12.0812 12.7435 12.7435 12.7753 12.7753 15.2123 15.2123 15.2257 15.2257 17.0872 17.0872 17.0973 17.0973 17.7921 17.7921 17.8222 17.8222 k = 0.5000 0.3649 0.1948 ( 2092 PWs) bands (ev): -1.8178 -1.8178 -1.8174 -1.8174 1.7139 1.7139 1.7220 1.7220 5.7069 5.7069 5.7096 5.7096 6.3219 6.3219 6.3272 6.3272 9.2485 9.2485 9.2492 9.2492 9.6167 9.6167 9.6339 9.6339 10.4177 10.4177 10.4431 10.4431 11.9281 11.9281 11.9411 11.9411 12.0612 12.0612 12.1093 12.1093 12.7432 12.7432 12.7744 12.7744 15.2468 15.2468 15.2614 15.2614 17.0414 17.0414 17.0517 17.0517 17.7246 17.7246 17.7554 17.7554 k = 0.5000 0.3649 0.2045 ( 2096 PWs) bands (ev): -1.8111 -1.8111 -1.8107 -1.8107 1.7106 1.7106 1.7180 1.7180 5.6808 5.6808 5.6834 5.6834 6.2677 6.2677 6.2730 6.2730 9.2971 9.2971 9.2973 9.2973 9.6347 9.6347 9.6506 9.6506 10.4953 10.4953 10.5204 10.5204 11.9151 11.9151 11.9207 11.9207 12.0829 12.0829 12.1372 12.1372 12.7429 12.7429 12.7734 12.7734 15.2846 15.2846 15.3002 15.3002 16.9958 16.9958 17.0064 17.0064 17.6542 17.6542 17.6855 17.6855 k = 0.5000 0.3649 0.2143 ( 2096 PWs) bands (ev): -1.8048 -1.8048 -1.8044 -1.8044 1.7074 1.7074 1.7142 1.7142 5.6585 5.6585 5.6611 5.6611 6.2167 6.2167 6.2219 6.2219 9.3396 9.3396 9.3404 9.3404 9.6517 9.6517 9.6662 9.6662 10.5716 10.5716 10.5960 10.5960 11.8962 11.8962 11.8985 11.8985 12.1087 12.1087 12.1643 12.1643 12.7428 12.7428 12.7722 12.7722 15.3254 15.3254 15.3418 15.3418 16.9506 16.9506 16.9613 16.9613 17.5827 17.5827 17.6140 17.6140 k = 0.5000 0.3649 0.2240 ( 2100 PWs) bands (ev): -1.7988 -1.7988 -1.7986 -1.7986 1.7044 1.7044 1.7105 1.7105 5.6400 5.6400 5.6425 5.6425 6.1692 6.1692 6.1742 6.1742 9.3767 9.3767 9.3779 9.3779 9.6674 9.6674 9.6805 9.6805 10.6458 10.6458 10.6692 10.6692 11.8736 11.8736 11.8748 11.8748 12.1357 12.1357 12.1898 12.1898 12.7429 12.7429 12.7709 12.7709 15.3688 15.3688 15.3857 15.3857 16.9060 16.9060 16.9165 16.9165 17.5118 17.5118 17.5426 17.5426 k = 0.5000 0.3649 0.2338 ( 2100 PWs) bands (ev): -1.7935 -1.7935 -1.7932 -1.7932 1.7017 1.7017 1.7070 1.7070 5.6250 5.6250 5.6274 5.6274 6.1258 6.1258 6.1305 6.1305 9.4086 9.4086 9.4100 9.4100 9.6818 9.6818 9.6934 9.6934 10.7170 10.7170 10.7391 10.7391 11.8489 11.8489 11.8500 11.8500 12.1625 12.1625 12.2133 12.2133 12.7433 12.7433 12.7693 12.7693 15.4142 15.4142 15.4310 15.4310 16.8622 16.8622 16.8722 16.8722 17.4435 17.4435 17.4732 17.4732 k = 0.5000 0.3649 0.2435 ( 2096 PWs) bands (ev): -1.7886 -1.7886 -1.7884 -1.7884 1.6992 1.6992 1.7038 1.7038 5.6133 5.6133 5.6156 5.6156 6.0866 6.0866 6.0910 6.0910 9.4356 9.4356 9.4371 9.4371 9.6948 9.6948 9.7047 9.7047 10.7843 10.7843 10.8047 10.8047 11.8230 11.8230 11.8244 11.8244 12.1881 12.1881 12.2341 12.2341 12.7440 12.7440 12.7676 12.7676 15.4605 15.4605 15.4769 15.4769 16.8195 16.8195 16.8286 16.8286 17.3800 17.3800 17.4077 17.4077 k = 0.5000 0.3649 0.2532 ( 2096 PWs) bands (ev): -1.7845 -1.7845 -1.7843 -1.7843 1.6971 1.6971 1.7009 1.7009 5.6046 5.6046 5.6066 5.6066 6.0523 6.0523 6.0562 6.0562 9.4578 9.4578 9.4593 9.4593 9.7060 9.7060 9.7144 9.7144 10.8464 10.8464 10.8647 10.8647 11.7969 11.7969 11.7989 11.7989 12.2116 12.2116 12.2517 12.2517 12.7450 12.7450 12.7657 12.7657 15.5063 15.5063 15.5216 15.5216 16.7787 16.7787 16.7865 16.7865 17.3233 17.3233 17.3482 17.3482 k = 0.5000 0.3649 0.2630 ( 2096 PWs) bands (ev): -1.7810 -1.7810 -1.7808 -1.7808 1.6953 1.6953 1.6984 1.6984 5.5983 5.5983 5.6001 5.6001 6.0233 6.0233 6.0266 6.0266 9.4757 9.4757 9.4770 9.4770 9.7156 9.7156 9.7222 9.7222 10.9020 10.9020 10.9177 10.9177 11.7720 11.7720 11.7743 11.7743 12.2325 12.2325 12.2658 12.2658 12.7463 12.7463 12.7636 12.7636 15.5498 15.5498 15.5634 15.5634 16.7407 16.7407 16.7470 16.7470 17.2753 17.2753 17.2964 17.2964 k = 0.5000 0.3649 0.2727 ( 2096 PWs) bands (ev): -1.7782 -1.7782 -1.7781 -1.7781 1.6940 1.6940 1.6963 1.6963 5.5942 5.5942 5.5957 5.5957 6.0002 6.0002 6.0028 6.0028 9.4895 9.4895 9.4905 9.4905 9.7233 9.7233 9.7283 9.7283 10.9491 10.9491 10.9617 10.9617 11.7497 11.7497 11.7521 11.7521 12.2502 12.2502 12.2760 12.2760 12.7479 12.7479 12.7614 12.7614 15.5886 15.5886 15.5998 15.5998 16.7074 16.7074 16.7119 16.7119 17.2374 17.2374 17.2539 17.2539 k = 0.5000 0.3649 0.2825 ( 2096 PWs) bands (ev): -1.7762 -1.7762 -1.7761 -1.7761 1.6931 1.6931 1.6947 1.6947 5.5918 5.5918 5.5928 5.5928 5.9833 5.9833 5.9851 5.9851 9.4992 9.4992 9.4999 9.4999 9.7290 9.7290 9.7324 9.7324 10.9858 10.9858 10.9947 10.9947 11.7320 11.7320 11.7340 11.7340 12.2645 12.2645 12.2821 12.2821 12.7498 12.7498 12.7590 12.7590 15.6200 15.6200 15.6280 15.6280 16.6810 16.6810 16.6838 16.6838 17.2107 17.2107 17.2220 17.2220 k = 0.5000 0.3649 0.2922 ( 2096 PWs) bands (ev): -1.7750 -1.7750 -1.7749 -1.7749 1.6928 1.6928 1.6935 1.6935 5.5907 5.5907 5.5912 5.5912 5.9732 5.9732 5.9741 5.9741 9.5051 9.5051 9.5055 9.5055 9.7328 9.7328 9.7345 9.7345 11.0099 11.0099 11.0145 11.0145 11.7207 11.7207 11.7218 11.7218 12.2750 12.2750 12.2839 12.2839 12.7519 12.7519 12.7566 12.7566 15.6412 15.6412 15.6454 15.6454 16.6640 16.6640 16.6653 16.6653 17.1957 17.1957 17.2014 17.2014 k = 0.5000 0.3649 0.3019 ( 2096 PWs) bands (ev): -1.7746 -1.7746 -1.7746 -1.7746 1.6929 1.6929 1.6929 1.6929 5.5905 5.5905 5.5905 5.5905 5.9701 5.9701 5.9701 5.9701 9.5072 9.5072 9.5072 9.5072 9.7346 9.7346 9.7346 9.7346 11.0198 11.0198 11.0198 11.0198 11.7171 11.7171 11.7171 11.7171 12.2816 12.2816 12.2816 12.2816 12.7542 12.7542 12.7542 12.7542 15.6500 15.6500 15.6500 15.6500 16.6584 16.6584 16.6584 16.6584 17.1926 17.1926 17.1926 17.1926 Writing output data file NiS2.save init_run : 0.34s CPU 0.62s WALL ( 1 calls) electrons : 353.30s CPU 356.62s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.03s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 353.28s CPU 356.58s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.02s WALL ( 1 calls) newd : 0.14s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.04s WALL ( 492 calls) cegterg : 330.56s CPU 333.30s WALL ( 886 calls) Called by sum_band: Called by *egterg: h_psi : 188.21s CPU 195.82s WALL ( 13063 calls) s_psi : 31.30s CPU 31.31s WALL ( 13063 calls) g_psi : 0.30s CPU 0.36s WALL ( 11685 calls) cdiaghg : 94.13s CPU 90.69s WALL ( 12177 calls) cegterg:over : 15.92s CPU 13.82s WALL ( 11685 calls) cegterg:upda : 3.26s CPU 5.96s WALL ( 11685 calls) cegterg:last : 4.37s CPU 5.37s WALL ( 2851 calls) Called by h_psi: h_psi:vloc : 156.40s CPU 163.12s WALL ( 13063 calls) h_psi:vnl : 31.76s CPU 32.45s WALL ( 13063 calls) add_vuspsi : 16.47s CPU 19.87s WALL ( 13063 calls) General routines calbec : 15.28s CPU 12.55s WALL ( 13063 calls) fft : 0.02s CPU 0.05s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 151.07s CPU 157.49s WALL ( 1689080 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.19s CPU 0.13s WALL ( 984 calls) Parallel routines fft_scatter : 102.04s CPU 110.05s WALL ( 1689103 calls) PWSCF : 6m20.76s CPU 6m29.46s WALL This run was terminated on: 16:33:11 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=