Program PWSCF v.5.1.1 starts on 16Jul2015 at 16:48:56 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: ./FeS2.save/ file Fe.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 31 24 7 1063 716 121 Max 32 25 8 1072 737 126 Sum 1015 779 237 34165 23227 3925 bravais-lattice index = 14 lattice parameter (alat) = 6.4007 a.u. unit-cell volume = 550.8969 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.400691 celldm(2)= 1.311771 celldm(3)= 1.601518 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 1.311771 0.000000 ) a(3) = ( 0.000000 0.000000 1.601518 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.762328 -0.000000 ) b(3) = ( 0.000000 0.000000 0.624408 ) 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 Fe read from file: /home/autes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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) Fe 8.00 55.84500 Fe( 1.00) 2 Sym. Ops. (no inversion) found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 460 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 2) = ( 0.0106383 -0.0000000 -0.0000000), wk = 0.0021739 k( 3) = ( 0.0212766 -0.0000000 -0.0000000), wk = 0.0021739 k( 4) = ( 0.0319149 -0.0000000 -0.0000000), wk = 0.0021739 k( 5) = ( 0.0425532 -0.0000000 -0.0000000), wk = 0.0021739 k( 6) = ( 0.0531915 -0.0000000 -0.0000000), wk = 0.0021739 k( 7) = ( 0.0638298 -0.0000000 -0.0000000), wk = 0.0021739 k( 8) = ( 0.0744681 -0.0000000 -0.0000000), wk = 0.0021739 k( 9) = ( 0.0851064 -0.0000000 -0.0000000), wk = 0.0021739 k( 10) = ( 0.0957447 -0.0000000 -0.0000000), wk = 0.0021739 k( 11) = ( 0.1063830 -0.0000000 -0.0000000), wk = 0.0021739 k( 12) = ( 0.1170213 -0.0000000 -0.0000000), wk = 0.0021739 k( 13) = ( 0.1276596 -0.0000000 -0.0000000), wk = 0.0021739 k( 14) = ( 0.1382979 -0.0000000 -0.0000000), wk = 0.0021739 k( 15) = ( 0.1489362 -0.0000000 -0.0000000), wk = 0.0021739 k( 16) = ( 0.1595745 -0.0000000 -0.0000000), wk = 0.0021739 k( 17) = ( 0.1702128 -0.0000000 -0.0000000), wk = 0.0021739 k( 18) = ( 0.1808511 -0.0000000 -0.0000000), wk = 0.0021739 k( 19) = ( 0.1914894 -0.0000000 -0.0000000), wk = 0.0021739 k( 20) = ( 0.2021277 -0.0000000 -0.0000000), wk = 0.0021739 k( 21) = ( 0.2127660 -0.0000000 -0.0000000), wk = 0.0021739 k( 22) = ( 0.2234043 -0.0000000 -0.0000000), wk = 0.0021739 k( 23) = ( 0.2340425 -0.0000000 -0.0000000), wk = 0.0021739 k( 24) = ( 0.2446809 -0.0000000 -0.0000000), wk = 0.0021739 k( 25) = ( 0.2553191 -0.0000000 -0.0000000), wk = 0.0021739 k( 26) = ( 0.2659574 -0.0000000 -0.0000000), wk = 0.0021739 k( 27) = ( 0.2765957 -0.0000000 -0.0000000), wk = 0.0021739 k( 28) = ( 0.2872340 -0.0000000 -0.0000000), wk = 0.0021739 k( 29) = ( 0.2978723 -0.0000000 -0.0000000), wk = 0.0021739 k( 30) = ( 0.3085106 -0.0000000 -0.0000000), wk = 0.0021739 k( 31) = ( 0.3191489 -0.0000000 -0.0000000), wk = 0.0021739 k( 32) = ( 0.3297872 -0.0000000 -0.0000000), wk = 0.0021739 k( 33) = ( 0.3404255 -0.0000000 -0.0000000), wk = 0.0021739 k( 34) = ( 0.3510638 -0.0000000 -0.0000000), wk = 0.0021739 k( 35) = ( 0.3617021 -0.0000000 -0.0000000), wk = 0.0021739 k( 36) = ( 0.3723404 -0.0000000 -0.0000000), wk = 0.0021739 k( 37) = ( 0.3829787 -0.0000000 -0.0000000), wk = 0.0021739 k( 38) = ( 0.3936170 -0.0000000 -0.0000000), wk = 0.0021739 k( 39) = ( 0.4042553 -0.0000000 -0.0000000), wk = 0.0021739 k( 40) = ( 0.4148936 -0.0000000 -0.0000000), wk = 0.0021739 k( 41) = ( 0.4255319 -0.0000000 -0.0000000), wk = 0.0021739 k( 42) = ( 0.4361702 -0.0000000 -0.0000000), wk = 0.0021739 k( 43) = ( 0.4468085 -0.0000000 -0.0000000), wk = 0.0021739 k( 44) = ( 0.4574468 -0.0000000 -0.0000000), wk = 0.0021739 k( 45) = ( 0.4680851 -0.0000000 -0.0000000), wk = 0.0021739 k( 46) = ( 0.4787234 -0.0000000 -0.0000000), wk = 0.0021739 k( 47) = ( 0.4893617 -0.0000000 -0.0000000), wk = 0.0021739 k( 48) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0021739 k( 49) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0021739 k( 50) = ( 0.5000000 0.0105879 -0.0000000), wk = 0.0021739 k( 51) = ( 0.5000000 0.0211758 -0.0000000), wk = 0.0021739 k( 52) = ( 0.5000000 0.0317637 -0.0000000), wk = 0.0021739 k( 53) = ( 0.5000000 0.0423516 -0.0000000), wk = 0.0021739 k( 54) = ( 0.5000000 0.0529394 -0.0000000), wk = 0.0021739 k( 55) = ( 0.5000000 0.0635273 -0.0000000), wk = 0.0021739 k( 56) = ( 0.5000000 0.0741152 -0.0000000), wk = 0.0021739 k( 57) = ( 0.5000000 0.0847031 -0.0000000), wk = 0.0021739 k( 58) = ( 0.5000000 0.0952910 -0.0000000), wk = 0.0021739 k( 59) = ( 0.5000000 0.1058789 -0.0000000), wk = 0.0021739 k( 60) = ( 0.5000000 0.1164668 -0.0000000), wk = 0.0021739 k( 61) = ( 0.5000000 0.1270547 -0.0000000), wk = 0.0021739 k( 62) = ( 0.5000000 0.1376426 -0.0000000), wk = 0.0021739 k( 63) = ( 0.5000000 0.1482305 -0.0000000), wk = 0.0021739 k( 64) = ( 0.5000000 0.1588184 -0.0000000), wk = 0.0021739 k( 65) = ( 0.5000000 0.1694062 -0.0000000), wk = 0.0021739 k( 66) = ( 0.5000000 0.1799941 -0.0000000), wk = 0.0021739 k( 67) = ( 0.5000000 0.1905820 -0.0000000), wk = 0.0021739 k( 68) = ( 0.5000000 0.2011699 -0.0000000), wk = 0.0021739 k( 69) = ( 0.5000000 0.2117578 -0.0000000), wk = 0.0021739 k( 70) = ( 0.5000000 0.2223457 -0.0000000), wk = 0.0021739 k( 71) = ( 0.5000000 0.2329336 -0.0000000), wk = 0.0021739 k( 72) = ( 0.5000000 0.2435215 -0.0000000), wk = 0.0021739 k( 73) = ( 0.5000000 0.2541094 -0.0000000), wk = 0.0021739 k( 74) = ( 0.5000000 0.2646973 -0.0000000), wk = 0.0021739 k( 75) = ( 0.5000000 0.2752851 -0.0000000), wk = 0.0021739 k( 76) = ( 0.5000000 0.2858730 -0.0000000), wk = 0.0021739 k( 77) = ( 0.5000000 0.2964609 -0.0000000), wk = 0.0021739 k( 78) = ( 0.5000000 0.3070488 -0.0000000), wk = 0.0021739 k( 79) = ( 0.5000000 0.3176367 -0.0000000), wk = 0.0021739 k( 80) = ( 0.5000000 0.3282246 -0.0000000), wk = 0.0021739 k( 81) = ( 0.5000000 0.3388125 -0.0000000), wk = 0.0021739 k( 82) = ( 0.5000000 0.3494004 -0.0000000), wk = 0.0021739 k( 83) = ( 0.5000000 0.3599883 -0.0000000), wk = 0.0021739 k( 84) = ( 0.5000000 0.3705762 -0.0000000), wk = 0.0021739 k( 85) = ( 0.5000000 0.3811641 -0.0000000), wk = 0.0021739 k( 86) = ( 0.5000000 0.3811641 -0.0000000), wk = 0.0021739 k( 87) = ( 0.4893617 0.3811641 -0.0000000), wk = 0.0021739 k( 88) = ( 0.4787234 0.3811641 -0.0000000), wk = 0.0021739 k( 89) = ( 0.4680851 0.3811641 -0.0000000), wk = 0.0021739 k( 90) = ( 0.4574468 0.3811641 -0.0000000), wk = 0.0021739 k( 91) = ( 0.4468085 0.3811641 -0.0000000), wk = 0.0021739 k( 92) = ( 0.4361702 0.3811641 -0.0000000), wk = 0.0021739 k( 93) = ( 0.4255319 0.3811641 -0.0000000), wk = 0.0021739 k( 94) = ( 0.4148936 0.3811641 -0.0000000), wk = 0.0021739 k( 95) = ( 0.4042553 0.3811641 -0.0000000), wk = 0.0021739 k( 96) = ( 0.3936170 0.3811641 -0.0000000), wk = 0.0021739 k( 97) = ( 0.3829787 0.3811641 -0.0000000), wk = 0.0021739 k( 98) = ( 0.3723404 0.3811641 -0.0000000), wk = 0.0021739 k( 99) = ( 0.3617021 0.3811641 -0.0000000), wk = 0.0021739 k( 100) = ( 0.3510638 0.3811641 -0.0000000), wk = 0.0021739 k( 101) = ( 0.3404255 0.3811641 -0.0000000), wk = 0.0021739 k( 102) = ( 0.3297872 0.3811641 -0.0000000), wk = 0.0021739 k( 103) = ( 0.3191489 0.3811641 -0.0000000), wk = 0.0021739 k( 104) = ( 0.3085106 0.3811641 -0.0000000), wk = 0.0021739 k( 105) = ( 0.2978723 0.3811641 -0.0000000), wk = 0.0021739 k( 106) = ( 0.2872340 0.3811641 -0.0000000), wk = 0.0021739 k( 107) = ( 0.2765957 0.3811641 -0.0000000), wk = 0.0021739 k( 108) = ( 0.2659574 0.3811641 -0.0000000), wk = 0.0021739 k( 109) = ( 0.2553191 0.3811641 -0.0000000), wk = 0.0021739 k( 110) = ( 0.2446809 0.3811641 -0.0000000), wk = 0.0021739 k( 111) = ( 0.2340425 0.3811641 -0.0000000), wk = 0.0021739 k( 112) = ( 0.2234043 0.3811641 -0.0000000), wk = 0.0021739 k( 113) = ( 0.2127660 0.3811641 -0.0000000), wk = 0.0021739 k( 114) = ( 0.2021277 0.3811641 -0.0000000), wk = 0.0021739 k( 115) = ( 0.1914894 0.3811641 -0.0000000), wk = 0.0021739 k( 116) = ( 0.1808511 0.3811641 -0.0000000), wk = 0.0021739 k( 117) = ( 0.1702128 0.3811641 -0.0000000), wk = 0.0021739 k( 118) = ( 0.1595745 0.3811641 -0.0000000), wk = 0.0021739 k( 119) = ( 0.1489362 0.3811641 -0.0000000), wk = 0.0021739 k( 120) = ( 0.1382979 0.3811641 -0.0000000), wk = 0.0021739 k( 121) = ( 0.1276596 0.3811641 -0.0000000), wk = 0.0021739 k( 122) = ( 0.1170213 0.3811641 -0.0000000), wk = 0.0021739 k( 123) = ( 0.1063830 0.3811641 -0.0000000), wk = 0.0021739 k( 124) = ( 0.0957447 0.3811641 -0.0000000), wk = 0.0021739 k( 125) = ( 0.0851064 0.3811641 -0.0000000), wk = 0.0021739 k( 126) = ( 0.0744681 0.3811641 -0.0000000), wk = 0.0021739 k( 127) = ( 0.0638298 0.3811641 -0.0000000), wk = 0.0021739 k( 128) = ( 0.0531915 0.3811641 -0.0000000), wk = 0.0021739 k( 129) = ( 0.0425532 0.3811641 -0.0000000), wk = 0.0021739 k( 130) = ( 0.0319149 0.3811641 -0.0000000), wk = 0.0021739 k( 131) = ( 0.0212766 0.3811641 -0.0000000), wk = 0.0021739 k( 132) = ( 0.0106383 0.3811641 -0.0000000), wk = 0.0021739 k( 133) = ( 0.0000000 0.3811641 -0.0000000), wk = 0.0021739 k( 134) = ( 0.0000000 0.3811641 -0.0000000), wk = 0.0021739 k( 135) = ( 0.0000000 0.3705762 -0.0000000), wk = 0.0021739 k( 136) = ( 0.0000000 0.3599883 -0.0000000), wk = 0.0021739 k( 137) = ( 0.0000000 0.3494004 -0.0000000), wk = 0.0021739 k( 138) = ( 0.0000000 0.3388125 -0.0000000), wk = 0.0021739 k( 139) = ( 0.0000000 0.3282246 -0.0000000), wk = 0.0021739 k( 140) = ( 0.0000000 0.3176367 -0.0000000), wk = 0.0021739 k( 141) = ( 0.0000000 0.3070488 -0.0000000), wk = 0.0021739 k( 142) = ( 0.0000000 0.2964609 -0.0000000), wk = 0.0021739 k( 143) = ( 0.0000000 0.2858730 -0.0000000), wk = 0.0021739 k( 144) = ( 0.0000000 0.2752851 -0.0000000), wk = 0.0021739 k( 145) = ( 0.0000000 0.2646973 -0.0000000), wk = 0.0021739 k( 146) = ( 0.0000000 0.2541094 -0.0000000), wk = 0.0021739 k( 147) = ( 0.0000000 0.2435215 -0.0000000), wk = 0.0021739 k( 148) = ( 0.0000000 0.2329336 -0.0000000), wk = 0.0021739 k( 149) = ( 0.0000000 0.2223457 -0.0000000), wk = 0.0021739 k( 150) = ( 0.0000000 0.2117578 -0.0000000), wk = 0.0021739 k( 151) = ( 0.0000000 0.2011699 -0.0000000), wk = 0.0021739 k( 152) = ( 0.0000000 0.1905820 -0.0000000), wk = 0.0021739 k( 153) = ( 0.0000000 0.1799941 -0.0000000), wk = 0.0021739 k( 154) = ( 0.0000000 0.1694062 -0.0000000), wk = 0.0021739 k( 155) = ( 0.0000000 0.1588184 -0.0000000), wk = 0.0021739 k( 156) = ( 0.0000000 0.1482305 -0.0000000), wk = 0.0021739 k( 157) = ( 0.0000000 0.1376426 -0.0000000), wk = 0.0021739 k( 158) = ( 0.0000000 0.1270547 -0.0000000), wk = 0.0021739 k( 159) = ( 0.0000000 0.1164668 -0.0000000), wk = 0.0021739 k( 160) = ( 0.0000000 0.1058789 -0.0000000), wk = 0.0021739 k( 161) = ( 0.0000000 0.0952910 -0.0000000), wk = 0.0021739 k( 162) = ( 0.0000000 0.0847031 -0.0000000), wk = 0.0021739 k( 163) = ( 0.0000000 0.0741152 -0.0000000), wk = 0.0021739 k( 164) = ( 0.0000000 0.0635273 -0.0000000), wk = 0.0021739 k( 165) = ( 0.0000000 0.0529394 -0.0000000), wk = 0.0021739 k( 166) = ( 0.0000000 0.0423516 -0.0000000), wk = 0.0021739 k( 167) = ( 0.0000000 0.0317637 -0.0000000), wk = 0.0021739 k( 168) = ( 0.0000000 0.0211758 -0.0000000), wk = 0.0021739 k( 169) = ( 0.0000000 0.0105879 -0.0000000), wk = 0.0021739 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 172) = ( 0.0000000 0.0000000 0.0107657), wk = 0.0021739 k( 173) = ( 0.0000000 0.0000000 0.0215313), wk = 0.0021739 k( 174) = ( 0.0000000 0.0000000 0.0322970), wk = 0.0021739 k( 175) = ( 0.0000000 0.0000000 0.0430626), wk = 0.0021739 k( 176) = ( 0.0000000 0.0000000 0.0538283), wk = 0.0021739 k( 177) = ( 0.0000000 0.0000000 0.0645939), wk = 0.0021739 k( 178) = ( 0.0000000 0.0000000 0.0753596), wk = 0.0021739 k( 179) = ( 0.0000000 0.0000000 0.0861252), wk = 0.0021739 k( 180) = ( 0.0000000 0.0000000 0.0968909), wk = 0.0021739 k( 181) = ( 0.0000000 0.0000000 0.1076565), wk = 0.0021739 k( 182) = ( 0.0000000 0.0000000 0.1184222), wk = 0.0021739 k( 183) = ( 0.0000000 0.0000000 0.1291878), wk = 0.0021739 k( 184) = ( 0.0000000 0.0000000 0.1399535), wk = 0.0021739 k( 185) = ( 0.0000000 0.0000000 0.1507191), wk = 0.0021739 k( 186) = ( 0.0000000 0.0000000 0.1614848), wk = 0.0021739 k( 187) = ( 0.0000000 0.0000000 0.1722504), wk = 0.0021739 k( 188) = ( 0.0000000 0.0000000 0.1830161), wk = 0.0021739 k( 189) = ( 0.0000000 0.0000000 0.1937817), wk = 0.0021739 k( 190) = ( 0.0000000 0.0000000 0.2045474), wk = 0.0021739 k( 191) = ( 0.0000000 0.0000000 0.2153130), wk = 0.0021739 k( 192) = ( 0.0000000 0.0000000 0.2260787), wk = 0.0021739 k( 193) = ( 0.0000000 0.0000000 0.2368443), wk = 0.0021739 k( 194) = ( 0.0000000 0.0000000 0.2476100), wk = 0.0021739 k( 195) = ( 0.0000000 0.0000000 0.2583756), wk = 0.0021739 k( 196) = ( 0.0000000 0.0000000 0.2691413), wk = 0.0021739 k( 197) = ( 0.0000000 0.0000000 0.2799069), wk = 0.0021739 k( 198) = ( 0.0000000 0.0000000 0.2906726), wk = 0.0021739 k( 199) = ( 0.0000000 0.0000000 0.3014382), wk = 0.0021739 k( 200) = ( 0.0000000 0.0000000 0.3122039), wk = 0.0021739 k( 201) = ( 0.0000000 0.0000000 0.3122039), wk = 0.0021739 k( 202) = ( 0.0106383 -0.0000000 0.3122039), wk = 0.0021739 k( 203) = ( 0.0212766 -0.0000000 0.3122039), wk = 0.0021739 k( 204) = ( 0.0319149 -0.0000000 0.3122039), wk = 0.0021739 k( 205) = ( 0.0425532 -0.0000000 0.3122039), wk = 0.0021739 k( 206) = ( 0.0531915 -0.0000000 0.3122039), wk = 0.0021739 k( 207) = ( 0.0638298 -0.0000000 0.3122039), wk = 0.0021739 k( 208) = ( 0.0744681 -0.0000000 0.3122039), wk = 0.0021739 k( 209) = ( 0.0851064 -0.0000000 0.3122039), wk = 0.0021739 k( 210) = ( 0.0957447 -0.0000000 0.3122039), wk = 0.0021739 k( 211) = ( 0.1063830 -0.0000000 0.3122039), wk = 0.0021739 k( 212) = ( 0.1170213 -0.0000000 0.3122039), wk = 0.0021739 k( 213) = ( 0.1276596 -0.0000000 0.3122039), wk = 0.0021739 k( 214) = ( 0.1382979 -0.0000000 0.3122039), wk = 0.0021739 k( 215) = ( 0.1489362 -0.0000000 0.3122039), wk = 0.0021739 k( 216) = ( 0.1595745 -0.0000000 0.3122039), wk = 0.0021739 k( 217) = ( 0.1702128 -0.0000000 0.3122039), wk = 0.0021739 k( 218) = ( 0.1808511 -0.0000000 0.3122039), wk = 0.0021739 k( 219) = ( 0.1914894 -0.0000000 0.3122039), wk = 0.0021739 k( 220) = ( 0.2021277 -0.0000000 0.3122039), wk = 0.0021739 k( 221) = ( 0.2127660 -0.0000000 0.3122039), wk = 0.0021739 k( 222) = ( 0.2234043 -0.0000000 0.3122039), wk = 0.0021739 k( 223) = ( 0.2340425 -0.0000000 0.3122039), wk = 0.0021739 k( 224) = ( 0.2446809 -0.0000000 0.3122039), wk = 0.0021739 k( 225) = ( 0.2553191 -0.0000000 0.3122039), wk = 0.0021739 k( 226) = ( 0.2659574 -0.0000000 0.3122039), wk = 0.0021739 k( 227) = ( 0.2765957 -0.0000000 0.3122039), wk = 0.0021739 k( 228) = ( 0.2872340 -0.0000000 0.3122039), wk = 0.0021739 k( 229) = ( 0.2978723 -0.0000000 0.3122039), wk = 0.0021739 k( 230) = ( 0.3085106 -0.0000000 0.3122039), wk = 0.0021739 k( 231) = ( 0.3191489 -0.0000000 0.3122039), wk = 0.0021739 k( 232) = ( 0.3297872 -0.0000000 0.3122039), wk = 0.0021739 k( 233) = ( 0.3404255 -0.0000000 0.3122039), wk = 0.0021739 k( 234) = ( 0.3510638 -0.0000000 0.3122039), wk = 0.0021739 k( 235) = ( 0.3617021 -0.0000000 0.3122039), wk = 0.0021739 k( 236) = ( 0.3723404 -0.0000000 0.3122039), wk = 0.0021739 k( 237) = ( 0.3829787 -0.0000000 0.3122039), wk = 0.0021739 k( 238) = ( 0.3936170 -0.0000000 0.3122039), wk = 0.0021739 k( 239) = ( 0.4042553 -0.0000000 0.3122039), wk = 0.0021739 k( 240) = ( 0.4148936 -0.0000000 0.3122039), wk = 0.0021739 k( 241) = ( 0.4255319 -0.0000000 0.3122039), wk = 0.0021739 k( 242) = ( 0.4361702 -0.0000000 0.3122039), wk = 0.0021739 k( 243) = ( 0.4468085 -0.0000000 0.3122039), wk = 0.0021739 k( 244) = ( 0.4574468 -0.0000000 0.3122039), wk = 0.0021739 k( 245) = ( 0.4680851 -0.0000000 0.3122039), wk = 0.0021739 k( 246) = ( 0.4787234 -0.0000000 0.3122039), wk = 0.0021739 k( 247) = ( 0.4893617 -0.0000000 0.3122039), wk = 0.0021739 k( 248) = ( 0.5000000 -0.0000000 0.3122039), wk = 0.0021739 k( 249) = ( 0.5000000 -0.0000000 0.3122039), wk = 0.0021739 k( 250) = ( 0.5000000 0.0105879 0.3122039), wk = 0.0021739 k( 251) = ( 0.5000000 0.0211758 0.3122039), wk = 0.0021739 k( 252) = ( 0.5000000 0.0317637 0.3122039), wk = 0.0021739 k( 253) = ( 0.5000000 0.0423516 0.3122039), wk = 0.0021739 k( 254) = ( 0.5000000 0.0529394 0.3122039), wk = 0.0021739 k( 255) = ( 0.5000000 0.0635273 0.3122039), wk = 0.0021739 k( 256) = ( 0.5000000 0.0741152 0.3122039), wk = 0.0021739 k( 257) = ( 0.5000000 0.0847031 0.3122039), wk = 0.0021739 k( 258) = ( 0.5000000 0.0952910 0.3122039), wk = 0.0021739 k( 259) = ( 0.5000000 0.1058789 0.3122039), wk = 0.0021739 k( 260) = ( 0.5000000 0.1164668 0.3122039), wk = 0.0021739 k( 261) = ( 0.5000000 0.1270547 0.3122039), wk = 0.0021739 k( 262) = ( 0.5000000 0.1376426 0.3122039), wk = 0.0021739 k( 263) = ( 0.5000000 0.1482305 0.3122039), wk = 0.0021739 k( 264) = ( 0.5000000 0.1588184 0.3122039), wk = 0.0021739 k( 265) = ( 0.5000000 0.1694062 0.3122039), wk = 0.0021739 k( 266) = ( 0.5000000 0.1799941 0.3122039), wk = 0.0021739 k( 267) = ( 0.5000000 0.1905820 0.3122039), wk = 0.0021739 k( 268) = ( 0.5000000 0.2011699 0.3122039), wk = 0.0021739 k( 269) = ( 0.5000000 0.2117578 0.3122039), wk = 0.0021739 k( 270) = ( 0.5000000 0.2223457 0.3122039), wk = 0.0021739 k( 271) = ( 0.5000000 0.2329336 0.3122039), wk = 0.0021739 k( 272) = ( 0.5000000 0.2435215 0.3122039), wk = 0.0021739 k( 273) = ( 0.5000000 0.2541094 0.3122039), wk = 0.0021739 k( 274) = ( 0.5000000 0.2646973 0.3122039), wk = 0.0021739 k( 275) = ( 0.5000000 0.2752851 0.3122039), wk = 0.0021739 k( 276) = ( 0.5000000 0.2858730 0.3122039), wk = 0.0021739 k( 277) = ( 0.5000000 0.2964609 0.3122039), wk = 0.0021739 k( 278) = ( 0.5000000 0.3070488 0.3122039), wk = 0.0021739 k( 279) = ( 0.5000000 0.3176367 0.3122039), wk = 0.0021739 k( 280) = ( 0.5000000 0.3282246 0.3122039), wk = 0.0021739 k( 281) = ( 0.5000000 0.3388125 0.3122039), wk = 0.0021739 k( 282) = ( 0.5000000 0.3494004 0.3122039), wk = 0.0021739 k( 283) = ( 0.5000000 0.3599883 0.3122039), wk = 0.0021739 k( 284) = ( 0.5000000 0.3705762 0.3122039), wk = 0.0021739 k( 285) = ( 0.5000000 0.3811641 0.3122039), wk = 0.0021739 k( 286) = ( 0.5000000 0.3811641 0.3122039), wk = 0.0021739 k( 287) = ( 0.4893617 0.3811641 0.3122039), wk = 0.0021739 k( 288) = ( 0.4787234 0.3811641 0.3122039), wk = 0.0021739 k( 289) = ( 0.4680851 0.3811641 0.3122039), wk = 0.0021739 k( 290) = ( 0.4574468 0.3811641 0.3122039), wk = 0.0021739 k( 291) = ( 0.4468085 0.3811641 0.3122039), wk = 0.0021739 k( 292) = ( 0.4361702 0.3811641 0.3122039), wk = 0.0021739 k( 293) = ( 0.4255319 0.3811641 0.3122039), wk = 0.0021739 k( 294) = ( 0.4148936 0.3811641 0.3122039), wk = 0.0021739 k( 295) = ( 0.4042553 0.3811641 0.3122039), wk = 0.0021739 k( 296) = ( 0.3936170 0.3811641 0.3122039), wk = 0.0021739 k( 297) = ( 0.3829787 0.3811641 0.3122039), wk = 0.0021739 k( 298) = ( 0.3723404 0.3811641 0.3122039), wk = 0.0021739 k( 299) = ( 0.3617021 0.3811641 0.3122039), wk = 0.0021739 k( 300) = ( 0.3510638 0.3811641 0.3122039), wk = 0.0021739 k( 301) = ( 0.3404255 0.3811641 0.3122039), wk = 0.0021739 k( 302) = ( 0.3297872 0.3811641 0.3122039), wk = 0.0021739 k( 303) = ( 0.3191489 0.3811641 0.3122039), wk = 0.0021739 k( 304) = ( 0.3085106 0.3811641 0.3122039), wk = 0.0021739 k( 305) = ( 0.2978723 0.3811641 0.3122039), wk = 0.0021739 k( 306) = ( 0.2872340 0.3811641 0.3122039), wk = 0.0021739 k( 307) = ( 0.2765957 0.3811641 0.3122039), wk = 0.0021739 k( 308) = ( 0.2659574 0.3811641 0.3122039), wk = 0.0021739 k( 309) = ( 0.2553191 0.3811641 0.3122039), wk = 0.0021739 k( 310) = ( 0.2446809 0.3811641 0.3122039), wk = 0.0021739 k( 311) = ( 0.2340425 0.3811641 0.3122039), wk = 0.0021739 k( 312) = ( 0.2234043 0.3811641 0.3122039), wk = 0.0021739 k( 313) = ( 0.2127660 0.3811641 0.3122039), wk = 0.0021739 k( 314) = ( 0.2021277 0.3811641 0.3122039), wk = 0.0021739 k( 315) = ( 0.1914894 0.3811641 0.3122039), wk = 0.0021739 k( 316) = ( 0.1808511 0.3811641 0.3122039), wk = 0.0021739 k( 317) = ( 0.1702128 0.3811641 0.3122039), wk = 0.0021739 k( 318) = ( 0.1595745 0.3811641 0.3122039), wk = 0.0021739 k( 319) = ( 0.1489362 0.3811641 0.3122039), wk = 0.0021739 k( 320) = ( 0.1382979 0.3811641 0.3122039), wk = 0.0021739 k( 321) = ( 0.1276596 0.3811641 0.3122039), wk = 0.0021739 k( 322) = ( 0.1170213 0.3811641 0.3122039), wk = 0.0021739 k( 323) = ( 0.1063830 0.3811641 0.3122039), wk = 0.0021739 k( 324) = ( 0.0957447 0.3811641 0.3122039), wk = 0.0021739 k( 325) = ( 0.0851064 0.3811641 0.3122039), wk = 0.0021739 k( 326) = ( 0.0744681 0.3811641 0.3122039), wk = 0.0021739 k( 327) = ( 0.0638298 0.3811641 0.3122039), wk = 0.0021739 k( 328) = ( 0.0531915 0.3811641 0.3122039), wk = 0.0021739 k( 329) = ( 0.0425532 0.3811641 0.3122039), wk = 0.0021739 k( 330) = ( 0.0319149 0.3811641 0.3122039), wk = 0.0021739 k( 331) = ( 0.0212766 0.3811641 0.3122039), wk = 0.0021739 k( 332) = ( 0.0106383 0.3811641 0.3122039), wk = 0.0021739 k( 333) = ( 0.0000000 0.3811641 0.3122039), wk = 0.0021739 k( 334) = ( 0.0000000 0.3811641 0.3122039), wk = 0.0021739 k( 335) = ( 0.0000000 0.3705762 0.3122039), wk = 0.0021739 k( 336) = ( 0.0000000 0.3599883 0.3122039), wk = 0.0021739 k( 337) = ( 0.0000000 0.3494004 0.3122039), wk = 0.0021739 k( 338) = ( 0.0000000 0.3388125 0.3122039), wk = 0.0021739 k( 339) = ( 0.0000000 0.3282246 0.3122039), wk = 0.0021739 k( 340) = ( 0.0000000 0.3176367 0.3122039), wk = 0.0021739 k( 341) = ( 0.0000000 0.3070488 0.3122039), wk = 0.0021739 k( 342) = ( 0.0000000 0.2964609 0.3122039), wk = 0.0021739 k( 343) = ( 0.0000000 0.2858730 0.3122039), wk = 0.0021739 k( 344) = ( 0.0000000 0.2752851 0.3122039), wk = 0.0021739 k( 345) = ( 0.0000000 0.2646973 0.3122039), wk = 0.0021739 k( 346) = ( 0.0000000 0.2541094 0.3122039), wk = 0.0021739 k( 347) = ( 0.0000000 0.2435215 0.3122039), wk = 0.0021739 k( 348) = ( 0.0000000 0.2329336 0.3122039), wk = 0.0021739 k( 349) = ( 0.0000000 0.2223457 0.3122039), wk = 0.0021739 k( 350) = ( 0.0000000 0.2117578 0.3122039), wk = 0.0021739 k( 351) = ( 0.0000000 0.2011699 0.3122039), wk = 0.0021739 k( 352) = ( 0.0000000 0.1905820 0.3122039), wk = 0.0021739 k( 353) = ( 0.0000000 0.1799941 0.3122039), wk = 0.0021739 k( 354) = ( 0.0000000 0.1694062 0.3122039), wk = 0.0021739 k( 355) = ( 0.0000000 0.1588184 0.3122039), wk = 0.0021739 k( 356) = ( 0.0000000 0.1482305 0.3122039), wk = 0.0021739 k( 357) = ( 0.0000000 0.1376426 0.3122039), wk = 0.0021739 k( 358) = ( 0.0000000 0.1270547 0.3122039), wk = 0.0021739 k( 359) = ( 0.0000000 0.1164668 0.3122039), wk = 0.0021739 k( 360) = ( 0.0000000 0.1058789 0.3122039), wk = 0.0021739 k( 361) = ( 0.0000000 0.0952910 0.3122039), wk = 0.0021739 k( 362) = ( 0.0000000 0.0847031 0.3122039), wk = 0.0021739 k( 363) = ( 0.0000000 0.0741152 0.3122039), wk = 0.0021739 k( 364) = ( 0.0000000 0.0635273 0.3122039), wk = 0.0021739 k( 365) = ( 0.0000000 0.0529394 0.3122039), wk = 0.0021739 k( 366) = ( 0.0000000 0.0423516 0.3122039), wk = 0.0021739 k( 367) = ( 0.0000000 0.0317637 0.3122039), wk = 0.0021739 k( 368) = ( 0.0000000 0.0211758 0.3122039), wk = 0.0021739 k( 369) = ( 0.0000000 0.0105879 0.3122039), wk = 0.0021739 k( 370) = ( 0.0000000 0.0000000 0.3122039), wk = 0.0021739 k( 371) = ( 0.0000000 0.3811641 -0.0000000), wk = 0.0021739 k( 372) = ( 0.0000000 0.3811641 0.0107657), wk = 0.0021739 k( 373) = ( 0.0000000 0.3811641 0.0215313), wk = 0.0021739 k( 374) = ( 0.0000000 0.3811641 0.0322970), wk = 0.0021739 k( 375) = ( 0.0000000 0.3811641 0.0430626), wk = 0.0021739 k( 376) = ( 0.0000000 0.3811641 0.0538283), wk = 0.0021739 k( 377) = ( 0.0000000 0.3811641 0.0645939), wk = 0.0021739 k( 378) = ( 0.0000000 0.3811641 0.0753596), wk = 0.0021739 k( 379) = ( 0.0000000 0.3811641 0.0861252), wk = 0.0021739 k( 380) = ( 0.0000000 0.3811641 0.0968909), wk = 0.0021739 k( 381) = ( 0.0000000 0.3811641 0.1076565), wk = 0.0021739 k( 382) = ( 0.0000000 0.3811641 0.1184222), wk = 0.0021739 k( 383) = ( 0.0000000 0.3811641 0.1291878), wk = 0.0021739 k( 384) = ( 0.0000000 0.3811641 0.1399535), wk = 0.0021739 k( 385) = ( 0.0000000 0.3811641 0.1507191), wk = 0.0021739 k( 386) = ( 0.0000000 0.3811641 0.1614848), wk = 0.0021739 k( 387) = ( 0.0000000 0.3811641 0.1722504), wk = 0.0021739 k( 388) = ( 0.0000000 0.3811641 0.1830161), wk = 0.0021739 k( 389) = ( 0.0000000 0.3811641 0.1937817), wk = 0.0021739 k( 390) = ( 0.0000000 0.3811641 0.2045474), wk = 0.0021739 k( 391) = ( 0.0000000 0.3811641 0.2153130), wk = 0.0021739 k( 392) = ( 0.0000000 0.3811641 0.2260787), wk = 0.0021739 k( 393) = ( 0.0000000 0.3811641 0.2368443), wk = 0.0021739 k( 394) = ( 0.0000000 0.3811641 0.2476100), wk = 0.0021739 k( 395) = ( 0.0000000 0.3811641 0.2583756), wk = 0.0021739 k( 396) = ( 0.0000000 0.3811641 0.2691413), wk = 0.0021739 k( 397) = ( 0.0000000 0.3811641 0.2799069), wk = 0.0021739 k( 398) = ( 0.0000000 0.3811641 0.2906726), wk = 0.0021739 k( 399) = ( 0.0000000 0.3811641 0.3014382), wk = 0.0021739 k( 400) = ( 0.0000000 0.3811641 0.3122039), wk = 0.0021739 k( 401) = ( 0.5000000 -0.0000000 0.3122039), wk = 0.0021739 k( 402) = ( 0.5000000 -0.0000000 0.3014382), wk = 0.0021739 k( 403) = ( 0.5000000 -0.0000000 0.2906726), wk = 0.0021739 k( 404) = ( 0.5000000 -0.0000000 0.2799069), wk = 0.0021739 k( 405) = ( 0.5000000 -0.0000000 0.2691413), wk = 0.0021739 k( 406) = ( 0.5000000 -0.0000000 0.2583756), wk = 0.0021739 k( 407) = ( 0.5000000 -0.0000000 0.2476100), wk = 0.0021739 k( 408) = ( 0.5000000 -0.0000000 0.2368443), wk = 0.0021739 k( 409) = ( 0.5000000 -0.0000000 0.2260787), wk = 0.0021739 k( 410) = ( 0.5000000 -0.0000000 0.2153130), wk = 0.0021739 k( 411) = ( 0.5000000 -0.0000000 0.2045474), wk = 0.0021739 k( 412) = ( 0.5000000 -0.0000000 0.1937817), wk = 0.0021739 k( 413) = ( 0.5000000 -0.0000000 0.1830161), wk = 0.0021739 k( 414) = ( 0.5000000 -0.0000000 0.1722504), wk = 0.0021739 k( 415) = ( 0.5000000 -0.0000000 0.1614848), wk = 0.0021739 k( 416) = ( 0.5000000 -0.0000000 0.1507191), wk = 0.0021739 k( 417) = ( 0.5000000 -0.0000000 0.1399535), wk = 0.0021739 k( 418) = ( 0.5000000 -0.0000000 0.1291878), wk = 0.0021739 k( 419) = ( 0.5000000 -0.0000000 0.1184222), wk = 0.0021739 k( 420) = ( 0.5000000 -0.0000000 0.1076565), wk = 0.0021739 k( 421) = ( 0.5000000 -0.0000000 0.0968909), wk = 0.0021739 k( 422) = ( 0.5000000 -0.0000000 0.0861252), wk = 0.0021739 k( 423) = ( 0.5000000 -0.0000000 0.0753596), wk = 0.0021739 k( 424) = ( 0.5000000 -0.0000000 0.0645939), wk = 0.0021739 k( 425) = ( 0.5000000 -0.0000000 0.0538283), wk = 0.0021739 k( 426) = ( 0.5000000 -0.0000000 0.0430626), wk = 0.0021739 k( 427) = ( 0.5000000 -0.0000000 0.0322970), wk = 0.0021739 k( 428) = ( 0.5000000 -0.0000000 0.0215313), wk = 0.0021739 k( 429) = ( 0.5000000 -0.0000000 0.0107657), wk = 0.0021739 k( 430) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0021739 k( 431) = ( 0.5000000 0.3811641 -0.0000000), wk = 0.0021739 k( 432) = ( 0.5000000 0.3811641 0.0107657), wk = 0.0021739 k( 433) = ( 0.5000000 0.3811641 0.0215313), wk = 0.0021739 k( 434) = ( 0.5000000 0.3811641 0.0322970), wk = 0.0021739 k( 435) = ( 0.5000000 0.3811641 0.0430626), wk = 0.0021739 k( 436) = ( 0.5000000 0.3811641 0.0538283), wk = 0.0021739 k( 437) = ( 0.5000000 0.3811641 0.0645939), wk = 0.0021739 k( 438) = ( 0.5000000 0.3811641 0.0753596), wk = 0.0021739 k( 439) = ( 0.5000000 0.3811641 0.0861252), wk = 0.0021739 k( 440) = ( 0.5000000 0.3811641 0.0968909), wk = 0.0021739 k( 441) = ( 0.5000000 0.3811641 0.1076565), wk = 0.0021739 k( 442) = ( 0.5000000 0.3811641 0.1184222), wk = 0.0021739 k( 443) = ( 0.5000000 0.3811641 0.1291878), wk = 0.0021739 k( 444) = ( 0.5000000 0.3811641 0.1399535), wk = 0.0021739 k( 445) = ( 0.5000000 0.3811641 0.1507191), wk = 0.0021739 k( 446) = ( 0.5000000 0.3811641 0.1614848), wk = 0.0021739 k( 447) = ( 0.5000000 0.3811641 0.1722504), wk = 0.0021739 k( 448) = ( 0.5000000 0.3811641 0.1830161), wk = 0.0021739 k( 449) = ( 0.5000000 0.3811641 0.1937817), wk = 0.0021739 k( 450) = ( 0.5000000 0.3811641 0.2045474), wk = 0.0021739 k( 451) = ( 0.5000000 0.3811641 0.2153130), wk = 0.0021739 k( 452) = ( 0.5000000 0.3811641 0.2260787), wk = 0.0021739 k( 453) = ( 0.5000000 0.3811641 0.2368443), wk = 0.0021739 k( 454) = ( 0.5000000 0.3811641 0.2476100), wk = 0.0021739 k( 455) = ( 0.5000000 0.3811641 0.2583756), wk = 0.0021739 k( 456) = ( 0.5000000 0.3811641 0.2691413), wk = 0.0021739 k( 457) = ( 0.5000000 0.3811641 0.2799069), wk = 0.0021739 k( 458) = ( 0.5000000 0.3811641 0.2906726), wk = 0.0021739 k( 459) = ( 0.5000000 0.3811641 0.3014382), wk = 0.0021739 k( 460) = ( 0.5000000 0.3811641 0.3122039), wk = 0.0021739 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 2) = ( 0.0106383 0.0000000 0.0000000), wk = 0.0021739 k( 3) = ( 0.0212766 0.0000000 0.0000000), wk = 0.0021739 k( 4) = ( 0.0319149 0.0000000 0.0000000), wk = 0.0021739 k( 5) = ( 0.0425532 0.0000000 0.0000000), wk = 0.0021739 k( 6) = ( 0.0531915 0.0000000 0.0000000), wk = 0.0021739 k( 7) = ( 0.0638298 0.0000000 0.0000000), wk = 0.0021739 k( 8) = ( 0.0744681 0.0000000 0.0000000), wk = 0.0021739 k( 9) = ( 0.0851064 0.0000000 0.0000000), wk = 0.0021739 k( 10) = ( 0.0957447 0.0000000 0.0000000), wk = 0.0021739 k( 11) = ( 0.1063830 0.0000000 0.0000000), wk = 0.0021739 k( 12) = ( 0.1170213 0.0000000 0.0000000), wk = 0.0021739 k( 13) = ( 0.1276596 0.0000000 0.0000000), wk = 0.0021739 k( 14) = ( 0.1382979 0.0000000 0.0000000), wk = 0.0021739 k( 15) = ( 0.1489362 0.0000000 0.0000000), wk = 0.0021739 k( 16) = ( 0.1595745 0.0000000 0.0000000), wk = 0.0021739 k( 17) = ( 0.1702128 0.0000000 0.0000000), wk = 0.0021739 k( 18) = ( 0.1808511 0.0000000 0.0000000), wk = 0.0021739 k( 19) = ( 0.1914894 0.0000000 0.0000000), wk = 0.0021739 k( 20) = ( 0.2021277 0.0000000 0.0000000), wk = 0.0021739 k( 21) = ( 0.2127660 0.0000000 0.0000000), wk = 0.0021739 k( 22) = ( 0.2234043 0.0000000 0.0000000), wk = 0.0021739 k( 23) = ( 0.2340425 0.0000000 0.0000000), wk = 0.0021739 k( 24) = ( 0.2446809 0.0000000 0.0000000), wk = 0.0021739 k( 25) = ( 0.2553191 0.0000000 0.0000000), wk = 0.0021739 k( 26) = ( 0.2659574 0.0000000 -0.0000000), wk = 0.0021739 k( 27) = ( 0.2765957 0.0000000 0.0000000), wk = 0.0021739 k( 28) = ( 0.2872340 0.0000000 0.0000000), wk = 0.0021739 k( 29) = ( 0.2978723 0.0000000 0.0000000), wk = 0.0021739 k( 30) = ( 0.3085106 0.0000000 0.0000000), wk = 0.0021739 k( 31) = ( 0.3191489 0.0000000 0.0000000), wk = 0.0021739 k( 32) = ( 0.3297872 0.0000000 0.0000000), wk = 0.0021739 k( 33) = ( 0.3404255 0.0000000 0.0000000), wk = 0.0021739 k( 34) = ( 0.3510638 0.0000000 0.0000000), wk = 0.0021739 k( 35) = ( 0.3617021 0.0000000 0.0000000), wk = 0.0021739 k( 36) = ( 0.3723404 0.0000000 0.0000000), wk = 0.0021739 k( 37) = ( 0.3829787 0.0000000 0.0000000), wk = 0.0021739 k( 38) = ( 0.3936170 0.0000000 0.0000000), wk = 0.0021739 k( 39) = ( 0.4042553 0.0000000 0.0000000), wk = 0.0021739 k( 40) = ( 0.4148936 0.0000000 0.0000000), wk = 0.0021739 k( 41) = ( 0.4255319 0.0000000 0.0000000), wk = 0.0021739 k( 42) = ( 0.4361702 0.0000000 0.0000000), wk = 0.0021739 k( 43) = ( 0.4468085 0.0000000 0.0000000), wk = 0.0021739 k( 44) = ( 0.4574468 0.0000000 0.0000000), wk = 0.0021739 k( 45) = ( 0.4680851 0.0000000 0.0000000), wk = 0.0021739 k( 46) = ( 0.4787234 0.0000000 0.0000000), wk = 0.0021739 k( 47) = ( 0.4893617 0.0000000 0.0000000), wk = 0.0021739 k( 48) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0021739 k( 49) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0021739 k( 50) = ( 0.5000000 0.0138889 0.0000000), wk = 0.0021739 k( 51) = ( 0.5000000 0.0277778 0.0000000), wk = 0.0021739 k( 52) = ( 0.5000000 0.0416667 0.0000000), wk = 0.0021739 k( 53) = ( 0.5000000 0.0555556 0.0000000), wk = 0.0021739 k( 54) = ( 0.5000000 0.0694444 0.0000000), wk = 0.0021739 k( 55) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0021739 k( 56) = ( 0.5000000 0.0972222 0.0000000), wk = 0.0021739 k( 57) = ( 0.5000000 0.1111111 0.0000000), wk = 0.0021739 k( 58) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0021739 k( 59) = ( 0.5000000 0.1388889 0.0000000), wk = 0.0021739 k( 60) = ( 0.5000000 0.1527778 -0.0000000), wk = 0.0021739 k( 61) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0021739 k( 62) = ( 0.5000000 0.1805556 0.0000000), wk = 0.0021739 k( 63) = ( 0.5000000 0.1944444 0.0000000), wk = 0.0021739 k( 64) = ( 0.5000000 0.2083333 0.0000000), wk = 0.0021739 k( 65) = ( 0.5000000 0.2222222 0.0000000), wk = 0.0021739 k( 66) = ( 0.5000000 0.2361111 -0.0000000), wk = 0.0021739 k( 67) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0021739 k( 68) = ( 0.5000000 0.2638889 0.0000000), wk = 0.0021739 k( 69) = ( 0.5000000 0.2777778 0.0000000), wk = 0.0021739 k( 70) = ( 0.5000000 0.2916667 0.0000000), wk = 0.0021739 k( 71) = ( 0.5000000 0.3055556 0.0000000), wk = 0.0021739 k( 72) = ( 0.5000000 0.3194444 0.0000000), wk = 0.0021739 k( 73) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0021739 k( 74) = ( 0.5000000 0.3472222 0.0000000), wk = 0.0021739 k( 75) = ( 0.5000000 0.3611111 0.0000000), wk = 0.0021739 k( 76) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0021739 k( 77) = ( 0.5000000 0.3888889 0.0000000), wk = 0.0021739 k( 78) = ( 0.5000000 0.4027778 0.0000000), wk = 0.0021739 k( 79) = ( 0.5000000 0.4166667 0.0000000), wk = 0.0021739 k( 80) = ( 0.5000000 0.4305556 0.0000000), wk = 0.0021739 k( 81) = ( 0.5000000 0.4444444 0.0000000), wk = 0.0021739 k( 82) = ( 0.5000000 0.4583333 0.0000000), wk = 0.0021739 k( 83) = ( 0.5000000 0.4722222 -0.0000000), wk = 0.0021739 k( 84) = ( 0.5000000 0.4861111 0.0000000), wk = 0.0021739 k( 85) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0021739 k( 86) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0021739 k( 87) = ( 0.4893617 0.5000000 0.0000000), wk = 0.0021739 k( 88) = ( 0.4787234 0.5000000 0.0000000), wk = 0.0021739 k( 89) = ( 0.4680851 0.5000000 0.0000000), wk = 0.0021739 k( 90) = ( 0.4574468 0.5000000 0.0000000), wk = 0.0021739 k( 91) = ( 0.4468085 0.5000000 0.0000000), wk = 0.0021739 k( 92) = ( 0.4361702 0.5000000 0.0000000), wk = 0.0021739 k( 93) = ( 0.4255319 0.5000000 0.0000000), wk = 0.0021739 k( 94) = ( 0.4148936 0.5000000 0.0000000), wk = 0.0021739 k( 95) = ( 0.4042553 0.5000000 0.0000000), wk = 0.0021739 k( 96) = ( 0.3936170 0.5000000 0.0000000), wk = 0.0021739 k( 97) = ( 0.3829787 0.5000000 0.0000000), wk = 0.0021739 k( 98) = ( 0.3723404 0.5000000 0.0000000), wk = 0.0021739 k( 99) = ( 0.3617021 0.5000000 -0.0000000), wk = 0.0021739 k( 100) = ( 0.3510638 0.5000000 0.0000000), wk = 0.0021739 k( 101) = ( 0.3404255 0.5000000 0.0000000), wk = 0.0021739 k( 102) = ( 0.3297872 0.5000000 0.0000000), wk = 0.0021739 k( 103) = ( 0.3191489 0.5000000 -0.0000000), wk = 0.0021739 k( 104) = ( 0.3085106 0.5000000 0.0000000), wk = 0.0021739 k( 105) = ( 0.2978723 0.5000000 -0.0000000), wk = 0.0021739 k( 106) = ( 0.2872340 0.5000000 0.0000000), wk = 0.0021739 k( 107) = ( 0.2765957 0.5000000 0.0000000), wk = 0.0021739 k( 108) = ( 0.2659574 0.5000000 -0.0000000), wk = 0.0021739 k( 109) = ( 0.2553191 0.5000000 -0.0000000), wk = 0.0021739 k( 110) = ( 0.2446809 0.5000000 0.0000000), wk = 0.0021739 k( 111) = ( 0.2340425 0.5000000 0.0000000), wk = 0.0021739 k( 112) = ( 0.2234043 0.5000000 0.0000000), wk = 0.0021739 k( 113) = ( 0.2127660 0.5000000 0.0000000), wk = 0.0021739 k( 114) = ( 0.2021277 0.5000000 0.0000000), wk = 0.0021739 k( 115) = ( 0.1914894 0.5000000 0.0000000), wk = 0.0021739 k( 116) = ( 0.1808511 0.5000000 0.0000000), wk = 0.0021739 k( 117) = ( 0.1702128 0.5000000 0.0000000), wk = 0.0021739 k( 118) = ( 0.1595745 0.5000000 0.0000000), wk = 0.0021739 k( 119) = ( 0.1489362 0.5000000 0.0000000), wk = 0.0021739 k( 120) = ( 0.1382979 0.5000000 0.0000000), wk = 0.0021739 k( 121) = ( 0.1276596 0.5000000 0.0000000), wk = 0.0021739 k( 122) = ( 0.1170213 0.5000000 -0.0000000), wk = 0.0021739 k( 123) = ( 0.1063830 0.5000000 0.0000000), wk = 0.0021739 k( 124) = ( 0.0957447 0.5000000 0.0000000), wk = 0.0021739 k( 125) = ( 0.0851064 0.5000000 -0.0000000), wk = 0.0021739 k( 126) = ( 0.0744681 0.5000000 0.0000000), wk = 0.0021739 k( 127) = ( 0.0638298 0.5000000 0.0000000), wk = 0.0021739 k( 128) = ( 0.0531915 0.5000000 0.0000000), wk = 0.0021739 k( 129) = ( 0.0425532 0.5000000 0.0000000), wk = 0.0021739 k( 130) = ( 0.0319149 0.5000000 -0.0000000), wk = 0.0021739 k( 131) = ( 0.0212766 0.5000000 0.0000000), wk = 0.0021739 k( 132) = ( 0.0106383 0.5000000 -0.0000000), wk = 0.0021739 k( 133) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021739 k( 134) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021739 k( 135) = ( 0.0000000 0.4861111 0.0000000), wk = 0.0021739 k( 136) = ( 0.0000000 0.4722222 0.0000000), wk = 0.0021739 k( 137) = ( 0.0000000 0.4583333 0.0000000), wk = 0.0021739 k( 138) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0021739 k( 139) = ( 0.0000000 0.4305556 -0.0000000), wk = 0.0021739 k( 140) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0021739 k( 141) = ( 0.0000000 0.4027778 0.0000000), wk = 0.0021739 k( 142) = ( 0.0000000 0.3888889 0.0000000), wk = 0.0021739 k( 143) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0021739 k( 144) = ( 0.0000000 0.3611111 0.0000000), wk = 0.0021739 k( 145) = ( 0.0000000 0.3472222 0.0000000), wk = 0.0021739 k( 146) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0021739 k( 147) = ( 0.0000000 0.3194444 0.0000000), wk = 0.0021739 k( 148) = ( 0.0000000 0.3055556 0.0000000), wk = 0.0021739 k( 149) = ( 0.0000000 0.2916667 -0.0000000), wk = 0.0021739 k( 150) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0021739 k( 151) = ( 0.0000000 0.2638889 0.0000000), wk = 0.0021739 k( 152) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0021739 k( 153) = ( 0.0000000 0.2361111 0.0000000), wk = 0.0021739 k( 154) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0021739 k( 155) = ( 0.0000000 0.2083333 0.0000000), wk = 0.0021739 k( 156) = ( 0.0000000 0.1944444 0.0000000), wk = 0.0021739 k( 157) = ( 0.0000000 0.1805556 0.0000000), wk = 0.0021739 k( 158) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0021739 k( 159) = ( 0.0000000 0.1527778 0.0000000), wk = 0.0021739 k( 160) = ( 0.0000000 0.1388889 0.0000000), wk = 0.0021739 k( 161) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0021739 k( 162) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0021739 k( 163) = ( 0.0000000 0.0972222 0.0000000), wk = 0.0021739 k( 164) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0021739 k( 165) = ( 0.0000000 0.0694444 -0.0000000), wk = 0.0021739 k( 166) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0021739 k( 167) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0021739 k( 168) = ( 0.0000000 0.0277778 -0.0000000), wk = 0.0021739 k( 169) = ( 0.0000000 0.0138889 -0.0000000), wk = 0.0021739 k( 170) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 171) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 172) = ( 0.0000000 0.0000000 0.0172414), wk = 0.0021739 k( 173) = ( 0.0000000 0.0000000 0.0344828), wk = 0.0021739 k( 174) = ( 0.0000000 0.0000000 0.0517241), wk = 0.0021739 k( 175) = ( 0.0000000 0.0000000 0.0689655), wk = 0.0021739 k( 176) = ( 0.0000000 0.0000000 0.0862069), wk = 0.0021739 k( 177) = ( 0.0000000 0.0000000 0.1034483), wk = 0.0021739 k( 178) = ( 0.0000000 0.0000000 0.1206897), wk = 0.0021739 k( 179) = ( 0.0000000 0.0000000 0.1379310), wk = 0.0021739 k( 180) = ( 0.0000000 0.0000000 0.1551724), wk = 0.0021739 k( 181) = ( 0.0000000 0.0000000 0.1724138), wk = 0.0021739 k( 182) = ( 0.0000000 0.0000000 0.1896552), wk = 0.0021739 k( 183) = ( 0.0000000 0.0000000 0.2068965), wk = 0.0021739 k( 184) = ( 0.0000000 0.0000000 0.2241379), wk = 0.0021739 k( 185) = ( 0.0000000 0.0000000 0.2413793), wk = 0.0021739 k( 186) = ( 0.0000000 0.0000000 0.2586207), wk = 0.0021739 k( 187) = ( 0.0000000 0.0000000 0.2758621), wk = 0.0021739 k( 188) = ( 0.0000000 0.0000000 0.2931034), wk = 0.0021739 k( 189) = ( 0.0000000 0.0000000 0.3103448), wk = 0.0021739 k( 190) = ( 0.0000000 0.0000000 0.3275862), wk = 0.0021739 k( 191) = ( 0.0000000 0.0000000 0.3448276), wk = 0.0021739 k( 192) = ( 0.0000000 0.0000000 0.3620690), wk = 0.0021739 k( 193) = ( 0.0000000 0.0000000 0.3793103), wk = 0.0021739 k( 194) = ( 0.0000000 0.0000000 0.3965517), wk = 0.0021739 k( 195) = ( 0.0000000 0.0000000 0.4137931), wk = 0.0021739 k( 196) = ( 0.0000000 0.0000000 0.4310345), wk = 0.0021739 k( 197) = ( 0.0000000 0.0000000 0.4482759), wk = 0.0021739 k( 198) = ( 0.0000000 0.0000000 0.4655172), wk = 0.0021739 k( 199) = ( 0.0000000 0.0000000 0.4827586), wk = 0.0021739 k( 200) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 201) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 202) = ( 0.0106383 0.0000000 0.5000000), wk = 0.0021739 k( 203) = ( 0.0212766 0.0000000 0.5000000), wk = 0.0021739 k( 204) = ( 0.0319149 0.0000000 0.5000000), wk = 0.0021739 k( 205) = ( 0.0425532 0.0000000 0.5000000), wk = 0.0021739 k( 206) = ( 0.0531915 0.0000000 0.5000000), wk = 0.0021739 k( 207) = ( 0.0638298 0.0000000 0.5000000), wk = 0.0021739 k( 208) = ( 0.0744681 0.0000000 0.5000000), wk = 0.0021739 k( 209) = ( 0.0851064 0.0000000 0.5000000), wk = 0.0021739 k( 210) = ( 0.0957447 0.0000000 0.5000000), wk = 0.0021739 k( 211) = ( 0.1063830 0.0000000 0.5000000), wk = 0.0021739 k( 212) = ( 0.1170213 0.0000000 0.5000000), wk = 0.0021739 k( 213) = ( 0.1276596 0.0000000 0.5000000), wk = 0.0021739 k( 214) = ( 0.1382979 0.0000000 0.5000000), wk = 0.0021739 k( 215) = ( 0.1489362 0.0000000 0.5000000), wk = 0.0021739 k( 216) = ( 0.1595745 0.0000000 0.5000000), wk = 0.0021739 k( 217) = ( 0.1702128 0.0000000 0.5000000), wk = 0.0021739 k( 218) = ( 0.1808511 0.0000000 0.5000000), wk = 0.0021739 k( 219) = ( 0.1914894 0.0000000 0.5000000), wk = 0.0021739 k( 220) = ( 0.2021277 0.0000000 0.5000000), wk = 0.0021739 k( 221) = ( 0.2127660 0.0000000 0.5000000), wk = 0.0021739 k( 222) = ( 0.2234043 0.0000000 0.5000000), wk = 0.0021739 k( 223) = ( 0.2340425 0.0000000 0.5000000), wk = 0.0021739 k( 224) = ( 0.2446809 0.0000000 0.5000000), wk = 0.0021739 k( 225) = ( 0.2553191 0.0000000 0.5000000), wk = 0.0021739 k( 226) = ( 0.2659574 0.0000000 0.5000000), wk = 0.0021739 k( 227) = ( 0.2765957 0.0000000 0.5000000), wk = 0.0021739 k( 228) = ( 0.2872340 0.0000000 0.5000000), wk = 0.0021739 k( 229) = ( 0.2978723 0.0000000 0.5000000), wk = 0.0021739 k( 230) = ( 0.3085106 0.0000000 0.5000000), wk = 0.0021739 k( 231) = ( 0.3191489 0.0000000 0.5000000), wk = 0.0021739 k( 232) = ( 0.3297872 0.0000000 0.5000000), wk = 0.0021739 k( 233) = ( 0.3404255 0.0000000 0.5000000), wk = 0.0021739 k( 234) = ( 0.3510638 0.0000000 0.5000000), wk = 0.0021739 k( 235) = ( 0.3617021 0.0000000 0.5000000), wk = 0.0021739 k( 236) = ( 0.3723404 0.0000000 0.5000000), wk = 0.0021739 k( 237) = ( 0.3829787 0.0000000 0.5000000), wk = 0.0021739 k( 238) = ( 0.3936170 0.0000000 0.5000000), wk = 0.0021739 k( 239) = ( 0.4042553 0.0000000 0.5000000), wk = 0.0021739 k( 240) = ( 0.4148936 0.0000000 0.5000000), wk = 0.0021739 k( 241) = ( 0.4255319 0.0000000 0.5000000), wk = 0.0021739 k( 242) = ( 0.4361702 0.0000000 0.5000000), wk = 0.0021739 k( 243) = ( 0.4468085 0.0000000 0.5000000), wk = 0.0021739 k( 244) = ( 0.4574468 0.0000000 0.5000000), wk = 0.0021739 k( 245) = ( 0.4680851 0.0000000 0.5000000), wk = 0.0021739 k( 246) = ( 0.4787234 0.0000000 0.5000000), wk = 0.0021739 k( 247) = ( 0.4893617 0.0000000 0.5000000), wk = 0.0021739 k( 248) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021739 k( 249) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021739 k( 250) = ( 0.5000000 0.0138889 0.5000000), wk = 0.0021739 k( 251) = ( 0.5000000 0.0277778 0.5000000), wk = 0.0021739 k( 252) = ( 0.5000000 0.0416667 0.5000000), wk = 0.0021739 k( 253) = ( 0.5000000 0.0555556 0.5000000), wk = 0.0021739 k( 254) = ( 0.5000000 0.0694444 0.5000000), wk = 0.0021739 k( 255) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0021739 k( 256) = ( 0.5000000 0.0972222 0.5000000), wk = 0.0021739 k( 257) = ( 0.5000000 0.1111111 0.5000000), wk = 0.0021739 k( 258) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0021739 k( 259) = ( 0.5000000 0.1388889 0.5000000), wk = 0.0021739 k( 260) = ( 0.5000000 0.1527778 0.5000000), wk = 0.0021739 k( 261) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0021739 k( 262) = ( 0.5000000 0.1805556 0.5000000), wk = 0.0021739 k( 263) = ( 0.5000000 0.1944444 0.5000000), wk = 0.0021739 k( 264) = ( 0.5000000 0.2083333 0.5000000), wk = 0.0021739 k( 265) = ( 0.5000000 0.2222222 0.5000000), wk = 0.0021739 k( 266) = ( 0.5000000 0.2361111 0.5000000), wk = 0.0021739 k( 267) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0021739 k( 268) = ( 0.5000000 0.2638889 0.5000000), wk = 0.0021739 k( 269) = ( 0.5000000 0.2777778 0.5000000), wk = 0.0021739 k( 270) = ( 0.5000000 0.2916667 0.5000000), wk = 0.0021739 k( 271) = ( 0.5000000 0.3055556 0.5000000), wk = 0.0021739 k( 272) = ( 0.5000000 0.3194444 0.5000000), wk = 0.0021739 k( 273) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0021739 k( 274) = ( 0.5000000 0.3472222 0.5000000), wk = 0.0021739 k( 275) = ( 0.5000000 0.3611111 0.5000000), wk = 0.0021739 k( 276) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0021739 k( 277) = ( 0.5000000 0.3888889 0.5000000), wk = 0.0021739 k( 278) = ( 0.5000000 0.4027778 0.5000000), wk = 0.0021739 k( 279) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0021739 k( 280) = ( 0.5000000 0.4305556 0.5000000), wk = 0.0021739 k( 281) = ( 0.5000000 0.4444444 0.5000000), wk = 0.0021739 k( 282) = ( 0.5000000 0.4583333 0.5000000), wk = 0.0021739 k( 283) = ( 0.5000000 0.4722222 0.5000000), wk = 0.0021739 k( 284) = ( 0.5000000 0.4861111 0.5000000), wk = 0.0021739 k( 285) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021739 k( 286) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021739 k( 287) = ( 0.4893617 0.5000000 0.5000000), wk = 0.0021739 k( 288) = ( 0.4787234 0.5000000 0.5000000), wk = 0.0021739 k( 289) = ( 0.4680851 0.5000000 0.5000000), wk = 0.0021739 k( 290) = ( 0.4574468 0.5000000 0.5000000), wk = 0.0021739 k( 291) = ( 0.4468085 0.5000000 0.5000000), wk = 0.0021739 k( 292) = ( 0.4361702 0.5000000 0.5000000), wk = 0.0021739 k( 293) = ( 0.4255319 0.5000000 0.5000000), wk = 0.0021739 k( 294) = ( 0.4148936 0.5000000 0.5000000), wk = 0.0021739 k( 295) = ( 0.4042553 0.5000000 0.5000000), wk = 0.0021739 k( 296) = ( 0.3936170 0.5000000 0.5000000), wk = 0.0021739 k( 297) = ( 0.3829787 0.5000000 0.5000000), wk = 0.0021739 k( 298) = ( 0.3723404 0.5000000 0.5000000), wk = 0.0021739 k( 299) = ( 0.3617021 0.5000000 0.5000000), wk = 0.0021739 k( 300) = ( 0.3510638 0.5000000 0.5000000), wk = 0.0021739 k( 301) = ( 0.3404255 0.5000000 0.5000000), wk = 0.0021739 k( 302) = ( 0.3297872 0.5000000 0.5000000), wk = 0.0021739 k( 303) = ( 0.3191489 0.5000000 0.5000000), wk = 0.0021739 k( 304) = ( 0.3085106 0.5000000 0.5000000), wk = 0.0021739 k( 305) = ( 0.2978723 0.5000000 0.5000000), wk = 0.0021739 k( 306) = ( 0.2872340 0.5000000 0.5000000), wk = 0.0021739 k( 307) = ( 0.2765957 0.5000000 0.5000000), wk = 0.0021739 k( 308) = ( 0.2659574 0.5000000 0.5000000), wk = 0.0021739 k( 309) = ( 0.2553191 0.5000000 0.5000000), wk = 0.0021739 k( 310) = ( 0.2446809 0.5000000 0.5000000), wk = 0.0021739 k( 311) = ( 0.2340425 0.5000000 0.5000000), wk = 0.0021739 k( 312) = ( 0.2234043 0.5000000 0.5000000), wk = 0.0021739 k( 313) = ( 0.2127660 0.5000000 0.5000000), wk = 0.0021739 k( 314) = ( 0.2021277 0.5000000 0.5000000), wk = 0.0021739 k( 315) = ( 0.1914894 0.5000000 0.5000000), wk = 0.0021739 k( 316) = ( 0.1808511 0.5000000 0.5000000), wk = 0.0021739 k( 317) = ( 0.1702128 0.5000000 0.5000000), wk = 0.0021739 k( 318) = ( 0.1595745 0.5000000 0.5000000), wk = 0.0021739 k( 319) = ( 0.1489362 0.5000000 0.5000000), wk = 0.0021739 k( 320) = ( 0.1382979 0.5000000 0.5000000), wk = 0.0021739 k( 321) = ( 0.1276596 0.5000000 0.5000000), wk = 0.0021739 k( 322) = ( 0.1170213 0.5000000 0.5000000), wk = 0.0021739 k( 323) = ( 0.1063830 0.5000000 0.5000000), wk = 0.0021739 k( 324) = ( 0.0957447 0.5000000 0.5000000), wk = 0.0021739 k( 325) = ( 0.0851064 0.5000000 0.5000000), wk = 0.0021739 k( 326) = ( 0.0744681 0.5000000 0.5000000), wk = 0.0021739 k( 327) = ( 0.0638298 0.5000000 0.5000000), wk = 0.0021739 k( 328) = ( 0.0531915 0.5000000 0.5000000), wk = 0.0021739 k( 329) = ( 0.0425532 0.5000000 0.5000000), wk = 0.0021739 k( 330) = ( 0.0319149 0.5000000 0.5000000), wk = 0.0021739 k( 331) = ( 0.0212766 0.5000000 0.5000000), wk = 0.0021739 k( 332) = ( 0.0106383 0.5000000 0.5000000), wk = 0.0021739 k( 333) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021739 k( 334) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021739 k( 335) = ( 0.0000000 0.4861111 0.5000000), wk = 0.0021739 k( 336) = ( 0.0000000 0.4722222 0.5000000), wk = 0.0021739 k( 337) = ( 0.0000000 0.4583333 0.5000000), wk = 0.0021739 k( 338) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0021739 k( 339) = ( 0.0000000 0.4305556 0.5000000), wk = 0.0021739 k( 340) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0021739 k( 341) = ( 0.0000000 0.4027778 0.5000000), wk = 0.0021739 k( 342) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0021739 k( 343) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0021739 k( 344) = ( 0.0000000 0.3611111 0.5000000), wk = 0.0021739 k( 345) = ( 0.0000000 0.3472222 0.5000000), wk = 0.0021739 k( 346) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0021739 k( 347) = ( 0.0000000 0.3194444 0.5000000), wk = 0.0021739 k( 348) = ( 0.0000000 0.3055556 0.5000000), wk = 0.0021739 k( 349) = ( 0.0000000 0.2916667 0.5000000), wk = 0.0021739 k( 350) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0021739 k( 351) = ( 0.0000000 0.2638889 0.5000000), wk = 0.0021739 k( 352) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0021739 k( 353) = ( 0.0000000 0.2361111 0.5000000), wk = 0.0021739 k( 354) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0021739 k( 355) = ( 0.0000000 0.2083333 0.5000000), wk = 0.0021739 k( 356) = ( 0.0000000 0.1944444 0.5000000), wk = 0.0021739 k( 357) = ( 0.0000000 0.1805556 0.5000000), wk = 0.0021739 k( 358) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0021739 k( 359) = ( 0.0000000 0.1527778 0.5000000), wk = 0.0021739 k( 360) = ( 0.0000000 0.1388889 0.5000000), wk = 0.0021739 k( 361) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0021739 k( 362) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0021739 k( 363) = ( 0.0000000 0.0972222 0.5000000), wk = 0.0021739 k( 364) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0021739 k( 365) = ( 0.0000000 0.0694444 0.5000000), wk = 0.0021739 k( 366) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0021739 k( 367) = ( 0.0000000 0.0416667 0.5000000), wk = 0.0021739 k( 368) = ( 0.0000000 0.0277778 0.5000000), wk = 0.0021739 k( 369) = ( 0.0000000 0.0138889 0.5000000), wk = 0.0021739 k( 370) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 371) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021739 k( 372) = ( 0.0000000 0.5000000 0.0172414), wk = 0.0021739 k( 373) = ( 0.0000000 0.5000000 0.0344828), wk = 0.0021739 k( 374) = ( 0.0000000 0.5000000 0.0517241), wk = 0.0021739 k( 375) = ( 0.0000000 0.5000000 0.0689655), wk = 0.0021739 k( 376) = ( 0.0000000 0.5000000 0.0862069), wk = 0.0021739 k( 377) = ( 0.0000000 0.5000000 0.1034483), wk = 0.0021739 k( 378) = ( 0.0000000 0.5000000 0.1206897), wk = 0.0021739 k( 379) = ( 0.0000000 0.5000000 0.1379310), wk = 0.0021739 k( 380) = ( 0.0000000 0.5000000 0.1551724), wk = 0.0021739 k( 381) = ( 0.0000000 0.5000000 0.1724138), wk = 0.0021739 k( 382) = ( 0.0000000 0.5000000 0.1896552), wk = 0.0021739 k( 383) = ( 0.0000000 0.5000000 0.2068965), wk = 0.0021739 k( 384) = ( 0.0000000 0.5000000 0.2241379), wk = 0.0021739 k( 385) = ( 0.0000000 0.5000000 0.2413793), wk = 0.0021739 k( 386) = ( 0.0000000 0.5000000 0.2586207), wk = 0.0021739 k( 387) = ( 0.0000000 0.5000000 0.2758621), wk = 0.0021739 k( 388) = ( 0.0000000 0.5000000 0.2931034), wk = 0.0021739 k( 389) = ( 0.0000000 0.5000000 0.3103448), wk = 0.0021739 k( 390) = ( 0.0000000 0.5000000 0.3275862), wk = 0.0021739 k( 391) = ( 0.0000000 0.5000000 0.3448276), wk = 0.0021739 k( 392) = ( 0.0000000 0.5000000 0.3620690), wk = 0.0021739 k( 393) = ( 0.0000000 0.5000000 0.3793103), wk = 0.0021739 k( 394) = ( 0.0000000 0.5000000 0.3965517), wk = 0.0021739 k( 395) = ( 0.0000000 0.5000000 0.4137931), wk = 0.0021739 k( 396) = ( 0.0000000 0.5000000 0.4310345), wk = 0.0021739 k( 397) = ( 0.0000000 0.5000000 0.4482759), wk = 0.0021739 k( 398) = ( 0.0000000 0.5000000 0.4655172), wk = 0.0021739 k( 399) = ( 0.0000000 0.5000000 0.4827586), wk = 0.0021739 k( 400) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021739 k( 401) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021739 k( 402) = ( 0.5000000 0.0000000 0.4827586), wk = 0.0021739 k( 403) = ( 0.5000000 0.0000000 0.4655172), wk = 0.0021739 k( 404) = ( 0.5000000 0.0000000 0.4482759), wk = 0.0021739 k( 405) = ( 0.5000000 0.0000000 0.4310345), wk = 0.0021739 k( 406) = ( 0.5000000 0.0000000 0.4137931), wk = 0.0021739 k( 407) = ( 0.5000000 0.0000000 0.3965517), wk = 0.0021739 k( 408) = ( 0.5000000 0.0000000 0.3793103), wk = 0.0021739 k( 409) = ( 0.5000000 0.0000000 0.3620690), wk = 0.0021739 k( 410) = ( 0.5000000 0.0000000 0.3448276), wk = 0.0021739 k( 411) = ( 0.5000000 0.0000000 0.3275862), wk = 0.0021739 k( 412) = ( 0.5000000 0.0000000 0.3103448), wk = 0.0021739 k( 413) = ( 0.5000000 0.0000000 0.2931034), wk = 0.0021739 k( 414) = ( 0.5000000 0.0000000 0.2758621), wk = 0.0021739 k( 415) = ( 0.5000000 0.0000000 0.2586207), wk = 0.0021739 k( 416) = ( 0.5000000 0.0000000 0.2413793), wk = 0.0021739 k( 417) = ( 0.5000000 0.0000000 0.2241379), wk = 0.0021739 k( 418) = ( 0.5000000 0.0000000 0.2068965), wk = 0.0021739 k( 419) = ( 0.5000000 0.0000000 0.1896552), wk = 0.0021739 k( 420) = ( 0.5000000 0.0000000 0.1724138), wk = 0.0021739 k( 421) = ( 0.5000000 0.0000000 0.1551724), wk = 0.0021739 k( 422) = ( 0.5000000 0.0000000 0.1379310), wk = 0.0021739 k( 423) = ( 0.5000000 0.0000000 0.1206897), wk = 0.0021739 k( 424) = ( 0.5000000 0.0000000 0.1034483), wk = 0.0021739 k( 425) = ( 0.5000000 0.0000000 0.0862069), wk = 0.0021739 k( 426) = ( 0.5000000 0.0000000 0.0689655), wk = 0.0021739 k( 427) = ( 0.5000000 0.0000000 0.0517241), wk = 0.0021739 k( 428) = ( 0.5000000 0.0000000 0.0344828), wk = 0.0021739 k( 429) = ( 0.5000000 0.0000000 0.0172414), wk = 0.0021739 k( 430) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0021739 k( 431) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0021739 k( 432) = ( 0.5000000 0.5000000 0.0172414), wk = 0.0021739 k( 433) = ( 0.5000000 0.5000000 0.0344828), wk = 0.0021739 k( 434) = ( 0.5000000 0.5000000 0.0517241), wk = 0.0021739 k( 435) = ( 0.5000000 0.5000000 0.0689655), wk = 0.0021739 k( 436) = ( 0.5000000 0.5000000 0.0862069), wk = 0.0021739 k( 437) = ( 0.5000000 0.5000000 0.1034483), wk = 0.0021739 k( 438) = ( 0.5000000 0.5000000 0.1206897), wk = 0.0021739 k( 439) = ( 0.5000000 0.5000000 0.1379310), wk = 0.0021739 k( 440) = ( 0.5000000 0.5000000 0.1551724), wk = 0.0021739 k( 441) = ( 0.5000000 0.5000000 0.1724138), wk = 0.0021739 k( 442) = ( 0.5000000 0.5000000 0.1896552), wk = 0.0021739 k( 443) = ( 0.5000000 0.5000000 0.2068965), wk = 0.0021739 k( 444) = ( 0.5000000 0.5000000 0.2241379), wk = 0.0021739 k( 445) = ( 0.5000000 0.5000000 0.2413793), wk = 0.0021739 k( 446) = ( 0.5000000 0.5000000 0.2586207), wk = 0.0021739 k( 447) = ( 0.5000000 0.5000000 0.2758621), wk = 0.0021739 k( 448) = ( 0.5000000 0.5000000 0.2931035), wk = 0.0021739 k( 449) = ( 0.5000000 0.5000000 0.3103448), wk = 0.0021739 k( 450) = ( 0.5000000 0.5000000 0.3275862), wk = 0.0021739 k( 451) = ( 0.5000000 0.5000000 0.3448276), wk = 0.0021739 k( 452) = ( 0.5000000 0.5000000 0.3620690), wk = 0.0021739 k( 453) = ( 0.5000000 0.5000000 0.3793103), wk = 0.0021739 k( 454) = ( 0.5000000 0.5000000 0.3965517), wk = 0.0021739 k( 455) = ( 0.5000000 0.5000000 0.4137931), wk = 0.0021739 k( 456) = ( 0.5000000 0.5000000 0.4310345), wk = 0.0021739 k( 457) = ( 0.5000000 0.5000000 0.4482759), wk = 0.0021739 k( 458) = ( 0.5000000 0.5000000 0.4655172), wk = 0.0021739 k( 459) = ( 0.5000000 0.5000000 0.4827586), wk = 0.0021739 k( 460) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021739 Dense grid: 34165 G-vectors FFT dimensions: ( 32, 45, 54) Smooth grid: 23227 G-vectors FFT dimensions: ( 27, 40, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.14 Mb ( 196, 48) NL pseudopotentials 0.31 Mb ( 98, 204) Each V/rho on FFT grid 0.04 Mb ( 2880) Each G-vector array 0.01 Mb ( 1065) G-vector shells 0.00 Mb ( 526) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.57 Mb ( 196, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.30 Mb ( 204, 2, 48) The potential is recalculated from file : ./FeS2.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 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.1 secs Computing kpt #: 3 total cpu time spent up to now is 4.8 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.3 secs Computing kpt #: 6 total cpu time spent up to now is 7.0 secs Computing kpt #: 7 total cpu time spent up to now is 7.8 secs Computing kpt #: 8 total cpu time spent up to now is 8.6 secs Computing kpt #: 9 total cpu time spent up to now is 9.4 secs Computing kpt #: 10 total cpu time spent up to now is 10.2 secs Computing kpt #: 11 total cpu time spent up to now is 11.0 secs Computing kpt #: 12 total cpu time spent up to now is 11.7 secs Computing kpt #: 13 total cpu time spent up to now is 12.5 secs Computing kpt #: 14 total cpu time spent up to now is 13.3 secs Computing kpt #: 15 total cpu time spent up to now is 14.1 secs Computing kpt #: 16 total cpu time spent up to now is 14.9 secs Computing kpt #: 17 total cpu time spent up to now is 15.6 secs Computing kpt #: 18 total cpu time spent up to now is 16.5 secs Computing kpt #: 19 total cpu time spent up to now is 17.2 secs Computing kpt #: 20 total cpu time spent up to now is 18.1 secs Computing kpt #: 21 total cpu time spent up to now is 18.9 secs Computing kpt #: 22 total cpu time spent up to now is 19.7 secs Computing kpt #: 23 total cpu time spent up to now is 20.5 secs Computing kpt #: 24 total cpu time spent up to now is 21.3 secs Computing kpt #: 25 total cpu time spent up to now is 22.1 secs Computing kpt #: 26 total cpu time spent up to now is 23.0 secs Computing kpt #: 27 total cpu time spent up to now is 23.9 secs Computing kpt #: 28 total cpu time spent up to now is 25.2 secs Computing kpt #: 29 total cpu time spent up to now is 26.1 secs Computing kpt #: 30 total cpu time spent up to now is 26.9 secs Computing kpt #: 31 total cpu time spent up to now is 27.8 secs Computing kpt #: 32 total cpu time spent up to now is 28.6 secs Computing kpt #: 33 total cpu time spent up to now is 29.5 secs Computing kpt #: 34 total cpu time spent up to now is 30.4 secs Computing kpt #: 35 total cpu time spent up to now is 31.1 secs Computing kpt #: 36 total cpu time spent up to now is 31.9 secs Computing kpt #: 37 total cpu time spent up to now is 32.7 secs Computing kpt #: 38 total cpu time spent up to now is 33.5 secs Computing kpt #: 39 total cpu time spent up to now is 34.3 secs Computing kpt #: 40 total cpu time spent up to now is 35.1 secs Computing kpt #: 41 total cpu time spent up to now is 35.9 secs Computing kpt #: 42 total cpu time spent up to now is 36.6 secs Computing kpt #: 43 total cpu time spent up to now is 37.4 secs Computing kpt #: 44 total cpu time spent up to now is 38.1 secs Computing kpt #: 45 total cpu time spent up to now is 38.9 secs Computing kpt #: 46 total cpu time spent up to now is 39.6 secs Computing kpt #: 47 total cpu time spent up to now is 40.4 secs Computing kpt #: 48 total cpu time spent up to now is 41.2 secs Computing kpt #: 49 total cpu time spent up to now is 42.0 secs Computing kpt #: 50 total cpu time spent up to now is 42.8 secs Computing kpt #: 51 total cpu time spent up to now is 43.6 secs Computing kpt #: 52 total cpu time spent up to now is 44.3 secs Computing kpt #: 53 total cpu time spent up to now is 45.0 secs Computing kpt #: 54 total cpu time spent up to now is 45.8 secs Computing kpt #: 55 total cpu time spent up to now is 46.5 secs Computing kpt #: 56 total cpu time spent up to now is 47.3 secs Computing kpt #: 57 total cpu time spent up to now is 48.1 secs Computing kpt #: 58 total cpu time spent up to now is 48.9 secs Computing kpt #: 59 total cpu time spent up to now is 49.7 secs Computing kpt #: 60 total cpu time spent up to now is 50.5 secs Computing kpt #: 61 total cpu time spent up to now is 51.2 secs Computing kpt #: 62 total cpu time spent up to now is 52.0 secs Computing kpt #: 63 total cpu time spent up to now is 52.8 secs Computing kpt #: 64 total cpu time spent up to now is 53.5 secs Computing kpt #: 65 total cpu time spent up to now is 54.2 secs Computing kpt #: 66 total cpu time spent up to now is 55.0 secs Computing kpt #: 67 total cpu time spent up to now is 55.7 secs Computing kpt #: 68 total cpu time spent up to now is 56.3 secs Computing kpt #: 69 total cpu time spent up to now is 56.9 secs Computing kpt #: 70 total cpu time spent up to now is 57.5 secs Computing kpt #: 71 total cpu time spent up to now is 58.0 secs Computing kpt #: 72 total cpu time spent up to now is 58.6 secs Computing kpt #: 73 total cpu time spent up to now is 59.2 secs Computing kpt #: 74 total cpu time spent up to now is 59.7 secs Computing kpt #: 75 total cpu time spent up to now is 60.3 secs Computing kpt #: 76 total cpu time spent up to now is 60.9 secs Computing kpt #: 77 total cpu time spent up to now is 61.5 secs Computing kpt #: 78 total cpu time spent up to now is 62.0 secs Computing kpt #: 79 total cpu time spent up to now is 62.6 secs Computing kpt #: 80 total cpu time spent up to now is 63.2 secs Computing kpt #: 81 total cpu time spent up to now is 63.7 secs Computing kpt #: 82 total cpu time spent up to now is 64.3 secs Computing kpt #: 83 total cpu time spent up to now is 64.8 secs Computing kpt #: 84 total cpu time spent up to now is 65.4 secs Computing kpt #: 85 total cpu time spent up to now is 66.0 secs Computing kpt #: 86 total cpu time spent up to now is 66.5 secs Computing kpt #: 87 total cpu time spent up to now is 67.1 secs Computing kpt #: 88 total cpu time spent up to now is 67.7 secs Computing kpt #: 89 total cpu time spent up to now is 68.2 secs Computing kpt #: 90 total cpu time spent up to now is 68.8 secs Computing kpt #: 91 total cpu time spent up to now is 69.4 secs Computing kpt #: 92 total cpu time spent up to now is 69.9 secs Computing kpt #: 93 total cpu time spent up to now is 70.5 secs Computing kpt #: 94 total cpu time spent up to now is 71.1 secs Computing kpt #: 95 total cpu time spent up to now is 71.7 secs Computing kpt #: 96 total cpu time spent up to now is 72.3 secs Computing kpt #: 97 total cpu time spent up to now is 72.9 secs Computing kpt #: 98 total cpu time spent up to now is 73.5 secs Computing kpt #: 99 total cpu time spent up to now is 74.1 secs Computing kpt #: 100 total cpu time spent up to now is 74.8 secs Computing kpt #: 101 total cpu time spent up to now is 75.5 secs Computing kpt #: 102 total cpu time spent up to now is 76.2 secs Computing kpt #: 103 total cpu time spent up to now is 76.9 secs Computing kpt #: 104 total cpu time spent up to now is 77.6 secs Computing kpt #: 105 total cpu time spent up to now is 78.3 secs Computing kpt #: 106 total cpu time spent up to now is 79.0 secs Computing kpt #: 107 total cpu time spent up to now is 79.7 secs Computing kpt #: 108 total cpu time spent up to now is 80.4 secs Computing kpt #: 109 total cpu time spent up to now is 81.1 secs Computing kpt #: 110 total cpu time spent up to now is 81.7 secs Computing kpt #: 111 total cpu time spent up to now is 82.4 secs Computing kpt #: 112 total cpu time spent up to now is 83.1 secs Computing kpt #: 113 total cpu time spent up to now is 83.8 secs Computing kpt #: 114 total cpu time spent up to now is 84.5 secs Computing kpt #: 115 total cpu time spent up to now is 85.3 secs Computing kpt #: 116 total cpu time spent up to now is 86.0 secs Computing kpt #: 117 total cpu time spent up to now is 86.8 secs Computing kpt #: 118 total cpu time spent up to now is 87.5 secs Computing kpt #: 119 total cpu time spent up to now is 88.3 secs Computing kpt #: 120 total cpu time spent up to now is 89.1 secs Computing kpt #: 121 total cpu time spent up to now is 89.8 secs Computing kpt #: 122 total cpu time spent up to now is 90.6 secs Computing kpt #: 123 total cpu time spent up to now is 91.4 secs Computing kpt #: 124 total cpu time spent up to now is 92.2 secs Computing kpt #: 125 total cpu time spent up to now is 93.0 secs Computing kpt #: 126 total cpu time spent up to now is 93.9 secs Computing kpt #: 127 total cpu time spent up to now is 94.7 secs Computing kpt #: 128 total cpu time spent up to now is 95.5 secs Computing kpt #: 129 total cpu time spent up to now is 96.4 secs Computing kpt #: 130 total cpu time spent up to now is 97.2 secs Computing kpt #: 131 total cpu time spent up to now is 98.0 secs Computing kpt #: 132 total cpu time spent up to now is 98.9 secs Computing kpt #: 133 total cpu time spent up to now is 99.7 secs Computing kpt #: 134 total cpu time spent up to now is 100.5 secs Computing kpt #: 135 total cpu time spent up to now is 101.3 secs Computing kpt #: 136 total cpu time spent up to now is 102.2 secs Computing kpt #: 137 total cpu time spent up to now is 103.1 secs Computing kpt #: 138 total cpu time spent up to now is 103.9 secs Computing kpt #: 139 total cpu time spent up to now is 104.8 secs Computing kpt #: 140 total cpu time spent up to now is 105.7 secs Computing kpt #: 141 total cpu time spent up to now is 106.6 secs Computing kpt #: 142 total cpu time spent up to now is 107.5 secs Computing kpt #: 143 total cpu time spent up to now is 108.4 secs Computing kpt #: 144 total cpu time spent up to now is 109.3 secs Computing kpt #: 145 total cpu time spent up to now is 110.1 secs Computing kpt #: 146 total cpu time spent up to now is 110.9 secs Computing kpt #: 147 total cpu time spent up to now is 111.7 secs Computing kpt #: 148 total cpu time spent up to now is 112.5 secs Computing kpt #: 149 total cpu time spent up to now is 113.2 secs Computing kpt #: 150 total cpu time spent up to now is 114.0 secs Computing kpt #: 151 total cpu time spent up to now is 114.8 secs Computing kpt #: 152 total cpu time spent up to now is 115.5 secs Computing kpt #: 153 total cpu time spent up to now is 116.3 secs Computing kpt #: 154 total cpu time spent up to now is 117.1 secs Computing kpt #: 155 total cpu time spent up to now is 117.9 secs Computing kpt #: 156 total cpu time spent up to now is 118.7 secs Computing kpt #: 157 total cpu time spent up to now is 119.5 secs Computing kpt #: 158 total cpu time spent up to now is 120.4 secs Computing kpt #: 159 total cpu time spent up to now is 121.3 secs Computing kpt #: 160 total cpu time spent up to now is 122.2 secs Computing kpt #: 161 total cpu time spent up to now is 123.1 secs Computing kpt #: 162 total cpu time spent up to now is 123.9 secs Computing kpt #: 163 total cpu time spent up to now is 124.7 secs Computing kpt #: 164 total cpu time spent up to now is 125.5 secs Computing kpt #: 165 total cpu time spent up to now is 126.2 secs Computing kpt #: 166 total cpu time spent up to now is 127.0 secs Computing kpt #: 167 total cpu time spent up to now is 127.7 secs Computing kpt #: 168 total cpu time spent up to now is 128.4 secs Computing kpt #: 169 total cpu time spent up to now is 129.1 secs Computing kpt #: 170 total cpu time spent up to now is 129.9 secs Computing kpt #: 171 total cpu time spent up to now is 130.5 secs Computing kpt #: 172 total cpu time spent up to now is 131.2 secs Computing kpt #: 173 total cpu time spent up to now is 131.9 secs Computing kpt #: 174 total cpu time spent up to now is 132.7 secs Computing kpt #: 175 total cpu time spent up to now is 133.4 secs Computing kpt #: 176 total cpu time spent up to now is 134.2 secs Computing kpt #: 177 total cpu time spent up to now is 135.0 secs Computing kpt #: 178 total cpu time spent up to now is 135.7 secs Computing kpt #: 179 total cpu time spent up to now is 136.5 secs Computing kpt #: 180 total cpu time spent up to now is 137.3 secs Computing kpt #: 181 total cpu time spent up to now is 138.2 secs Computing kpt #: 182 total cpu time spent up to now is 139.0 secs Computing kpt #: 183 total cpu time spent up to now is 139.9 secs Computing kpt #: 184 total cpu time spent up to now is 140.8 secs Computing kpt #: 185 total cpu time spent up to now is 141.7 secs Computing kpt #: 186 total cpu time spent up to now is 142.5 secs Computing kpt #: 187 total cpu time spent up to now is 143.4 secs Computing kpt #: 188 total cpu time spent up to now is 144.2 secs Computing kpt #: 189 total cpu time spent up to now is 145.0 secs Computing kpt #: 190 total cpu time spent up to now is 145.8 secs Computing kpt #: 191 total cpu time spent up to now is 146.6 secs Computing kpt #: 192 total cpu time spent up to now is 147.4 secs Computing kpt #: 193 total cpu time spent up to now is 148.2 secs Computing kpt #: 194 total cpu time spent up to now is 148.9 secs Computing kpt #: 195 total cpu time spent up to now is 149.7 secs Computing kpt #: 196 total cpu time spent up to now is 150.5 secs Computing kpt #: 197 total cpu time spent up to now is 151.3 secs Computing kpt #: 198 total cpu time spent up to now is 152.0 secs Computing kpt #: 199 total cpu time spent up to now is 152.8 secs Computing kpt #: 200 total cpu time spent up to now is 153.5 secs Computing kpt #: 201 total cpu time spent up to now is 154.2 secs Computing kpt #: 202 total cpu time spent up to now is 155.0 secs Computing kpt #: 203 total cpu time spent up to now is 155.7 secs Computing kpt #: 204 total cpu time spent up to now is 156.5 secs Computing kpt #: 205 total cpu time spent up to now is 157.3 secs Computing kpt #: 206 total cpu time spent up to now is 158.1 secs Computing kpt #: 207 total cpu time spent up to now is 158.9 secs Computing kpt #: 208 total cpu time spent up to now is 159.7 secs Computing kpt #: 209 total cpu time spent up to now is 160.5 secs Computing kpt #: 210 total cpu time spent up to now is 161.3 secs Computing kpt #: 211 total cpu time spent up to now is 162.1 secs Computing kpt #: 212 total cpu time spent up to now is 163.0 secs Computing kpt #: 213 total cpu time spent up to now is 163.8 secs Computing kpt #: 214 total cpu time spent up to now is 164.6 secs Computing kpt #: 215 total cpu time spent up to now is 165.4 secs Computing kpt #: 216 total cpu time spent up to now is 166.2 secs Computing kpt #: 217 total cpu time spent up to now is 167.0 secs Computing kpt #: 218 total cpu time spent up to now is 167.8 secs Computing kpt #: 219 total cpu time spent up to now is 168.6 secs Computing kpt #: 220 total cpu time spent up to now is 169.4 secs Computing kpt #: 221 total cpu time spent up to now is 170.2 secs Computing kpt #: 222 total cpu time spent up to now is 171.0 secs Computing kpt #: 223 total cpu time spent up to now is 171.7 secs Computing kpt #: 224 total cpu time spent up to now is 172.5 secs Computing kpt #: 225 total cpu time spent up to now is 173.3 secs Computing kpt #: 226 total cpu time spent up to now is 174.1 secs Computing kpt #: 227 total cpu time spent up to now is 174.9 secs Computing kpt #: 228 total cpu time spent up to now is 175.7 secs Computing kpt #: 229 total cpu time spent up to now is 176.5 secs Computing kpt #: 230 total cpu time spent up to now is 177.3 secs Computing kpt #: 231 total cpu time spent up to now is 178.1 secs Computing kpt #: 232 total cpu time spent up to now is 178.8 secs Computing kpt #: 233 total cpu time spent up to now is 179.6 secs Computing kpt #: 234 total cpu time spent up to now is 180.4 secs Computing kpt #: 235 total cpu time spent up to now is 181.2 secs Computing kpt #: 236 total cpu time spent up to now is 182.0 secs Computing kpt #: 237 total cpu time spent up to now is 182.8 secs Computing kpt #: 238 total cpu time spent up to now is 183.5 secs Computing kpt #: 239 total cpu time spent up to now is 184.3 secs Computing kpt #: 240 total cpu time spent up to now is 185.1 secs Computing kpt #: 241 total cpu time spent up to now is 185.8 secs Computing kpt #: 242 total cpu time spent up to now is 186.6 secs Computing kpt #: 243 total cpu time spent up to now is 187.4 secs Computing kpt #: 244 total cpu time spent up to now is 188.1 secs Computing kpt #: 245 total cpu time spent up to now is 188.8 secs Computing kpt #: 246 total cpu time spent up to now is 189.6 secs Computing kpt #: 247 total cpu time spent up to now is 190.3 secs Computing kpt #: 248 total cpu time spent up to now is 191.0 secs Computing kpt #: 249 total cpu time spent up to now is 191.7 secs Computing kpt #: 250 total cpu time spent up to now is 192.5 secs Computing kpt #: 251 total cpu time spent up to now is 193.2 secs Computing kpt #: 252 total cpu time spent up to now is 193.9 secs Computing kpt #: 253 total cpu time spent up to now is 194.7 secs Computing kpt #: 254 total cpu time spent up to now is 195.4 secs Computing kpt #: 255 total cpu time spent up to now is 196.2 secs Computing kpt #: 256 total cpu time spent up to now is 196.9 secs Computing kpt #: 257 total cpu time spent up to now is 197.7 secs Computing kpt #: 258 total cpu time spent up to now is 198.5 secs Computing kpt #: 259 total cpu time spent up to now is 199.3 secs Computing kpt #: 260 total cpu time spent up to now is 200.1 secs Computing kpt #: 261 total cpu time spent up to now is 200.9 secs Computing kpt #: 262 total cpu time spent up to now is 201.7 secs Computing kpt #: 263 total cpu time spent up to now is 202.4 secs Computing kpt #: 264 total cpu time spent up to now is 203.2 secs Computing kpt #: 265 total cpu time spent up to now is 204.0 secs Computing kpt #: 266 total cpu time spent up to now is 204.8 secs Computing kpt #: 267 total cpu time spent up to now is 205.6 secs Computing kpt #: 268 total cpu time spent up to now is 206.4 secs Computing kpt #: 269 total cpu time spent up to now is 207.6 secs Computing kpt #: 270 total cpu time spent up to now is 208.4 secs Computing kpt #: 271 total cpu time spent up to now is 209.4 secs Computing kpt #: 272 total cpu time spent up to now is 210.2 secs Computing kpt #: 273 total cpu time spent up to now is 211.0 secs Computing kpt #: 274 total cpu time spent up to now is 211.8 secs Computing kpt #: 275 total cpu time spent up to now is 212.6 secs Computing kpt #: 276 total cpu time spent up to now is 213.4 secs Computing kpt #: 277 total cpu time spent up to now is 214.2 secs Computing kpt #: 278 total cpu time spent up to now is 215.0 secs Computing kpt #: 279 total cpu time spent up to now is 215.8 secs Computing kpt #: 280 total cpu time spent up to now is 216.5 secs Computing kpt #: 281 total cpu time spent up to now is 217.3 secs Computing kpt #: 282 total cpu time spent up to now is 218.1 secs Computing kpt #: 283 total cpu time spent up to now is 218.8 secs Computing kpt #: 284 total cpu time spent up to now is 219.6 secs Computing kpt #: 285 total cpu time spent up to now is 220.4 secs Computing kpt #: 286 total cpu time spent up to now is 221.1 secs Computing kpt #: 287 total cpu time spent up to now is 221.8 secs Computing kpt #: 288 total cpu time spent up to now is 222.6 secs Computing kpt #: 289 total cpu time spent up to now is 223.4 secs Computing kpt #: 290 total cpu time spent up to now is 224.2 secs Computing kpt #: 291 total cpu time spent up to now is 225.0 secs Computing kpt #: 292 total cpu time spent up to now is 225.7 secs Computing kpt #: 293 total cpu time spent up to now is 226.6 secs Computing kpt #: 294 total cpu time spent up to now is 227.4 secs Computing kpt #: 295 total cpu time spent up to now is 228.3 secs Computing kpt #: 296 total cpu time spent up to now is 229.2 secs Computing kpt #: 297 total cpu time spent up to now is 230.2 secs Computing kpt #: 298 total cpu time spent up to now is 231.1 secs Computing kpt #: 299 total cpu time spent up to now is 231.9 secs Computing kpt #: 300 total cpu time spent up to now is 232.8 secs Computing kpt #: 301 total cpu time spent up to now is 233.6 secs Computing kpt #: 302 total cpu time spent up to now is 234.4 secs Computing kpt #: 303 total cpu time spent up to now is 235.3 secs Computing kpt #: 304 total cpu time spent up to now is 236.1 secs Computing kpt #: 305 total cpu time spent up to now is 236.8 secs Computing kpt #: 306 total cpu time spent up to now is 237.6 secs Computing kpt #: 307 total cpu time spent up to now is 238.4 secs Computing kpt #: 308 total cpu time spent up to now is 239.2 secs Computing kpt #: 309 total cpu time spent up to now is 240.0 secs Computing kpt #: 310 total cpu time spent up to now is 240.7 secs Computing kpt #: 311 total cpu time spent up to now is 241.5 secs Computing kpt #: 312 total cpu time spent up to now is 242.2 secs Computing kpt #: 313 total cpu time spent up to now is 243.0 secs Computing kpt #: 314 total cpu time spent up to now is 243.7 secs Computing kpt #: 315 total cpu time spent up to now is 244.5 secs Computing kpt #: 316 total cpu time spent up to now is 245.2 secs Computing kpt #: 317 total cpu time spent up to now is 245.9 secs Computing kpt #: 318 total cpu time spent up to now is 246.6 secs Computing kpt #: 319 total cpu time spent up to now is 247.3 secs Computing kpt #: 320 total cpu time spent up to now is 248.0 secs Computing kpt #: 321 total cpu time spent up to now is 248.6 secs Computing kpt #: 322 total cpu time spent up to now is 249.3 secs Computing kpt #: 323 total cpu time spent up to now is 250.0 secs Computing kpt #: 324 total cpu time spent up to now is 250.6 secs Computing kpt #: 325 total cpu time spent up to now is 251.3 secs Computing kpt #: 326 total cpu time spent up to now is 252.0 secs Computing kpt #: 327 total cpu time spent up to now is 252.6 secs Computing kpt #: 328 total cpu time spent up to now is 253.3 secs Computing kpt #: 329 total cpu time spent up to now is 253.9 secs Computing kpt #: 330 total cpu time spent up to now is 254.5 secs Computing kpt #: 331 total cpu time spent up to now is 255.2 secs Computing kpt #: 332 total cpu time spent up to now is 255.8 secs Computing kpt #: 333 total cpu time spent up to now is 256.3 secs Computing kpt #: 334 total cpu time spent up to now is 256.9 secs Computing kpt #: 335 total cpu time spent up to now is 257.5 secs Computing kpt #: 336 total cpu time spent up to now is 258.1 secs Computing kpt #: 337 total cpu time spent up to now is 258.7 secs Computing kpt #: 338 total cpu time spent up to now is 259.4 secs Computing kpt #: 339 total cpu time spent up to now is 260.0 secs Computing kpt #: 340 total cpu time spent up to now is 260.7 secs Computing kpt #: 341 total cpu time spent up to now is 261.4 secs Computing kpt #: 342 total cpu time spent up to now is 262.1 secs Computing kpt #: 343 total cpu time spent up to now is 262.8 secs Computing kpt #: 344 total cpu time spent up to now is 263.5 secs Computing kpt #: 345 total cpu time spent up to now is 264.2 secs Computing kpt #: 346 total cpu time spent up to now is 265.0 secs Computing kpt #: 347 total cpu time spent up to now is 265.7 secs Computing kpt #: 348 total cpu time spent up to now is 266.5 secs Computing kpt #: 349 total cpu time spent up to now is 267.3 secs Computing kpt #: 350 total cpu time spent up to now is 268.1 secs Computing kpt #: 351 total cpu time spent up to now is 268.9 secs Computing kpt #: 352 total cpu time spent up to now is 269.7 secs Computing kpt #: 353 total cpu time spent up to now is 270.6 secs Computing kpt #: 354 total cpu time spent up to now is 271.4 secs Computing kpt #: 355 total cpu time spent up to now is 272.3 secs Computing kpt #: 356 total cpu time spent up to now is 273.2 secs Computing kpt #: 357 total cpu time spent up to now is 274.0 secs Computing kpt #: 358 total cpu time spent up to now is 274.9 secs Computing kpt #: 359 total cpu time spent up to now is 275.8 secs Computing kpt #: 360 total cpu time spent up to now is 276.6 secs Computing kpt #: 361 total cpu time spent up to now is 277.4 secs Computing kpt #: 362 total cpu time spent up to now is 278.2 secs Computing kpt #: 363 total cpu time spent up to now is 279.0 secs Computing kpt #: 364 total cpu time spent up to now is 279.8 secs Computing kpt #: 365 total cpu time spent up to now is 280.5 secs Computing kpt #: 366 total cpu time spent up to now is 281.3 secs Computing kpt #: 367 total cpu time spent up to now is 282.0 secs Computing kpt #: 368 total cpu time spent up to now is 282.8 secs Computing kpt #: 369 total cpu time spent up to now is 283.6 secs Computing kpt #: 370 total cpu time spent up to now is 284.3 secs Computing kpt #: 371 total cpu time spent up to now is 285.1 secs Computing kpt #: 372 total cpu time spent up to now is 286.0 secs Computing kpt #: 373 total cpu time spent up to now is 286.8 secs Computing kpt #: 374 total cpu time spent up to now is 287.6 secs Computing kpt #: 375 total cpu time spent up to now is 288.5 secs Computing kpt #: 376 total cpu time spent up to now is 289.3 secs Computing kpt #: 377 total cpu time spent up to now is 290.1 secs Computing kpt #: 378 total cpu time spent up to now is 290.9 secs Computing kpt #: 379 total cpu time spent up to now is 291.7 secs Computing kpt #: 380 total cpu time spent up to now is 292.5 secs Computing kpt #: 381 total cpu time spent up to now is 293.3 secs Computing kpt #: 382 total cpu time spent up to now is 294.0 secs Computing kpt #: 383 total cpu time spent up to now is 294.8 secs Computing kpt #: 384 total cpu time spent up to now is 295.6 secs Computing kpt #: 385 total cpu time spent up to now is 296.3 secs Computing kpt #: 386 total cpu time spent up to now is 297.1 secs Computing kpt #: 387 total cpu time spent up to now is 297.8 secs Computing kpt #: 388 total cpu time spent up to now is 298.5 secs Computing kpt #: 389 total cpu time spent up to now is 299.2 secs Computing kpt #: 390 total cpu time spent up to now is 299.9 secs Computing kpt #: 391 total cpu time spent up to now is 300.5 secs Computing kpt #: 392 total cpu time spent up to now is 301.2 secs Computing kpt #: 393 total cpu time spent up to now is 301.9 secs Computing kpt #: 394 total cpu time spent up to now is 302.5 secs Computing kpt #: 395 total cpu time spent up to now is 303.1 secs Computing kpt #: 396 total cpu time spent up to now is 303.8 secs Computing kpt #: 397 total cpu time spent up to now is 304.3 secs Computing kpt #: 398 total cpu time spent up to now is 304.9 secs Computing kpt #: 399 total cpu time spent up to now is 305.5 secs Computing kpt #: 400 total cpu time spent up to now is 306.1 secs Computing kpt #: 401 total cpu time spent up to now is 306.8 secs Computing kpt #: 402 total cpu time spent up to now is 307.5 secs Computing kpt #: 403 total cpu time spent up to now is 308.2 secs Computing kpt #: 404 total cpu time spent up to now is 309.0 secs Computing kpt #: 405 total cpu time spent up to now is 309.7 secs Computing kpt #: 406 total cpu time spent up to now is 310.5 secs Computing kpt #: 407 total cpu time spent up to now is 311.2 secs Computing kpt #: 408 total cpu time spent up to now is 311.9 secs Computing kpt #: 409 total cpu time spent up to now is 312.7 secs Computing kpt #: 410 total cpu time spent up to now is 313.4 secs Computing kpt #: 411 total cpu time spent up to now is 314.1 secs Computing kpt #: 412 total cpu time spent up to now is 314.9 secs Computing kpt #: 413 total cpu time spent up to now is 315.6 secs Computing kpt #: 414 total cpu time spent up to now is 316.4 secs Computing kpt #: 415 total cpu time spent up to now is 317.2 secs Computing kpt #: 416 total cpu time spent up to now is 318.0 secs Computing kpt #: 417 total cpu time spent up to now is 318.8 secs Computing kpt #: 418 total cpu time spent up to now is 319.6 secs Computing kpt #: 419 total cpu time spent up to now is 320.4 secs Computing kpt #: 420 total cpu time spent up to now is 321.2 secs Computing kpt #: 421 total cpu time spent up to now is 321.9 secs Computing kpt #: 422 total cpu time spent up to now is 322.7 secs Computing kpt #: 423 total cpu time spent up to now is 323.4 secs Computing kpt #: 424 total cpu time spent up to now is 324.2 secs Computing kpt #: 425 total cpu time spent up to now is 325.0 secs Computing kpt #: 426 total cpu time spent up to now is 325.8 secs Computing kpt #: 427 total cpu time spent up to now is 326.6 secs Computing kpt #: 428 total cpu time spent up to now is 327.5 secs Computing kpt #: 429 total cpu time spent up to now is 328.2 secs Computing kpt #: 430 total cpu time spent up to now is 329.0 secs Computing kpt #: 431 total cpu time spent up to now is 329.6 secs Computing kpt #: 432 total cpu time spent up to now is 330.1 secs Computing kpt #: 433 total cpu time spent up to now is 330.7 secs Computing kpt #: 434 total cpu time spent up to now is 331.3 secs Computing kpt #: 435 total cpu time spent up to now is 331.8 secs Computing kpt #: 436 total cpu time spent up to now is 332.4 secs Computing kpt #: 437 total cpu time spent up to now is 333.0 secs Computing kpt #: 438 total cpu time spent up to now is 333.6 secs Computing kpt #: 439 total cpu time spent up to now is 334.1 secs Computing kpt #: 440 total cpu time spent up to now is 334.7 secs Computing kpt #: 441 total cpu time spent up to now is 335.3 secs Computing kpt #: 442 total cpu time spent up to now is 335.9 secs Computing kpt #: 443 total cpu time spent up to now is 336.5 secs Computing kpt #: 444 total cpu time spent up to now is 337.0 secs Computing kpt #: 445 total cpu time spent up to now is 337.6 secs Computing kpt #: 446 total cpu time spent up to now is 338.3 secs Computing kpt #: 447 total cpu time spent up to now is 339.0 secs Computing kpt #: 448 total cpu time spent up to now is 339.6 secs Computing kpt #: 449 total cpu time spent up to now is 340.3 secs Computing kpt #: 450 total cpu time spent up to now is 341.0 secs Computing kpt #: 451 total cpu time spent up to now is 341.8 secs Computing kpt #: 452 total cpu time spent up to now is 342.5 secs Computing kpt #: 453 total cpu time spent up to now is 343.3 secs Computing kpt #: 454 total cpu time spent up to now is 344.1 secs Computing kpt #: 455 total cpu time spent up to now is 344.9 secs Computing kpt #: 456 total cpu time spent up to now is 345.7 secs Computing kpt #: 457 total cpu time spent up to now is 346.4 secs Computing kpt #: 458 total cpu time spent up to now is 347.1 secs Computing kpt #: 459 total cpu time spent up to now is 347.8 secs Computing kpt #: 460 total cpu time spent up to now is 348.5 secs ethr = 2.50E-11, avg # of iterations = 30.5 total cpu time spent up to now is 348.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -5.7926 -5.7926 -3.5179 -3.5179 -1.4885 -1.4885 -0.7732 -0.7732 3.3921 3.3921 4.9626 4.9626 5.3553 5.3553 5.9884 5.9884 6.8289 6.8289 6.9047 6.9047 7.3496 7.3496 7.5025 7.5025 7.6118 7.6118 9.4309 9.4309 9.6178 9.6178 9.9169 9.9169 10.0756 10.0756 10.2434 10.2434 10.3197 10.3197 10.5230 10.5230 12.2520 12.2520 12.4348 12.4348 13.7952 13.7952 14.0706 14.0706 k = 0.0106-0.0000-0.0000 ( 2881 PWs) bands (ev): -5.7917 -5.7917 -3.5178 -3.5178 -1.4880 -1.4880 -0.7731 -0.7731 3.3932 3.3932 4.9629 4.9629 5.3556 5.3556 5.9863 5.9863 6.8288 6.8288 6.8988 6.8988 7.3489 7.3489 7.5053 7.5053 7.6116 7.6116 9.4162 9.4162 9.6212 9.6212 9.9145 9.9145 10.0866 10.0866 10.2433 10.2433 10.3190 10.3190 10.5240 10.5240 12.2540 12.2540 12.4352 12.4352 13.7946 13.7946 14.0687 14.0687 k = 0.0213-0.0000-0.0000 ( 2879 PWs) bands (ev): -5.7887 -5.7887 -3.5173 -3.5173 -1.4866 -1.4866 -0.7727 -0.7727 3.3967 3.3967 4.9638 4.9638 5.3565 5.3565 5.9803 5.9803 6.8285 6.8285 6.8813 6.8813 7.3468 7.3468 7.5136 7.5136 7.6109 7.6109 9.3750 9.3750 9.6311 9.6311 9.9077 9.9077 10.1165 10.1165 10.2434 10.2434 10.3170 10.3170 10.5274 10.5274 12.2600 12.2600 12.4363 12.4363 13.7930 13.7930 14.0632 14.0632 k = 0.0319-0.0000-0.0000 ( 2879 PWs) bands (ev): -5.7838 -5.7838 -3.5166 -3.5166 -1.4841 -1.4841 -0.7721 -0.7721 3.4024 3.4024 4.9652 4.9652 5.3579 5.3579 5.9705 5.9705 6.8280 6.8280 6.8528 6.8528 7.3435 7.3435 7.5273 7.5273 7.6097 7.6097 9.3136 9.3136 9.6470 9.6470 9.8967 9.8967 10.1576 10.1576 10.2447 10.2447 10.3139 10.3139 10.5331 10.5331 12.2698 12.2698 12.4381 12.4381 13.7899 13.7899 14.0542 14.0542 k = 0.0426-0.0000-0.0000 ( 2881 PWs) bands (ev): -5.7770 -5.7770 -3.5155 -3.5155 -1.4806 -1.4806 -0.7712 -0.7712 3.4104 3.4104 4.9671 4.9671 5.3599 5.3599 5.9571 5.9571 6.8141 6.8141 6.8273 6.8273 7.3388 7.3388 7.5463 7.5463 7.6078 7.6078 9.2380 9.2380 9.6678 9.6678 9.8817 9.8817 10.1971 10.1971 10.2525 10.2526 10.3113 10.3113 10.5410 10.5410 12.2832 12.2832 12.4407 12.4407 13.7849 13.7849 14.0417 14.0417 k = 0.0532-0.0000-0.0000 ( 2881 PWs) bands (ev): -5.7682 -5.7682 -3.5143 -3.5143 -1.4762 -1.4762 -0.7701 -0.7701 3.4207 3.4207 4.9694 4.9694 5.3624 5.3624 5.9404 5.9404 6.7665 6.7665 6.8263 6.8263 7.3330 7.3330 7.5700 7.5700 7.6050 7.6050 9.1525 9.1525 9.6926 9.6926 9.8633 9.8633 10.2150 10.2150 10.2734 10.2734 10.3188 10.3188 10.5514 10.5514 12.2997 12.2997 12.4441 12.4441 13.7773 13.7773 14.0260 14.0260 k = 0.0638-0.0000-0.0000 ( 2889 PWs) bands (ev): -5.7575 -5.7575 -3.5128 -3.5128 -1.4708 -1.4708 -0.7687 -0.7687 3.4332 3.4332 4.9719 4.9719 5.3652 5.3652 5.9208 5.9208 6.7111 6.7111 6.8250 6.8250 7.3261 7.3261 7.5972 7.5972 7.6021 7.6021 9.0602 9.0602 9.7198 9.7198 9.8424 9.8424 10.2163 10.2163 10.2784 10.2784 10.3570 10.3570 10.5643 10.5643 12.3189 12.3189 12.4481 12.4481 13.7658 13.7658 14.0073 14.0073 k = 0.0745-0.0000-0.0000 ( 2885 PWs) bands (ev): -5.7449 -5.7449 -3.5111 -3.5111 -1.4644 -1.4644 -0.7672 -0.7672 3.4479 3.4479 4.9745 4.9745 5.3684 5.3684 5.8988 5.8988 6.6495 6.6495 6.8234 6.8234 7.3182 7.3182 7.5957 7.5957 7.6307 7.6307 8.9630 8.9630 9.7473 9.7473 9.8207 9.8207 10.2125 10.2125 10.2715 10.2715 10.4091 10.4091 10.5795 10.5795 12.3403 12.3403 12.4530 12.4530 13.7487 13.7487 13.9859 13.9859 k = 0.0851-0.0000-0.0000 ( 2877 PWs) bands (ev): -5.7304 -5.7304 -3.5093 -3.5093 -1.4571 -1.4571 -0.7654 -0.7654 3.4647 3.4647 4.9769 4.9769 5.3718 5.3718 5.8747 5.8747 6.5830 6.5830 6.8214 6.8214 7.3093 7.3093 7.5892 7.5892 7.6665 7.6665 8.8623 8.8623 9.7668 9.7668 9.8061 9.8061 10.2062 10.2062 10.2612 10.2612 10.4626 10.4626 10.5973 10.5973 12.3634 12.3634 12.4586 12.4586 13.7240 13.7240 13.9623 13.9623 k = 0.0957-0.0000-0.0000 ( 2882 PWs) bands (ev): -5.7139 -5.7139 -3.5074 -3.5074 -1.4489 -1.4489 -0.7635 -0.7635 3.4837 3.4837 4.9789 4.9789 5.3752 5.3752 5.8488 5.8488 6.5132 6.5132 6.8189 6.8189 7.2994 7.2994 7.5810 7.5810 7.7055 7.7055 8.7592 8.7592 9.7561 9.7561 9.8202 9.8202 10.1977 10.1977 10.2493 10.2493 10.5143 10.5143 10.6176 10.6177 12.3876 12.3876 12.4649 12.4649 13.6896 13.6896 13.9367 13.9367 k = 0.1064-0.0000-0.0000 ( 2882 PWs) bands (ev): -5.6957 -5.6957 -3.5055 -3.5055 -1.4398 -1.4398 -0.7613 -0.7613 3.5047 3.5047 4.9800 4.9800 5.3786 5.3786 5.8216 5.8216 6.4414 6.4414 6.8159 6.8159 7.2885 7.2885 7.5712 7.5712 7.7473 7.7473 8.6545 8.6545 9.7323 9.7323 9.8463 9.8463 10.1869 10.1869 10.2368 10.2368 10.5625 10.5625 10.6407 10.6407 12.4123 12.4123 12.4722 12.4722 13.6442 13.6442 13.9096 13.9096 k = 0.1170-0.0000-0.0000 ( 2882 PWs) bands (ev): -5.6755 -5.6755 -3.5036 -3.5036 -1.4298 -1.4298 -0.7591 -0.7591 3.5278 3.5278 4.9799 4.9799 5.3817 5.3817 5.7934 5.7934 6.3691 6.3691 6.8124 6.8124 7.2765 7.2765 7.5597 7.5597 7.7915 7.7915 8.5490 8.5490 9.7067 9.7067 9.8726 9.8726 10.1736 10.1736 10.2241 10.2241 10.6060 10.6060 10.6670 10.6670 12.4367 12.4367 12.4807 12.4807 13.5882 13.5882 13.8813 13.8813 k = 0.1277-0.0000-0.0000 ( 2892 PWs) bands (ev): -5.6536 -5.6536 -3.5017 -3.5017 -1.4190 -1.4190 -0.7567 -0.7567 3.5527 3.5527 4.9781 4.9781 5.3843 5.3843 5.7646 5.7646 6.2978 6.2978 6.8080 6.8080 7.2629 7.2629 7.5468 7.5468 7.8376 7.8376 8.4432 8.4432 9.6815 9.6815 9.8974 9.8974 10.1576 10.1576 10.2117 10.2117 10.6436 10.6436 10.6969 10.6969 12.4592 12.4592 12.4915 12.4915 13.5233 13.5233 13.8519 13.8519 k = 0.1383-0.0000-0.0000 ( 2886 PWs) bands (ev): -5.6298 -5.6298 -3.5000 -3.5000 -1.4073 -1.4073 -0.7542 -0.7542 3.5795 3.5795 4.9740 4.9740 5.3862 5.3862 5.7354 5.7354 6.2289 6.2289 6.8029 6.8029 7.2476 7.2476 7.5327 7.5327 7.8855 7.8855 8.3379 8.3379 9.6575 9.6575 9.9199 9.9199 10.1393 10.1393 10.1997 10.1997 10.6753 10.6753 10.7297 10.7297 12.4777 12.4777 12.5064 12.5064 13.4520 13.4520 13.8218 13.8218 k = 0.1489-0.0000-0.0000 ( 2886 PWs) bands (ev): -5.6043 -5.6043 -3.4986 -3.4986 -1.3949 -1.3949 -0.7516 -0.7516 3.6080 3.6080 4.9671 4.9671 5.3872 5.3872 5.7061 5.7061 6.1637 6.1637 6.7969 6.7969 7.2300 7.2300 7.5180 7.5180 7.9346 7.9346 8.2336 8.2336 9.6352 9.6352 9.9395 9.9395 10.1191 10.1191 10.1878 10.1878 10.7028 10.7028 10.7633 10.7633 12.4911 12.4911 12.5260 12.5260 13.3764 13.3764 13.7910 13.7910 k = 0.1596-0.0000-0.0000 ( 2890 PWs) bands (ev): -5.5770 -5.5770 -3.4975 -3.4975 -1.3817 -1.3817 -0.7489 -0.7489 3.6381 3.6381 4.9568 4.9568 5.3869 5.3869 5.6769 5.6769 6.1035 6.1035 6.7898 6.7898 7.2095 7.2095 7.5031 7.5031 7.9843 7.9843 8.1312 8.1312 9.6151 9.6151 9.9556 9.9556 10.0981 10.0981 10.1760 10.1760 10.7272 10.7272 10.7957 10.7957 12.5019 12.5019 12.5475 12.5475 13.2982 13.2982 13.7597 13.7597 k = 0.1702-0.0000-0.0000 ( 2892 PWs) bands (ev): -5.5480 -5.5480 -3.4968 -3.4968 -1.3677 -1.3677 -0.7463 -0.7463 3.6696 3.6696 4.9425 4.9425 5.3852 5.3852 5.6481 5.6481 6.0497 6.0497 6.7815 6.7815 7.1856 7.1856 7.4889 7.4889 8.0198 8.0198 8.0458 8.0458 9.5974 9.5974 9.9666 9.9666 10.0781 10.0781 10.1640 10.1640 10.7493 10.7493 10.8260 10.8260 12.5117 12.5117 12.5692 12.5692 13.2190 13.2190 13.7280 13.7280 k = 0.1809-0.0000-0.0000 ( 2894 PWs) bands (ev): -5.5173 -5.5173 -3.4966 -3.4966 -1.3531 -1.3531 -0.7436 -0.7436 3.7024 3.7024 4.9240 4.9240 5.3816 5.3816 5.6199 5.6199 6.0032 6.0032 6.7719 6.7719 7.1578 7.1578 7.4761 7.4761 7.9300 7.9300 8.0888 8.0888 9.5824 9.5824 9.9693 9.9693 10.0627 10.0627 10.1520 10.1520 10.7692 10.7692 10.8535 10.8535 12.5210 12.5210 12.5900 12.5900 13.1399 13.1399 13.6961 13.6961 k = 0.1915-0.0000-0.0000 ( 2888 PWs) bands (ev): -5.4850 -5.4850 -3.4970 -3.4970 -1.3378 -1.3378 -0.7409 -0.7409 3.7360 3.7360 4.9011 4.9011 5.3758 5.3758 5.5924 5.5924 5.9648 5.9648 6.7607 6.7607 7.1256 7.1256 7.4652 7.4652 7.8356 7.8356 8.1399 8.1399 9.5700 9.5700 9.9601 9.9601 10.0561 10.0561 10.1398 10.1398 10.7869 10.7869 10.8781 10.8781 12.5301 12.5301 12.6098 12.6098 13.0618 13.0618 13.6640 13.6640 k = 0.2021-0.0000-0.0000 ( 2884 PWs) bands (ev): -5.4511 -5.4511 -3.4981 -3.4981 -1.3218 -1.3218 -0.7383 -0.7383 3.7703 3.7703 4.8742 4.8742 5.3674 5.3674 5.5658 5.5658 5.9348 5.9348 6.7479 6.7479 7.0888 7.0888 7.4566 7.4566 7.7447 7.7447 8.1911 8.1911 9.5604 9.5604 9.9397 9.9397 10.0575 10.0575 10.1275 10.1275 10.8020 10.8020 10.8995 10.8995 12.5389 12.5389 12.6283 12.6283 12.9857 12.9857 13.6318 13.6318 k = 0.2128-0.0000-0.0000 ( 2882 PWs) bands (ev): -5.4157 -5.4157 -3.5000 -3.5000 -1.3053 -1.3053 -0.7359 -0.7359 3.8048 3.8048 4.8440 4.8440 5.3561 5.3561 5.5403 5.5403 5.9133 5.9133 6.7331 6.7331 7.0476 7.0476 7.4508 7.4508 7.6581 7.6581 8.2418 8.2418 9.5535 9.5535 9.9123 9.9123 10.0632 10.0632 10.1151 10.1151 10.8147 10.8147 10.9178 10.9178 12.5474 12.5474 12.6453 12.6453 12.9120 12.9120 13.5995 13.5995 k = 0.2234-0.0000-0.0000 ( 2886 PWs) bands (ev): -5.3788 -5.3788 -3.5028 -3.5028 -1.2883 -1.2883 -0.7335 -0.7335 3.8390 3.8390 4.8116 4.8116 5.3415 5.3415 5.5160 5.5160 5.8998 5.8998 6.7164 6.7164 7.0021 7.0021 7.4474 7.4474 7.5765 7.5765 8.2917 8.2917 9.5490 9.5490 9.8812 9.8812 10.0703 10.0703 10.1031 10.1031 10.8246 10.8246 10.9330 10.9330 12.5556 12.5556 12.6606 12.6606 12.8416 12.8416 13.5670 13.5670 k = 0.2340-0.0000-0.0000 ( 2888 PWs) bands (ev): -5.3404 -5.3404 -3.5066 -3.5066 -1.2708 -1.2708 -0.7313 -0.7313 3.8722 3.8722 4.7787 4.7787 5.3232 5.3232 5.4929 5.4929 5.8938 5.8938 6.6975 6.6975 6.9530 6.9530 7.4461 7.4461 7.5009 7.5009 8.3404 8.3404 9.5469 9.5469 9.8477 9.8477 10.0763 10.0763 10.0925 10.0925 10.8319 10.8319 10.9451 10.9451 12.5633 12.5633 12.6733 12.6733 12.7761 12.7761 13.5343 13.5343 k = 0.2447-0.0000-0.0000 ( 2894 PWs) bands (ev): -5.3006 -5.3006 -3.5115 -3.5115 -1.2529 -1.2529 -0.7293 -0.7293 3.9035 3.9035 4.7469 4.7469 5.3009 5.3009 5.4714 5.4714 5.8945 5.8945 6.6763 6.6763 6.9005 6.9005 7.4250 7.4250 7.4533 7.4533 8.3874 8.3874 9.5470 9.5470 9.8130 9.8130 10.0738 10.0738 10.0906 10.0906 10.8365 10.8365 10.9541 10.9541 12.5702 12.5702 12.6760 12.6760 12.7235 12.7235 13.5012 13.5012 k = 0.2553-0.0000-0.0000 ( 2898 PWs) bands (ev): -5.2595 -5.2595 -3.5177 -3.5177 -1.2345 -1.2345 -0.7276 -0.7276 3.9320 3.9320 4.7183 4.7183 5.2744 5.2744 5.4513 5.4513 5.9012 5.9012 6.6529 6.6529 6.8453 6.8453 7.3623 7.3623 7.4556 7.4556 8.4323 8.4323 9.5490 9.5490 9.7776 9.7776 10.0634 10.0634 10.0965 10.0965 10.8384 10.8384 10.9601 10.9601 12.5756 12.5756 12.6404 12.6404 12.7136 12.7136 13.4679 13.4679 k = 0.2660-0.0000-0.0000 ( 2896 PWs) bands (ev): -5.2172 -5.2172 -3.5252 -3.5252 -1.2159 -1.2159 -0.7261 -0.7261 3.9565 3.9565 4.6949 4.6949 5.2435 5.2435 5.4329 5.4329 5.9130 5.9130 6.6274 6.6274 6.7878 6.7878 7.3033 7.3033 7.4624 7.4624 8.4746 8.4746 9.5527 9.5527 9.7424 9.7424 10.0523 10.0523 10.1033 10.1033 10.8378 10.8378 10.9631 10.9631 12.5692 12.5692 12.6009 12.6009 12.7223 12.7223 13.4342 13.4342 k = 0.2766-0.0000-0.0000 ( 2900 PWs) bands (ev): -5.1736 -5.1736 -3.5341 -3.5341 -1.1969 -1.1969 -0.7250 -0.7250 3.9757 3.9757 4.6789 4.6789 5.2081 5.2081 5.4163 5.4163 5.9293 5.9293 6.5998 6.5998 6.7285 6.7285 7.2498 7.2498 7.4717 7.4717 8.5136 8.5136 9.5577 9.5577 9.7078 9.7078 10.0416 10.0416 10.1102 10.1102 10.8346 10.8346 10.9631 10.9632 12.5288 12.5288 12.5968 12.5968 12.7330 12.7330 13.3995 13.3995 k = 0.2872-0.0000-0.0000 ( 2900 PWs) bands (ev): -5.1289 -5.1289 -3.5445 -3.5445 -1.1778 -1.1778 -0.7242 -0.7242 3.9887 3.9887 4.6719 4.6719 5.1683 5.1683 5.4015 5.4015 5.9493 5.9493 6.5703 6.5703 6.6680 6.6680 7.2015 7.2015 7.4833 7.4833 8.5487 8.5487 9.5637 9.5637 9.6746 9.6746 10.0315 10.0315 10.1167 10.1167 10.8291 10.8291 10.9604 10.9604 12.4835 12.4835 12.6010 12.6010 12.7439 12.7439 13.3397 13.3397 k = 0.2979-0.0000-0.0000 ( 2904 PWs) bands (ev): -5.0831 -5.0831 -3.5565 -3.5565 -1.1584 -1.1584 -0.7238 -0.7238 3.9950 3.9950 4.6750 4.6750 5.1242 5.1242 5.3886 5.3886 5.9727 5.9727 6.5388 6.5388 6.6068 6.6068 7.1580 7.1580 7.4971 7.4971 8.5793 8.5793 9.5703 9.5703 9.6439 9.6439 10.0222 10.0222 10.1230 10.1230 10.8213 10.8213 10.9548 10.9548 12.4416 12.4416 12.6059 12.6059 12.7547 12.7547 13.2773 13.2773 k = 0.3085-0.0000-0.0000 ( 2900 PWs) bands (ev): -5.0363 -5.0363 -3.5703 -3.5703 -1.1390 -1.1390 -0.7238 -0.7238 3.9949 3.9949 4.6883 4.6883 5.0761 5.0761 5.3778 5.3778 5.9987 5.9987 6.5051 6.5051 6.5460 6.5460 7.1188 7.1188 7.5131 7.5131 8.6044 8.6044 9.5761 9.5761 9.6175 9.6175 10.0139 10.0139 10.1291 10.1291 10.8115 10.8115 10.9467 10.9467 12.4041 12.4041 12.6107 12.6107 12.7656 12.7656 13.2177 13.2177 k = 0.3191-0.0000-0.0000 ( 2900 PWs) bands (ev): -4.9887 -4.9887 -3.5858 -3.5858 -1.1194 -1.1194 -0.7242 -0.7242 3.9895 3.9895 4.7113 4.7113 5.0245 5.0245 5.3691 5.3691 6.0271 6.0271 6.4654 6.4654 6.4895 6.4895 7.0832 7.0832 7.5311 7.5311 8.6234 8.6234 9.5751 9.5751 9.6019 9.6019 10.0068 10.0068 10.1349 10.1349 10.7998 10.7998 10.9361 10.9361 12.3712 12.3712 12.6151 12.6151 12.7764 12.7764 13.1611 13.1611 k = 0.3298-0.0000-0.0000 ( 2908 PWs) bands (ev): -4.9402 -4.9402 -3.6031 -3.6031 -1.0999 -1.0999 -0.7252 -0.7252 3.9802 3.9802 4.7428 4.7428 4.9698 4.9698 5.3624 5.3624 6.0574 6.0574 6.4118 6.4118 6.4458 6.4458 7.0507 7.0507 7.5512 7.5512 8.6355 8.6355 9.5615 9.5615 9.6033 9.6033 10.0010 10.0010 10.1404 10.1404 10.7865 10.7865 10.9232 10.9232 12.3430 12.3430 12.6192 12.6192 12.7871 12.7871 13.1078 13.1078 k = 0.3404-0.0000-0.0000 ( 2904 PWs) bands (ev): -4.8910 -4.8910 -3.6224 -3.6224 -1.0804 -1.0804 -0.7267 -0.7267 3.9686 3.9686 4.7812 4.7812 4.9127 4.9127 5.3581 5.3581 6.0893 6.0893 6.3516 6.3516 6.4079 6.4079 7.0206 7.0206 7.5733 7.5733 8.6402 8.6402 9.5473 9.5473 9.6104 9.6104 9.9967 9.9967 10.1456 10.1456 10.7718 10.7718 10.9082 10.9082 12.3198 12.3198 12.6230 12.6230 12.7975 12.7975 13.0578 13.0578 k = 0.3511-0.0000-0.0000 ( 2904 PWs) bands (ev): -4.8411 -4.8411 -3.6436 -3.6436 -1.0611 -1.0611 -0.7287 -0.7287 3.9562 3.9562 4.8227 4.8227 4.8563 4.8563 5.3561 5.3561 6.1225 6.1225 6.2907 6.2907 6.3702 6.3702 6.9925 6.9925 7.5974 7.5974 8.6372 8.6372 9.5370 9.5370 9.6185 9.6185 9.9940 9.9940 10.1504 10.1504 10.7559 10.7559 10.8912 10.8912 12.3013 12.3013 12.6264 12.6264 12.8072 12.8072 13.0113 13.0113 k = 0.3617-0.0000-0.0000 ( 2900 PWs) bands (ev): -4.7907 -4.7907 -3.6667 -3.6667 -1.0419 -1.0419 -0.7314 -0.7314 3.9444 3.9444 4.7900 4.7900 4.8774 4.8774 5.3564 5.3564 6.1565 6.1565 6.2303 6.2303 6.3317 6.3317 6.9659 6.9659 7.6235 7.6235 8.6266 8.6266 9.5315 9.5315 9.6267 9.6267 9.9929 9.9929 10.1549 10.1549 10.7392 10.7392 10.8727 10.8727 12.2877 12.2877 12.6296 12.6296 12.8153 12.8153 12.9683 12.9683 k = 0.3723-0.0000-0.0000 ( 2896 PWs) bands (ev): -4.7399 -4.7399 -3.6919 -3.6919 -1.0229 -1.0229 -0.7347 -0.7347 3.9341 3.9341 4.7290 4.7290 4.9296 4.9296 5.3591 5.3591 6.1690 6.1690 6.1925 6.1925 6.2923 6.2923 6.9403 6.9403 7.6515 7.6515 8.6088 8.6088 9.5307 9.5307 9.6345 9.6345 9.9936 9.9936 10.1588 10.1588 10.7221 10.7221 10.8528 10.8528 12.2787 12.2787 12.6326 12.6326 12.8206 12.8206 12.9288 12.9288 k = 0.3830-0.0000-0.0000 ( 2904 PWs) bands (ev): -4.6887 -4.6887 -3.7190 -3.7190 -1.0042 -1.0042 -0.7386 -0.7386 3.9261 3.9261 4.6670 4.6670 4.9854 4.9854 5.3643 5.3643 6.1113 6.1113 6.2221 6.2221 6.2560 6.2560 6.9154 6.9154 7.6813 7.6813 8.5845 8.5845 9.5340 9.5340 9.6416 9.6416 9.9959 9.9959 10.1621 10.1621 10.7047 10.7047 10.8319 10.8319 12.2744 12.2744 12.6354 12.6354 12.8208 12.8208 12.8926 12.8926 k = 0.3936-0.0000-0.0000 ( 2910 PWs) bands (ev): -4.6373 -4.6373 -3.7481 -3.7481 -0.9858 -0.9858 -0.7432 -0.7432 3.9211 3.9211 4.6051 4.6051 5.0436 5.0436 5.3719 5.3719 6.0542 6.0542 6.2019 6.2019 6.2690 6.2690 6.8908 6.8908 7.7131 7.7131 8.5546 8.5546 9.5406 9.5406 9.6481 9.6481 10.0001 10.0001 10.1646 10.1646 10.6876 10.6876 10.8102 10.8102 12.2745 12.2745 12.6381 12.6381 12.8138 12.8138 12.8600 12.8600 k = 0.4043-0.0000-0.0000 ( 2898 PWs) bands (ev): -4.5858 -4.5858 -3.7792 -3.7792 -0.9677 -0.9677 -0.7485 -0.7485 3.9195 3.9195 4.5439 4.5439 5.1036 5.1036 5.3822 5.3822 5.9986 5.9986 6.1583 6.1583 6.3040 6.3040 6.8663 6.8663 7.7466 7.7466 8.5199 8.5199 9.5500 9.5500 9.6536 9.6536 10.0060 10.0060 10.1663 10.1663 10.6715 10.6715 10.7881 10.7881 12.2790 12.2790 12.6408 12.6408 12.7975 12.7975 12.8312 12.8312 k = 0.4149-0.0000-0.0000 ( 2898 PWs) bands (ev): -4.5344 -4.5344 -3.8122 -3.8122 -0.9502 -0.9502 -0.7545 -0.7545 3.9216 3.9216 4.4837 4.4837 5.1650 5.1650 5.3950 5.3950 5.9448 5.9448 6.1115 6.1115 6.3403 6.3403 6.8416 6.8416 7.7818 7.7818 8.4814 8.4814 9.5609 9.5609 9.6582 9.6582 10.0136 10.0136 10.1668 10.1668 10.6565 10.6565 10.7660 10.7660 12.2877 12.2877 12.6435 12.6435 12.7723 12.7723 12.8063 12.8063 k = 0.4255-0.0000-0.0000 ( 2902 PWs) bands (ev): -4.4830 -4.4830 -3.8471 -3.8471 -0.9330 -0.9330 -0.7613 -0.7613 3.9277 3.9277 4.4251 4.4251 5.2273 5.2273 5.4104 5.4104 5.8927 5.8927 6.0626 6.0626 6.3766 6.3767 6.8166 6.8166 7.8188 7.8188 8.4400 8.4400 9.5730 9.5730 9.6616 9.6616 10.0227 10.0227 10.1659 10.1659 10.6431 10.6431 10.7441 10.7441 12.3004 12.3004 12.6462 12.6462 12.7412 12.7412 12.7840 12.7840 k = 0.4362-0.0000-0.0000 ( 2902 PWs) bands (ev): -4.4319 -4.4319 -3.8838 -3.8838 -0.9164 -0.9164 -0.7688 -0.7688 3.9378 3.9378 4.3684 4.3684 5.2901 5.2901 5.4285 5.4285 5.8427 5.8427 6.0117 6.0117 6.4129 6.4129 6.7909 6.7909 7.8573 7.8573 8.3962 8.3962 9.5855 9.5855 9.6638 9.6638 10.0332 10.0332 10.1634 10.1634 10.6320 10.6320 10.7228 10.7228 12.3169 12.3169 12.6488 12.6488 12.7071 12.7071 12.7639 12.7639 k = 0.4468-0.0000-0.0000 ( 2900 PWs) bands (ev): -4.3812 -4.3812 -3.9223 -3.9223 -0.9004 -0.9004 -0.7770 -0.7770 3.9522 3.9522 4.3140 4.3140 5.3531 5.3531 5.4495 5.4495 5.7948 5.7948 5.9588 5.9588 6.4488 6.4488 6.7645 6.7645 7.8974 7.8974 8.3509 8.3509 9.5979 9.5979 9.6646 9.6646 10.0449 10.0449 10.1592 10.1592 10.6234 10.6234 10.7026 10.7026 12.3370 12.3370 12.6487 12.6487 12.6740 12.6740 12.7459 12.7459 k = 0.4574-0.0000-0.0000 ( 2896 PWs) bands (ev): -4.3309 -4.3309 -3.9624 -3.9624 -0.8849 -0.8849 -0.7860 -0.7860 3.9708 3.9708 4.2622 4.2622 5.4157 5.4157 5.4736 5.4736 5.7492 5.7492 5.9043 5.9043 6.4842 6.4842 6.7372 6.7372 7.9390 7.9390 8.3046 8.3046 9.6098 9.6098 9.6642 9.6642 10.0576 10.0576 10.1531 10.1531 10.6179 10.6179 10.6837 10.6837 12.3604 12.3604 12.6267 12.6267 12.6624 12.6624 12.7300 12.7300 k = 0.4681-0.0000-0.0000 ( 2904 PWs) bands (ev): -4.2814 -4.2814 -4.0041 -4.0041 -0.8701 -0.8701 -0.7959 -0.7959 3.9936 3.9936 4.2133 4.2133 5.4753 5.4753 5.5029 5.5029 5.7059 5.7059 5.8480 5.8480 6.5190 6.5190 6.7090 6.7090 7.9818 7.9818 8.2576 8.2576 9.6210 9.6210 9.6622 9.6622 10.0710 10.0710 10.1450 10.1450 10.6155 10.6155 10.6664 10.6664 12.3868 12.3868 12.5904 12.5904 12.6653 12.6653 12.7160 12.7160 k = 0.4787-0.0000-0.0000 ( 2908 PWs) bands (ev): -4.2325 -4.2325 -4.0473 -4.0473 -0.8560 -0.8560 -0.8064 -0.8064 4.0205 4.0205 4.1676 4.1676 5.5198 5.5198 5.5491 5.5491 5.6652 5.6652 5.7903 5.7903 6.5530 6.5530 6.6798 6.6798 8.0258 8.0258 8.2104 8.2104 9.6311 9.6311 9.6588 9.6588 10.0847 10.0847 10.1352 10.1352 10.6164 10.6164 10.6512 10.6512 12.4159 12.4159 12.5532 12.5532 12.6704 12.6704 12.7039 12.7039 k = 0.4894-0.0000-0.0000 ( 2910 PWs) bands (ev): -4.1846 -4.1846 -4.0918 -4.0918 -0.8425 -0.8425 -0.8177 -0.8177 4.0516 4.0516 4.1253 4.1253 5.5535 5.5535 5.6034 5.6034 5.6316 5.6316 5.7315 5.7315 6.5861 6.5861 6.6496 6.6496 8.0709 8.0709 8.1634 8.1634 9.6401 9.6401 9.6540 9.6540 10.0984 10.0984 10.1240 10.1240 10.6206 10.6206 10.6382 10.6382 12.4475 12.4475 12.5166 12.5166 12.6769 12.6769 12.6935 12.6935 k = 0.5000-0.0000-0.0000 ( 2906 PWs) bands (ev): -4.1376 -4.1376 -4.1376 -4.1376 -0.8297 -0.8297 -0.8297 -0.8297 4.0865 4.0865 4.0865 4.0865 5.5870 5.5870 5.5870 5.5870 5.6722 5.6722 5.6722 5.6722 6.6183 6.6183 6.6183 6.6183 8.1168 8.1168 8.1168 8.1168 9.6477 9.6477 9.6478 9.6478 10.1116 10.1116 10.1116 10.1116 10.6280 10.6280 10.6280 10.6280 12.4812 12.4812 12.4813 12.4813 12.6845 12.6845 12.6845 12.6845 k = 0.5000-0.0000-0.0000 ( 2906 PWs) bands (ev): -4.1376 -4.1376 -4.1376 -4.1376 -0.8297 -0.8297 -0.8297 -0.8297 4.0865 4.0865 4.0865 4.0865 5.5870 5.5870 5.5870 5.5870 5.6722 5.6722 5.6722 5.6722 6.6183 6.6183 6.6183 6.6183 8.1168 8.1168 8.1168 8.1168 9.6477 9.6477 9.6478 9.6478 10.1116 10.1116 10.1116 10.1116 10.6280 10.6280 10.6280 10.6280 12.4812 12.4812 12.4813 12.4813 12.6845 12.6845 12.6845 12.6845 k = 0.5000 0.0106-0.0000 ( 2906 PWs) bands (ev): -4.1371 -4.1371 -4.1371 -4.1370 -0.8311 -0.8311 -0.8306 -0.8306 4.0869 4.0869 4.0872 4.0872 5.5488 5.5488 5.5688 5.5688 5.6926 5.6926 5.7123 5.7123 6.6165 6.6165 6.6167 6.6167 8.1158 8.1158 8.1164 8.1164 9.6438 9.6438 9.6479 9.6479 10.1113 10.1113 10.1127 10.1127 10.6272 10.6272 10.6293 10.6293 12.4758 12.4758 12.4831 12.4831 12.6813 12.6813 12.6910 12.6910 k = 0.5000 0.0212-0.0000 ( 2906 PWs) bands (ev): -4.1354 -4.1354 -4.1353 -4.1353 -0.8347 -0.8347 -0.8336 -0.8336 4.0884 4.0884 4.0889 4.0889 5.4982 5.4982 5.5212 5.5212 5.7460 5.7460 5.7688 5.7688 6.6112 6.6112 6.6117 6.6117 8.1133 8.1133 8.1145 8.1145 9.6362 9.6362 9.6445 9.6445 10.1117 10.1117 10.1147 10.1147 10.6270 10.6270 10.6311 10.6311 12.4675 12.4675 12.4813 12.4813 12.6817 12.6817 12.7002 12.7002 k = 0.5000 0.0318-0.0000 ( 2908 PWs) bands (ev): -4.1325 -4.1325 -4.1324 -4.1324 -0.8405 -0.8405 -0.8389 -0.8389 4.0909 4.0909 4.0917 4.0917 5.4476 5.4476 5.4714 5.4714 5.8055 5.8055 5.8288 5.8288 6.6028 6.6028 6.6035 6.6035 8.1092 8.1092 8.1109 8.1109 9.6253 9.6253 9.6376 9.6376 10.1130 10.1130 10.1174 10.1174 10.6272 10.6272 10.6333 10.6333 12.4571 12.4571 12.4760 12.4760 12.6855 12.6855 12.7111 12.7111 k = 0.5000 0.0424-0.0000 ( 2904 PWs) bands (ev): -4.1285 -4.1285 -4.1284 -4.1284 -0.8485 -0.8485 -0.8464 -0.8464 4.0945 4.0945 4.0955 4.0955 5.3993 5.3993 5.4233 5.4233 5.8664 5.8664 5.8899 5.8899 6.5917 6.5917 6.5927 6.5927 8.1033 8.1033 8.1055 8.1055 9.6115 9.6115 9.6279 9.6279 10.1148 10.1148 10.1208 10.1208 10.6280 10.6280 10.6359 10.6359 12.4453 12.4453 12.4679 12.4679 12.6919 12.6919 12.7229 12.7229 k = 0.5000 0.0529-0.0000 ( 2904 PWs) bands (ev): -4.1234 -4.1234 -4.1233 -4.1233 -0.8586 -0.8586 -0.8559 -0.8559 4.0991 4.0991 4.1003 4.1003 5.3541 5.3541 5.3781 5.3781 5.9270 5.9270 5.9505 5.9505 6.5786 6.5786 6.5800 6.5800 8.0954 8.0954 8.0979 8.0979 9.5956 9.5956 9.6159 9.6159 10.1173 10.1173 10.1248 10.1248 10.6292 10.6292 10.6388 10.6388 12.4327 12.4327 12.4579 12.4579 12.7001 12.7001 12.7348 12.7348 k = 0.5000 0.0635-0.0000 ( 2894 PWs) bands (ev): -4.1172 -4.1171 -4.1170 -4.1170 -0.8708 -0.8708 -0.8676 -0.8676 4.1046 4.1046 4.1060 4.1060 5.3124 5.3124 5.3363 5.3363 5.9856 5.9856 6.0091 6.0091 6.5646 6.5646 6.5665 6.5665 8.0852 8.0852 8.0879 8.0879 9.5782 9.5782 9.6024 9.6024 10.1204 10.1204 10.1295 10.1295 10.6309 10.6309 10.6419 10.6419 12.4198 12.4198 12.4468 12.4468 12.7093 12.7093 12.7466 12.7466 k = 0.5000 0.0741-0.0000 ( 2886 PWs) bands (ev): -4.1099 -4.1099 -4.1097 -4.1097 -0.8850 -0.8850 -0.8813 -0.8813 4.1111 4.1111 4.1126 4.1126 5.2746 5.2746 5.2982 5.2982 6.0403 6.0403 6.0636 6.0636 6.5516 6.5516 6.5540 6.5540 8.0721 8.0721 8.0750 8.0750 9.5603 9.5603 9.5883 9.5883 10.1239 10.1239 10.1347 10.1347 10.6327 10.6328 10.6451 10.6451 12.4069 12.4070 12.4350 12.4350 12.7190 12.7190 12.7577 12.7577 k = 0.5000 0.0847-0.0000 ( 2894 PWs) bands (ev): -4.1015 -4.1015 -4.1014 -4.1014 -0.9012 -0.9012 -0.8970 -0.8970 4.1185 4.1185 4.1200 4.1200 5.2408 5.2408 5.2642 5.2642 6.0883 6.0883 6.1111 6.1111 6.5422 6.5422 6.5449 6.5449 8.0559 8.0559 8.0587 8.0587 9.5427 9.5427 9.5744 9.5744 10.1278 10.1278 10.1401 10.1402 10.6348 10.6348 10.6483 10.6483 12.3944 12.3944 12.4231 12.4231 12.7288 12.7288 12.7682 12.7682 k = 0.5000 0.0953-0.0000 ( 2896 PWs) bands (ev): -4.0922 -4.0922 -4.0920 -4.0920 -0.9191 -0.9191 -0.9145 -0.9145 4.1267 4.1267 4.1282 4.1282 5.2113 5.2113 5.2342 5.2342 6.1260 6.1260 6.1478 6.1478 6.5402 6.5402 6.5428 6.5429 8.0361 8.0361 8.0389 8.0389 9.5263 9.5263 9.5616 9.5616 10.1320 10.1320 10.1461 10.1461 10.6371 10.6371 10.6516 10.6516 12.3825 12.3825 12.4116 12.4116 12.7385 12.7385 12.7779 12.7779 k = 0.5000 0.1059-0.0000 ( 2896 PWs) bands (ev): -4.0819 -4.0819 -4.0817 -4.0817 -0.9388 -0.9388 -0.9337 -0.9337 4.1357 4.1357 4.1372 4.1372 5.1862 5.1862 5.2086 5.2086 6.1495 6.1495 6.1694 6.1694 6.5495 6.5495 6.5515 6.5516 8.0124 8.0124 8.0149 8.0149 9.5121 9.5121 9.5507 9.5507 10.1366 10.1366 10.1523 10.1523 10.6394 10.6394 10.6549 10.6549 12.3715 12.3715 12.4006 12.4006 12.7480 12.7480 12.7871 12.7871 k = 0.5000 0.1165-0.0000 ( 2896 PWs) bands (ev): -4.0707 -4.0707 -4.0705 -4.0705 -0.9601 -0.9601 -0.9546 -0.9546 4.1455 4.1455 4.1468 4.1468 5.1656 5.1656 5.1873 5.1873 6.1567 6.1567 6.1742 6.1742 6.5717 6.5717 6.5734 6.5734 7.9843 7.9843 7.9867 7.9867 9.5008 9.5008 9.5427 9.5427 10.1414 10.1414 10.1587 10.1587 10.6419 10.6419 10.6581 10.6581 12.3615 12.3615 12.3905 12.3905 12.7573 12.7573 12.7958 12.7958 k = 0.5000 0.1271-0.0000 ( 2906 PWs) bands (ev): -4.0587 -4.0586 -4.0584 -4.0584 -0.9829 -0.9829 -0.9769 -0.9769 4.1561 4.1561 4.1571 4.1571 5.1495 5.1495 5.1704 5.1704 6.1487 6.1487 6.1634 6.1634 6.6050 6.6050 6.6075 6.6075 7.9516 7.9516 7.9539 7.9539 9.4931 9.4931 9.5380 9.5380 10.1464 10.1464 10.1653 10.1653 10.6442 10.6442 10.6611 10.6611 12.3528 12.3528 12.3815 12.3815 12.7664 12.7664 12.8042 12.8042 k = 0.5000 0.1376-0.0000 ( 2914 PWs) bands (ev): -4.0458 -4.0458 -4.0456 -4.0456 -1.0071 -1.0071 -1.0007 -1.0007 4.1674 4.1674 4.1681 4.1681 5.1378 5.1378 5.1578 5.1578 6.1285 6.1285 6.1408 6.1408 6.6463 6.6463 6.6499 6.6499 7.9143 7.9143 7.9165 7.9165 9.4895 9.4895 9.5372 9.5372 10.1516 10.1516 10.1720 10.1720 10.6466 10.6466 10.6641 10.6641 12.3456 12.3456 12.3738 12.3739 12.7753 12.7753 12.8123 12.8123 k = 0.5000 0.1482-0.0000 ( 2924 PWs) bands (ev): -4.0322 -4.0322 -4.0320 -4.0320 -1.0324 -1.0324 -1.0257 -1.0257 4.1795 4.1795 4.1799 4.1799 5.1304 5.1304 5.1495 5.1495 6.0998 6.0998 6.1100 6.1100 6.6926 6.6926 6.6969 6.6969 7.8724 7.8724 7.8744 7.8744 9.4903 9.4903 9.5406 9.5406 10.1568 10.1568 10.1787 10.1787 10.6490 10.6490 10.6670 10.6670 12.3399 12.3399 12.3677 12.3677 12.7842 12.7842 12.8204 12.8204 k = 0.5000 0.1588-0.0000 ( 2924 PWs) bands (ev): -4.0180 -4.0180 -4.0177 -4.0177 -1.0588 -1.0588 -1.0517 -1.0517 4.1922 4.1922 4.1925 4.1925 5.1272 5.1272 5.1451 5.1451 6.0653 6.0653 6.0739 6.0739 6.7409 6.7409 6.7455 6.7455 7.8260 7.8260 7.8281 7.8281 9.4957 9.4957 9.5485 9.5485 10.1622 10.1622 10.1855 10.1855 10.6513 10.6513 10.6698 10.6698 12.3361 12.3361 12.3632 12.3632 12.7932 12.7932 12.8285 12.8285 k = 0.5000 0.1694-0.0000 ( 2924 PWs) bands (ev): -4.0031 -4.0031 -4.0029 -4.0029 -1.0860 -1.0860 -1.0786 -1.0786 4.2056 4.2056 4.2063 4.2063 5.1277 5.1277 5.1445 5.1445 6.0271 6.0271 6.0343 6.0343 6.7893 6.7893 6.7940 6.7940 7.7754 7.7754 7.7777 7.7777 9.5058 9.5058 9.5608 9.5608 10.1677 10.1677 10.1923 10.1923 10.6536 10.6536 10.6725 10.6725 12.3342 12.3342 12.3604 12.3604 12.8023 12.8023 12.8367 12.8367 k = 0.5000 0.1800-0.0000 ( 2916 PWs) bands (ev): -3.9878 -3.9878 -3.9876 -3.9875 -1.1139 -1.1139 -1.1062 -1.1062 4.2198 4.2198 4.2210 4.2210 5.1317 5.1317 5.1472 5.1472 5.9869 5.9869 5.9929 5.9929 6.8364 6.8364 6.8409 6.8409 7.7212 7.7212 7.7237 7.7237 9.5203 9.5203 9.5773 9.5773 10.1732 10.1732 10.1991 10.1991 10.6558 10.6558 10.6751 10.6751 12.3343 12.3343 12.3596 12.3596 12.8115 12.8115 12.8451 12.8451 k = 0.5000 0.1906-0.0000 ( 2916 PWs) bands (ev): -3.9721 -3.9721 -3.9718 -3.9718 -1.1423 -1.1423 -1.1343 -1.1343 4.2350 4.2350 4.2367 4.2367 5.1385 5.1385 5.1526 5.1526 5.9458 5.9458 5.9508 5.9508 6.8810 6.8810 6.8852 6.8852 7.6639 7.6639 7.6669 7.6669 9.5388 9.5388 9.5976 9.5976 10.1786 10.1786 10.2057 10.2057 10.6579 10.6579 10.6776 10.6776 12.3365 12.3365 12.3608 12.3608 12.8209 12.8209 12.8537 12.8538 k = 0.5000 0.2012-0.0000 ( 2916 PWs) bands (ev): -3.9561 -3.9561 -3.9559 -3.9558 -1.1710 -1.1710 -1.1627 -1.1627 4.2512 4.2512 4.2535 4.2535 5.1474 5.1474 5.1600 5.1600 5.9052 5.9052 5.9093 5.9093 6.9221 6.9221 6.9259 6.9259 7.6046 7.6046 7.6081 7.6081 9.5608 9.5608 9.6214 9.6214 10.1839 10.1839 10.2122 10.2122 10.6599 10.6599 10.6799 10.6799 12.3408 12.3408 12.3639 12.3639 12.8307 12.8307 12.8628 12.8628 k = 0.5000 0.2118-0.0000 ( 2920 PWs) bands (ev): -3.9400 -3.9400 -3.9397 -3.9397 -1.1997 -1.1997 -1.1912 -1.1912 4.2687 4.2687 4.2716 4.2716 5.1574 5.1574 5.1685 5.1685 5.8663 5.8663 5.8695 5.8695 6.9586 6.9586 6.9620 6.9620 7.5442 7.5442 7.5485 7.5485 9.5859 9.5859 9.6482 9.6482 10.1891 10.1891 10.2185 10.2185 10.6618 10.6618 10.6821 10.6821 12.3472 12.3472 12.3691 12.3691 12.8408 12.8408 12.8723 12.8723 k = 0.5000 0.2223-0.0000 ( 2916 PWs) bands (ev): -3.9238 -3.9238 -3.9235 -3.9235 -1.2284 -1.2284 -1.2196 -1.2196 4.2874 4.2874 4.2909 4.2909 5.1674 5.1674 5.1769 5.1769 5.8305 5.8305 5.8330 5.8330 6.9890 6.9890 6.9919 6.9919 7.4846 7.4846 7.4897 7.4897 9.6135 9.6135 9.6773 9.6773 10.1943 10.1943 10.2247 10.2247 10.6636 10.6636 10.6843 10.6843 12.3556 12.3556 12.3761 12.3761 12.8513 12.8513 12.8822 12.8822 k = 0.5000 0.2329-0.0000 ( 2920 PWs) bands (ev): -3.9076 -3.9076 -3.9073 -3.9073 -1.2566 -1.2566 -1.2476 -1.2476 4.3075 4.3075 4.3116 4.3116 5.1757 5.1757 5.1836 5.1836 5.7995 5.7995 5.8014 5.8014 7.0111 7.0111 7.0135 7.0135 7.4283 7.4283 7.4343 7.4343 9.6429 9.6429 9.7082 9.7082 10.1992 10.1992 10.2306 10.2306 10.6653 10.6653 10.6862 10.6862 12.3660 12.3660 12.3850 12.3850 12.8623 12.8623 12.8927 12.8927 k = 0.5000 0.2435-0.0000 ( 2920 PWs) bands (ev): -3.8917 -3.8917 -3.8914 -3.8914 -1.2843 -1.2843 -1.2751 -1.2751 4.3291 4.3291 4.3337 4.3337 5.1806 5.1806 5.1870 5.1870 5.7751 5.7751 5.7764 5.7764 7.0213 7.0213 7.0233 7.0233 7.3793 7.3793 7.3859 7.3859 9.6734 9.6734 9.7401 9.7401 10.2040 10.2040 10.2362 10.2362 10.6669 10.6669 10.6881 10.6881 12.3780 12.3780 12.3956 12.3956 12.8739 12.8739 12.9038 12.9038 k = 0.5000 0.2541-0.0000 ( 2924 PWs) bands (ev): -3.8761 -3.8761 -3.8758 -3.8758 -1.3112 -1.3111 -1.3017 -1.3017 4.3522 4.3522 4.3574 4.3574 5.1803 5.1803 5.1852 5.1852 5.7591 5.7591 5.7601 5.7601 7.0151 7.0151 7.0173 7.0173 7.3422 7.3422 7.3492 7.3492 9.7043 9.7043 9.7725 9.7725 10.2085 10.2086 10.2416 10.2416 10.6684 10.6684 10.6899 10.6899 12.3915 12.3915 12.4075 12.4075 12.8861 12.8861 12.9154 12.9154 k = 0.5000 0.2647-0.0000 ( 2920 PWs) bands (ev): -3.8610 -3.8609 -3.8606 -3.8606 -1.3370 -1.3370 -1.3274 -1.3274 4.3769 4.3769 4.3825 4.3825 5.1733 5.1733 5.1768 5.1768 5.7529 5.7529 5.7539 5.7539 6.9895 6.9895 6.9929 6.9929 7.3206 7.3206 7.3274 7.3274 9.7351 9.7351 9.8046 9.8046 10.2129 10.2129 10.2468 10.2468 10.6699 10.6699 10.6916 10.6916 12.4061 12.4061 12.4206 12.4206 12.8988 12.8988 12.9278 12.9278 k = 0.5000 0.2753-0.0000 ( 2924 PWs) bands (ev): -3.8465 -3.8465 -3.8462 -3.8462 -1.3615 -1.3615 -1.3518 -1.3518 4.4031 4.4031 4.4093 4.4093 5.1588 5.1588 5.1612 5.1612 5.7571 5.7571 5.7586 5.7586 6.9463 6.9463 6.9515 6.9515 7.3130 7.3130 7.3193 7.3193 9.7651 9.7651 9.8359 9.8359 10.2171 10.2171 10.2516 10.2516 10.6712 10.6712 10.6931 10.6931 12.4215 12.4215 12.4344 12.4344 12.9121 12.9121 12.9407 12.9407 k = 0.5000 0.2859-0.0000 ( 2924 PWs) bands (ev): -3.8328 -3.8328 -3.8325 -3.8325 -1.3845 -1.3845 -1.3747 -1.3747 4.4309 4.4309 4.4376 4.4376 5.1371 5.1371 5.1386 5.1386 5.7715 5.7715 5.7739 5.7739 6.8907 6.8907 6.8981 6.8981 7.3147 7.3147 7.3208 7.3208 9.7939 9.7939 9.8659 9.8659 10.2210 10.2210 10.2561 10.2561 10.6724 10.6724 10.6945 10.6946 12.4371 12.4371 12.4486 12.4486 12.9259 12.9259 12.9542 12.9542 k = 0.5000 0.2965-0.0000 ( 2924 PWs) bands (ev): -3.8200 -3.8200 -3.8197 -3.8197 -1.4059 -1.4059 -1.3959 -1.3959 4.4603 4.4603 4.4674 4.4674 5.1091 5.1091 5.1100 5.1100 5.7950 5.7950 5.7987 5.7987 6.8276 6.8276 6.8374 6.8374 7.3213 7.3213 7.3273 7.3273 9.8208 9.8208 9.8939 9.8939 10.2246 10.2246 10.2602 10.2602 10.6735 10.6735 10.6958 10.6959 12.4527 12.4527 12.4626 12.4626 12.9400 12.9400 12.9680 12.9680 k = 0.5000 0.3070-0.0000 ( 2920 PWs) bands (ev): -3.8084 -3.8084 -3.8080 -3.8080 -1.4252 -1.4252 -1.4151 -1.4151 4.4910 4.4910 4.4987 4.4987 5.0763 5.0763 5.0767 5.0767 5.8260 5.8260 5.8316 5.8316 6.7606 6.7606 6.7729 6.7729 7.3300 7.3300 7.3359 7.3359 9.8454 9.8454 9.9195 9.9195 10.2280 10.2280 10.2640 10.2640 10.6745 10.6745 10.6970 10.6970 12.4676 12.4676 12.4762 12.4762 12.9541 12.9541 12.9819 12.9819 k = 0.5000 0.3176-0.0000 ( 2924 PWs) bands (ev): -3.7979 -3.7979 -3.7976 -3.7976 -1.4425 -1.4425 -1.4323 -1.4323 4.5229 4.5229 4.5313 4.5313 5.0400 5.0400 5.0404 5.0404 5.8629 5.8629 5.8710 5.8710 6.6918 6.6918 6.7070 6.7070 7.3390 7.3390 7.3450 7.3450 9.8674 9.8674 9.9424 9.9424 10.2310 10.2310 10.2673 10.2673 10.6754 10.6754 10.6980 10.6980 12.4815 12.4815 12.4887 12.4887 12.9680 12.9680 12.9955 12.9955 k = 0.5000 0.3282-0.0000 ( 2908 PWs) bands (ev): -3.7888 -3.7888 -3.7885 -3.7884 -1.4574 -1.4574 -1.4472 -1.4472 4.5559 4.5559 4.5650 4.5650 5.0014 5.0014 5.0023 5.0023 5.9041 5.9041 5.9153 5.9153 6.6231 6.6231 6.6417 6.6417 7.3475 7.3475 7.3536 7.3536 9.8866 9.8866 9.9623 9.9623 10.2337 10.2337 10.2702 10.2702 10.6762 10.6762 10.6990 10.6990 12.4939 12.4939 12.5000 12.5000 12.9811 12.9811 13.0085 13.0085 k = 0.5000 0.3388-0.0000 ( 2904 PWs) bands (ev): -3.7812 -3.7812 -3.7808 -3.7808 -1.4699 -1.4699 -1.4595 -1.4595 4.5892 4.5892 4.5993 4.5993 4.9620 4.9620 4.9638 4.9638 5.9475 5.9475 5.9629 5.9629 6.5557 6.5557 6.5786 6.5786 7.3547 7.3547 7.3610 7.3610 9.9025 9.9025 9.9788 9.9788 10.2360 10.2360 10.2727 10.2727 10.6769 10.6769 10.6997 10.6997 12.5045 12.5045 12.5097 12.5097 12.9929 12.9929 13.0202 13.0202 k = 0.5000 0.3494-0.0000 ( 2902 PWs) bands (ev): -3.7752 -3.7752 -3.7748 -3.7748 -1.4797 -1.4797 -1.4693 -1.4693 4.6220 4.6220 4.6335 4.6335 4.9233 4.9233 4.9263 4.9263 5.9908 5.9908 6.0116 6.0116 6.4919 6.4919 6.5203 6.5203 7.3606 7.3606 7.3670 7.3670 9.9150 9.9151 9.9918 9.9918 10.2379 10.2379 10.2746 10.2746 10.6774 10.6774 10.7003 10.7003 12.5130 12.5130 12.5174 12.5174 13.0029 13.0029 13.0301 13.0301 k = 0.5000 0.3600-0.0000 ( 2902 PWs) bands (ev): -3.7708 -3.7708 -3.7704 -3.7704 -1.4868 -1.4868 -1.4764 -1.4764 4.6524 4.6524 4.6659 4.6659 4.8875 4.8875 4.8924 4.8924 6.0301 6.0301 6.0580 6.0580 6.4348 6.4348 6.4704 6.4704 7.3648 7.3648 7.3713 7.3713 9.9241 9.9241 10.0012 10.0012 10.2393 10.2393 10.2760 10.2760 10.6777 10.6777 10.7007 10.7007 12.5192 12.5192 12.5230 12.5230 13.0105 13.0105 13.0376 13.0376 k = 0.5000 0.3706-0.0000 ( 2904 PWs) bands (ev): -3.7681 -3.7681 -3.7678 -3.7678 -1.4911 -1.4911 -1.4807 -1.4807 4.6760 4.6760 4.6921 4.6921 4.8590 4.8590 4.8664 4.8664 6.0593 6.0593 6.0949 6.0949 6.3915 6.3915 6.4348 6.4348 7.3674 7.3674 7.3740 7.3740 9.9296 9.9296 10.0068 10.0068 10.2401 10.2401 10.2768 10.2768 10.6780 10.6780 10.7010 10.7010 12.5230 12.5230 12.5265 12.5265 13.0153 13.0153 13.0423 13.0423 k = 0.5000 0.3812-0.0000 ( 2900 PWs) bands (ev): -3.7672 -3.7672 -3.7669 -3.7669 -1.4926 -1.4926 -1.4821 -1.4821 4.6856 4.6856 4.7032 4.7032 4.8471 4.8471 4.8561 4.8561 6.0704 6.0704 6.1101 6.1101 6.3742 6.3742 6.4216 6.4216 7.3683 7.3683 7.3749 7.3749 9.9314 9.9314 10.0087 10.0087 10.2404 10.2404 10.2772 10.2772 10.6781 10.6781 10.7011 10.7011 12.5243 12.5243 12.5276 12.5276 13.0169 13.0169 13.0439 13.0439 k = 0.5000 0.3812-0.0000 ( 2900 PWs) bands (ev): -3.7672 -3.7672 -3.7669 -3.7669 -1.4926 -1.4926 -1.4821 -1.4821 4.6856 4.6856 4.7032 4.7032 4.8471 4.8471 4.8561 4.8561 6.0704 6.0704 6.1101 6.1101 6.3742 6.3742 6.4216 6.4216 7.3683 7.3683 7.3749 7.3749 9.9314 9.9314 10.0087 10.0087 10.2404 10.2404 10.2772 10.2772 10.6781 10.6781 10.7011 10.7011 12.5243 12.5243 12.5276 12.5276 13.0169 13.0169 13.0439 13.0439 k = 0.4894 0.3812-0.0000 ( 2906 PWs) bands (ev): -3.7681 -3.7681 -3.7677 -3.7677 -1.4930 -1.4930 -1.4825 -1.4825 4.6764 4.6764 4.6934 4.6934 4.8572 4.8572 4.8668 4.8669 6.0643 6.0645 6.1040 6.1041 6.3825 6.3829 6.4298 6.4300 7.3702 7.3703 7.3767 7.3768 9.9315 9.9319 10.0089 10.0091 10.2398 10.2399 10.2764 10.2767 10.6776 10.6780 10.7008 10.7009 12.5227 12.5231 12.5262 12.5263 13.0179 13.0182 13.0449 13.0452 k = 0.4787 0.3812-0.0000 ( 2906 PWs) bands (ev): -3.7708 -3.7707 -3.7704 -3.7704 -1.4942 -1.4942 -1.4837 -1.4837 4.6536 4.6536 4.6692 4.6694 4.8829 4.8829 4.8936 4.8937 6.0482 6.0485 6.0879 6.0881 6.4057 6.4064 6.4528 6.4532 7.3760 7.3762 7.3823 7.3826 9.9322 9.9331 10.0097 10.0102 10.2381 10.2384 10.2745 10.2752 10.6767 10.6776 10.7001 10.7004 12.5184 12.5191 12.5221 12.5222 13.0212 13.0217 13.0480 13.0485 k = 0.4681 0.3812-0.0000 ( 2902 PWs) bands (ev): -3.7751 -3.7751 -3.7747 -3.7747 -1.4962 -1.4962 -1.4858 -1.4857 4.6240 4.6241 4.6385 4.6386 4.9171 4.9172 4.9288 4.9288 6.0264 6.0268 6.0659 6.0661 6.4396 6.4405 6.4864 6.4869 7.3857 7.3860 7.3918 7.3922 9.9336 9.9349 10.0112 10.0119 10.2354 10.2358 10.2713 10.2724 10.6756 10.6768 10.6992 10.6997 12.5116 12.5126 12.5155 12.5156 13.0266 13.0274 13.0532 13.0539 k = 0.4574 0.3812-0.0000 ( 2898 PWs) bands (ev): -3.7812 -3.7812 -3.7808 -3.7808 -1.4990 -1.4989 -1.4886 -1.4886 4.5913 4.5914 4.6048 4.6050 4.9560 4.9560 4.9683 4.9683 6.0028 6.0032 6.0418 6.0421 6.4804 6.4814 6.5268 6.5274 7.3994 7.3998 7.4052 7.4057 9.9356 9.9374 10.0133 10.0143 10.2316 10.2321 10.2670 10.2686 10.6742 10.6758 10.6981 10.6986 12.5023 12.5036 12.5064 12.5066 13.0341 13.0350 13.0602 13.0612 k = 0.4468 0.3812-0.0000 ( 2902 PWs) bands (ev): -3.7889 -3.7889 -3.7886 -3.7885 -1.5026 -1.5025 -1.4922 -1.4922 4.5572 4.5573 4.5697 4.5699 4.9977 4.9977 5.0104 5.0104 5.9802 5.9806 6.0186 6.0189 6.5252 6.5264 6.5712 6.5719 7.4171 7.4175 7.4224 7.4231 9.9381 9.9405 10.0160 10.0172 10.2266 10.2272 10.2614 10.2634 10.6727 10.6747 10.6968 10.6975 12.4907 12.4922 12.4950 12.4952 13.0432 13.0442 13.0689 13.0701 k = 0.4362 0.3812-0.0000 ( 2898 PWs) bands (ev): -3.7982 -3.7982 -3.7979 -3.7979 -1.5069 -1.5069 -1.4966 -1.4966 4.5222 4.5223 4.5339 4.5340 5.0413 5.0413 5.0542 5.0542 5.9604 5.9608 5.9980 5.9983 6.5722 6.5736 6.6178 6.6186 7.4390 7.4395 7.4437 7.4445 9.9413 9.9443 10.0194 10.0208 10.2203 10.2211 10.2545 10.2571 10.6712 10.6736 10.6957 10.6964 12.4770 12.4788 12.4816 12.4817 13.0538 13.0550 13.0790 13.0803 k = 0.4255 0.3812-0.0000 ( 2906 PWs) bands (ev): -3.8091 -3.8090 -3.8088 -3.8088 -1.5121 -1.5120 -1.5018 -1.5018 4.4866 4.4867 4.4974 4.4975 5.0861 5.0862 5.0991 5.0991 5.9449 5.9452 5.9814 5.9817 6.6203 6.6218 6.6653 6.6661 7.4649 7.4655 7.4689 7.4699 9.9451 9.9488 10.0234 10.0249 10.2128 10.2138 10.2463 10.2495 10.6698 10.6727 10.6946 10.6954 12.4615 12.4634 12.4662 12.4663 13.0656 13.0668 13.0902 13.0916 k = 0.4149 0.3812-0.0000 ( 2906 PWs) bands (ev): -3.8214 -3.8214 -3.8211 -3.8211 -1.5180 -1.5178 -1.5078 -1.5077 4.4504 4.4505 4.4603 4.4605 5.1318 5.1320 5.1446 5.1447 5.9346 5.9349 5.9698 5.9701 6.6685 6.6702 6.7127 6.7136 7.4951 7.4958 7.4983 7.4994 9.9494 9.9539 10.0280 10.0297 10.2040 10.2052 10.2368 10.2408 10.6689 10.6722 10.6940 10.6948 12.4442 12.4462 12.4492 12.4492 13.0783 13.0796 13.1023 13.1038 k = 0.4043 0.3812-0.0000 ( 2906 PWs) bands (ev): -3.8351 -3.8350 -3.8348 -3.8348 -1.5246 -1.5245 -1.5145 -1.5144 4.4136 4.4137 4.4226 4.4228 5.1779 5.1781 5.1903 5.1905 5.9305 5.9307 5.9641 5.9644 6.7162 6.7180 6.7595 6.7604 7.5295 7.5302 7.5316 7.5329 9.9543 9.9597 10.0332 10.0351 10.1939 10.1953 10.2260 10.2309 10.6686 10.6723 10.6939 10.6947 12.4254 12.4276 12.4305 12.4306 13.0917 13.0931 13.1150 13.1166 k = 0.3936 0.3812-0.0000 ( 2912 PWs) bands (ev): -3.8501 -3.8500 -3.8498 -3.8498 -1.5319 -1.5318 -1.5219 -1.5218 4.3762 4.3763 4.3843 4.3845 5.2241 5.2243 5.2359 5.2361 5.9330 5.9332 5.9649 5.9652 6.7629 6.7648 6.8051 6.8061 7.5678 7.5686 7.5689 7.5702 9.9597 9.9661 10.0391 10.0411 10.1825 10.1841 10.2139 10.2199 10.6690 10.6731 10.6945 10.6953 12.4052 12.4075 12.4104 12.4107 13.1056 13.1070 13.1282 13.1298 k = 0.3830 0.3812-0.0000 ( 2908 PWs) bands (ev): -3.8663 -3.8662 -3.8660 -3.8660 -1.5400 -1.5398 -1.5300 -1.5300 4.3381 4.3382 4.3453 4.3455 5.2700 5.2702 5.2810 5.2812 5.9428 5.9430 5.9727 5.9730 6.8083 6.8103 6.8492 6.8503 7.6099 7.6100 7.6109 7.6114 9.9655 9.9732 10.0456 10.0476 10.1700 10.1718 10.2008 10.2081 10.6704 10.6749 10.6959 10.6966 12.3839 12.3862 12.3891 12.3895 13.1197 13.1211 13.1415 13.1432 k = 0.3723 0.3812-0.0000 ( 2914 PWs) bands (ev): -3.8835 -3.8834 -3.8832 -3.8832 -1.5487 -1.5485 -1.5389 -1.5388 4.2994 4.2994 4.3057 4.3059 5.3153 5.3155 5.3252 5.3254 5.9602 5.9603 5.9878 5.9881 6.8521 6.8542 6.8917 6.8927 7.6544 7.6558 7.6560 7.6567 9.9717 9.9809 10.0526 10.0546 10.1563 10.1585 10.1866 10.1956 10.6726 10.6775 10.6980 10.6987 12.3614 12.3638 12.3668 12.3674 13.1340 13.1353 13.1550 13.1566 k = 0.3617 0.3812-0.0000 ( 2910 PWs) bands (ev): -3.9018 -3.9017 -3.9015 -3.9015 -1.5581 -1.5579 -1.5483 -1.5483 4.2600 4.2601 4.2655 4.2657 5.3597 5.3600 5.3684 5.3687 5.9852 5.9852 6.0104 6.0107 6.8942 6.8964 6.9324 6.9335 7.7021 7.7039 7.7047 7.7057 9.9780 9.9893 10.0602 10.0620 10.1418 10.1445 10.1718 10.1828 10.6758 10.6811 10.7010 10.7016 12.3382 12.3406 12.3436 12.3443 13.1481 13.1494 13.1683 13.1699 k = 0.3511 0.3812-0.0000 ( 2900 PWs) bands (ev): -3.9209 -3.9208 -3.9206 -3.9206 -1.5680 -1.5678 -1.5584 -1.5583 4.2201 4.2201 4.2247 4.2249 5.4033 5.4036 5.4105 5.4109 6.0176 6.0177 6.0404 6.0407 6.9347 6.9370 6.9715 6.9726 7.7526 7.7545 7.7565 7.7574 9.9843 9.9980 10.0681 10.0693 10.1268 10.1303 10.1566 10.1701 10.6802 10.6858 10.7050 10.7055 12.3141 12.3166 12.3197 12.3206 13.1620 13.1633 13.1814 13.1830 k = 0.3404 0.3812-0.0000 ( 2904 PWs) bands (ev): -3.9407 -3.9406 -3.9405 -3.9405 -1.5785 -1.5783 -1.5691 -1.5690 4.1797 4.1797 4.1836 4.1837 5.4459 5.4463 5.4517 5.4522 6.0572 6.0573 6.0775 6.0778 6.9736 6.9760 7.0090 7.0100 7.8054 7.8074 7.8104 7.8114 9.9901 10.0070 10.0754 10.0757 10.1119 10.1172 10.1412 10.1580 10.6856 10.6915 10.7098 10.7102 12.2895 12.2920 12.2952 12.2963 13.1757 13.1769 13.1941 13.1956 k = 0.3298 0.3812-0.0000 ( 2908 PWs) bands (ev): -3.9612 -3.9611 -3.9610 -3.9610 -1.5895 -1.5894 -1.5803 -1.5802 4.1389 4.1389 4.1420 4.1422 5.4878 5.4882 5.4922 5.4927 6.1034 6.1036 6.1213 6.1216 7.0110 7.0134 7.0449 7.0460 7.8601 7.8622 7.8661 7.8671 9.9950 10.0158 10.0764 10.0797 10.1008 10.1092 10.1264 10.1472 10.6920 10.6982 10.7154 10.7157 12.2645 12.2670 12.2705 12.2717 13.1889 13.1901 13.2065 13.2079 k = 0.3191 0.3812-0.0000 ( 2908 PWs) bands (ev): -3.9823 -3.9822 -3.9821 -3.9821 -1.6010 -1.6008 -1.5919 -1.5918 4.0979 4.0979 4.1003 4.1005 5.5292 5.5297 5.5323 5.5329 6.1555 6.1557 6.1711 6.1714 7.0471 7.0496 7.0796 7.0806 7.9161 7.9184 7.9230 7.9239 9.9983 10.0238 10.0682 10.0713 10.1024 10.1109 10.1130 10.1386 10.6994 10.7060 10.7219 10.7221 12.2394 12.2419 12.2456 12.2471 13.2016 13.2028 13.2183 13.2196 k = 0.3085 0.3812-0.0000 ( 2912 PWs) bands (ev): -4.0038 -4.0037 -4.0036 -4.0036 -1.6129 -1.6127 -1.6040 -1.6039 4.0568 4.0568 4.0586 4.0588 5.5704 5.5708 5.5723 5.5729 6.2126 6.2130 6.2262 6.2266 7.0821 7.0846 7.1132 7.1142 7.9729 7.9753 7.9804 7.9814 9.9994 10.0295 10.0545 10.0564 10.1028 10.1110 10.1184 10.1330 10.7078 10.7146 10.7291 10.7292 12.2144 12.2169 12.2209 12.2225 13.2139 13.2149 13.2297 13.2309 k = 0.2979 0.3812-0.0000 ( 2904 PWs) bands (ev): -4.0256 -4.0254 -4.0254 -4.0254 -1.6252 -1.6250 -1.6165 -1.6164 4.0157 4.0157 4.0170 4.0171 5.6117 5.6121 5.6125 5.6132 6.2741 6.2745 6.2859 6.2863 7.1162 7.1187 7.1460 7.1469 8.0300 8.0325 8.0380 8.0389 9.9979 10.0307 10.0395 10.0408 10.0982 10.1211 10.1280 10.1312 10.7172 10.7242 10.7371 10.7371 12.1899 12.1924 12.1967 12.1985 13.2255 13.2266 13.2405 13.2416 k = 0.2872 0.3812-0.0000 ( 2904 PWs) bands (ev): -4.0476 -4.0474 -4.0474 -4.0474 -1.6378 -1.6376 -1.6292 -1.6291 3.9749 3.9749 3.9756 3.9757 5.6532 5.6532 5.6536 5.6539 6.3390 6.3395 6.3493 6.3496 7.1496 7.1521 7.1782 7.1790 8.0868 8.0894 8.0951 8.0959 9.9937 10.0244 10.0254 10.0263 10.1004 10.1318 10.1332 10.1385 10.7273 10.7345 10.7455 10.7456 12.1660 12.1685 12.1731 12.1751 13.2367 13.2376 13.2508 13.2517 k = 0.2766 0.3812-0.0000 ( 2908 PWs) bands (ev): -4.0697 -4.0696 -4.0696 -4.0696 -1.6506 -1.6504 -1.6422 -1.6422 3.9344 3.9344 3.9346 3.9348 5.6946 5.6952 5.6953 5.6956 6.4064 6.4071 6.4155 6.4159 7.1826 7.1852 7.2100 7.2107 8.1428 8.1455 8.1512 8.1520 9.9877 10.0100 10.0109 10.0180 10.1080 10.1385 10.1428 10.1494 10.7380 10.7454 10.7544 10.7545 12.1431 12.1456 12.1507 12.1528 13.2472 13.2481 13.2605 13.2613 k = 0.2660 0.3812-0.0000 ( 2908 PWs) bands (ev): -4.0918 -4.0917 -4.0917 -4.0917 -1.6635 -1.6633 -1.6555 -1.6554 3.8942 3.8944 3.8944 3.8944 5.7366 5.7374 5.7378 5.7382 6.4757 6.4764 6.4838 6.4841 7.2156 7.2181 7.2417 7.2423 8.1975 8.2004 8.2058 8.2065 9.9805 9.9966 9.9974 10.0081 10.1187 10.1466 10.1540 10.1606 10.7493 10.7569 10.7636 10.7639 12.1217 12.1242 12.1297 12.1320 13.2571 13.2580 13.2696 13.2703 k = 0.2553 0.3812-0.0000 ( 2912 PWs) bands (ev): -4.1138 -4.1137 -4.1137 -4.1137 -1.6766 -1.6764 -1.6688 -1.6687 3.8545 3.8547 3.8550 3.8551 5.7795 5.7803 5.7810 5.7814 6.5459 6.5467 6.5532 6.5535 7.2488 7.2514 7.2738 7.2743 8.2503 8.2535 8.2584 8.2590 9.9731 9.9845 9.9854 9.9983 10.1311 10.1566 10.1652 10.1718 10.7610 10.7688 10.7732 10.7735 12.1020 12.1045 12.1105 12.1129 13.2664 13.2672 13.2782 13.2787 k = 0.2447 0.3812-0.0000 ( 2916 PWs) bands (ev): -4.1357 -4.1356 -4.1356 -4.1355 -1.6898 -1.6896 -1.6822 -1.6821 3.8157 3.8158 3.8164 3.8165 5.8231 5.8240 5.8249 5.8253 6.6160 6.6170 6.6228 6.6231 7.2828 7.2854 7.3066 7.3069 8.3010 8.3044 8.3086 8.3091 9.9661 9.9740 9.9749 9.9893 10.1444 10.1680 10.1763 10.1829 10.7731 10.7810 10.7830 10.7833 12.0846 12.0870 12.0935 12.0961 13.2751 13.2758 13.2863 13.2866 k = 0.2340 0.3812-0.0000 ( 2912 PWs) bands (ev): -4.1572 -4.1572 -4.1572 -4.1571 -1.7029 -1.7027 -1.6956 -1.6955 3.7777 3.7779 3.7787 3.7788 5.8675 5.8684 5.8694 5.8699 6.6851 6.6862 6.6916 6.6919 7.3182 7.3208 7.3407 7.3407 8.3491 8.3527 8.3562 8.3565 9.9600 9.9651 9.9661 9.9816 10.1583 10.1803 10.1873 10.1940 10.7854 10.7928 10.7932 10.7934 12.0698 12.0723 12.0792 12.0819 13.2831 13.2838 13.2937 13.2939 k = 0.2234 0.3812-0.0000 ( 2912 PWs) bands (ev): -4.1784 -4.1784 -4.1784 -4.1783 -1.7160 -1.7158 -1.7089 -1.7088 3.7408 3.7410 3.7421 3.7421 5.9124 5.9134 5.9144 5.9149 6.7522 6.7534 6.7587 6.7589 7.3554 7.3580 7.3764 7.3765 8.3943 8.3982 8.4007 8.4009 9.9550 9.9581 9.9591 9.9753 10.1724 10.1932 10.1980 10.2046 10.7978 10.8027 10.8031 10.8059 12.0582 12.0606 12.0679 12.0708 13.2903 13.2910 13.3006 13.3006 k = 0.2128 0.3812-0.0000 ( 2904 PWs) bands (ev): -4.1992 -4.1991 -4.1991 -4.1990 -1.7289 -1.7287 -1.7221 -1.7220 3.7051 3.7052 3.7065 3.7066 5.9579 5.9589 5.9599 5.9604 6.8160 6.8174 6.8227 6.8229 7.3951 7.3978 7.4144 7.4148 8.4364 8.4406 8.4420 8.4421 9.9514 9.9528 9.9540 9.9707 10.1865 10.2063 10.2083 10.2149 10.8103 10.8125 10.8129 10.8185 12.0502 12.0526 12.0603 12.0632 13.2968 13.2974 13.3066 13.3068 k = 0.2021 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.2194 -4.2193 -4.2193 -4.2193 -1.7416 -1.7414 -1.7351 -1.7350 3.6706 3.6708 3.6722 3.6722 6.0037 6.0047 6.0057 6.0061 6.8756 6.8771 6.8828 6.8828 7.4378 7.4405 7.4553 7.4561 8.4754 8.4799 8.4800 8.4803 9.9490 9.9493 9.9505 9.9676 10.2004 10.2182 10.2195 10.2247 10.8220 10.8224 10.8224 10.8308 12.0463 12.0487 12.0566 12.0596 13.3025 13.3030 13.3120 13.3123 k = 0.1915 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.2390 -4.2390 -4.2389 -4.2389 -1.7540 -1.7539 -1.7478 -1.7478 3.6375 3.6376 3.6391 3.6392 6.0496 6.0507 6.0516 6.0520 6.9300 6.9317 6.9376 6.9378 7.4840 7.4867 7.4995 7.5007 8.5112 8.5147 8.5154 8.5161 9.9472 9.9478 9.9485 9.9657 10.2140 10.2276 10.2325 10.2340 10.8311 10.8316 10.8344 10.8427 12.0468 12.0492 12.0572 12.0603 13.3072 13.3076 13.3165 13.3169 k = 0.1809 0.3812-0.0000 ( 2896 PWs) bands (ev): -4.2579 -4.2579 -4.2579 -4.2578 -1.7661 -1.7660 -1.7602 -1.7602 3.6058 3.6059 3.6075 3.6075 6.0956 6.0966 6.0974 6.0979 6.9786 6.9804 6.9868 6.9870 7.5335 7.5364 7.5472 7.5488 8.5441 8.5466 8.5476 8.5494 9.9463 9.9474 9.9476 9.9647 10.2271 10.2365 10.2427 10.2452 10.8399 10.8404 10.8459 10.8543 12.0523 12.0546 12.0627 12.0658 13.3107 13.3111 13.3200 13.3207 k = 0.1702 0.3812-0.0000 ( 2892 PWs) bands (ev): -4.2761 -4.2761 -4.2761 -4.2760 -1.7779 -1.7777 -1.7723 -1.7722 3.5756 3.5757 3.5773 3.5773 6.1413 6.1424 6.1430 6.1435 7.0211 7.0230 7.0297 7.0301 7.5861 7.5892 7.5979 7.6000 8.5745 8.5759 8.5774 8.5802 9.9460 9.9473 9.9474 9.9643 10.2398 10.2449 10.2509 10.2574 10.8483 10.8488 10.8570 10.8654 12.0630 12.0653 12.0731 12.0763 13.3130 13.3133 13.3224 13.3232 k = 0.1596 0.3812-0.0000 ( 2896 PWs) bands (ev): -4.2935 -4.2935 -4.2935 -4.2934 -1.7892 -1.7890 -1.7839 -1.7839 3.5469 3.5470 3.5486 3.5487 6.1865 6.1877 6.1881 6.1886 7.0576 7.0596 7.0666 7.0671 7.6410 7.6442 7.6510 7.6536 8.6028 8.6032 8.6052 8.6090 9.9460 9.9472 9.9474 9.9639 10.2518 10.2529 10.2585 10.2691 10.8563 10.8567 10.8676 10.8759 12.0791 12.0813 12.0888 12.0920 13.3138 13.3139 13.3235 13.3245 k = 0.1489 0.3812-0.0000 ( 2908 PWs) bands (ev): -4.3101 -4.3101 -4.3101 -4.3100 -1.8000 -1.7999 -1.7951 -1.7950 3.5198 3.5199 3.5215 3.5216 6.2311 6.2323 6.2326 6.2330 7.0884 7.0905 7.0977 7.0983 7.6969 7.7004 7.7054 7.7084 8.6293 8.6297 8.6317 8.6364 9.9456 9.9466 9.9469 9.9631 10.2605 10.2631 10.2657 10.2800 10.8638 10.8641 10.8775 10.8858 12.1009 12.1029 12.1099 12.1130 13.3127 13.3127 13.3230 13.3240 k = 0.1383 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.3257 -4.3257 -4.3257 -4.3256 -1.8103 -1.8102 -1.8057 -1.8056 3.4944 3.4946 3.4961 3.4962 6.2748 6.2760 6.2762 6.2766 7.1142 7.1163 7.1236 7.1243 7.7525 7.7563 7.7596 7.7631 8.6548 8.6562 8.6579 8.6634 9.9443 9.9450 9.9455 9.9612 10.2680 10.2728 10.2739 10.2905 10.8710 10.8713 10.8869 10.8951 12.1283 12.1302 12.1364 12.1395 13.3094 13.3096 13.3205 13.3217 k = 0.1277 0.3812-0.0000 ( 2888 PWs) bands (ev): -4.3404 -4.3404 -4.3404 -4.3403 -1.8200 -1.8199 -1.8157 -1.8157 3.4708 3.4709 3.4724 3.4725 6.3174 6.3186 6.3186 6.3190 7.1355 7.1377 7.1449 7.1456 7.8063 7.8104 7.8122 7.8162 8.6807 8.6828 8.6843 8.6905 9.9415 9.9419 9.9426 9.9577 10.2755 10.2797 10.2841 10.3002 10.8780 10.8782 10.8956 10.9037 12.1612 12.1631 12.1683 12.1713 13.3035 13.3039 13.3156 13.3169 k = 0.1170 0.3812-0.0000 ( 2890 PWs) bands (ev): -4.3540 -4.3540 -4.3540 -4.3539 -1.8290 -1.8289 -1.8251 -1.8251 3.4489 3.4490 3.4504 3.4505 6.3585 6.3595 6.3597 6.3599 7.1530 7.1552 7.1622 7.1629 7.8569 7.8614 7.8618 7.8663 8.7076 8.7103 8.7119 8.7186 9.9368 9.9369 9.9378 9.9524 10.2830 10.2864 10.2936 10.3091 10.8847 10.8847 10.9035 10.9115 12.1994 12.2011 12.2054 12.2083 13.2946 13.2952 13.3078 13.3091 k = 0.1064 0.3812-0.0000 ( 2894 PWs) bands (ev): -4.3667 -4.3666 -4.3666 -4.3665 -1.8375 -1.8373 -1.8339 -1.8338 3.4287 3.4288 3.4302 3.4302 6.3978 6.3987 6.3990 6.3991 7.1671 7.1693 7.1760 7.1767 7.9032 7.9072 7.9080 7.9121 8.7362 8.7394 8.7411 8.7481 9.9294 9.9300 9.9309 9.9449 10.2905 10.2932 10.3024 10.3173 10.8909 10.8911 10.9107 10.9185 12.2426 12.2442 12.2472 12.2500 13.2821 13.2829 13.2965 13.2978 k = 0.0957 0.3812-0.0000 ( 2892 PWs) bands (ev): -4.3782 -4.3782 -4.3781 -4.3781 -1.8451 -1.8450 -1.8419 -1.8419 3.4104 3.4105 3.4118 3.4119 6.4351 6.4359 6.4362 6.4363 7.1785 7.1806 7.1869 7.1875 7.9443 7.9475 7.9494 7.9529 8.7667 8.7704 8.7723 8.7795 9.9199 9.9209 9.9218 9.9352 10.2981 10.3000 10.3106 10.3248 10.8969 10.8973 10.9172 10.9247 12.2904 12.2918 12.2935 12.2962 13.2655 13.2666 13.2810 13.2823 k = 0.0851 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.3886 -4.3886 -4.3885 -4.3885 -1.8521 -1.8520 -1.8492 -1.8492 3.3940 3.3941 3.3952 3.3953 6.4699 6.4706 6.4708 6.4711 7.1873 7.1894 7.1952 7.1958 7.9797 7.9821 7.9850 7.9879 8.7992 8.8032 8.8053 8.8127 9.9081 9.9097 9.9106 9.9233 10.3056 10.3067 10.3180 10.3315 10.9026 10.9033 10.9227 10.9300 12.3422 12.3433 12.3437 12.3463 13.2442 13.2456 13.2607 13.2619 k = 0.0745 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.3978 -4.3978 -4.3978 -4.3977 -1.8583 -1.8582 -1.8557 -1.8557 3.3794 3.3796 3.3805 3.3806 6.5020 6.5026 6.5028 6.5032 7.1942 7.1962 7.2014 7.2019 8.0092 8.0111 8.0147 8.0171 8.8331 8.8372 8.8397 8.8470 9.8947 9.8968 9.8976 9.9096 10.3131 10.3132 10.3247 10.3373 10.9082 10.9092 10.9275 10.9345 12.3973 12.3973 12.3982 12.3997 13.2180 13.2196 13.2352 13.2361 k = 0.0638 0.3812-0.0000 ( 2896 PWs) bands (ev): -4.4059 -4.4059 -4.4058 -4.4058 -1.8637 -1.8636 -1.8615 -1.8615 3.3668 3.3669 3.3677 3.3678 6.5309 6.5314 6.5316 6.5321 7.1994 7.2013 7.2059 7.2062 8.0330 8.0345 8.0388 8.0406 8.8674 8.8716 8.8746 8.8815 9.8801 9.8827 9.8833 9.8945 10.3195 10.3203 10.3305 10.3422 10.9135 10.9148 10.9314 10.9381 12.4534 12.4550 12.4556 12.4556 13.1866 13.1885 13.2040 13.2048 k = 0.0532 0.3812-0.0000 ( 2900 PWs) bands (ev): -4.4128 -4.4127 -4.4127 -4.4127 -1.8683 -1.8682 -1.8664 -1.8664 3.3561 3.3562 3.3569 3.3570 6.5563 6.5568 6.5568 6.5574 7.2032 7.2050 7.2089 7.2091 8.0517 8.0528 8.0576 8.0590 8.9008 8.9048 8.9085 8.9149 9.8650 9.8682 9.8684 9.8788 10.3254 10.3270 10.3353 10.3461 10.9184 10.9202 10.9344 10.9407 12.5111 12.5131 12.5142 12.5146 13.1503 13.1525 13.1676 13.1680 k = 0.0426 0.3812-0.0000 ( 2904 PWs) bands (ev): -4.4184 -4.4184 -4.4183 -4.4183 -1.8720 -1.8719 -1.8705 -1.8705 3.3473 3.3474 3.3480 3.3481 6.5777 6.5781 6.5782 6.5787 7.2060 7.2076 7.2108 7.2108 8.0658 8.0666 8.0718 8.0729 8.9318 8.9354 8.9399 8.9455 9.8505 9.8537 9.8542 9.8633 10.3306 10.3332 10.3391 10.3490 10.9230 10.9252 10.9364 10.9423 12.5693 12.5710 12.5737 12.5738 13.1100 13.1126 13.1267 13.1267 k = 0.0319 0.3812-0.0000 ( 2892 PWs) bands (ev): -4.4228 -4.4228 -4.4227 -4.4227 -1.8749 -1.8748 -1.8738 -1.8738 3.3405 3.3406 3.3410 3.3411 6.5949 6.5952 6.5954 6.5958 7.2079 7.2094 7.2116 7.2118 8.0761 8.0766 8.0821 8.0829 8.9586 8.9616 8.9671 8.9716 9.8376 9.8405 9.8420 9.8493 10.3352 10.3387 10.3419 10.3509 10.9272 10.9298 10.9377 10.9431 12.6261 12.6274 12.6312 12.6315 13.0676 13.0705 13.0825 13.0830 k = 0.0213 0.3812-0.0000 ( 2896 PWs) bands (ev): -4.4260 -4.4260 -4.4259 -4.4259 -1.8769 -1.8768 -1.8762 -1.8761 3.3357 3.3358 3.3360 3.3361 6.6074 6.6076 6.6079 6.6082 7.2093 7.2106 7.2118 7.2122 8.0829 8.0832 8.0890 8.0895 8.9795 8.9816 8.9883 8.9915 9.8276 9.8297 9.8326 9.8377 10.3389 10.3433 10.3435 10.3516 10.9307 10.9338 10.9379 10.9429 12.6781 12.6789 12.6831 12.6838 13.0267 13.0299 13.0388 13.0400 k = 0.0106 0.3812-0.0000 ( 2904 PWs) bands (ev): -4.4279 -4.4279 -4.4278 -4.4278 -1.8780 -1.8780 -1.8777 -1.8776 3.3328 3.3329 3.3329 3.3330 6.6150 6.6151 6.6156 6.6157 7.2103 7.2114 7.2116 7.2122 8.0869 8.0870 8.0930 8.0933 8.9929 8.9940 9.0021 9.0038 9.8213 9.8224 9.8270 9.8296 10.3416 10.3439 10.3469 10.3511 10.9336 10.9371 10.9372 10.9418 12.7192 12.7192 12.7223 12.7232 12.9947 12.9980 13.0020 13.0041 k = 0.0000 0.3812-0.0000 ( 2918 PWs) bands (ev): -4.4285 -4.4285 -4.4284 -4.4284 -1.8783 -1.8783 -1.8783 -1.8783 3.3319 3.3319 3.3320 3.3320 6.6176 6.6176 6.6182 6.6182 7.2111 7.2111 7.2119 7.2119 8.0882 8.0882 8.0944 8.0944 8.9978 8.9978 9.0073 9.0073 9.8195 9.8195 9.8259 9.8259 10.3432 10.3432 10.3494 10.3494 10.9358 10.9358 10.9398 10.9398 12.7367 12.7367 12.7374 12.7374 12.9841 12.9841 12.9871 12.9871 k = 0.0000 0.3812-0.0000 ( 2918 PWs) bands (ev): -4.4285 -4.4285 -4.4284 -4.4284 -1.8783 -1.8783 -1.8783 -1.8783 3.3319 3.3319 3.3320 3.3320 6.6176 6.6176 6.6182 6.6182 7.2111 7.2111 7.2119 7.2119 8.0882 8.0882 8.0944 8.0944 8.9978 8.9978 9.0073 9.0073 9.8195 9.8195 9.8259 9.8259 10.3432 10.3432 10.3494 10.3494 10.9358 10.9358 10.9398 10.9398 12.7367 12.7367 12.7374 12.7374 12.9841 12.9841 12.9871 12.9871 k = 0.0000 0.3706-0.0000 ( 2904 PWs) bands (ev): -4.4934 -4.4933 -4.3635 -4.3634 -1.8957 -1.8957 -1.8598 -1.8597 3.3174 3.3176 3.3503 3.3504 6.6043 6.6049 6.6323 6.6329 7.1679 7.1688 7.2386 7.2394 8.0233 8.0289 8.1642 8.1710 8.9491 8.9579 9.0455 9.0557 9.7830 9.7886 9.8533 9.8605 10.3397 10.3460 10.3461 10.3522 10.8968 10.9016 10.9715 10.9749 12.6959 12.6962 12.7812 12.7825 12.9755 12.9782 12.9921 12.9956 k = 0.0000 0.3600-0.0000 ( 2892 PWs) bands (ev): -4.5579 -4.5578 -4.2986 -4.2986 -1.9115 -1.9115 -1.8404 -1.8403 3.3073 3.3074 3.3728 3.3729 6.5924 6.5930 6.6484 6.6489 7.1072 7.1082 7.2533 7.2540 7.9718 7.9770 8.2480 8.2555 8.8995 8.9076 9.0918 9.1029 9.7438 9.7488 9.8841 9.8921 10.3352 10.3417 10.3479 10.3540 10.8556 10.8610 11.0031 11.0058 12.6603 12.6604 12.8280 12.8301 12.9665 12.9690 12.9998 13.0038 k = 0.0000 0.3494-0.0000 ( 2892 PWs) bands (ev): -4.6219 -4.6218 -4.2342 -4.2342 -1.9256 -1.9256 -1.8203 -1.8203 3.3014 3.3015 3.3989 3.3990 6.5819 6.5825 6.6657 6.6663 7.0291 7.0303 7.2579 7.2585 7.9341 7.9389 8.3358 8.3439 8.8487 8.8564 9.1368 9.1487 9.7026 9.7069 9.9118 9.9207 10.3297 10.3365 10.3488 10.3550 10.8126 10.8187 11.0295 11.0314 12.6309 12.6312 12.8747 12.8780 12.9576 12.9600 13.0077 13.0125 k = 0.0000 0.3388-0.0000 ( 2894 PWs) bands (ev): -4.6852 -4.6851 -4.1706 -4.1706 -1.9374 -1.9374 -1.8000 -1.7999 3.3000 3.3001 3.4287 3.4288 6.5726 6.5733 6.6844 6.6850 6.9354 6.9366 7.2549 7.2555 7.9089 7.9133 8.4239 8.4327 8.7972 8.8043 9.1802 9.1931 9.6601 9.6638 9.9364 9.9464 10.3232 10.3303 10.3490 10.3552 10.7686 10.7754 11.0498 11.0508 12.6092 12.6097 12.9165 12.9219 12.9490 12.9523 13.0191 13.0247 k = 0.0000 0.3282-0.0000 ( 2894 PWs) bands (ev): -4.7475 -4.7474 -4.1082 -4.1081 -1.9467 -1.9466 -1.7795 -1.7794 3.3032 3.3033 3.4619 3.4620 6.5645 6.5652 6.7044 6.7049 6.8290 6.8302 7.2465 7.2471 7.8937 7.8978 8.5089 8.5183 8.7448 8.7515 9.2220 9.2356 9.6177 9.6209 9.9579 9.9690 10.3159 10.3235 10.3484 10.3547 10.7241 10.7316 11.0629 11.0632 12.5964 12.5969 12.9376 12.9412 12.9527 12.9541 13.0418 13.0467 k = 0.0000 0.3176-0.0000 ( 2894 PWs) bands (ev): -4.8088 -4.8087 -4.0472 -4.0471 -1.9529 -1.9527 -1.7591 -1.7590 3.3110 3.3112 3.4984 3.4985 6.5567 6.5575 6.7115 6.7137 6.7265 6.7279 7.2341 7.2346 7.8859 7.8899 8.5871 8.5969 8.6919 8.6982 9.2617 9.2757 9.5774 9.5805 9.9763 9.9887 10.3078 10.3160 10.3472 10.3535 10.6794 10.6876 11.0677 11.0683 12.5930 12.5936 12.9342 12.9348 12.9641 12.9641 13.0796 13.0819 k = 0.0000 0.3070-0.0000 ( 2898 PWs) bands (ev): -4.8689 -4.8688 -3.9882 -3.9881 -1.9556 -1.9554 -1.7390 -1.7388 3.3236 3.3238 3.5379 3.5380 6.5410 6.5418 6.5987 6.6002 6.7483 6.7489 7.2187 7.2192 7.8833 7.8873 8.6373 8.6437 8.6548 8.6653 9.2988 9.3120 9.5427 9.5464 9.9916 10.0055 10.2991 10.3079 10.3454 10.3518 10.6349 10.6440 11.0639 11.0655 12.5998 12.6003 12.9298 12.9302 12.9621 12.9632 13.1184 13.1204 k = 0.0000 0.2965-0.0000 ( 2900 PWs) bands (ev): -4.9277 -4.9275 -3.9315 -3.9314 -1.9544 -1.9542 -1.7192 -1.7191 3.3411 3.3412 3.5803 3.5804 6.4462 6.4468 6.5602 6.5602 6.7719 6.7725 7.2014 7.2017 7.8842 7.8881 8.5838 8.5897 8.7058 8.7157 9.3327 9.3426 9.5181 9.5245 10.0038 10.0191 10.2900 10.2995 10.3431 10.3496 10.5910 10.6009 11.0520 11.0545 12.6166 12.6171 12.9264 12.9270 12.9520 12.9541 13.1172 13.1228 k = 0.0000 0.2859-0.0000 ( 2890 PWs) bands (ev): -4.9850 -4.9849 -3.8775 -3.8774 -1.9489 -1.9486 -1.7001 -1.6999 3.3634 3.3635 3.6253 3.6254 6.3140 6.3147 6.5552 6.5556 6.7966 6.7971 7.1826 7.1828 7.8870 7.8909 8.5294 8.5350 8.7361 8.7447 9.3627 9.3655 9.5089 9.5209 10.0128 10.0296 10.2809 10.2912 10.3406 10.3471 10.5478 10.5587 11.0324 11.0358 12.6431 12.6434 12.9193 12.9200 12.9404 12.9426 13.0800 13.0839 k = 0.0000 0.2753-0.0000 ( 2886 PWs) bands (ev): -5.0408 -5.0407 -3.8267 -3.8266 -1.9386 -1.9384 -1.6815 -1.6814 3.3906 3.3907 3.6728 3.6729 6.1764 6.1772 6.5542 6.5546 6.8224 6.8228 7.1629 7.1630 7.8907 7.8947 8.4747 8.4800 8.7412 8.7480 9.3830 9.3896 9.5177 9.5370 10.0182 10.0365 10.2722 10.2831 10.3378 10.3443 10.5054 10.5174 11.0056 11.0100 12.6787 12.6787 12.8958 12.8958 12.9411 12.9422 13.0426 13.0449 k = 0.0000 0.2647-0.0000 ( 2882 PWs) bands (ev): -5.0950 -5.0949 -3.7795 -3.7793 -1.9233 -1.9230 -1.6638 -1.6636 3.4227 3.4229 3.7224 3.7225 6.0362 6.0370 6.5552 6.5556 6.8490 6.8494 7.1427 7.1427 7.8946 7.8986 8.4197 8.4248 8.7198 8.7247 9.4011 9.4159 9.5416 9.5668 10.0199 10.0396 10.2644 10.2757 10.3350 10.3413 10.4641 10.4775 10.9728 10.9781 12.7216 12.7220 12.8600 12.8602 12.9501 12.9503 13.0113 13.0118 k = 0.0000 0.2541-0.0000 ( 2882 PWs) bands (ev): -5.1476 -5.1474 -3.7361 -3.7359 -1.9026 -1.9023 -1.6469 -1.6467 3.4598 3.4599 3.7739 3.7740 5.8947 5.8954 6.5578 6.5583 6.8763 6.8766 7.1222 7.1224 7.8978 7.9020 8.3647 8.3697 8.6746 8.6778 9.4230 9.4433 9.5757 9.6044 10.0179 10.0386 10.2580 10.2692 10.3322 10.3382 10.4239 10.4391 10.9348 10.9411 12.7697 12.7717 12.8191 12.8202 12.9615 12.9647 12.9834 12.9873 k = 0.0000 0.2435-0.0000 ( 2888 PWs) bands (ev): -5.1984 -5.1982 -3.6968 -3.6966 -1.8764 -1.8760 -1.6309 -1.6307 3.5017 3.5019 3.8271 3.8271 5.7527 5.7533 6.5620 6.5626 6.9041 6.9041 7.1020 7.1025 7.9001 7.9044 8.3096 8.3145 8.6101 8.6121 9.4479 9.4709 9.6161 9.6459 10.0119 10.0333 10.2533 10.2636 10.3297 10.3349 10.3848 10.4026 10.8929 10.9001 12.7724 12.7758 12.8261 12.8282 12.9505 12.9545 12.9885 12.9940 k = 0.0000 0.2329-0.0000 ( 2884 PWs) bands (ev): -5.2473 -5.2472 -3.6618 -3.6616 -1.8445 -1.8441 -1.6158 -1.6156 3.5486 3.5488 3.8814 3.8815 5.6109 5.6114 6.5678 6.5683 6.9315 6.9318 7.0828 7.0837 7.9008 7.9053 8.2546 8.2595 8.5307 8.5320 9.4733 9.4971 9.6598 9.6892 10.0021 10.0239 10.2503 10.2585 10.3278 10.3310 10.3471 10.3696 10.8481 10.8563 12.7309 12.7333 12.8800 12.8830 12.9252 12.9302 13.0186 13.0235 k = 0.0000 0.2223-0.0000 ( 2884 PWs) bands (ev): -5.2944 -5.2943 -3.6311 -3.6308 -1.8071 -1.8066 -1.6017 -1.6015 3.6003 3.6005 3.9366 3.9367 5.4700 5.4704 6.5750 6.5755 6.9572 6.9582 7.0658 7.0675 7.8998 7.9046 8.1998 8.2047 8.4399 8.4407 9.4976 9.5209 9.7044 9.7323 9.9888 10.0105 10.2486 10.2525 10.3108 10.3225 10.3270 10.3454 10.8015 10.8106 12.6898 12.6923 12.8922 12.8970 12.9385 12.9455 13.0596 13.0649 k = 0.0000 0.2118-0.0000 ( 2884 PWs) bands (ev): -5.3396 -5.3395 -3.6045 -3.6043 -1.7643 -1.7638 -1.5886 -1.5884 3.6568 3.6570 3.9921 3.9921 5.3308 5.3312 6.5836 6.5842 6.9770 6.9793 7.0551 7.0581 7.8967 7.9018 8.1453 8.1504 8.3402 8.3408 9.5195 9.5418 9.7482 9.7741 9.9723 9.9939 10.2426 10.2469 10.2771 10.3051 10.3273 10.3376 10.7539 10.7639 12.6509 12.6534 12.8650 12.8677 12.9905 12.9953 13.1131 13.1186 k = 0.0000 0.2012-0.0000 ( 2880 PWs) bands (ev): -5.3828 -5.3827 -3.5821 -3.5818 -1.7165 -1.7160 -1.5765 -1.5763 3.7180 3.7182 4.0470 4.0471 5.1944 5.1948 6.5937 6.5943 6.9831 6.9861 7.0594 7.0633 7.8912 7.8969 8.0911 8.0966 8.2335 8.2340 9.5383 9.5593 9.7900 9.8133 9.9532 9.9748 10.2252 10.2348 10.2557 10.2914 10.3294 10.3370 10.7064 10.7173 12.6145 12.6171 12.8342 12.8366 13.0396 13.0438 13.1778 13.1833 k = 0.0000 0.1906-0.0000 ( 2884 PWs) bands (ev): -5.4240 -5.4239 -3.5635 -3.5632 -1.6640 -1.6636 -1.5653 -1.5651 3.7838 3.7840 4.1003 4.1003 5.0621 5.0624 6.6051 6.6057 6.9749 6.9776 7.0799 7.0835 7.8831 7.8896 8.0374 8.0437 8.1213 8.1220 9.5538 9.5733 9.8286 9.8485 9.9321 9.9545 10.2013 10.2055 10.2528 10.2845 10.3335 10.3392 10.6597 10.6713 12.5807 12.5833 12.8017 12.8042 13.0876 13.0914 13.2506 13.2559 k = 0.0000 0.1800-0.0000 ( 2876 PWs) bands (ev): -5.4632 -5.4631 -3.5483 -3.5481 -1.6076 -1.6071 -1.5550 -1.5548 3.8541 3.8543 4.1500 4.1500 4.9359 4.9361 6.6179 6.6186 6.9606 6.9627 7.1074 7.1107 7.8719 7.8796 7.9838 7.9919 8.0049 8.0063 9.5656 9.5838 9.8628 9.8763 9.9105 9.9368 10.1748 10.1752 10.2522 10.2813 10.3398 10.3438 10.6147 10.6270 12.5496 12.5524 12.7681 12.7707 13.1363 13.1396 13.3286 13.3337 k = 0.0000 0.1694-0.0000 ( 2876 PWs) bands (ev): -5.5003 -5.5001 -3.5364 -3.5361 -1.5506 -1.5501 -1.5428 -1.5426 3.9287 3.9289 4.1925 4.1925 4.8196 4.8198 6.6319 6.6327 6.9441 6.9460 7.1371 7.1402 7.8543 7.8616 7.8877 7.8915 7.9325 7.9421 9.5736 9.5905 9.8773 9.8829 9.9040 9.9355 10.1459 10.1478 10.2515 10.2792 10.3482 10.3504 10.5721 10.5847 12.5211 12.5239 12.7337 12.7363 13.1864 13.1892 13.4097 13.4146 k = 0.0000 0.1588-0.0000 ( 2872 PWs) bands (ev): -5.5352 -5.5351 -3.5272 -3.5269 -1.5379 -1.5378 -1.4843 -1.4838 4.0076 4.0078 4.2210 4.2210 4.7203 4.7204 6.6473 6.6480 6.9271 6.9287 7.1672 7.1704 7.7595 7.7597 7.8398 7.8570 7.8809 7.8965 9.5778 9.5935 9.8565 9.8658 9.9284 9.9538 10.1182 10.1215 10.2505 10.2776 10.3585 10.3586 10.5326 10.5453 12.4949 12.4977 12.6989 12.7017 13.2379 13.2404 13.4925 13.4974 k = 0.0000 0.1482-0.0000 ( 2880 PWs) bands (ev): -5.5680 -5.5679 -3.5204 -3.5201 -1.5303 -1.5302 -1.4196 -1.4192 4.0904 4.0907 4.2233 4.2234 4.6501 4.6501 6.6637 6.6645 6.9098 6.9113 7.1962 7.1998 7.6366 7.6374 7.8091 7.8291 7.8411 7.8596 9.5781 9.5927 9.8319 9.8422 9.9528 9.9749 10.0920 10.0963 10.2491 10.2761 10.3677 10.3703 10.4974 10.5091 12.4707 12.4736 12.6644 12.6673 13.2906 13.2929 13.5759 13.5808 k = 0.0000 0.1376-0.0000 ( 2876 PWs) bands (ev): -5.5987 -5.5986 -3.5156 -3.5154 -1.5235 -1.5234 -1.3536 -1.3531 4.1761 4.1765 4.1892 4.1895 4.6205 4.6206 6.6813 6.6822 6.8922 6.8937 7.2221 7.2264 7.5145 7.5162 7.7687 7.7798 7.8225 7.8321 9.5748 9.5882 9.8069 9.8172 9.9744 9.9943 10.0677 10.0726 10.2477 10.2745 10.3763 10.3832 10.4676 10.4765 12.4484 12.4513 12.6307 12.6336 13.3440 13.3460 13.6592 13.6641 k = 0.0000 0.1271-0.0000 ( 2876 PWs) bands (ev): -5.6272 -5.6271 -3.5125 -3.5123 -1.5175 -1.5174 -1.2870 -1.2866 4.1200 4.1201 4.2679 4.2681 4.6273 4.6274 6.7000 6.7009 6.8740 6.8754 7.2362 7.2424 7.4025 7.4062 7.7239 7.7313 7.8029 7.8087 9.5679 9.5804 9.7822 9.7921 9.9927 10.0111 10.0453 10.0508 10.2462 10.2728 10.3814 10.3968 10.4463 10.4480 12.4273 12.4301 12.5984 12.6013 13.3974 13.3992 13.7414 13.7463 k = 0.0000 0.1165-0.0000 ( 2878 PWs) bands (ev): -5.6534 -5.6534 -3.5108 -3.5106 -1.5123 -1.5122 -1.2209 -1.2205 4.0344 4.0344 4.3617 4.3619 4.6553 4.6554 6.7195 6.7204 6.8539 6.8554 7.2007 7.2073 7.3426 7.3468 7.6784 7.6840 7.7820 7.7860 9.5580 9.5694 9.7583 9.7675 10.0067 10.0221 10.0278 10.0320 10.2447 10.2710 10.3779 10.4089 10.4252 10.4382 12.4071 12.4099 12.5682 12.5711 13.4503 13.4518 13.8216 13.8266 k = 0.0000 0.1059-0.0000 ( 2878 PWs) bands (ev): -5.6775 -5.6774 -3.5101 -3.5099 -1.5077 -1.5076 -1.1560 -1.1556 3.9427 3.9428 4.4587 4.4589 4.6930 4.6932 6.7397 6.7406 6.8290 6.8304 7.1061 7.1104 7.3489 7.3507 7.6336 7.6382 7.7604 7.7633 9.5455 9.5559 9.7355 9.7441 10.0051 10.0057 10.0276 10.0378 10.2434 10.2688 10.3667 10.3991 10.4285 10.4426 12.3874 12.3901 12.5408 12.5436 13.5017 13.5031 13.8978 13.9029 k = 0.0000 0.0953-0.0000 ( 2870 PWs) bands (ev): -5.6993 -5.6992 -3.5102 -3.5100 -1.5037 -1.5036 -1.0933 -1.0929 3.8516 3.8516 4.5585 4.5587 4.7345 4.7346 6.7597 6.7605 6.7921 6.7933 7.0077 7.0108 7.3705 7.3712 7.5901 7.5941 7.7384 7.7407 9.5310 9.5404 9.7142 9.7220 9.9881 9.9909 10.0366 10.0476 10.2423 10.2665 10.3540 10.3821 10.4425 10.4525 12.3679 12.3704 12.5168 12.5193 13.5511 13.5523 13.9614 13.9646 k = 0.0000 0.0847-0.0000 ( 2876 PWs) bands (ev): -5.7188 -5.7187 -3.5108 -3.5107 -1.5002 -1.5002 -1.0336 -1.0333 3.7644 3.7644 4.6604 4.6606 4.7764 4.7765 6.7241 6.7253 6.7834 6.7845 6.9342 6.9364 7.3939 7.3941 7.5484 7.5520 7.7165 7.7184 9.5152 9.5236 9.6945 9.7015 9.9730 9.9759 10.0454 10.0553 10.2413 10.2637 10.3428 10.3676 10.4566 10.4641 12.3486 12.3507 12.4963 12.4985 13.5977 13.5987 13.9928 13.9930 k = 0.0000 0.0741-0.0000 ( 2876 PWs) bands (ev): -5.7361 -5.7360 -3.5119 -3.5117 -1.4973 -1.4973 -0.9780 -0.9776 3.6833 3.6833 4.7628 4.7629 4.8180 4.8182 6.6289 6.6295 6.8042 6.8053 6.8924 6.8937 7.4165 7.4166 7.5090 7.5122 7.6953 7.6969 9.4991 9.5065 9.6767 9.6830 9.9596 9.9624 10.0529 10.0616 10.2406 10.2608 10.3340 10.3557 10.4701 10.4759 12.3296 12.3314 12.4794 12.4813 13.6407 13.6416 14.0120 14.0124 k = 0.0000 0.0635-0.0000 ( 2876 PWs) bands (ev): -5.7510 -5.7510 -3.5131 -3.5129 -1.4949 -1.4948 -0.9273 -0.9270 3.6101 3.6101 4.8442 4.8442 4.8788 4.8790 6.5169 6.5172 6.8249 6.8260 6.8694 6.8702 7.4368 7.4370 7.4729 7.4756 7.6753 7.6767 9.4832 9.4896 9.6611 9.6665 9.9481 9.9506 10.0590 10.0665 10.2402 10.2577 10.3276 10.3461 10.4828 10.4873 12.3114 12.3129 12.4659 12.4675 13.6796 13.6803 14.0278 14.0283 k = 0.0000 0.0529-0.0000 ( 2876 PWs) bands (ev): -5.7637 -5.7637 -3.5143 -3.5142 -1.4929 -1.4928 -0.8824 -0.8822 3.5459 3.5459 4.8816 4.8816 4.9794 4.9796 6.4003 6.4004 6.8437 6.8443 6.8561 6.8570 7.4358 7.4388 7.4585 7.4589 7.6572 7.6584 9.4684 9.4737 9.6476 9.6522 9.9383 9.9406 10.0640 10.0701 10.2400 10.2547 10.3231 10.3385 10.4942 10.4977 12.2947 12.2959 12.4554 12.4566 13.7136 13.7142 14.0409 14.0414 k = 0.0000 0.0424-0.0000 ( 2881 PWs) bands (ev): -5.7741 -5.7741 -3.5155 -3.5154 -1.4913 -1.4913 -0.8443 -0.8442 3.4918 3.4919 4.9102 4.9102 5.0822 5.0824 6.2853 6.2853 6.8434 6.8435 6.8651 6.8663 7.4077 7.4102 7.4730 7.4733 7.6416 7.6425 9.4554 9.4596 9.6366 9.6403 9.9304 9.9322 10.0679 10.0728 10.2401 10.2518 10.3203 10.3324 10.5039 10.5066 12.2801 12.2809 12.4474 12.4484 13.7422 13.7427 14.0516 14.0520 k = 0.0000 0.0318-0.0000 ( 2881 PWs) bands (ev): -5.7822 -5.7822 -3.5165 -3.5165 -1.4901 -1.4901 -0.8138 -0.8136 3.4488 3.4488 4.9328 4.9328 5.1802 5.1804 6.1771 6.1771 6.8369 6.8370 6.8808 6.8818 7.3833 7.3853 7.4855 7.4858 7.6288 7.6295 9.4447 9.4479 9.6281 9.6308 9.9243 9.9257 10.0709 10.0745 10.2405 10.2491 10.3188 10.3278 10.5118 10.5138 12.2681 12.2687 12.4416 12.4423 13.7651 13.7654 14.0599 14.0602 k = 0.0000 0.0212-0.0000 ( 2883 PWs) bands (ev): -5.7880 -5.7880 -3.5173 -3.5172 -1.4892 -1.4892 -0.7914 -0.7913 3.4175 3.4175 4.9492 4.9492 5.2670 5.2671 6.0828 6.0828 6.8324 6.8324 6.8935 6.8942 7.3648 7.3662 7.4948 7.4950 7.6194 7.6199 9.4368 9.4389 9.6221 9.6239 9.9200 9.9209 10.0732 10.0756 10.2412 10.2469 10.3183 10.3242 10.5177 10.5190 12.2592 12.2595 12.4377 12.4381 13.7816 13.7819 14.0658 14.0660 k = 0.0000 0.0106-0.0000 ( 2881 PWs) bands (ev): -5.7915 -5.7915 -3.5178 -3.5177 -1.4887 -1.4887 -0.7778 -0.7777 3.3985 3.3985 4.9592 4.9593 5.3308 5.3309 6.0143 6.0143 6.8298 6.8298 6.9018 6.9021 7.3533 7.3540 7.5005 7.5006 7.6136 7.6139 9.4322 9.4332 9.6187 9.6196 9.9175 9.9180 10.0747 10.0759 10.2421 10.2450 10.3186 10.3216 10.5214 10.5221 12.2537 12.2539 12.4355 12.4357 13.7917 13.7919 14.0694 14.0695 k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -5.7926 -5.7926 -3.5179 -3.5179 -1.4885 -1.4885 -0.7732 -0.7732 3.3921 3.3921 4.9626 4.9626 5.3553 5.3553 5.9884 5.9884 6.8289 6.8289 6.9047 6.9047 7.3496 7.3496 7.5025 7.5025 7.6118 7.6118 9.4309 9.4309 9.6178 9.6178 9.9169 9.9169 10.0756 10.0756 10.2434 10.2434 10.3197 10.3197 10.5230 10.5230 12.2520 12.2520 12.4348 12.4348 13.7952 13.7952 14.0706 14.0706 k = 0.0000 0.0000 0.0000 ( 2877 PWs) bands (ev): -5.7926 -5.7926 -3.5179 -3.5179 -1.4885 -1.4885 -0.7732 -0.7732 3.3921 3.3921 4.9626 4.9626 5.3553 5.3553 5.9884 5.9884 6.8289 6.8289 6.9047 6.9047 7.3496 7.3496 7.5025 7.5025 7.6118 7.6118 9.4309 9.4309 9.6178 9.6178 9.9169 9.9169 10.0756 10.0756 10.2434 10.2434 10.3197 10.3197 10.5230 10.5230 12.2520 12.2520 12.4348 12.4348 13.7952 13.7952 14.0706 14.0706 k = 0.0000 0.0000 0.0108 ( 2883 PWs) bands (ev): -5.7915 -5.7915 -3.5210 -3.5210 -1.4867 -1.4867 -0.7732 -0.7732 3.3924 3.3924 4.9648 4.9648 5.3522 5.3522 5.9898 5.9899 6.8199 6.8201 6.9049 6.9052 7.3490 7.3498 7.5031 7.5033 7.6222 7.6228 9.4233 9.4238 9.6190 9.6199 9.9218 9.9237 10.0759 10.0772 10.2420 10.2430 10.3196 10.3203 10.5212 10.5223 12.2512 12.2513 12.4338 12.4338 13.7947 13.7949 14.0692 14.0693 k = 0.0000 0.0000 0.0215 ( 2881 PWs) bands (ev): -5.7881 -5.7881 -3.5302 -3.5301 -1.4812 -1.4811 -0.7732 -0.7732 3.3935 3.3935 4.9714 4.9714 5.3430 5.3431 5.9943 5.9945 6.7949 6.7952 6.9057 6.9063 7.3480 7.3494 7.5053 7.5057 7.6528 7.6538 9.4022 9.4031 9.6234 9.6251 9.9369 9.9409 10.0783 10.0811 10.2388 10.2406 10.3201 10.3216 10.5171 10.5193 12.2489 12.2491 12.4309 12.4310 13.7935 13.7938 14.0652 14.0654 k = 0.0000 0.0000 0.0323 ( 2883 PWs) bands (ev): -5.7825 -5.7824 -3.5453 -3.5452 -1.4721 -1.4720 -0.7732 -0.7732 3.3953 3.3953 4.9824 4.9824 5.3278 5.3279 6.0018 6.0021 6.7579 6.7583 6.9069 6.9078 7.3465 7.3482 7.5090 7.5096 7.6996 7.7007 9.3703 9.3716 9.6308 9.6333 9.9583 9.9643 10.0840 10.0887 10.2335 10.2359 10.3212 10.3240 10.5106 10.5141 12.2453 12.2455 12.4261 12.4263 13.7915 13.7919 14.0585 14.0590 k = 0.0000 0.0000 0.0431 ( 2894 PWs) bands (ev): -5.7746 -5.7745 -3.5661 -3.5660 -1.4597 -1.4596 -0.7732 -0.7732 3.3978 3.3978 4.9976 4.9976 5.3065 5.3066 6.0124 6.0127 6.7134 6.7138 6.9085 6.9096 7.3441 7.3458 7.5142 7.5151 7.7584 7.7594 9.3307 9.3323 9.6412 9.6443 9.9803 9.9884 10.0957 10.1023 10.2258 10.2286 10.3232 10.3277 10.5018 10.5067 12.2404 12.2407 12.4194 12.4197 13.7887 13.7893 14.0494 14.0502 k = 0.0000 0.0000 0.0538 ( 2892 PWs) bands (ev): -5.7644 -5.7644 -3.5923 -3.5921 -1.4443 -1.4441 -0.7733 -0.7733 3.4010 3.4010 5.0170 5.0170 5.2792 5.2793 6.0261 6.0265 6.6650 6.6654 6.9105 6.9120 7.3408 7.3425 7.5210 7.5221 7.8249 7.8258 9.2857 9.2878 9.6546 9.6582 9.9983 10.0075 10.1166 10.1247 10.2153 10.2186 10.3264 10.3331 10.4909 10.4975 12.2345 12.2349 12.4110 12.4114 13.7850 13.7858 14.0381 14.0392 k = 0.0000 0.0000 0.0646 ( 2888 PWs) bands (ev): -5.7521 -5.7520 -3.6235 -3.6233 -1.4261 -1.4259 -0.7734 -0.7734 3.4049 3.4050 5.0403 5.0403 5.2462 5.2463 6.0430 6.0435 6.6155 6.6160 6.9129 6.9147 7.3366 7.3383 7.5293 7.5307 7.8961 7.8967 9.2372 9.2397 9.6705 9.6747 10.0100 10.0192 10.1464 10.1561 10.2020 10.2068 10.3306 10.3402 10.4778 10.4866 12.2278 12.2282 12.4011 12.4015 13.7805 13.7814 14.0245 14.0263 k = 0.0000 0.0000 0.0754 ( 2904 PWs) bands (ev): -5.7375 -5.7374 -3.6594 -3.6591 -1.4055 -1.4053 -0.7736 -0.7736 3.4097 3.4097 5.0670 5.0671 5.2079 5.2080 6.0632 6.0637 6.5667 6.5671 6.9158 6.9179 7.3315 7.3331 7.5390 7.5406 7.9693 7.9695 9.1864 9.1892 9.6890 9.6937 10.0165 10.0253 10.1724 10.1854 10.1938 10.2024 10.3356 10.3490 10.4627 10.4744 12.2205 12.2209 12.3895 12.3900 13.7751 13.7760 14.0089 14.0117 k = 0.0000 0.0000 0.0861 ( 2900 PWs) bands (ev): -5.7206 -5.7206 -3.6994 -3.6992 -1.3829 -1.3827 -0.7739 -0.7739 3.4152 3.4152 5.0954 5.0955 5.1661 5.1663 6.0868 6.0874 6.5199 6.5203 6.9192 6.9215 7.3257 7.3271 7.5504 7.5522 8.0423 8.0424 9.1340 9.1374 9.7099 9.7151 10.0200 10.0283 10.1631 10.1663 10.2340 10.2351 10.3408 10.3595 10.4459 10.4619 12.2130 12.2135 12.3766 12.3772 13.7687 13.7697 13.9914 13.9958 k = 0.0000 0.0000 0.0969 ( 2900 PWs) bands (ev): -5.7016 -5.7015 -3.7432 -3.7430 -1.3586 -1.3584 -0.7744 -0.7743 3.4215 3.4215 5.1011 5.1012 5.1454 5.1456 6.1140 6.1146 6.4756 6.4761 6.9231 6.9256 7.3190 7.3204 7.5632 7.5653 8.1130 8.1137 9.0808 9.0848 9.7330 9.7387 10.0216 10.0297 10.1423 10.1445 10.2756 10.2779 10.3452 10.3716 10.4276 10.4502 12.2056 12.2060 12.3626 12.3633 13.7612 13.7624 13.9714 13.9789 k = 0.0000 0.0000 0.1077 ( 2900 PWs) bands (ev): -5.6804 -5.6803 -3.7904 -3.7901 -1.3330 -1.3328 -0.7750 -0.7750 3.4288 3.4288 5.0542 5.0544 5.1757 5.1759 6.1450 6.1456 6.4343 6.4348 6.9274 6.9302 7.3117 7.3130 7.5776 7.5798 8.1801 8.1815 9.0272 9.0320 9.7580 9.7643 10.0219 10.0300 10.1184 10.1207 10.3177 10.3207 10.3468 10.3853 10.4083 10.4415 12.1986 12.1989 12.3475 12.3484 13.7527 13.7539 13.9476 13.9613 k = 0.0000 0.0000 0.1184 ( 2900 PWs) bands (ev): -5.6571 -5.6570 -3.8405 -3.8402 -1.3064 -1.3062 -0.7758 -0.7758 3.4370 3.4370 4.9975 4.9977 5.2145 5.2148 6.1799 6.1805 6.3961 6.3965 6.9323 6.9353 7.3036 7.3048 7.5934 7.5958 8.2420 8.2443 8.9734 8.9792 9.7847 9.7915 10.0207 10.0292 10.0933 10.0961 10.3417 10.3552 10.3639 10.3910 10.4012 10.4385 12.1922 12.1925 12.3317 12.3327 13.7431 13.7443 13.9154 13.9426 k = 0.0000 0.0000 0.1292 ( 2902 PWs) bands (ev): -5.6316 -5.6315 -3.8932 -3.8929 -1.2791 -1.2789 -0.7769 -0.7769 3.4463 3.4463 4.9367 4.9369 5.2563 5.2566 6.2189 6.2196 6.3607 6.3612 6.9377 6.9408 7.2949 7.2961 7.6106 7.6133 8.2969 8.3003 8.9198 8.9268 9.8129 9.8201 10.0167 10.0254 10.0700 10.0733 10.3317 10.3575 10.4029 10.4032 10.4219 10.4432 12.1868 12.1870 12.3153 12.3165 13.7323 13.7335 13.8676 13.9049 k = 0.0000 0.0000 0.1400 ( 2904 PWs) bands (ev): -5.6040 -5.6039 -3.9480 -3.9477 -1.2514 -1.2512 -0.7783 -0.7783 3.4568 3.4568 4.8730 4.8732 5.3000 5.3004 6.2623 6.2630 6.3281 6.3285 6.9435 6.9469 7.2856 7.2867 7.6293 7.6322 8.3431 8.3481 8.8666 8.8754 9.8421 9.8498 10.0059 10.0130 10.0553 10.0573 10.3159 10.3364 10.4260 10.4351 10.4534 10.4595 12.1826 12.1826 12.2985 12.3000 13.7202 13.7214 13.8068 13.8327 k = 0.0000 0.0000 0.1507 ( 2902 PWs) bands (ev): -5.5743 -5.5742 -4.0047 -4.0044 -1.2236 -1.2233 -0.7800 -0.7800 3.4686 3.4686 4.8071 4.8073 5.3450 5.3455 6.2963 6.2974 6.3118 6.3118 6.9499 6.9534 7.2758 7.2768 7.6494 7.6525 8.3788 8.3859 8.8141 8.8251 9.8721 9.8800 9.9868 9.9909 10.0511 10.0518 10.2967 10.3128 10.4453 10.4543 10.4893 10.4902 12.1795 12.1796 12.2817 12.2835 13.7070 13.7075 13.7431 13.7626 k = 0.0000 0.0000 0.1615 ( 2894 PWs) bands (ev): -5.5425 -5.5424 -4.0629 -4.0626 -1.1957 -1.1955 -0.7822 -0.7822 3.4817 3.4818 4.7398 4.7400 5.3906 5.3912 6.2688 6.2695 6.3639 6.3643 6.9567 6.9605 7.2654 7.2664 7.6710 7.6743 8.4023 8.4121 8.7626 8.7763 9.9024 9.9098 9.9648 9.9663 10.0513 10.0535 10.2755 10.2884 10.4643 10.4706 10.5240 10.5244 12.1776 12.1779 12.2650 12.2671 13.6775 13.6919 13.6962 13.6975 k = 0.0000 0.0000 0.1723 ( 2886 PWs) bands (ev): -5.5088 -5.5086 -4.1224 -4.1220 -1.1682 -1.1679 -0.7848 -0.7848 3.4965 3.4965 4.6717 4.6718 5.4364 5.4371 6.2421 6.2428 6.4219 6.4223 6.9641 6.9681 7.2546 7.2556 7.6939 7.6974 8.4122 8.4252 8.7124 8.7293 9.9296 9.9296 9.9458 9.9531 10.0548 10.0580 10.2532 10.2637 10.4836 10.4873 10.5563 10.5573 12.1769 12.1773 12.2488 12.2512 13.6207 13.6365 13.6768 13.6789 k = 0.0000 0.0000 0.1830 ( 2886 PWs) bands (ev): -5.4730 -5.4729 -4.1827 -4.1824 -1.1411 -1.1408 -0.7879 -0.7879 3.5129 3.5129 4.6031 4.6033 5.4819 5.4827 6.2166 6.2174 6.4851 6.4854 6.9720 6.9762 7.2433 7.2443 7.7182 7.7219 8.4076 8.4241 8.6634 8.6839 9.9165 9.9195 9.9653 9.9765 10.0605 10.0641 10.2305 10.2389 10.5031 10.5046 10.5861 10.5876 12.1771 12.1776 12.2333 12.2361 13.5677 13.5818 13.6597 13.6616 k = 0.0000 0.0000 0.1938 ( 2882 PWs) bands (ev): -5.4353 -5.4352 -4.2438 -4.2435 -1.1145 -1.1143 -0.7916 -0.7916 3.5311 3.5312 4.5348 4.5350 5.5266 5.5275 6.1922 6.1930 6.5534 6.5538 6.9804 6.9849 7.2317 7.2327 7.7439 7.7478 8.3886 8.4084 8.6158 8.6393 9.9009 9.9031 9.9942 10.0053 10.0676 10.0717 10.2079 10.2146 10.5225 10.5228 10.6129 10.6149 12.1780 12.1786 12.2188 12.2222 13.5204 13.5333 13.6415 13.6431 k = 0.0000 0.0000 0.2045 ( 2890 PWs) bands (ev): -5.3957 -5.3955 -4.3054 -4.3051 -1.0887 -1.0885 -0.7960 -0.7960 3.5513 3.5513 4.4670 4.4672 5.5703 5.5713 6.1683 6.1692 6.6267 6.6272 6.9894 6.9942 7.2198 7.2207 7.7708 7.7751 8.3565 8.3784 8.5689 8.5945 9.8891 9.8909 10.0224 10.0334 10.0752 10.0798 10.1866 10.1914 10.5407 10.5425 10.6366 10.6390 12.1791 12.1796 12.2054 12.2096 13.4791 13.4909 13.6221 13.6236 k = 0.0000 0.0000 0.2153 ( 2898 PWs) bands (ev): -5.3542 -5.3541 -4.3672 -4.3669 -1.0638 -1.0636 -0.8010 -0.8010 3.5736 3.5736 4.4002 4.4004 5.6126 5.6136 6.1450 6.1459 6.7046 6.7054 6.9990 7.0044 7.2076 7.2085 7.7992 7.8037 8.3129 8.3356 8.5220 8.5483 9.8816 9.8833 10.0490 10.0594 10.0821 10.0871 10.1681 10.1707 10.5591 10.5621 10.6570 10.6598 12.1798 12.1799 12.1939 12.1992 13.4442 13.4551 13.6016 13.6029 k = 0.0000 0.0000 0.2261 ( 2902 PWs) bands (ev): -5.3109 -5.3108 -4.4290 -4.4287 -1.0397 -1.0395 -0.8068 -0.8068 3.5980 3.5981 4.3347 4.3348 5.6534 5.6545 6.1218 6.1228 6.7866 6.7880 7.0095 7.0157 7.1952 7.1961 7.8288 7.8336 8.2591 8.2815 8.4746 8.5003 9.8784 9.8800 10.0733 10.0780 10.0897 10.0906 10.1557 10.1558 10.5775 10.5816 10.6741 10.6773 12.1779 12.1781 12.1860 12.1924 13.4159 13.4259 13.5803 13.5813 k = 0.0000 0.0000 0.2368 ( 2904 PWs) bands (ev): -5.2659 -5.2657 -4.4907 -4.4904 -1.0167 -1.0165 -0.8135 -0.8134 3.6248 3.6249 4.2708 4.2709 5.6925 5.6937 6.0987 6.0997 6.8712 6.8740 7.0214 7.0295 7.1826 7.1835 7.8597 7.8649 8.1964 8.2174 8.4268 8.4509 9.8790 9.8806 10.0744 10.0821 10.0983 10.1088 10.1510 10.1533 10.5956 10.6006 10.6877 10.6915 12.1719 12.1731 12.1837 12.1894 13.3944 13.4034 13.5581 13.5589 k = 0.0000 0.0000 0.2476 ( 2904 PWs) bands (ev): -5.2191 -5.2189 -4.5522 -4.5519 -0.9947 -0.9945 -0.8210 -0.8209 3.6540 3.6541 4.2087 4.2088 5.7300 5.7313 6.0754 6.0764 6.9528 6.9596 7.0382 7.0504 7.1699 7.1708 7.8919 7.8974 8.1254 8.1444 8.3791 8.4010 9.8829 9.8846 10.0605 10.0680 10.1178 10.1280 10.1554 10.1589 10.6132 10.6189 10.6980 10.7023 12.1656 12.1681 12.1825 12.1878 13.3794 13.3875 13.5355 13.5359 k = 0.0000 0.0000 0.2584 ( 2910 PWs) bands (ev): -5.1707 -5.1705 -4.6131 -4.6129 -0.9739 -0.9737 -0.8294 -0.8294 3.6857 3.6858 4.1486 4.1487 5.7659 5.7671 6.0517 6.0527 7.0112 7.0197 7.0841 7.0985 7.1571 7.1580 7.9252 7.9310 8.0471 8.0637 8.3318 8.3513 9.8896 9.8914 10.0428 10.0494 10.1355 10.1449 10.1636 10.1681 10.6301 10.6362 10.7050 10.7096 12.1610 12.1642 12.1807 12.1858 13.3707 13.3779 13.5126 13.5126 k = 0.0000 0.0000 0.2691 ( 2910 PWs) bands (ev): -5.1208 -5.1205 -4.6735 -4.6732 -0.9542 -0.9540 -0.8388 -0.8388 3.7201 3.7202 4.0908 4.0909 5.8001 5.8014 6.0275 6.0286 7.0375 7.0413 7.1442 7.1450 7.1719 7.1822 7.9539 7.9565 7.9742 7.9796 8.2856 8.3026 9.8985 9.9007 10.0238 10.0296 10.1508 10.1594 10.1721 10.1774 10.6460 10.6525 10.7088 10.7139 12.1581 12.1619 12.1780 12.1832 13.3681 13.3744 13.4893 13.4898 k = 0.0000 0.0000 0.2799 ( 2908 PWs) bands (ev): -5.0693 -5.0690 -4.7332 -4.7329 -0.9356 -0.9355 -0.8493 -0.8492 3.7570 3.7571 4.0353 4.0354 5.8329 5.8342 6.0026 6.0038 7.0538 7.0554 7.1315 7.1322 7.2696 7.2782 7.8691 7.8819 7.9974 8.0047 8.2405 8.2554 9.9095 9.9119 10.0048 10.0099 10.1635 10.1715 10.1792 10.1852 10.6607 10.6674 10.7095 10.7150 12.1571 12.1613 12.1745 12.1797 13.3710 13.3763 13.4666 13.4675 k = 0.0000 0.0000 0.2907 ( 2912 PWs) bands (ev): -5.0163 -5.0161 -4.7919 -4.7917 -0.9183 -0.9182 -0.8608 -0.8607 3.7967 3.7968 3.9823 3.9824 5.8642 5.8655 5.9769 5.9782 7.0676 7.0682 7.1187 7.1194 7.3704 7.3785 7.7738 7.7851 8.0344 8.0425 8.1967 8.2097 9.9222 9.9249 9.9862 9.9908 10.1736 10.1811 10.1840 10.1905 10.6740 10.6807 10.7073 10.7132 12.1577 12.1622 12.1706 12.1758 13.3787 13.3832 13.4447 13.4462 k = 0.0000 0.0000 0.3014 ( 2916 PWs) bands (ev): -4.9620 -4.9618 -4.8498 -4.8495 -0.9022 -0.9021 -0.8734 -0.8733 3.8390 3.8392 3.9319 3.9320 5.8941 5.8954 5.9504 5.9516 7.0807 7.0807 7.1060 7.1065 7.4723 7.4807 7.6751 7.6851 8.0730 8.0820 8.1542 8.1656 9.9363 9.9394 9.9685 9.9725 10.1807 10.1859 10.1880 10.1928 10.6855 10.6922 10.7024 10.7086 12.1596 12.1645 12.1665 12.1717 13.3906 13.3943 13.4243 13.4265 k = 0.0000 0.0000 0.3122 ( 2918 PWs) bands (ev): -4.9065 -4.9065 -4.9062 -4.9062 -0.8872 -0.8872 -0.8871 -0.8871 3.8841 3.8841 3.8842 3.8842 5.9228 5.9228 5.9241 5.9241 7.0933 7.0933 7.0937 7.0937 7.5742 7.5742 7.5832 7.5832 8.1129 8.1129 8.1230 8.1230 9.9518 9.9518 9.9553 9.9553 10.1849 10.1849 10.1920 10.1920 10.6951 10.6951 10.7016 10.7016 12.1627 12.1627 12.1678 12.1678 13.4061 13.4061 13.4090 13.4090 k = 0.0000 0.0000 0.3122 ( 2918 PWs) bands (ev): -4.9065 -4.9065 -4.9062 -4.9062 -0.8872 -0.8872 -0.8871 -0.8871 3.8841 3.8841 3.8842 3.8842 5.9228 5.9228 5.9241 5.9241 7.0933 7.0933 7.0937 7.0937 7.5742 7.5742 7.5832 7.5832 8.1129 8.1129 8.1230 8.1230 9.9518 9.9518 9.9553 9.9553 10.1849 10.1849 10.1920 10.1920 10.6951 10.6951 10.7016 10.7016 12.1627 12.1627 12.1678 12.1678 13.4061 13.4061 13.4090 13.4090 k = 0.0106-0.0000 0.3122 ( 2916 PWs) bands (ev): -4.9057 -4.9057 -4.9054 -4.9054 -0.8874 -0.8873 -0.8872 -0.8871 3.8850 3.8850 3.8851 3.8851 5.9225 5.9232 5.9237 5.9245 7.0905 7.0907 7.0910 7.0914 7.5694 7.5718 7.5782 7.5807 8.1105 8.1160 8.1205 8.1260 9.9536 9.9539 9.9553 9.9593 10.1837 10.1860 10.1905 10.1934 10.6960 10.6963 10.7018 10.7035 12.1633 12.1653 12.1684 12.1704 13.4042 13.4056 13.4071 13.4085 k = 0.0213-0.0000 0.3122 ( 2916 PWs) bands (ev): -4.9033 -4.9033 -4.9030 -4.9030 -0.8877 -0.8876 -0.8874 -0.8873 3.8875 3.8876 3.8876 3.8877 5.9222 5.9234 5.9235 5.9249 7.0824 7.0827 7.0835 7.0840 7.5574 7.5619 7.5660 7.5706 8.1091 8.1189 8.1198 8.1294 9.9589 9.9590 9.9594 9.9668 10.1827 10.1870 10.1889 10.1951 10.6992 10.6998 10.7043 10.7076 12.1672 12.1712 12.1722 12.1763 13.3998 13.4028 13.4029 13.4058 k = 0.0319-0.0000 0.3122 ( 2908 PWs) bands (ev): -4.8993 -4.8992 -4.8990 -4.8990 -0.8882 -0.8881 -0.8877 -0.8877 3.8918 3.8918 3.8919 3.8920 5.9218 5.9229 5.9238 5.9252 7.0693 7.0695 7.0708 7.0713 7.5386 7.5448 7.5468 7.5531 8.1092 8.1185 8.1244 8.1335 9.9654 9.9671 9.9674 9.9764 10.1826 10.1875 10.1881 10.1977 10.7049 10.7055 10.7093 10.7140 12.1743 12.1793 12.1803 12.1854 13.3928 13.3962 13.3974 13.4004 k = 0.0426-0.0000 0.3122 ( 2904 PWs) bands (ev): -4.8936 -4.8936 -4.8934 -4.8933 -0.8889 -0.8888 -0.8883 -0.8882 3.8978 3.8978 3.8978 3.8979 5.9211 5.9223 5.9239 5.9253 7.0511 7.0512 7.0529 7.0535 7.5137 7.5211 7.5213 7.5289 8.1112 8.1200 8.1301 8.1387 9.9735 9.9754 9.9774 9.9866 10.1840 10.1866 10.1896 10.2015 10.7128 10.7134 10.7166 10.7224 12.1847 12.1896 12.1925 12.1976 13.3828 13.3865 13.3890 13.3922 k = 0.0532-0.0000 0.3122 ( 2904 PWs) bands (ev): -4.8864 -4.8864 -4.8862 -4.8861 -0.8898 -0.8897 -0.8890 -0.8889 3.9054 3.9054 3.9055 3.9056 5.9200 5.9211 5.9235 5.9250 7.0279 7.0280 7.0298 7.0304 7.4835 7.4905 7.4916 7.4987 8.1157 8.1238 8.1373 8.1452 9.9814 9.9825 9.9871 9.9951 10.1868 10.1879 10.1921 10.2073 10.7232 10.7235 10.7265 10.7329 12.1984 12.2032 12.2080 12.2131 13.3693 13.3733 13.3771 13.3805 k = 0.0638-0.0000 0.3122 ( 2908 PWs) bands (ev): -4.8777 -4.8776 -4.8774 -4.8773 -0.8909 -0.8908 -0.8899 -0.8899 3.9146 3.9147 3.9147 3.9148 5.9181 5.9191 5.9223 5.9239 6.9997 6.9998 7.0015 7.0023 7.4493 7.4556 7.4576 7.4641 8.1226 8.1300 8.1461 8.1534 9.9868 9.9875 9.9947 10.0001 10.1885 10.1948 10.1958 10.2153 10.7360 10.7361 10.7389 10.7455 12.2154 12.2201 12.2266 12.2317 13.3516 13.3560 13.3610 13.3646 k = 0.0745-0.0000 0.3122 ( 2908 PWs) bands (ev): -4.8673 -4.8672 -4.8671 -4.8670 -0.8922 -0.8921 -0.8911 -0.8910 3.9255 3.9255 3.9256 3.9257 5.9150 5.9160 5.9200 5.9216 6.9668 6.9669 6.9683 6.9691 7.4124 7.4181 7.4207 7.4266 8.1318 8.1386 8.1566 8.1632 9.9874 9.9906 9.9988 10.0006 10.1922 10.2008 10.2046 10.2251 10.7507 10.7513 10.7538 10.7603 12.2356 12.2402 12.2484 12.2534 13.3289 13.3337 13.3398 13.3436 k = 0.0851-0.0000 0.3122 ( 2906 PWs) bands (ev): -4.8555 -4.8554 -4.8552 -4.8551 -0.8937 -0.8936 -0.8924 -0.8924 3.9379 3.9380 3.9380 3.9381 5.9101 5.9111 5.9160 5.9175 6.9296 6.9297 6.9305 6.9313 7.3744 7.3795 7.3825 7.3879 8.1431 8.1493 8.1686 8.1746 9.9839 9.9898 9.9963 9.9986 10.1974 10.2068 10.2163 10.2360 10.7676 10.7688 10.7711 10.7771 12.2591 12.2636 12.2733 12.2783 13.3004 13.3056 13.3125 13.3164 k = 0.0957-0.0000 0.3122 ( 2898 PWs) bands (ev): -4.8421 -4.8420 -4.8418 -4.8417 -0.8955 -0.8954 -0.8941 -0.8940 3.9518 3.9520 3.9520 3.9520 5.9029 5.9038 5.9095 5.9111 6.8887 6.8888 6.8889 6.8896 7.3367 7.3411 7.3445 7.3494 8.1561 8.1617 8.1818 8.1873 9.9766 9.9851 9.9879 9.9939 10.2035 10.2131 10.2284 10.2468 10.7865 10.7883 10.7904 10.7958 12.2858 12.2901 12.3012 12.3061 13.2655 13.2710 13.2784 13.2823 k = 0.1064-0.0000 0.3122 ( 2892 PWs) bands (ev): -4.8273 -4.8271 -4.8270 -4.8269 -0.8976 -0.8974 -0.8960 -0.8959 3.9672 3.9673 3.9674 3.9674 5.8924 5.8932 5.8998 5.9015 6.8443 6.8451 6.8453 6.8455 7.3002 7.3041 7.3079 7.3124 8.1703 8.1753 8.1960 8.2010 9.9661 9.9761 9.9768 9.9853 10.2094 10.2186 10.2394 10.2564 10.8071 10.8093 10.8114 10.8159 12.3155 12.3196 12.3320 12.3368 13.2239 13.2297 13.2370 13.2408 k = 0.1170-0.0000 0.3122 ( 2892 PWs) bands (ev): -4.8110 -4.8108 -4.8108 -4.8106 -0.8999 -0.8998 -0.8982 -0.8982 3.9839 3.9841 3.9842 3.9842 5.8778 5.8786 5.8860 5.8876 6.7984 6.7993 6.8007 6.8010 7.2657 7.2691 7.2734 7.2775 8.1852 8.1898 8.2107 8.2153 9.9527 9.9615 9.9654 9.9734 10.2140 10.2226 10.2485 10.2638 10.8287 10.8313 10.8333 10.8370 12.3481 12.3518 12.3654 12.3701 13.1759 13.1818 13.1887 13.1922 k = 0.1277-0.0000 0.3122 ( 2892 PWs) bands (ev): -4.7934 -4.7932 -4.7931 -4.7929 -0.9026 -0.9024 -0.9007 -0.9007 4.0019 4.0020 4.0023 4.0023 5.8581 5.8588 5.8670 5.8686 6.7532 6.7539 6.7567 6.7570 7.2336 7.2366 7.2415 7.2453 8.2005 8.2047 8.2255 8.2298 9.9371 9.9448 9.9514 9.9588 10.2165 10.2245 10.2546 10.2683 10.8509 10.8538 10.8558 10.8586 12.3832 12.3867 12.4012 12.4058 13.1222 13.1282 13.1344 13.1375 k = 0.1383-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.7743 -4.7741 -4.7741 -4.7739 -0.9056 -0.9054 -0.9036 -0.9036 4.0210 4.0212 4.0216 4.0217 5.8324 5.8330 5.8418 5.8433 6.7104 6.7110 6.7152 6.7155 7.2043 7.2069 7.2123 7.2158 8.2158 8.2196 8.2403 8.2442 9.9196 9.9263 9.9353 9.9421 10.2166 10.2239 10.2577 10.2699 10.8731 10.8760 10.8780 10.8802 12.4206 12.4237 12.4391 12.4435 13.0638 13.0699 13.0753 13.0781 k = 0.1489-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.7540 -4.7538 -4.7537 -4.7535 -0.9089 -0.9087 -0.9068 -0.9068 4.0412 4.0414 4.0421 4.0421 5.7998 5.8004 5.8095 5.8109 6.6718 6.6723 6.6776 6.6780 7.1776 7.1799 7.1858 7.1892 8.2306 8.2342 8.2546 8.2583 9.9006 9.9064 9.9175 9.9237 10.2141 10.2206 10.2575 10.2683 10.8946 10.8974 10.8995 10.9010 12.4599 12.4624 12.4786 12.4828 13.0020 13.0083 13.0128 13.0153 k = 0.1596-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.7324 -4.7321 -4.7321 -4.7319 -0.9127 -0.9125 -0.9105 -0.9105 4.0623 4.0625 4.0634 4.0634 5.7601 5.7607 5.7697 5.7711 6.6388 6.6391 6.6455 6.6458 7.1536 7.1556 7.1621 7.1653 8.2449 8.2482 8.2682 8.2716 9.8803 9.8853 9.8983 9.9039 10.2087 10.2146 10.2539 10.2635 10.9148 10.9175 10.9196 10.9207 12.5004 12.5021 12.5191 12.5230 12.9381 12.9448 12.9484 12.9507 k = 0.1702-0.0000 0.3122 ( 2886 PWs) bands (ev): -4.7096 -4.7094 -4.7093 -4.7091 -0.9168 -0.9166 -0.9145 -0.9145 4.0841 4.0843 4.0855 4.0855 5.7134 5.7139 5.7226 5.7239 6.6121 6.6123 6.6193 6.6197 7.1324 7.1341 7.1411 7.1442 8.2582 8.2612 8.2808 8.2840 9.8590 9.8633 9.8778 9.8830 10.2009 10.2061 10.2474 10.2559 10.9333 10.9357 10.9378 10.9386 12.5412 12.5418 12.5596 12.5631 12.8738 12.8813 12.8839 12.8862 k = 0.1809-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.6857 -4.6854 -4.6854 -4.6852 -0.9214 -0.9212 -0.9190 -0.9190 4.1064 4.1066 4.1082 4.1082 5.6603 5.6607 5.6688 5.6699 6.5919 6.5919 6.5993 6.5997 7.1138 7.1153 7.1228 7.1257 8.2703 8.2731 8.2922 8.2952 9.8367 9.8405 9.8564 9.8611 10.1905 10.1952 10.2381 10.2456 10.9497 10.9516 10.9537 10.9545 12.5789 12.5804 12.5978 12.6007 12.8114 12.8207 12.8221 12.8245 k = 0.1915-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.6607 -4.6604 -4.6603 -4.6601 -0.9264 -0.9262 -0.9240 -0.9240 4.1289 4.1291 4.1312 4.1313 5.6018 5.6021 5.6093 5.6103 6.5774 6.5776 6.5851 6.5854 7.0979 7.0992 7.1071 7.1100 8.2810 8.2837 8.3022 8.3050 9.8136 9.8169 9.8342 9.8384 10.1778 10.1819 10.2260 10.2327 10.9636 10.9649 10.9670 10.9679 12.6067 12.6118 12.6267 12.6284 12.7574 12.7700 12.7701 12.7734 k = 0.2021-0.0000 0.3122 ( 2896 PWs) bands (ev): -4.6347 -4.6345 -4.6343 -4.6341 -0.9319 -0.9317 -0.9294 -0.9294 4.1513 4.1516 4.1543 4.1543 5.5394 5.5397 5.5456 5.5465 6.5681 6.5684 6.5758 6.5762 7.0848 7.0859 7.0942 7.0970 8.2902 8.2927 8.3105 8.3132 9.7899 9.7928 9.8112 9.8151 10.1629 10.1666 10.2116 10.2175 10.9747 10.9753 10.9774 10.9786 12.6064 12.6140 12.6244 12.6245 12.7333 12.7481 12.7503 12.7548 k = 0.2128-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.6078 -4.6075 -4.6074 -4.6072 -0.9379 -0.9377 -0.9354 -0.9354 4.1733 4.1736 4.1769 4.1770 5.4745 5.4748 5.4793 5.4801 6.5631 6.5635 6.5706 6.5710 7.0745 7.0755 7.0841 7.0868 8.2978 8.3001 8.3172 8.3197 9.7657 9.7682 9.7877 9.7912 10.1460 10.1493 10.1950 10.2002 10.9830 10.9831 10.9851 10.9867 12.5694 12.5743 12.5830 12.5833 12.7522 12.7640 12.7703 12.7748 k = 0.2234-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.5801 -4.5798 -4.5796 -4.5794 -0.9444 -0.9442 -0.9418 -0.9418 4.1943 4.1946 4.1988 4.1988 5.4088 5.4090 5.4119 5.4127 6.5612 6.5617 6.5685 6.5689 7.0671 7.0680 7.0769 7.0795 8.3035 8.3057 8.3220 8.3245 9.7410 9.7432 9.7636 9.7669 10.1274 10.1303 10.1764 10.1810 10.9876 10.9886 10.9896 10.9919 12.5168 12.5194 12.5286 12.5289 12.7872 12.7964 12.8045 12.8085 k = 0.2340-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.5516 -4.5513 -4.5511 -4.5509 -0.9514 -0.9512 -0.9488 -0.9488 4.2138 4.2140 4.2192 4.2193 5.3438 5.3440 5.3451 5.3458 6.5616 6.5622 6.5687 6.5692 7.0628 7.0635 7.0727 7.0752 8.3075 8.3095 8.3249 8.3273 9.7160 9.7178 9.7392 9.7422 10.1071 10.1097 10.1560 10.1602 10.9891 10.9911 10.9912 10.9942 12.4608 12.4622 12.4724 12.4727 12.8254 12.8331 12.8414 12.8451 k = 0.2447-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.5224 -4.5222 -4.5219 -4.5217 -0.9589 -0.9587 -0.9563 -0.9563 4.2309 4.2312 4.2374 4.2375 5.2805 5.2811 5.2812 5.2812 6.5635 6.5641 6.5703 6.5708 7.0615 7.0621 7.0716 7.0739 8.3095 8.3115 8.3259 8.3282 9.6907 9.6923 9.7145 9.7172 10.0854 10.0876 10.1340 10.1377 10.9876 10.9896 10.9907 10.9936 12.4052 12.4059 12.4173 12.4176 12.8633 12.8700 12.8778 12.8811 k = 0.2553-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.4927 -4.4925 -4.4921 -4.4920 -0.9670 -0.9668 -0.9643 -0.9643 4.2449 4.2452 4.2526 4.2528 5.2197 5.2203 5.2222 5.2223 6.5662 6.5667 6.5727 6.5732 7.0633 7.0638 7.0734 7.0756 8.3098 8.3116 8.3250 8.3272 9.6651 9.6666 9.6896 9.6921 10.0624 10.0643 10.1106 10.1140 10.9831 10.9851 10.9875 10.9901 12.3515 12.3517 12.3645 12.3648 12.8997 12.9056 12.9125 12.9154 k = 0.2660-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.4626 -4.4624 -4.4620 -4.4618 -0.9755 -0.9753 -0.9729 -0.9729 4.2547 4.2550 4.2638 4.2640 5.1642 5.1648 5.1689 5.1689 6.5690 6.5696 6.5753 6.5758 7.0682 7.0686 7.0783 7.0804 8.3083 8.3099 8.3223 8.3244 9.6395 9.6407 9.6645 9.6668 10.0383 10.0400 10.0861 10.0892 10.9758 10.9777 10.9814 10.9839 12.3003 12.3004 12.3146 12.3149 12.9338 12.9391 12.9446 12.9471 k = 0.2766-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.4322 -4.4320 -4.4315 -4.4314 -0.9845 -0.9843 -0.9819 -0.9819 4.2592 4.2596 4.2698 4.2700 5.1157 5.1162 5.1225 5.1225 6.5716 6.5721 6.5776 6.5782 7.0759 7.0763 7.0861 7.0880 8.3051 8.3066 8.3178 8.3199 9.6138 9.6148 9.6393 9.6414 10.0133 10.0147 10.0605 10.0633 10.9657 10.9676 10.9727 10.9750 12.2519 12.2522 12.2678 12.2682 12.9652 12.9699 12.9738 12.9760 k = 0.2872-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.4016 -4.4014 -4.4009 -4.4007 -0.9940 -0.9938 -0.9915 -0.9914 4.2576 4.2579 4.2696 4.2698 5.0756 5.0761 5.0844 5.0844 6.5737 6.5741 6.5795 6.5801 7.0864 7.0867 7.0966 7.0982 8.3004 8.3018 8.3118 8.3139 9.5881 9.5890 9.6141 9.6160 9.9876 9.9888 10.0342 10.0367 10.9532 10.9551 10.9615 10.9637 12.2068 12.2072 12.2244 12.2248 12.9938 12.9978 12.9999 13.0018 k = 0.2979-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.3710 -4.3707 -4.3702 -4.3700 -1.0039 -1.0037 -1.0014 -1.0014 4.2491 4.2495 4.2623 4.2625 5.0450 5.0455 5.0556 5.0556 6.5750 6.5753 6.5807 6.5813 7.0993 7.0996 7.1094 7.1109 8.2944 8.2958 8.3045 8.3065 9.5624 9.5632 9.5889 9.5906 9.9612 9.9622 10.0072 10.0095 10.9385 10.9403 10.9482 10.9502 12.1649 12.1655 12.1843 12.1848 13.0193 13.0228 13.0230 13.0246 k = 0.3085-0.0000 0.3122 ( 2898 PWs) bands (ev): -4.3404 -4.3402 -4.3395 -4.3394 -1.0142 -1.0140 -1.0118 -1.0117 4.2336 4.2340 4.2478 4.2480 5.0244 5.0249 5.0364 5.0364 6.5754 6.5757 6.5812 6.5818 7.1142 7.1145 7.1244 7.1256 8.2874 8.2886 8.2960 8.2979 9.5369 9.5376 9.5638 9.5653 9.9345 9.9353 9.9797 9.9818 10.9218 10.9236 10.9328 10.9348 12.1264 12.1270 12.1475 12.1481 13.0418 13.0431 13.0444 13.0449 k = 0.3191-0.0000 0.3122 ( 2908 PWs) bands (ev): -4.3101 -4.3099 -4.3092 -4.3090 -1.0249 -1.0247 -1.0224 -1.0224 4.2116 4.2119 4.2263 4.2265 5.0135 5.0140 5.0266 5.0266 6.5750 6.5751 6.5808 6.5814 7.1308 7.1311 7.1409 7.1420 8.2796 8.2807 8.2867 8.2886 9.5115 9.5121 9.5389 9.5403 9.9074 9.9081 9.9519 9.9538 10.9034 10.9051 10.9157 10.9176 12.0911 12.0917 12.1140 12.1146 13.0603 13.0614 13.0615 13.0641 k = 0.3298-0.0000 0.3122 ( 2912 PWs) bands (ev): -4.2802 -4.2799 -4.2792 -4.2790 -1.0357 -1.0355 -1.0334 -1.0334 4.1839 4.1842 4.1989 4.1991 5.0116 5.0120 5.0253 5.0253 6.5738 6.5738 6.5797 6.5803 7.1486 7.1488 7.1586 7.1595 8.2714 8.2724 8.2770 8.2788 9.4865 9.4870 9.5142 9.5154 9.8804 9.8809 9.9241 9.9259 10.8837 10.8853 10.8971 10.8989 12.0590 12.0597 12.0837 12.0843 13.0752 13.0760 13.0786 13.0808 k = 0.3404-0.0000 0.3122 ( 2908 PWs) bands (ev): -4.2508 -4.2506 -4.2497 -4.2496 -1.0468 -1.0466 -1.0445 -1.0445 4.1520 4.1523 4.1669 4.1671 5.0172 5.0176 5.0312 5.0312 6.5716 6.5717 6.5778 6.5784 7.1671 7.1673 7.1771 7.1778 8.2631 8.2639 8.2671 8.2689 9.4617 9.4622 9.4898 9.4909 9.8535 9.8539 9.8964 9.8981 10.8630 10.8646 10.8776 10.8792 12.0301 12.0308 12.0565 12.0570 13.0878 13.0885 13.0935 13.0953 k = 0.3511-0.0000 0.3122 ( 2904 PWs) bands (ev): -4.2221 -4.2219 -4.2210 -4.2209 -1.0579 -1.0577 -1.0558 -1.0557 4.1172 4.1175 4.1318 4.1320 5.0289 5.0293 5.0429 5.0429 6.5688 6.5689 6.5754 6.5760 7.1858 7.1861 7.1958 7.1963 8.2550 8.2557 8.2574 8.2591 9.4375 9.4378 9.4658 9.4668 9.8269 9.8272 9.8691 9.8706 10.8417 10.8432 10.8572 10.8588 12.0041 12.0048 12.0320 12.0326 13.0987 13.0992 13.1064 13.1078 k = 0.3617-0.0000 0.3122 ( 2896 PWs) bands (ev): -4.1944 -4.1942 -4.1932 -4.1931 -1.0691 -1.0689 -1.0670 -1.0670 4.0809 4.0811 4.0951 4.0953 5.0452 5.0456 5.0591 5.0591 6.5652 6.5654 6.5723 6.5729 7.2044 7.2046 7.2144 7.2147 8.2474 8.2480 8.2483 8.2499 9.4137 9.4140 9.4423 9.4432 9.8009 9.8011 9.8424 9.8437 10.8201 10.8215 10.8365 10.8379 11.9808 11.9815 12.0103 12.0109 13.1079 13.1083 13.1175 13.1187 k = 0.3723-0.0000 0.3122 ( 2892 PWs) bands (ev): -4.1677 -4.1675 -4.1665 -4.1664 -1.0801 -1.0799 -1.0781 -1.0781 4.0442 4.0444 4.0579 4.0581 5.0648 5.0652 5.0784 5.0784 6.5611 6.5614 6.5688 6.5693 7.2223 7.2225 7.2324 7.2325 8.2400 8.2407 8.2412 8.2416 9.3905 9.3908 9.4193 9.4201 9.7755 9.7756 9.8163 9.8175 10.7985 10.7998 10.8156 10.8170 11.9602 11.9609 11.9910 11.9916 13.1158 13.1161 13.1271 13.1280 k = 0.3830-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.1423 -4.1421 -4.1410 -4.1409 -1.0909 -1.0907 -1.0890 -1.0890 4.0081 4.0083 4.0213 4.0214 5.0866 5.0869 5.0998 5.0999 6.5565 6.5568 6.5648 6.5654 7.2392 7.2395 7.2494 7.2494 8.2329 8.2344 8.2352 8.2355 9.3680 9.3682 9.3970 9.3977 9.7511 9.7512 9.7912 9.7923 10.7773 10.7785 10.7951 10.7963 11.9419 11.9426 11.9741 11.9746 13.1226 13.1229 13.1354 13.1361 k = 0.3936-0.0000 0.3122 ( 2888 PWs) bands (ev): -4.1183 -4.1182 -4.1170 -4.1169 -1.1014 -1.1012 -1.0996 -1.0995 3.9734 3.9736 3.9861 3.9862 5.1096 5.1099 5.1224 5.1225 6.5515 6.5519 6.5606 6.5610 7.2548 7.2551 7.2650 7.2651 8.2272 8.2286 8.2309 8.2311 9.3464 9.3465 9.3756 9.3762 9.7278 9.7278 9.7672 9.7682 10.7568 10.7579 10.7751 10.7763 11.9259 11.9266 11.9592 11.9597 13.1285 13.1286 13.1426 13.1432 k = 0.4043-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.0959 -4.0958 -4.0946 -4.0945 -1.1114 -1.1112 -1.1096 -1.1096 3.9406 3.9408 3.9528 3.9529 5.1329 5.1332 5.1453 5.1454 6.5463 6.5467 6.5561 6.5565 7.2690 7.2692 7.2792 7.2794 8.2229 8.2242 8.2280 8.2282 9.3258 9.3259 9.3551 9.3556 9.7058 9.7058 9.7446 9.7455 10.7373 10.7383 10.7560 10.7571 11.9121 11.9127 11.9463 11.9468 13.1335 13.1336 13.1488 13.1493 k = 0.4149-0.0000 0.3122 ( 2886 PWs) bands (ev): -4.0754 -4.0752 -4.0739 -4.0739 -1.1207 -1.1206 -1.1191 -1.1191 3.9104 3.9105 3.9221 3.9222 5.1558 5.1561 5.1678 5.1679 6.5410 6.5414 6.5515 6.5519 7.2814 7.2816 7.2917 7.2920 8.2201 8.2213 8.2265 8.2266 9.3064 9.3064 9.3358 9.3362 9.6854 9.6854 9.7236 9.7244 10.7190 10.7200 10.7381 10.7391 11.9001 11.9006 11.9352 11.9357 13.1378 13.1379 13.1542 13.1545 k = 0.4255-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.0568 -4.0566 -4.0553 -4.0552 -1.1294 -1.1292 -1.1278 -1.1278 3.8829 3.8831 3.8943 3.8944 5.1777 5.1779 5.1893 5.1894 6.5357 6.5360 6.5469 6.5473 7.2921 7.2923 7.3025 7.3028 8.2187 8.2198 8.2262 8.2262 9.2884 9.2884 9.3179 9.3183 9.6668 9.6668 9.7045 9.7052 10.7024 10.7032 10.7216 10.7225 11.8899 11.8904 11.9258 11.9262 13.1415 13.1416 13.1588 13.1591 k = 0.4362-0.0000 0.3122 ( 2884 PWs) bands (ev): -4.0403 -4.0402 -4.0387 -4.0387 -1.1371 -1.1370 -1.1357 -1.1357 3.8587 3.8588 3.8697 3.8698 5.1980 5.1982 5.2092 5.2093 6.5305 6.5309 6.5425 6.5429 7.3010 7.3012 7.3116 7.3119 8.2185 8.2195 8.2270 8.2270 9.2720 9.2720 9.3016 9.3019 9.6502 9.6503 9.6874 9.6881 10.6874 10.6882 10.7069 10.7076 11.8813 11.8817 11.9179 11.9182 13.1446 13.1447 13.1627 13.1629 k = 0.4468-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.0260 -4.0260 -4.0245 -4.0244 -1.1440 -1.1439 -1.1426 -1.1426 3.8378 3.8379 3.8485 3.8486 5.2161 5.2163 5.2270 5.2271 6.5258 6.5261 6.5384 6.5387 7.3083 7.3084 7.3190 7.3193 8.2192 8.2200 8.2285 8.2286 9.2576 9.2576 9.2872 9.2875 9.6358 9.6358 9.6726 9.6731 10.6744 10.6750 10.6939 10.6946 11.8743 11.8746 11.9114 11.9117 13.1472 13.1472 13.1660 13.1661 k = 0.4574-0.0000 0.3122 ( 2894 PWs) bands (ev): -4.0142 -4.0141 -4.0126 -4.0126 -1.1497 -1.1496 -1.1484 -1.1484 3.8205 3.8206 3.8310 3.8311 5.2316 5.2318 5.2422 5.2423 6.5216 6.5218 6.5348 6.5350 7.3139 7.3141 7.3249 7.3252 8.2205 8.2211 8.2305 8.2306 9.2453 9.2453 9.2750 9.2752 9.6237 9.6238 9.6602 9.6606 10.6636 10.6641 10.6832 10.6837 11.8686 11.8689 11.9062 11.9064 13.1493 13.1493 13.1686 13.1687 k = 0.4681-0.0000 0.3122 ( 2904 PWs) bands (ev): -4.0049 -4.0048 -4.0033 -4.0032 -1.1542 -1.1542 -1.1530 -1.1530 3.8069 3.8070 3.8172 3.8173 5.2441 5.2442 5.2545 5.2545 6.5181 6.5183 6.5318 6.5320 7.3182 7.3183 7.3293 7.3295 8.2219 8.2225 8.2325 8.2326 9.2353 9.2353 9.2650 9.2652 9.6142 9.6142 9.6504 9.6507 10.6550 10.6553 10.6747 10.6751 11.8644 11.8646 11.9022 11.9024 13.1509 13.1509 13.1706 13.1706 k = 0.4787-0.0000 0.3122 ( 2908 PWs) bands (ev): -3.9981 -3.9981 -3.9965 -3.9965 -1.1576 -1.1575 -1.1563 -1.1563 3.7972 3.7972 3.8073 3.8074 5.2533 5.2534 5.2635 5.2635 6.5155 6.5156 6.5295 6.5297 7.3211 7.3212 7.3324 7.3325 8.2233 8.2237 8.2342 8.2343 9.2280 9.2280 9.2578 9.2579 9.6073 9.6073 9.6433 9.6435 10.6488 10.6490 10.6685 10.6688 11.8613 11.8615 11.8994 11.8996 13.1520 13.1520 13.1720 13.1720 k = 0.4894-0.0000 0.3122 ( 2912 PWs) bands (ev): -3.9941 -3.9941 -3.9924 -3.9924 -1.1596 -1.1595 -1.1584 -1.1584 3.7913 3.7913 3.8014 3.8014 5.2589 5.2590 5.2690 5.2690 6.5139 6.5140 6.5282 6.5282 7.3228 7.3228 7.3342 7.3343 8.2243 8.2245 8.2354 8.2354 9.2236 9.2236 9.2534 9.2535 9.6031 9.6032 9.6391 9.6392 10.6450 10.6451 10.6648 10.6649 11.8596 11.8596 11.8978 11.8979 13.1527 13.1527 13.1728 13.1728 k = 0.5000-0.0000 0.3122 ( 2916 PWs) bands (ev): -3.9927 -3.9927 -3.9911 -3.9911 -1.1602 -1.1602 -1.1590 -1.1590 3.7893 3.7893 3.7994 3.7994 5.2608 5.2608 5.2709 5.2709 6.5134 6.5134 6.5277 6.5277 7.3234 7.3234 7.3348 7.3348 8.2247 8.2247 8.2358 8.2358 9.2221 9.2221 9.2519 9.2519 9.6017 9.6017 9.6377 9.6377 10.6437 10.6437 10.6635 10.6635 11.8590 11.8590 11.8973 11.8973 13.1529 13.1529 13.1731 13.1731 k = 0.5000-0.0000 0.3122 ( 2916 PWs) bands (ev): -3.9927 -3.9927 -3.9911 -3.9911 -1.1602 -1.1602 -1.1590 -1.1590 3.7893 3.7893 3.7994 3.7994 5.2608 5.2608 5.2709 5.2709 6.5134 6.5134 6.5277 6.5277 7.3234 7.3234 7.3348 7.3348 8.2247 8.2247 8.2358 8.2358 9.2221 9.2221 9.2519 9.2519 9.6017 9.6017 9.6377 9.6377 10.6437 10.6437 10.6635 10.6635 11.8590 11.8590 11.8973 11.8973 13.1529 13.1529 13.1731 13.1731 k = 0.5000 0.0106 0.3122 ( 2916 PWs) bands (ev): -3.9922 -3.9921 -3.9905 -3.9905 -1.1610 -1.1606 -1.1598 -1.1594 3.7853 3.7868 3.7953 3.7966 5.2653 5.2671 5.2752 5.2770 6.5058 6.5100 6.5198 6.5243 7.3217 7.3284 7.3330 7.3394 8.2226 8.2252 8.2335 8.2363 9.2239 9.2276 9.2538 9.2573 9.6005 9.6046 9.6363 9.6406 10.6431 10.6445 10.6630 10.6640 11.8599 11.8603 11.8982 11.8985 13.1514 13.1571 13.1716 13.1772 k = 0.5000 0.0212 0.3122 ( 2916 PWs) bands (ev): -3.9906 -3.9905 -3.9889 -3.9889 -1.1628 -1.1622 -1.1618 -1.1610 3.7749 3.7777 3.7846 3.7872 5.2804 5.2838 5.2897 5.2933 6.4875 6.4957 6.5010 6.5095 7.3234 7.3339 7.3365 7.3465 8.2192 8.2240 8.2299 8.2351 9.2330 9.2403 9.2629 9.2697 9.6007 9.6090 9.6366 9.6453 10.6425 10.6454 10.6625 10.6646 11.8631 11.8638 11.9014 11.9018 13.1524 13.1638 13.1726 13.1837 k = 0.5000 0.0318 0.3122 ( 2912 PWs) bands (ev): -3.9879 -3.9877 -3.9862 -3.9861 -1.1659 -1.1650 -1.1649 -1.1637 3.7587 3.7628 3.7679 3.7717 5.3053 5.3103 5.3138 5.3190 6.4594 6.4710 6.4720 6.4842 7.3278 7.3370 7.3473 7.3558 8.2148 8.2211 8.2254 8.2322 9.2489 9.2596 9.2786 9.2886 9.6025 9.6151 9.6384 9.6516 10.6420 10.6463 10.6621 10.6652 11.8686 11.8696 11.9067 11.9074 13.1559 13.1731 13.1760 13.1927 k = 0.5000 0.0424 0.3122 ( 2912 PWs) bands (ev): -3.9842 -3.9839 -3.9824 -3.9823 -1.1701 -1.1691 -1.1689 -1.1676 3.7375 3.7428 3.7461 3.7510 5.3392 5.3455 5.3465 5.3532 6.4223 6.4342 6.4369 6.4493 7.3343 7.3419 7.3600 7.3668 8.2100 8.2169 8.2203 8.2280 9.2708 9.2846 9.3003 9.3132 9.6057 9.6229 9.6419 9.6597 10.6416 10.6474 10.6617 10.6658 11.8763 11.8777 11.9141 11.9151 13.1617 13.1816 13.1847 13.2040 k = 0.5000 0.0529 0.3122 ( 2904 PWs) bands (ev): -3.9794 -3.9790 -3.9776 -3.9775 -1.1754 -1.1745 -1.1739 -1.1727 3.7124 3.7186 3.7202 3.7260 5.3808 5.3867 5.3882 5.3946 6.3777 6.3888 6.3946 6.4061 7.3423 7.3479 7.3740 7.3789 8.2052 8.2117 8.2153 8.2228 9.2978 9.3144 9.3270 9.3428 9.6105 9.6325 9.6470 9.6696 10.6413 10.6485 10.6614 10.6664 11.8863 11.8880 11.9238 11.9250 13.1697 13.1893 13.1984 13.2173 k = 0.5000 0.0635 0.3122 ( 2900 PWs) bands (ev): -3.9735 -3.9731 -3.9718 -3.9716 -1.1819 -1.1811 -1.1801 -1.1789 3.6843 3.6913 3.6914 3.6978 5.4285 5.4329 5.4368 5.4416 6.3269 6.3374 6.3453 6.3561 7.3509 7.3545 7.3886 7.3915 8.2009 8.2060 8.2108 8.2171 9.3286 9.3480 9.3575 9.3761 9.6169 9.6440 9.6538 9.6815 10.6411 10.6496 10.6610 10.6670 11.8985 11.9006 11.9357 11.9371 13.1796 13.1988 13.2141 13.2325 k = 0.5000 0.0741 0.3122 ( 2892 PWs) bands (ev): -3.9667 -3.9662 -3.9649 -3.9647 -1.1896 -1.1889 -1.1874 -1.1863 3.6542 3.6604 3.6620 3.6676 5.4808 5.4833 5.4896 5.4924 6.2716 6.2820 6.2906 6.3011 7.3596 7.3611 7.4033 7.4041 8.1974 8.2002 8.2068 8.2117 9.3622 9.3842 9.3907 9.4122 9.6249 9.6577 9.6623 9.6955 10.6410 10.6509 10.6607 10.6677 11.9131 11.9155 11.9498 11.9514 13.1910 13.2096 13.2313 13.2490 k = 0.5000 0.0847 0.3122 ( 2892 PWs) bands (ev): -3.9588 -3.9583 -3.9570 -3.9568 -1.1984 -1.1977 -1.1959 -1.1948 3.6231 3.6284 3.6315 3.6362 5.5355 5.5357 5.5443 5.5446 6.2139 6.2247 6.2327 6.2433 7.3675 7.3680 7.4165 7.4176 8.1938 8.1959 8.2029 8.2077 9.3970 9.4220 9.4250 9.4500 9.6346 9.6726 9.6738 9.7117 10.6411 10.6522 10.6605 10.6684 11.9299 11.9326 11.9660 11.9679 13.2035 13.2213 13.2494 13.2662 k = 0.5000 0.0953 0.3122 ( 2892 PWs) bands (ev): -3.9501 -3.9494 -3.9483 -3.9480 -1.2083 -1.2077 -1.2054 -1.2044 3.5919 3.5963 3.6008 3.6045 5.5872 5.5898 5.5947 5.5975 6.1572 6.1690 6.1743 6.1855 7.3732 7.3757 7.4283 7.4314 8.1889 8.1948 8.1986 8.2060 9.4321 9.4593 9.4602 9.4882 9.6464 9.6851 9.6926 9.7304 10.6412 10.6535 10.6602 10.6690 11.9491 11.9520 11.9845 11.9866 13.2163 13.2332 13.2679 13.2836 k = 0.5000 0.1059 0.3122 ( 2892 PWs) bands (ev): -3.9404 -3.9397 -3.9386 -3.9383 -1.2192 -1.2188 -1.2161 -1.2151 3.5612 3.5648 3.5704 3.5734 5.6327 5.6371 5.6388 5.6437 6.1068 6.1201 6.1206 6.1328 7.3783 7.3826 7.4393 7.4442 8.1846 8.1947 8.1953 8.2062 9.4662 9.4922 9.4976 9.5255 9.6609 9.7000 9.7144 9.7517 10.6414 10.6550 10.6601 10.6698 11.9705 11.9737 12.0053 12.0076 13.2289 13.2446 13.2858 13.3003 k = 0.5000 0.1165 0.3122 ( 2888 PWs) bands (ev): -3.9298 -3.9291 -3.9280 -3.9277 -1.2313 -1.2310 -1.2279 -1.2269 3.5317 3.5345 3.5413 3.5434 5.6625 5.6643 5.6726 5.6751 6.0721 6.0786 6.0884 6.0933 7.3825 7.3886 7.4495 7.4561 8.1814 8.1916 8.1973 8.2081 9.4984 9.5228 9.5333 9.5603 9.6789 9.7177 9.7396 9.7759 10.6418 10.6564 10.6600 10.6705 11.9943 11.9978 12.0282 12.0308 13.2404 13.2545 13.3023 13.3151 k = 0.5000 0.1271 0.3122 ( 2896 PWs) bands (ev): -3.9185 -3.9177 -3.9167 -3.9164 -1.2444 -1.2442 -1.2406 -1.2398 3.5040 3.5060 3.5137 3.5151 5.6609 5.6709 5.6742 5.6844 6.0613 6.0657 6.0777 6.0828 7.3859 7.3936 7.4586 7.4668 8.1792 8.1896 8.2007 8.2115 9.5279 9.5502 9.5659 9.5908 9.7015 9.7387 9.7681 9.8028 10.6422 10.6579 10.6598 10.6711 12.0204 12.0240 12.0534 12.0563 13.2498 13.2621 13.3160 13.3269 k = 0.5000 0.1376 0.3122 ( 2900 PWs) bands (ev): -3.9064 -3.9056 -3.9046 -3.9043 -1.2584 -1.2584 -1.2544 -1.2536 3.4784 3.4797 3.4883 3.4890 5.6293 5.6431 5.6464 5.6605 6.0772 6.0902 6.0924 6.1063 7.3885 7.3976 7.4666 7.4764 8.1783 8.1887 8.2054 8.2161 9.5543 9.5742 9.5947 9.6161 9.7291 9.7633 9.7995 9.8323 10.6427 10.6594 10.6598 10.6719 12.0488 12.0526 12.0808 12.0840 13.2560 13.2663 13.3255 13.3343 k = 0.5000 0.1482 0.3122 ( 2908 PWs) bands (ev): -3.8936 -3.8927 -3.8918 -3.8915 -1.2735 -1.2734 -1.2691 -1.2684 3.4553 3.4559 3.4654 3.4655 5.5748 5.5879 5.5961 5.6094 6.1192 6.1319 6.1381 6.1519 7.3903 7.4008 7.4736 7.4847 8.1786 8.1891 8.2112 8.2219 9.5774 9.5948 9.6193 9.6365 9.7610 9.7914 9.8334 9.8642 10.6433 10.6598 10.6609 10.6726 12.0795 12.0833 12.1104 12.1139 13.2580 13.2660 13.3296 13.3359 k = 0.5000 0.1588 0.3122 ( 2912 PWs) bands (ev): -3.8802 -3.8793 -3.8784 -3.8781 -1.2894 -1.2892 -1.2846 -1.2839 3.4351 3.4352 3.4447 3.4455 5.5065 5.5186 5.5296 5.5418 6.1765 6.1866 6.1992 6.2107 7.3915 7.4032 7.4795 7.4918 8.1801 8.1906 8.2181 8.2286 9.5972 9.6122 9.6399 9.6530 9.7958 9.8225 9.8691 9.8979 10.6441 10.6599 10.6625 10.6734 12.1124 12.1163 12.1421 12.1460 13.2550 13.2606 13.3271 13.3309 k = 0.5000 0.1694 0.3122 ( 2916 PWs) bands (ev): -3.8663 -3.8654 -3.8645 -3.8642 -1.3061 -1.3059 -1.3009 -1.3003 3.4175 3.4182 3.4272 3.4286 5.4302 5.4414 5.4539 5.4651 6.2417 6.2495 6.2673 6.2765 7.3920 7.4048 7.4843 7.4978 8.1828 8.1932 8.2259 8.2362 9.6139 9.6267 9.6570 9.6666 9.8320 9.8557 9.9059 9.9329 10.6450 10.6601 10.6642 10.6742 12.1476 12.1514 12.1760 12.1804 13.2465 13.2495 13.3174 13.3188 k = 0.5000 0.1800 0.3122 ( 2924 PWs) bands (ev): -3.8519 -3.8510 -3.8502 -3.8498 -1.3235 -1.3231 -1.3179 -1.3174 3.4032 3.4045 3.4131 3.4150 5.3491 5.3598 5.3728 5.3834 6.3109 6.3165 6.3389 6.3462 7.3919 7.4057 7.4880 7.5025 8.1865 8.1968 8.2344 8.2445 9.6276 9.6386 9.6710 9.6781 9.8688 9.8902 9.9434 9.9689 10.6460 10.6603 10.6659 10.6750 12.1848 12.1885 12.2118 12.2168 13.2321 13.2328 13.2997 13.3005 k = 0.5000 0.1906 0.3122 ( 2928 PWs) bands (ev): -3.8372 -3.8362 -3.8355 -3.8351 -1.3414 -1.3410 -1.3354 -1.3350 3.3925 3.3944 3.4025 3.4050 5.2653 5.2756 5.2887 5.2989 6.3817 6.3855 6.4121 6.4177 7.3913 7.4061 7.4908 7.5062 8.1912 8.2013 8.2435 8.2533 9.6386 9.6480 9.6825 9.6877 9.9056 9.9255 9.9810 10.0053 10.6470 10.6606 10.6675 10.6758 12.2241 12.2277 12.2495 12.2554 13.2108 13.2121 13.2745 13.2770 k = 0.5000 0.2012 0.3122 ( 2920 PWs) bands (ev): -3.8222 -3.8212 -3.8205 -3.8201 -1.3598 -1.3593 -1.3534 -1.3531 3.3855 3.3879 3.3956 3.3986 5.1800 5.1900 5.2028 5.2127 6.4529 6.4550 6.4856 6.4897 7.3904 7.4060 7.4927 7.5088 8.1968 8.2066 8.2530 8.2625 9.6471 9.6552 9.6918 9.6958 9.9422 9.9610 10.0187 10.0419 10.6483 10.6610 10.6693 10.6767 12.2653 12.2689 12.2891 12.2960 13.1841 13.1873 13.2442 13.2482 k = 0.5000 0.2118 0.3122 ( 2916 PWs) bands (ev): -3.8070 -3.8060 -3.8053 -3.8050 -1.3785 -1.3779 -1.3717 -1.3715 3.3823 3.3852 3.3925 3.3960 5.0940 5.1037 5.1162 5.1258 6.5234 6.5239 6.5588 6.5613 7.3890 7.4054 7.4936 7.5105 8.2030 8.2125 8.2627 8.2718 9.6531 9.6602 9.6991 9.7022 9.9784 9.9965 10.0560 10.0784 10.6495 10.6614 10.6710 10.6776 12.3081 12.3120 12.3302 12.3386 13.1536 13.1582 13.2100 13.2151 k = 0.5000 0.2223 0.3122 ( 2924 PWs) bands (ev): -3.7918 -3.7908 -3.7902 -3.7898 -1.3973 -1.3967 -1.3902 -1.3900 3.3829 3.3863 3.3933 3.3972 5.0078 5.0174 5.0293 5.0388 6.5917 6.5927 6.6308 6.6318 7.3873 7.4044 7.4937 7.5112 8.2097 8.2188 8.2726 8.2813 9.6568 9.6630 9.7044 9.7069 10.0139 10.0316 10.0928 10.1145 10.6509 10.6619 10.6727 10.6785 12.3520 12.3569 12.3725 12.3828 13.1201 13.1258 13.1733 13.1792 k = 0.5000 0.2329 0.3122 ( 2916 PWs) bands (ev): -3.7766 -3.7757 -3.7751 -3.7747 -1.4161 -1.4155 -1.4087 -1.4086 3.3874 3.3913 3.3980 3.4023 4.9220 4.9314 4.9428 4.9521 6.6576 6.6602 6.7009 6.7012 7.3853 7.4030 7.4929 7.5110 8.2167 8.2254 8.2824 8.2907 9.6585 9.6639 9.7080 9.7101 10.0489 10.0663 10.1291 10.1501 10.6523 10.6624 10.6744 10.6793 12.3968 12.4037 12.4159 12.4287 13.0845 13.0912 13.1354 13.1418 k = 0.5000 0.2435 0.3122 ( 2916 PWs) bands (ev): -3.7617 -3.7607 -3.7602 -3.7598 -1.4348 -1.4341 -1.4271 -1.4270 3.3958 3.4001 3.4065 3.4113 4.8368 4.8461 4.8569 4.8661 6.7214 6.7254 6.7679 6.7697 7.3829 7.4013 7.4914 7.5099 8.2240 8.2322 8.2921 8.2999 9.6583 9.6630 9.7100 9.7118 10.0832 10.1003 10.1647 10.1850 10.6537 10.6629 10.6760 10.6801 12.4421 12.4520 12.4598 12.4761 13.0478 13.0551 13.0973 13.1041 k = 0.5000 0.2541 0.3122 ( 2916 PWs) bands (ev): -3.7471 -3.7461 -3.7457 -3.7453 -1.4531 -1.4524 -1.4452 -1.4451 3.4081 3.4128 3.4190 3.4241 4.7526 4.7618 4.7720 4.7811 6.7825 6.7880 6.8326 6.8358 7.3804 7.3993 7.4890 7.5080 8.2314 8.2391 8.3016 8.3088 9.6563 9.6605 9.7105 9.7122 10.1166 10.1334 10.1993 10.2189 10.6551 10.6633 10.6775 10.6809 12.4871 12.5015 12.5035 12.5247 13.0108 13.0184 13.0605 13.0674 k = 0.5000 0.2647 0.3122 ( 2912 PWs) bands (ev): -3.7329 -3.7320 -3.7316 -3.7312 -1.4709 -1.4702 -1.4627 -1.4627 3.4243 3.4293 3.4354 3.4408 4.6697 4.6788 4.6884 4.6974 6.8407 6.8476 6.8946 6.8992 7.3775 7.3970 7.4859 7.5052 8.2387 8.2459 8.3107 8.3174 9.6529 9.6566 9.7098 9.7113 10.1491 10.1654 10.2328 10.2516 10.6565 10.6638 10.6790 10.6817 12.5311 12.5463 12.5521 12.5742 12.9742 12.9820 13.0263 13.0333 k = 0.5000 0.2753 0.3122 ( 2904 PWs) bands (ev): -3.7194 -3.7185 -3.7181 -3.7177 -1.4880 -1.4872 -1.4795 -1.4795 3.4442 3.4495 3.4555 3.4612 4.5884 4.5974 4.6064 4.6153 6.8956 6.9039 6.9536 6.9596 7.3744 7.3943 7.4820 7.5016 8.2459 8.2525 8.3193 8.3255 9.6484 9.6516 9.7080 9.7093 10.1803 10.1962 10.2650 10.2829 10.6579 10.6643 10.6804 10.6824 12.5727 12.5865 12.6030 12.6240 12.9391 12.9469 12.9966 13.0036 k = 0.5000 0.2859 0.3122 ( 2900 PWs) bands (ev): -3.7066 -3.7057 -3.7054 -3.7050 -1.5041 -1.5034 -1.4955 -1.4955 3.4678 3.4734 3.4794 3.4854 4.5089 4.5177 4.5261 4.5350 6.9469 6.9565 7.0094 7.0168 7.3710 7.3913 7.4772 7.4971 8.2527 8.2587 8.3274 8.3331 9.6429 9.6457 9.7053 9.7065 10.2100 10.2252 10.2956 10.3124 10.6593 10.6647 10.6816 10.6831 12.6096 12.6221 12.6535 12.6734 12.9066 12.9141 12.9737 12.9806 k = 0.5000 0.2965 0.3122 ( 2900 PWs) bands (ev): -3.6946 -3.6938 -3.6936 -3.6932 -1.5192 -1.5185 -1.5104 -1.5104 3.4949 3.5009 3.5068 3.5131 4.4314 4.4402 4.4480 4.4567 6.9943 7.0053 7.0617 7.0704 7.3674 7.3878 7.4716 7.4915 8.2592 8.2645 8.3349 8.3400 9.6369 9.6393 9.7019 9.7031 10.2380 10.2524 10.3242 10.3399 10.6605 10.6651 10.6827 10.6836 12.6393 12.6503 12.7017 12.7203 12.8786 12.8858 12.9606 12.9675 k = 0.5000 0.3070 0.3122 ( 2912 PWs) bands (ev): -3.6837 -3.6829 -3.6828 -3.6824 -1.5330 -1.5324 -1.5241 -1.5240 3.5255 3.5316 3.5377 3.5441 4.3563 4.3649 4.3722 4.3808 7.0377 7.0498 7.1103 7.1202 7.3634 7.3839 7.4649 7.4848 8.2651 8.2698 8.3418 8.3462 9.6305 9.6325 9.6982 9.6992 10.2639 10.2772 10.3506 10.3650 10.6616 10.6654 10.6837 10.6841 12.6590 12.6684 12.7424 12.7590 12.8604 12.8679 12.9599 12.9668 k = 0.5000 0.3176 0.3122 ( 2912 PWs) bands (ev): -3.6739 -3.6731 -3.6731 -3.6727 -1.5453 -1.5448 -1.5363 -1.5363 3.5591 3.5654 3.5717 3.5783 4.2840 4.2923 4.2991 4.3075 7.0769 7.0897 7.1550 7.1661 7.3593 7.3795 7.4572 7.4771 8.2704 8.2745 8.3478 8.3517 9.6242 9.6259 9.6943 9.6952 10.2875 10.2995 10.3746 10.3874 10.6627 10.6657 10.6845 10.6846 12.6679 12.6756 12.7626 12.7749 12.8649 12.8745 12.9724 12.9791 k = 0.5000 0.3282 0.3122 ( 2916 PWs) bands (ev): -3.6654 -3.6647 -3.6647 -3.6643 -1.5561 -1.5556 -1.5470 -1.5469 3.5955 3.6019 3.6085 3.6152 4.2148 4.2229 4.2292 4.2374 7.1116 7.1248 7.1956 7.2078 7.3551 7.3745 7.4486 7.4680 8.2751 8.2785 8.3531 8.3563 9.6182 9.6196 9.6906 9.6913 10.3084 10.3189 10.3957 10.4068 10.6637 10.6659 10.6851 10.6852 12.6680 12.6742 12.7585 12.7670 12.8954 12.9065 12.9955 13.0018 k = 0.5000 0.3388 0.3122 ( 2920 PWs) bands (ev): -3.6583 -3.6577 -3.6576 -3.6572 -1.5651 -1.5647 -1.5559 -1.5558 3.6339 3.6403 3.6475 3.6542 4.1496 4.1573 4.1632 4.1710 7.1416 7.1546 7.2321 7.2449 7.3510 7.3690 7.4390 7.4577 8.2791 8.2818 8.3576 8.3601 9.6130 9.6141 9.6872 9.6878 10.3262 10.3349 10.4136 10.4229 10.6645 10.6661 10.6855 10.6858 12.6631 12.6680 12.7459 12.7522 12.9353 12.9458 13.0245 13.0302 k = 0.5000 0.3494 0.3122 ( 2924 PWs) bands (ev): -3.6526 -3.6522 -3.6519 -3.6517 -1.5722 -1.5719 -1.5630 -1.5629 3.6732 3.6793 3.6875 3.6939 4.0897 4.0968 4.1025 4.1097 7.1666 7.1784 7.2640 7.2768 7.3475 7.3630 7.4288 7.4461 8.2823 8.2844 8.3611 8.3631 9.6086 9.6094 9.6844 9.6848 10.3407 10.3475 10.4282 10.4353 10.6652 10.6663 10.6859 10.6862 12.6566 12.6602 12.7334 12.7380 12.9744 12.9834 13.0547 13.0594 k = 0.5000 0.3600 0.3122 ( 2920 PWs) bands (ev): -3.6484 -3.6481 -3.6478 -3.6476 -1.5773 -1.5771 -1.5681 -1.5680 3.7110 3.7163 3.7261 3.7317 4.0379 4.0439 4.0497 4.0558 7.1863 7.1955 7.2908 7.3024 7.3452 7.3570 7.4192 7.4338 8.2848 8.2861 8.3638 8.3651 9.6054 9.6059 9.6822 9.6825 10.3516 10.3563 10.4392 10.4440 10.6657 10.6664 10.6862 10.6865 12.6507 12.6531 12.7239 12.7269 13.0077 13.0143 13.0815 13.0849 k = 0.5000 0.3706 0.3122 ( 2920 PWs) bands (ev): -3.6459 -3.6458 -3.6453 -3.6452 -1.5804 -1.5803 -1.5712 -1.5712 3.7418 3.7452 3.7579 3.7615 4.0002 4.0039 4.0109 4.0148 7.1998 7.2050 7.3110 7.3186 7.3450 7.3514 7.4128 7.4219 8.2864 8.2871 8.3655 8.3662 9.6034 9.6037 9.6809 9.6811 10.3588 10.3611 10.4464 10.4488 10.6661 10.6664 10.6865 10.6866 12.6470 12.6482 12.7182 12.7197 13.0309 13.0345 13.1005 13.1023 k = 0.5000 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6450 -3.6450 -3.6445 -3.6445 -1.5814 -1.5814 -1.5722 -1.5722 3.7557 3.7557 3.7724 3.7724 3.9868 3.9868 3.9971 3.9971 7.2064 7.2064 7.3216 7.3216 7.3471 7.3471 7.4136 7.4136 8.2871 8.2871 8.3663 8.3663 9.6028 9.6028 9.6806 9.6806 10.3620 10.3620 10.4496 10.4496 10.6663 10.6663 10.6866 10.6866 12.6460 12.6460 12.7167 12.7167 13.0404 13.0404 13.1080 13.1080 k = 0.5000 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6450 -3.6450 -3.6445 -3.6445 -1.5814 -1.5814 -1.5722 -1.5722 3.7557 3.7557 3.7724 3.7724 3.9868 3.9868 3.9971 3.9971 7.2064 7.2064 7.3216 7.3216 7.3471 7.3471 7.4136 7.4136 8.2871 8.2871 8.3663 8.3663 9.6028 9.6028 9.6806 9.6806 10.3620 10.3620 10.4496 10.4496 10.6663 10.6663 10.6866 10.6866 12.6460 12.6460 12.7167 12.7167 13.0404 13.0404 13.1080 13.1080 k = 0.4894 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6456 -3.6456 -3.6450 -3.6450 -1.5828 -1.5828 -1.5736 -1.5736 3.7574 3.7574 3.7742 3.7742 3.9888 3.9888 3.9990 3.9990 7.2065 7.2065 7.3216 7.3216 7.3474 7.3474 7.4139 7.4139 8.2875 8.2875 8.3666 8.3666 9.6028 9.6028 9.6804 9.6804 10.3620 10.3620 10.4496 10.4496 10.6657 10.6657 10.6859 10.6859 12.6466 12.6466 12.7168 12.7168 13.0422 13.0422 13.1092 13.1092 k = 0.4787 0.3812 0.3122 ( 2924 PWs) bands (ev): -3.6473 -3.6473 -3.6467 -3.6467 -1.5870 -1.5870 -1.5779 -1.5779 3.7625 3.7625 3.7793 3.7793 3.9945 3.9945 4.0047 4.0047 7.2070 7.2070 7.3216 7.3216 7.3481 7.3481 7.4146 7.4146 8.2885 8.2885 8.3674 8.3674 9.6029 9.6029 9.6800 9.6800 10.3622 10.3622 10.4495 10.4495 10.6639 10.6639 10.6840 10.6840 12.6484 12.6484 12.7169 12.7169 13.0476 13.0476 13.1129 13.1129 k = 0.4681 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6501 -3.6501 -3.6496 -3.6496 -1.5940 -1.5940 -1.5849 -1.5849 3.7709 3.7709 3.7878 3.7878 4.0041 4.0041 4.0142 4.0142 7.2080 7.2080 7.3218 7.3218 7.3492 7.3492 7.4157 7.4157 8.2903 8.2903 8.3688 8.3688 9.6029 9.6029 9.6793 9.6793 10.3627 10.3627 10.4494 10.4494 10.6609 10.6609 10.6808 10.6808 12.6513 12.6513 12.7170 12.7170 13.0566 13.0566 13.1192 13.1192 k = 0.4574 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6541 -3.6541 -3.6536 -3.6536 -1.6037 -1.6037 -1.5946 -1.5946 3.7827 3.7827 3.7997 3.7997 4.0173 4.0173 4.0272 4.0272 7.2094 7.2094 7.3221 7.3221 7.3506 7.3506 7.4172 7.4172 8.2929 8.2929 8.3709 8.3709 9.6027 9.6027 9.6781 9.6781 10.3632 10.3632 10.4492 10.4492 10.6568 10.6568 10.6765 10.6765 12.6551 12.6551 12.7172 12.7172 13.0691 13.0691 13.1280 13.1280 k = 0.4468 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6592 -3.6592 -3.6586 -3.6586 -1.6160 -1.6160 -1.6070 -1.6070 3.7978 3.7978 3.8149 3.8149 4.0340 4.0340 4.0437 4.0437 7.2115 7.2115 7.3227 7.3227 7.3523 7.3523 7.4190 7.4190 8.2964 8.2964 8.3738 8.3738 9.6024 9.6024 9.6766 9.6766 10.3638 10.3638 10.4490 10.4490 10.6517 10.6517 10.6710 10.6710 12.6597 12.6597 12.7175 12.7175 13.0849 13.0849 13.1394 13.1394 k = 0.4362 0.3812 0.3122 ( 2916 PWs) bands (ev): -3.6653 -3.6653 -3.6647 -3.6647 -1.6308 -1.6308 -1.6219 -1.6219 3.8161 3.8161 3.8334 3.8334 4.0540 4.0540 4.0635 4.0635 7.2144 7.2144 7.3239 7.3239 7.3542 7.3542 7.4209 7.4209 8.3010 8.3010 8.3775 8.3775 9.6018 9.6018 9.6745 9.6745 10.3646 10.3646 10.4488 10.4488 10.6457 10.6457 10.6647 10.6647 12.6650 12.6650 12.7177 12.7177 13.1039 13.1039 13.1534 13.1534 k = 0.4255 0.3812 0.3122 ( 2916 PWs) bands (ev): -3.6724 -3.6724 -3.6719 -3.6719 -1.6480 -1.6480 -1.6392 -1.6392 3.8376 3.8376 3.8551 3.8551 4.0770 4.0770 4.0862 4.0862 7.2183 7.2183 7.3259 7.3259 7.3561 7.3561 7.4227 7.4227 8.3068 8.3068 8.3823 8.3823 9.6008 9.6008 9.6718 9.6718 10.3656 10.3656 10.4485 10.4485 10.6390 10.6390 10.6576 10.6576 12.6706 12.6706 12.7179 12.7179 13.1261 13.1261 13.1700 13.1700 k = 0.4149 0.3812 0.3122 ( 2908 PWs) bands (ev): -3.6805 -3.6805 -3.6800 -3.6800 -1.6674 -1.6674 -1.6588 -1.6588 3.8623 3.8623 3.8800 3.8800 4.1027 4.1027 4.1115 4.1115 7.2236 7.2236 7.3289 7.3289 7.3578 7.3578 7.4243 7.4243 8.3139 8.3139 8.3882 8.3882 9.5993 9.5993 9.6685 9.6685 10.3667 10.3667 10.4482 10.4482 10.6318 10.6318 10.6499 10.6499 12.6764 12.6764 12.7181 12.7181 13.1511 13.1511 13.1892 13.1892 k = 0.4043 0.3812 0.3122 ( 2916 PWs) bands (ev): -3.6895 -3.6895 -3.6890 -3.6890 -1.6890 -1.6890 -1.6804 -1.6804 3.8899 3.8899 3.9079 3.9079 4.1308 4.1308 4.1392 4.1392 7.2304 7.2304 7.3331 7.3331 7.3591 7.3591 7.4255 7.4255 8.3226 8.3226 8.3955 8.3955 9.5972 9.5972 9.6642 9.6642 10.3678 10.3678 10.4478 10.4478 10.6239 10.6239 10.6415 10.6415 12.6822 12.6822 12.7181 12.7181 13.1788 13.1788 13.2108 13.2108 k = 0.3936 0.3812 0.3122 ( 2916 PWs) bands (ev): -3.6994 -3.6994 -3.6989 -3.6989 -1.7124 -1.7124 -1.7040 -1.7040 3.9206 3.9206 3.9388 3.9388 4.1610 4.1610 4.1689 4.1689 7.2391 7.2391 7.3390 7.3390 7.3599 7.3599 7.4260 7.4260 8.3331 8.3331 8.4043 8.4043 9.5942 9.5942 9.6592 9.6592 10.3691 10.3691 10.4474 10.4474 10.6157 10.6157 10.6327 10.6327 12.6878 12.6878 12.7180 12.7180 13.2088 13.2088 13.2346 13.2346 k = 0.3830 0.3812 0.3122 ( 2916 PWs) bands (ev): -3.7102 -3.7102 -3.7097 -3.7097 -1.7376 -1.7376 -1.7294 -1.7294 3.9540 3.9540 3.9725 3.9725 4.1928 4.1928 4.2002 4.2002 7.2499 7.2499 7.3469 7.3469 7.3600 7.3600 7.4257 7.4257 8.3455 8.3455 8.4149 8.4149 9.5905 9.5905 9.6532 9.6532 10.3704 10.3704 10.4470 10.4470 10.6072 10.6072 10.6238 10.6238 12.6929 12.6929 12.7176 12.7176 13.2397 13.2397 13.2577 13.2578 k = 0.3723 0.3812 0.3122 ( 2924 PWs) bands (ev): -3.7217 -3.7217 -3.7212 -3.7212 -1.7644 -1.7644 -1.7563 -1.7563 3.9902 3.9902 4.0091 4.0091 4.2259 4.2259 4.2327 4.2327 7.2632 7.2632 7.3563 7.3563 7.3597 7.3597 7.4244 7.4244 8.3601 8.3601 8.4274 8.4274 9.5857 9.5857 9.6461 9.6461 10.3718 10.3718 10.4465 10.4465 10.5987 10.5987 10.6146 10.6146 12.6974 12.6974 12.7170 12.7170 13.2384 13.2384 13.2730 13.2730 k = 0.3617 0.3812 0.3122 ( 2924 PWs) bands (ev): -3.7338 -3.7338 -3.7334 -3.7334 -1.7925 -1.7925 -1.7846 -1.7846 4.0291 4.0291 4.0482 4.0482 4.2598 4.2598 4.2660 4.2660 7.2792 7.2792 7.3569 7.3569 7.3699 7.3699 7.4220 7.4220 8.3770 8.3770 8.4420 8.4420 9.5799 9.5799 9.6380 9.6380 10.3733 10.3733 10.4460 10.4460 10.5902 10.5902 10.6055 10.6055 12.7013 12.7013 12.7161 12.7161 13.2039 13.2039 13.2533 13.2533 k = 0.3511 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.7466 -3.7466 -3.7462 -3.7462 -1.8219 -1.8219 -1.8142 -1.8142 4.0704 4.0704 4.0899 4.0899 4.2942 4.2942 4.2996 4.2996 7.2981 7.2981 7.3539 7.3539 7.3849 7.3849 7.4187 7.4187 8.3963 8.3963 8.4590 8.4590 9.5730 9.5730 9.6287 9.6287 10.3747 10.3747 10.4454 10.4454 10.5817 10.5817 10.5964 10.5964 12.7042 12.7042 12.7149 12.7149 13.1662 13.1662 13.2166 13.2166 k = 0.3404 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.7600 -3.7600 -3.7595 -3.7595 -1.8522 -1.8522 -1.8447 -1.8447 4.1141 4.1141 4.1341 4.1341 4.3286 4.3286 4.3333 4.3333 7.3194 7.3194 7.3504 7.3504 7.3995 7.3995 7.4176 7.4176 8.4183 8.4183 8.4783 8.4783 9.5650 9.5650 9.6184 9.6184 10.3761 10.3761 10.4447 10.4447 10.5733 10.5733 10.5874 10.5874 12.7062 12.7062 12.7134 12.7134 13.1271 13.1271 13.1780 13.1780 k = 0.3298 0.3812 0.3122 ( 2932 PWs) bands (ev): -3.7738 -3.7738 -3.7734 -3.7734 -1.8834 -1.8834 -1.8761 -1.8761 4.1601 4.1601 4.1805 4.1805 4.3627 4.3627 4.3665 4.3665 7.3345 7.3345 7.3553 7.3553 7.4002 7.4002 7.4325 7.4325 8.4429 8.4429 8.5001 8.5001 9.5559 9.5559 9.6070 9.6070 10.3774 10.3774 10.4438 10.4438 10.5650 10.5650 10.5785 10.5785 12.7067 12.7067 12.7119 12.7119 13.0872 13.0872 13.1386 13.1386 k = 0.3191 0.3812 0.3122 ( 2932 PWs) bands (ev): -3.7881 -3.7881 -3.7876 -3.7876 -1.9152 -1.9152 -1.9082 -1.9082 4.2082 4.2082 4.2291 4.2291 4.3960 4.3960 4.3989 4.3989 7.3302 7.3302 7.3803 7.3804 7.3935 7.3935 7.4581 7.4581 8.4701 8.4701 8.5245 8.5245 9.5457 9.5457 9.5946 9.5946 10.3786 10.3786 10.4428 10.4428 10.5568 10.5569 10.5698 10.5698 12.7054 12.7054 12.7105 12.7105 13.0470 13.0470 13.0988 13.0988 k = 0.3085 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.8027 -3.8027 -3.8022 -3.8022 -1.9476 -1.9476 -1.9407 -1.9407 4.2583 4.2583 4.2796 4.2796 4.4282 4.4282 4.4302 4.4302 7.3206 7.3206 7.3799 7.3799 7.4171 7.4171 7.4890 7.4890 8.5001 8.5001 8.5515 8.5515 9.5345 9.5345 9.5812 9.5812 10.3797 10.3797 10.4416 10.4416 10.5489 10.5489 10.5612 10.5612 12.7025 12.7025 12.7090 12.7090 13.0067 13.0067 13.0592 13.0592 k = 0.2979 0.3812 0.3122 ( 2936 PWs) bands (ev): -3.8175 -3.8175 -3.8171 -3.8171 -1.9802 -1.9802 -1.9735 -1.9735 4.3103 4.3103 4.3321 4.3321 4.4590 4.4590 4.4600 4.4600 7.3086 7.3086 7.3670 7.3670 7.4560 7.4560 7.5246 7.5246 8.5326 8.5326 8.5811 8.5811 9.5222 9.5222 9.5669 9.5669 10.3804 10.3804 10.4400 10.4400 10.5409 10.5409 10.5526 10.5526 12.6984 12.6984 12.7068 12.7068 12.9670 12.9670 13.0200 13.0200 k = 0.2872 0.3812 0.3122 ( 2936 PWs) bands (ev): -3.8326 -3.8326 -3.8322 -3.8322 -2.0130 -2.0130 -2.0066 -2.0066 4.3639 4.3639 4.3862 4.3862 4.4880 4.4881 4.4882 4.4882 7.2944 7.2944 7.3518 7.3518 7.5000 7.5000 7.5649 7.5649 8.5677 8.5677 8.6132 8.6132 9.5091 9.5091 9.5519 9.5519 10.3808 10.3808 10.4381 10.4381 10.5330 10.5330 10.5442 10.5442 12.6935 12.6935 12.7036 12.7036 12.9280 12.9280 12.9817 12.9817 k = 0.2766 0.3812 0.3122 ( 2924 PWs) bands (ev): -3.8477 -3.8477 -3.8474 -3.8474 -2.0458 -2.0458 -2.0396 -2.0396 4.4191 4.4191 4.4419 4.4419 4.5144 4.5144 4.5153 4.5153 7.2783 7.2783 7.3346 7.3346 7.5488 7.5488 7.6100 7.6100 8.6053 8.6053 8.6478 8.6478 9.4952 9.4952 9.5361 9.5361 10.3809 10.3809 10.4358 10.4358 10.5252 10.5252 10.5358 10.5358 12.6876 12.6876 12.6992 12.6992 12.8904 12.8904 12.9448 12.9448 k = 0.2660 0.3812 0.3122 ( 2932 PWs) bands (ev): -3.8630 -3.8629 -3.8626 -3.8626 -2.0784 -2.0784 -2.0724 -2.0724 4.4757 4.4757 4.4989 4.4989 4.5386 4.5386 4.5406 4.5406 7.2601 7.2601 7.3153 7.3153 7.6023 7.6023 7.6598 7.6598 8.6450 8.6450 8.6847 8.6847 9.4806 9.4806 9.5198 9.5198 10.3803 10.3803 10.4328 10.4328 10.5170 10.5170 10.5272 10.5272 12.6808 12.6808 12.6936 12.6936 12.8544 12.8544 12.9094 12.9094 k = 0.2553 0.3812 0.3122 ( 2940 PWs) bands (ev): -3.8782 -3.8782 -3.8778 -3.8778 -2.1108 -2.1108 -2.1050 -2.1050 4.5333 4.5333 4.5556 4.5556 4.5611 4.5611 4.5650 4.5650 7.2400 7.2400 7.2942 7.2942 7.6605 7.6605 7.7145 7.7145 8.6868 8.6868 8.7237 8.7237 9.4654 9.4654 9.5030 9.5030 10.3791 10.3791 10.4291 10.4291 10.5087 10.5087 10.5184 10.5185 12.6729 12.6730 12.6866 12.6866 12.8206 12.8206 12.8761 12.8761 k = 0.2447 0.3812 0.3122 ( 2932 PWs) bands (ev): -3.8933 -3.8933 -3.8930 -3.8930 -2.1427 -2.1427 -2.1371 -2.1371 4.5792 4.5792 4.5831 4.5831 4.5938 4.5938 4.6177 4.6177 7.2180 7.2180 7.2712 7.2712 7.7233 7.7233 7.7738 7.7738 8.7305 8.7305 8.7647 8.7647 9.4498 9.4498 9.4859 9.4859 10.3772 10.3772 10.4249 10.4249 10.5001 10.5001 10.5095 10.5095 12.6641 12.6642 12.6784 12.6784 12.7893 12.7893 12.8453 12.8453 k = 0.2340 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.9083 -3.9083 -3.9079 -3.9079 -2.1740 -2.1740 -2.1688 -2.1688 4.5975 4.5975 4.6018 4.6018 4.6530 4.6530 4.6780 4.6780 7.1943 7.1943 7.2466 7.2466 7.7905 7.7905 7.8376 7.8376 8.7758 8.7758 8.8076 8.8076 9.4339 9.4339 9.4687 9.4687 10.3745 10.3745 10.4197 10.4197 10.4909 10.4909 10.5002 10.5002 12.6543 12.6543 12.6688 12.6688 12.7610 12.7610 12.8173 12.8173 k = 0.2234 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.9230 -3.9230 -3.9227 -3.9227 -2.2048 -2.2048 -2.1997 -2.1997 4.6129 4.6129 4.6179 4.6179 4.7137 4.7137 4.7392 4.7392 7.1689 7.1689 7.2202 7.2202 7.8618 7.8618 7.9057 7.9057 8.8225 8.8225 8.8519 8.8519 9.4179 9.4179 9.4514 9.4514 10.3709 10.3709 10.4135 10.4135 10.4811 10.4812 10.4903 10.4903 12.6434 12.6434 12.6579 12.6579 12.7359 12.7359 12.7923 12.7923 k = 0.2128 0.3812 0.3122 ( 2928 PWs) bands (ev): -3.9375 -3.9375 -3.9372 -3.9372 -2.2347 -2.2347 -2.2299 -2.2299 4.6263 4.6263 4.6318 4.6318 4.7750 4.7750 4.8012 4.8012 7.1418 7.1418 7.1923 7.1923 7.9370 7.9370 7.9779 7.9779 8.8704 8.8704 8.8975 8.8975 9.4018 9.4018 9.4342 9.4342 10.3663 10.3663 10.4063 10.4063 10.4706 10.4706 10.4799 10.4799 12.6316 12.6316 12.6457 12.6457 12.7144 12.7144 12.7708 12.7708 k = 0.2021 0.3812 0.3122 ( 2932 PWs) bands (ev): -3.9517 -3.9517 -3.9514 -3.9514 -2.2638 -2.2638 -2.2592 -2.2592 4.6376 4.6376 4.6436 4.6436 4.8369 4.8369 4.8636 4.8636 7.1132 7.1132 7.1629 7.1629 8.0157 8.0157 8.0538 8.0538 8.9191 8.9191 8.9442 8.9442 9.3857 9.3857 9.4172 9.4172 10.3605 10.3605 10.3978 10.3978 10.4592 10.4592 10.4687 10.4687 12.6188 12.6188 12.6325 12.6325 12.6965 12.6965 12.7528 12.7528 k = 0.1915 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.9654 -3.9654 -3.9652 -3.9652 -2.2919 -2.2919 -2.2875 -2.2875 4.6471 4.6471 4.6535 4.6535 4.8991 4.8991 4.9263 4.9263 7.0833 7.0833 7.1321 7.1321 8.0976 8.0976 8.1330 8.1330 8.9684 8.9684 8.9916 8.9916 9.3699 9.3699 9.4007 9.4007 10.3535 10.3535 10.3881 10.3881 10.4469 10.4469 10.4567 10.4567 12.6051 12.6051 12.6186 12.6186 12.6824 12.6824 12.7388 12.7388 k = 0.1809 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.9788 -3.9788 -3.9785 -3.9785 -2.3189 -2.3189 -2.3148 -2.3148 4.6548 4.6548 4.6616 4.6616 4.9615 4.9615 4.9891 4.9891 7.0520 7.0520 7.1000 7.1000 8.1821 8.1821 8.2152 8.2152 9.0179 9.0179 9.0395 9.0395 9.3545 9.3545 9.3847 9.3847 10.3452 10.3452 10.3768 10.3768 10.4333 10.4333 10.4437 10.4437 12.5907 12.5907 12.6041 12.6041 12.6720 12.6720 12.7287 12.7287 k = 0.1702 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.9916 -3.9916 -3.9914 -3.9914 -2.3448 -2.3448 -2.3409 -2.3409 4.6611 4.6611 4.6680 4.6680 5.0238 5.0238 5.0519 5.0519 7.0194 7.0194 7.0666 7.0666 8.2690 8.2690 8.3000 8.3000 9.0675 9.0675 9.0876 9.0876 9.3396 9.3396 9.3693 9.3693 10.3355 10.3355 10.3641 10.3641 10.4184 10.4185 10.4296 10.4296 12.5755 12.5755 12.5890 12.5890 12.6656 12.6656 12.7228 12.7228 k = 0.1596 0.3812 0.3122 ( 2916 PWs) bands (ev): -4.0039 -4.0039 -4.0037 -4.0037 -2.3695 -2.3695 -2.3658 -2.3658 4.6660 4.6660 4.6729 4.6729 5.0860 5.0860 5.1144 5.1144 6.9859 6.9859 7.0322 7.0322 8.3575 8.3576 8.3868 8.3868 9.1168 9.1168 9.1356 9.1356 9.3255 9.3255 9.3549 9.3549 10.3243 10.3243 10.3497 10.3497 10.4023 10.4023 10.4144 10.4144 12.5597 12.5597 12.5732 12.5732 12.6636 12.6636 12.7210 12.7210 k = 0.1489 0.3812 0.3122 ( 2916 PWs) bands (ev): -4.0156 -4.0156 -4.0154 -4.0154 -2.3928 -2.3928 -2.3895 -2.3895 4.6697 4.6697 4.6766 4.6766 5.1477 5.1477 5.1765 5.1765 6.9514 6.9514 6.9968 6.9968 8.4473 8.4473 8.4751 8.4751 9.1653 9.1653 9.1830 9.1830 9.3122 9.3122 9.3416 9.3416 10.3116 10.3116 10.3335 10.3335 10.3847 10.3847 10.3980 10.3980 12.5432 12.5432 12.5567 12.5567 12.6661 12.6661 12.7235 12.7235 k = 0.1383 0.3812 0.3122 ( 2916 PWs) bands (ev): -4.0267 -4.0267 -4.0265 -4.0265 -2.4149 -2.4149 -2.4117 -2.4117 4.6724 4.6724 4.6792 4.6792 5.2088 5.2088 5.2378 5.2378 6.9161 6.9161 6.9606 6.9606 8.5377 8.5377 8.5644 8.5644 9.2122 9.2122 9.2294 9.2294 9.3006 9.3006 9.3299 9.3299 10.2973 10.2973 10.3154 10.3154 10.3656 10.3656 10.3805 10.3805 12.5262 12.5262 12.5394 12.5394 12.6732 12.6732 12.7300 12.7300 k = 0.1277 0.3812 0.3122 ( 2908 PWs) bands (ev): -4.0371 -4.0371 -4.0370 -4.0370 -2.4355 -2.4355 -2.4326 -2.4326 4.6742 4.6742 4.6808 4.6808 5.2690 5.2690 5.2982 5.2982 6.8802 6.8802 6.9237 6.9237 8.6280 8.6280 8.6542 8.6542 9.2537 9.2537 9.2726 9.2726 9.2945 9.2945 9.3218 9.3218 10.2812 10.2812 10.2952 10.2952 10.3451 10.3452 10.3618 10.3618 12.5090 12.5090 12.5217 12.5217 12.6847 12.6847 12.7404 12.7404 k = 0.1170 0.3812 0.3122 ( 2912 PWs) bands (ev): -4.0469 -4.0469 -4.0467 -4.0467 -2.4546 -2.4546 -2.4520 -2.4520 4.6753 4.6753 4.6816 4.6816 5.3282 5.3282 5.3573 5.3573 6.8440 6.8440 6.8862 6.8862 8.7172 8.7172 8.7436 8.7436 9.2674 9.2674 9.2976 9.2976 9.3160 9.3160 9.3326 9.3326 10.2629 10.2629 10.2728 10.2728 10.3235 10.3235 10.3423 10.3423 12.4915 12.4915 12.5036 12.5036 12.7001 12.7001 12.7542 12.7542 k = 0.1064 0.3812 0.3122 ( 2900 PWs) bands (ev): -4.0558 -4.0558 -4.0557 -4.0557 -2.4722 -2.4722 -2.4698 -2.4698 4.6759 4.6759 4.6819 4.6819 5.3859 5.3859 5.4147 5.4147 6.8078 6.8078 6.8486 6.8486 8.8045 8.8045 8.8319 8.8319 9.2620 9.2620 9.2967 9.2967 9.3564 9.3564 9.3705 9.3705 10.2420 10.2420 10.2485 10.2485 10.3011 10.3011 10.3221 10.3221 12.4742 12.4742 12.4855 12.4855 12.7191 12.7191 12.7709 12.7709 k = 0.0957 0.3812 0.3122 ( 2900 PWs) bands (ev): -4.0641 -4.0641 -4.0639 -4.0639 -2.4883 -2.4883 -2.4861 -2.4861 4.6761 4.6761 4.6816 4.6816 5.4418 5.4418 5.4702 5.4702 6.7718 6.7718 6.8109 6.8109 8.8882 8.8882 8.9179 8.9179 9.2561 9.2561 9.2943 9.2943 9.3978 9.3978 9.4110 9.4110 10.2169 10.2169 10.2227 10.2228 10.2786 10.2786 10.3014 10.3014 12.4573 12.4573 12.4677 12.4677 12.7409 12.7409 12.7900 12.7900 k = 0.0851 0.3812 0.3122 ( 2892 PWs) bands (ev): -4.0715 -4.0715 -4.0714 -4.0714 -2.5028 -2.5028 -2.5009 -2.5009 4.6759 4.6759 4.6810 4.6810 5.4955 5.4955 5.5231 5.5231 6.7365 6.7365 6.7737 6.7737 8.9660 8.9660 8.9995 8.9995 9.2532 9.2532 9.2962 9.2962 9.4377 9.4377 9.4502 9.4502 10.1875 10.1876 10.1953 10.1953 10.2568 10.2568 10.2806 10.2806 12.4410 12.4411 12.4505 12.4505 12.7648 12.7648 12.8107 12.8107 k = 0.0745 0.3812 0.3122 ( 2884 PWs) bands (ev): -4.0781 -4.0781 -4.0780 -4.0780 -2.5156 -2.5156 -2.5139 -2.5139 4.6756 4.6756 4.6801 4.6801 5.5465 5.5465 5.5730 5.5730 6.7025 6.7025 6.7374 6.7374 9.0344 9.0344 9.0727 9.0727 9.2570 9.2570 9.3057 9.3057 9.4752 9.4752 9.4870 9.4870 10.1549 10.1549 10.1649 10.1649 10.2364 10.2364 10.2601 10.2601 12.4258 12.4258 12.4343 12.4343 12.7901 12.7901 12.8321 12.8321 k = 0.0638 0.3812 0.3122 ( 2888 PWs) bands (ev): -4.0839 -4.0839 -4.0838 -4.0838 -2.5268 -2.5268 -2.5253 -2.5253 4.6752 4.6752 4.6791 4.6791 5.5942 5.5942 5.6189 5.6189 6.6704 6.6704 6.7024 6.7024 9.0885 9.0885 9.1288 9.1288 9.2754 9.2754 9.3267 9.3267 9.5100 9.5100 9.5210 9.5210 10.1198 10.1198 10.1313 10.1313 10.2176 10.2176 10.2401 10.2401 12.4118 12.4118 12.4192 12.4192 12.8156 12.8156 12.8531 12.8531 k = 0.0532 0.3812 0.3122 ( 2892 PWs) bands (ev): -4.0888 -4.0888 -4.0887 -4.0887 -2.5362 -2.5362 -2.5350 -2.5350 4.6747 4.6747 4.6780 4.6780 5.6378 5.6378 5.6602 5.6602 6.6411 6.6411 6.6695 6.6695 9.1251 9.1251 9.1591 9.1592 9.3161 9.3161 9.3615 9.3615 9.5417 9.5417 9.5517 9.5517 10.0827 10.0827 10.0951 10.0951 10.2008 10.2008 10.2212 10.2212 12.3994 12.3994 12.4057 12.4057 12.8404 12.8404 12.8728 12.8728 k = 0.0426 0.3812 0.3122 ( 2888 PWs) bands (ev): -4.0928 -4.0928 -4.0928 -4.0928 -2.5440 -2.5440 -2.5430 -2.5430 4.6743 4.6743 4.6770 4.6770 5.6763 5.6763 5.6958 5.6958 6.6154 6.6154 6.6397 6.6397 9.1465 9.1465 9.1704 9.1704 9.3710 9.3710 9.4060 9.4060 9.5697 9.5697 9.5785 9.5785 10.0451 10.0451 10.0575 10.0575 10.1866 10.1866 10.2039 10.2039 12.3890 12.3890 12.3940 12.3941 12.8633 12.8633 12.8900 12.8900 k = 0.0319 0.3812 0.3122 ( 2892 PWs) bands (ev): -4.0960 -4.0960 -4.0959 -4.0959 -2.5500 -2.5500 -2.5493 -2.5493 4.6740 4.6740 4.6761 4.6761 5.7088 5.7088 5.7245 5.7245 6.5946 6.5946 6.6139 6.6139 9.1580 9.1580 9.1735 9.1735 9.4267 9.4267 9.4522 9.4522 9.5937 9.5937 9.6010 9.6010 10.0087 10.0087 10.0203 10.0203 10.1751 10.1752 10.1889 10.1889 12.3807 12.3807 12.3845 12.3846 12.8833 12.8833 12.9039 12.9039 k = 0.0213 0.3812 0.3122 ( 2892 PWs) bands (ev): -4.0982 -4.0982 -4.0982 -4.0982 -2.5543 -2.5543 -2.5538 -2.5538 4.6739 4.6739 4.6752 4.6752 5.7341 5.7341 5.7451 5.7451 6.5798 6.5798 6.5932 6.5932 9.1644 9.1644 9.1735 9.1736 9.4747 9.4747 9.4917 9.4917 9.6133 9.6133 9.6187 9.6187 9.9770 9.9770 9.9864 9.9864 10.1672 10.1672 10.1767 10.1767 12.3749 12.3749 12.3774 12.3774 12.8994 12.8994 12.9134 12.9134 k = 0.0106 0.3812 0.3122 ( 2876 PWs) bands (ev): -4.0996 -4.0996 -4.0996 -4.0996 -2.5568 -2.5568 -2.5566 -2.5566 4.6739 4.6739 4.6746 4.6746 5.7511 5.7511 5.7568 5.7568 6.5719 6.5719 6.5788 6.5788 9.1682 9.1682 9.1725 9.1725 9.5086 9.5086 9.5173 9.5173 9.6273 9.6273 9.6303 9.6303 9.9553 9.9553 9.9608 9.9608 10.1633 10.1633 10.1682 10.1682 12.3716 12.3716 12.3729 12.3729 12.9110 12.9110 12.9180 12.9180 k = 0.0000 0.3812 0.3122 ( 2872 PWs) bands (ev): -4.1000 -4.1000 -4.1000 -4.1000 -2.5576 -2.5576 -2.5576 -2.5576 4.6742 4.6742 4.6742 4.6742 5.7588 5.7588 5.7588 5.7588 6.5716 6.5716 6.5716 6.5716 9.1707 9.1707 9.1707 9.1707 9.5235 9.5235 9.5235 9.5235 9.6336 9.6336 9.6336 9.6336 9.9491 9.9491 9.9492 9.9492 10.1637 10.1637 10.1637 10.1637 12.3709 12.3709 12.3709 12.3709 12.9172 12.9172 12.9172 12.9172 k = 0.0000 0.3812 0.3122 ( 2872 PWs) bands (ev): -4.1000 -4.1000 -4.1000 -4.1000 -2.5576 -2.5576 -2.5576 -2.5576 4.6742 4.6742 4.6742 4.6742 5.7588 5.7588 5.7588 5.7588 6.5716 6.5716 6.5716 6.5716 9.1707 9.1707 9.1707 9.1707 9.5235 9.5235 9.5235 9.5235 9.6336 9.6336 9.6336 9.6336 9.9491 9.9491 9.9492 9.9492 10.1637 10.1637 10.1637 10.1637 12.3709 12.3709 12.3709 12.3709 12.9172 12.9172 12.9172 12.9172 k = 0.0000 0.3706 0.3122 ( 2876 PWs) bands (ev): -4.1029 -4.1029 -4.1029 -4.1028 -2.5534 -2.5534 -2.5534 -2.5534 4.6713 4.6713 4.6713 4.6713 5.7622 5.7622 5.7623 5.7623 6.5722 6.5722 6.5723 6.5723 9.1583 9.1584 9.1606 9.1607 9.5142 9.5143 9.5241 9.5241 9.6261 9.6261 9.6478 9.6478 9.9423 9.9423 9.9581 9.9581 10.1656 10.1656 10.1717 10.1717 12.3715 12.3715 12.3722 12.3722 12.9185 12.9185 12.9194 12.9194 k = 0.0000 0.3600 0.3122 ( 2884 PWs) bands (ev): -4.1113 -4.1113 -4.1112 -4.1112 -2.5410 -2.5410 -2.5410 -2.5410 4.6627 4.6627 4.6628 4.6628 5.7725 5.7725 5.7726 5.7726 6.5741 6.5741 6.5743 6.5743 9.1254 9.1254 9.1296 9.1296 9.5002 9.5002 9.5121 9.5121 9.6292 9.6292 9.6624 9.6624 9.9404 9.9404 9.9680 9.9680 10.1774 10.1774 10.1880 10.1881 12.3740 12.3740 12.3755 12.3755 12.9230 12.9231 12.9248 12.9248 k = 0.0000 0.3494 0.3122 ( 2884 PWs) bands (ev): -4.1249 -4.1249 -4.1248 -4.1248 -2.5207 -2.5207 -2.5206 -2.5206 4.6489 4.6489 4.6490 4.6490 5.7892 5.7892 5.7894 5.7894 6.5773 6.5773 6.5776 6.5776 9.0753 9.0754 9.0810 9.0810 9.4816 9.4816 9.4893 9.4893 9.6393 9.6394 9.6735 9.6735 9.9460 9.9460 9.9796 9.9796 10.1972 10.1973 10.2104 10.2105 12.3784 12.3785 12.3806 12.3806 12.9310 12.9310 12.9336 12.9336 k = 0.0000 0.3388 0.3122 ( 2888 PWs) bands (ev): -4.1433 -4.1433 -4.1432 -4.1432 -2.4930 -2.4930 -2.4928 -2.4928 4.6303 4.6303 4.6305 4.6305 5.8116 5.8117 5.8119 5.8119 6.5819 6.5819 6.5822 6.5823 9.0120 9.0120 9.0185 9.0185 9.4570 9.4570 9.4594 9.4594 9.6513 9.6513 9.6805 9.6805 9.9594 9.9594 9.9936 9.9937 10.2227 10.2227 10.2369 10.2369 12.3845 12.3845 12.3872 12.3872 12.9423 12.9423 12.9456 12.9456 k = 0.0000 0.3282 0.3122 ( 2884 PWs) bands (ev): -4.1660 -4.1659 -4.1658 -4.1658 -2.4584 -2.4584 -2.4582 -2.4582 4.6077 4.6077 4.6079 4.6080 5.8392 5.8392 5.8395 5.8395 6.5878 6.5878 6.5882 6.5883 8.9386 8.9386 8.9455 8.9455 9.4226 9.4226 9.4275 9.4275 9.6625 9.6625 9.6846 9.6846 9.9789 9.9790 10.0106 10.0106 10.2514 10.2514 10.2656 10.2656 12.3919 12.3920 12.3952 12.3952 12.9569 12.9569 12.9609 12.9609 k = 0.0000 0.3176 0.3122 ( 2884 PWs) bands (ev): -4.1922 -4.1922 -4.1920 -4.1920 -2.4176 -2.4176 -2.4174 -2.4174 4.5817 4.5817 4.5820 4.5820 5.8709 5.8709 5.8713 5.8713 6.5949 6.5949 6.5955 6.5955 8.8574 8.8574 8.8644 8.8644 9.3823 9.3823 9.3910 9.3910 9.6723 9.6724 9.6877 9.6877 10.0020 10.0020 10.0296 10.0296 10.2816 10.2817 10.2955 10.2955 12.4005 12.4005 12.4041 12.4042 12.9746 12.9746 12.9792 12.9792 k = 0.0000 0.3070 0.3122 ( 2888 PWs) bands (ev): -4.2213 -4.2213 -4.2211 -4.2211 -2.3714 -2.3714 -2.3712 -2.3712 4.5530 4.5530 4.5533 4.5533 5.9060 5.9060 5.9065 5.9065 6.6033 6.6033 6.6040 6.6040 8.7705 8.7705 8.7774 8.7774 9.3382 9.3383 9.3493 9.3493 9.6811 9.6811 9.6911 9.6911 10.0263 10.0263 10.0498 10.0498 10.3122 10.3122 10.3254 10.3255 12.4098 12.4098 12.4137 12.4137 12.9955 12.9955 13.0004 13.0005 k = 0.0000 0.2965 0.3122 ( 2886 PWs) bands (ev): -4.2529 -4.2529 -4.2526 -4.2526 -2.3205 -2.3204 -2.3202 -2.3202 4.5222 4.5222 4.5226 4.5226 5.9437 5.9437 5.9443 5.9443 6.6130 6.6130 6.6138 6.6138 8.6792 8.6793 8.6859 8.6859 9.2911 9.2911 9.3034 9.3034 9.6891 9.6891 9.6954 9.6955 10.0501 10.0502 10.0701 10.0701 10.3425 10.3425 10.3551 10.3551 12.4194 12.4195 12.4235 12.4236 13.0193 13.0193 13.0246 13.0246 k = 0.0000 0.2859 0.3122 ( 2894 PWs) bands (ev): -4.2862 -4.2861 -4.2859 -4.2859 -2.2654 -2.2653 -2.2651 -2.2651 4.4899 4.4899 4.4903 4.4903 5.9831 5.9831 5.9838 5.9838 6.6238 6.6239 6.6247 6.6248 8.5849 8.5849 8.5913 8.5913 9.2415 9.2415 9.2542 9.2542 9.6968 9.6968 9.7009 9.7010 10.0725 10.0725 10.0895 10.0896 10.3719 10.3719 10.3839 10.3839 12.4291 12.4291 12.4332 12.4332 13.0458 13.0459 13.0513 13.0513 k = 0.0000 0.2753 0.3122 ( 2894 PWs) bands (ev): -4.3207 -4.3207 -4.3205 -4.3205 -2.2067 -2.2067 -2.2065 -2.2065 4.4565 4.4565 4.4569 4.4569 6.0235 6.0235 6.0243 6.0243 6.6359 6.6360 6.6370 6.6370 8.4886 8.4886 8.4948 8.4948 9.1900 9.1900 9.2027 9.2027 9.7044 9.7045 9.7078 9.7078 10.0928 10.0928 10.1075 10.1076 10.4003 10.4003 10.4117 10.4117 12.4383 12.4384 12.4424 12.4424 13.0751 13.0752 13.0806 13.0807 k = 0.0000 0.2647 0.3122 ( 2884 PWs) bands (ev): -4.3561 -4.3561 -4.3558 -4.3558 -2.1452 -2.1452 -2.1449 -2.1449 4.4225 4.4225 4.4229 4.4229 6.0641 6.0641 6.0651 6.0651 6.6492 6.6493 6.6504 6.6504 8.3915 8.3915 8.3974 8.3974 9.1371 9.1371 9.1495 9.1495 9.7124 9.7124 9.7158 9.7158 10.1107 10.1108 10.1238 10.1238 10.4274 10.4274 10.4382 10.4382 12.4468 12.4468 12.4506 12.4506 13.1069 13.1070 13.1123 13.1124 k = 0.0000 0.2541 0.3122 ( 2884 PWs) bands (ev): -4.3919 -4.3919 -4.3916 -4.3916 -2.0812 -2.0812 -2.0809 -2.0809 4.3882 4.3882 4.3886 4.3886 6.1042 6.1042 6.1053 6.1053 6.6637 6.6637 6.6649 6.6649 8.2946 8.2946 8.3002 8.3002 9.0831 9.0831 9.0950 9.0950 9.7210 9.7210 9.7246 9.7246 10.1262 10.1262 10.1379 10.1379 10.4530 10.4530 10.4633 10.4633 12.4541 12.4541 12.4576 12.4576 13.1410 13.1410 13.1461 13.1461 k = 0.0000 0.2435 0.3122 ( 2888 PWs) bands (ev): -4.4277 -4.4277 -4.4275 -4.4275 -2.0153 -2.0153 -2.0150 -2.0150 4.3539 4.3539 4.3543 4.3544 6.1429 6.1429 6.1441 6.1441 6.6792 6.6792 6.6806 6.6806 8.1988 8.1989 8.2043 8.2043 9.0283 9.0283 9.0397 9.0397 9.7302 9.7302 9.7340 9.7340 10.1392 10.1392 10.1498 10.1498 10.4772 10.4773 10.4870 10.4870 12.4598 12.4598 12.4629 12.4629 13.1770 13.1770 13.1818 13.1818 k = 0.0000 0.2329 0.3122 ( 2888 PWs) bands (ev): -4.4634 -4.4633 -4.4631 -4.4631 -1.9479 -1.9479 -1.9477 -1.9477 4.3198 4.3198 4.3203 4.3203 6.1794 6.1794 6.1807 6.1807 6.6957 6.6957 6.6972 6.6973 8.1055 8.1055 8.1107 8.1107 8.9731 8.9731 8.9840 8.9840 9.7403 9.7403 9.7441 9.7441 10.1498 10.1499 10.1596 10.1597 10.4999 10.5000 10.5092 10.5092 12.4637 12.4637 12.4663 12.4663 13.2147 13.2147 13.2192 13.2192 k = 0.0000 0.2223 0.3122 ( 2888 PWs) bands (ev): -4.4985 -4.4985 -4.4982 -4.4982 -1.8795 -1.8795 -1.8792 -1.8792 4.2863 4.2863 4.2867 4.2867 6.2127 6.2127 6.2142 6.2142 6.7133 6.7133 6.7149 6.7149 8.0155 8.0155 8.0207 8.0207 8.9178 8.9178 8.9281 8.9281 9.7510 9.7510 9.7549 9.7549 10.1583 10.1584 10.1674 10.1675 10.5211 10.5212 10.5299 10.5299 12.4654 12.4654 12.4675 12.4676 13.2539 13.2539 13.2580 13.2580 k = 0.0000 0.2118 0.3122 ( 2902 PWs) bands (ev): -4.5330 -4.5330 -4.5327 -4.5327 -1.8104 -1.8104 -1.8102 -1.8102 4.2533 4.2533 4.2538 4.2538 6.2421 6.2421 6.2436 6.2437 6.7317 6.7317 6.7335 6.7335 7.9303 7.9303 7.9354 7.9354 8.8624 8.8624 8.8722 8.8722 9.7624 9.7624 9.7662 9.7662 10.1648 10.1648 10.1734 10.1734 10.5408 10.5408 10.5491 10.5491 12.4646 12.4646 12.4664 12.4664 13.2940 13.2940 13.2979 13.2979 k = 0.0000 0.2012 0.3122 ( 2902 PWs) bands (ev): -4.5665 -4.5665 -4.5663 -4.5662 -1.7411 -1.7411 -1.7408 -1.7408 4.2212 4.2212 4.2217 4.2217 6.2663 6.2663 6.2680 6.2680 6.7510 6.7510 6.7528 6.7529 7.8510 7.8510 7.8561 7.8561 8.8073 8.8073 8.8167 8.8167 9.7745 9.7745 9.7781 9.7781 10.1696 10.1696 10.1777 10.1778 10.5590 10.5590 10.5669 10.5669 12.4612 12.4612 12.4628 12.4628 13.3347 13.3347 13.3388 13.3389 k = 0.0000 0.1906 0.3122 ( 2902 PWs) bands (ev): -4.5990 -4.5990 -4.5988 -4.5988 -1.6719 -1.6719 -1.6717 -1.6717 4.1900 4.1900 4.1905 4.1905 6.2846 6.2846 6.2863 6.2863 6.7711 6.7711 6.7730 6.7730 7.7789 7.7789 7.7840 7.7841 8.7527 8.7527 8.7617 8.7617 9.7871 9.7871 9.7905 9.7905 10.1728 10.1729 10.1807 10.1807 10.5757 10.5757 10.5833 10.5834 12.4550 12.4551 12.4567 12.4567 13.3753 13.3753 13.3805 13.3805 k = 0.0000 0.1800 0.3122 ( 2902 PWs) bands (ev): -4.6303 -4.6303 -4.6301 -4.6301 -1.6033 -1.6033 -1.6030 -1.6030 4.1599 4.1599 4.1603 4.1603 6.2958 6.2958 6.2976 6.2976 6.7918 6.7918 6.7938 6.7938 7.7151 7.7151 7.7203 7.7203 8.6987 8.6987 8.7074 8.7074 9.8001 9.8001 9.8034 9.8034 10.1749 10.1749 10.1824 10.1825 10.5911 10.5911 10.5984 10.5984 12.4460 12.4460 12.4479 12.4480 13.4149 13.4149 13.4223 13.4223 k = 0.0000 0.1694 0.3122 ( 2902 PWs) bands (ev): -4.6604 -4.6604 -4.6601 -4.6601 -1.5356 -1.5356 -1.5353 -1.5353 4.1309 4.1309 4.1313 4.1313 6.2993 6.2993 6.3011 6.3011 6.8132 6.8132 6.8152 6.8152 7.6606 7.6606 7.6659 7.6659 8.6456 8.6456 8.6539 8.6539 9.8135 9.8135 9.8166 9.8166 10.1759 10.1759 10.1832 10.1832 10.6051 10.6051 10.6122 10.6122 12.4342 12.4342 12.4365 12.4365 13.4524 13.4524 13.4637 13.4637 k = 0.0000 0.1588 0.3122 ( 2906 PWs) bands (ev): -4.6889 -4.6889 -4.6887 -4.6887 -1.4691 -1.4691 -1.4689 -1.4689 4.1031 4.1031 4.1036 4.1036 6.2946 6.2946 6.2963 6.2963 6.8352 6.8352 6.8371 6.8371 7.6160 7.6160 7.6214 7.6214 8.5934 8.5935 8.6015 8.6016 9.8270 9.8270 9.8300 9.8300 10.1761 10.1761 10.1832 10.1833 10.6178 10.6178 10.6247 10.6247 12.4197 12.4197 12.4225 12.4225 13.4853 13.4853 13.5032 13.5033 k = 0.0000 0.1482 0.3122 ( 2904 PWs) bands (ev): -4.7160 -4.7160 -4.7157 -4.7157 -1.4044 -1.4044 -1.4042 -1.4042 4.0767 4.0767 4.0772 4.0772 6.2818 6.2819 6.2835 6.2835 6.8576 6.8576 6.8594 6.8594 7.5813 7.5813 7.5869 7.5869 8.5425 8.5425 8.5505 8.5505 9.8407 9.8407 9.8436 9.8436 10.1757 10.1758 10.1828 10.1829 10.6293 10.6293 10.6360 10.6361 12.4028 12.4028 12.4060 12.4061 13.5083 13.5083 13.5362 13.5363 k = 0.0000 0.1376 0.3122 ( 2904 PWs) bands (ev): -4.7415 -4.7415 -4.7412 -4.7412 -1.3417 -1.3417 -1.3415 -1.3415 4.0517 4.0517 4.0521 4.0521 6.2615 6.2616 6.2631 6.2631 6.8803 6.8803 6.8821 6.8821 7.5563 7.5563 7.5619 7.5619 8.4931 8.4931 8.5009 8.5009 9.8542 9.8542 9.8571 9.8571 10.1751 10.1751 10.1821 10.1822 10.6396 10.6396 10.6463 10.6463 12.3838 12.3838 12.3874 12.3874 13.5156 13.5156 13.5466 13.5466 k = 0.0000 0.1271 0.3122 ( 2914 PWs) bands (ev): -4.7653 -4.7653 -4.7651 -4.7651 -1.2815 -1.2815 -1.2813 -1.2813 4.0282 4.0282 4.0285 4.0285 6.2348 6.2348 6.2363 6.2363 6.9033 6.9033 6.9049 6.9049 7.5399 7.5399 7.5456 7.5457 8.4452 8.4453 8.4530 8.4530 9.8674 9.8674 9.8704 9.8704 10.1743 10.1743 10.1814 10.1814 10.6488 10.6488 10.6554 10.6554 12.3629 12.3629 12.3669 12.3669 13.5089 13.5089 13.5331 13.5331 k = 0.0000 0.1165 0.3122 ( 2914 PWs) bands (ev): -4.7874 -4.7874 -4.7872 -4.7872 -1.2242 -1.2242 -1.2240 -1.2240 4.0062 4.0062 4.0065 4.0065 6.2031 6.2031 6.2045 6.2045 6.9263 6.9263 6.9277 6.9277 7.5308 7.5308 7.5368 7.5368 8.3993 8.3993 8.4070 8.4070 9.8802 9.8802 9.8832 9.8832 10.1737 10.1737 10.1808 10.1808 10.6570 10.6570 10.6635 10.6635 12.3407 12.3407 12.3450 12.3450 13.4958 13.4959 13.5143 13.5143 k = 0.0000 0.1059 0.3122 ( 2900 PWs) bands (ev): -4.8078 -4.8078 -4.8075 -4.8075 -1.1701 -1.1701 -1.1699 -1.1699 3.9858 3.9858 3.9861 3.9861 6.1681 6.1681 6.1694 6.1694 6.9491 6.9491 6.9504 6.9504 7.5278 7.5278 7.5339 7.5339 8.3555 8.3555 8.3634 8.3634 9.8924 9.8924 9.8955 9.8955 10.1735 10.1735 10.1806 10.1806 10.6642 10.6643 10.6708 10.6708 12.3177 12.3177 12.3222 12.3222 13.4812 13.4812 13.4959 13.4959 k = 0.0000 0.0953 0.3122 ( 2910 PWs) bands (ev): -4.8263 -4.8263 -4.8260 -4.8260 -1.1197 -1.1197 -1.1196 -1.1196 3.9671 3.9671 3.9674 3.9674 6.1313 6.1313 6.1325 6.1325 6.9715 6.9715 6.9726 6.9726 7.5291 7.5291 7.5355 7.5355 8.3142 8.3142 8.3221 8.3221 9.9036 9.9036 9.9069 9.9069 10.1735 10.1735 10.1807 10.1808 10.6705 10.6706 10.6770 10.6771 12.2942 12.2942 12.2989 12.2989 13.4669 13.4669 13.4789 13.4790 k = 0.0000 0.0847 0.3122 ( 2910 PWs) bands (ev): -4.8430 -4.8430 -4.8427 -4.8427 -1.0734 -1.0734 -1.0732 -1.0732 3.9501 3.9501 3.9504 3.9504 6.0943 6.0943 6.0955 6.0956 6.9931 6.9931 6.9941 6.9941 7.5336 7.5336 7.5402 7.5402 8.2756 8.2756 8.2838 8.2838 9.9139 9.9139 9.9173 9.9173 10.1741 10.1741 10.1814 10.1814 10.6760 10.6760 10.6825 10.6825 12.2711 12.2712 12.2760 12.2760 13.4538 13.4538 13.4639 13.4639 k = 0.0000 0.0741 0.3122 ( 2918 PWs) bands (ev): -4.8578 -4.8578 -4.8575 -4.8575 -1.0315 -1.0315 -1.0313 -1.0313 3.9350 3.9350 3.9352 3.9352 6.0586 6.0587 6.0599 6.0599 7.0136 7.0137 7.0145 7.0145 7.5399 7.5399 7.5469 7.5469 8.2402 8.2402 8.2486 8.2486 9.9230 9.9230 9.9265 9.9265 10.1751 10.1752 10.1824 10.1825 10.6806 10.6807 10.6871 10.6872 12.2489 12.2489 12.2538 12.2538 13.4422 13.4422 13.4507 13.4508 k = 0.0000 0.0635 0.3122 ( 2910 PWs) bands (ev): -4.8706 -4.8706 -4.8704 -4.8704 -0.9943 -0.9943 -0.9942 -0.9942 3.9217 3.9217 3.9219 3.9219 6.0254 6.0255 6.0267 6.0267 7.0328 7.0328 7.0335 7.0335 7.5471 7.5471 7.5544 7.5544 8.2084 8.2084 8.2170 8.2171 9.9308 9.9309 9.9344 9.9345 10.1766 10.1767 10.1839 10.1840 10.6846 10.6847 10.6911 10.6912 12.2282 12.2282 12.2332 12.2332 13.4323 13.4323 13.4395 13.4395 k = 0.0000 0.0529 0.3122 ( 2914 PWs) bands (ev): -4.8815 -4.8815 -4.8813 -4.8813 -0.9623 -0.9623 -0.9621 -0.9621 3.9103 3.9103 3.9105 3.9105 5.9957 5.9957 5.9969 5.9969 7.0499 7.0500 7.0505 7.0506 7.5543 7.5543 7.5621 7.5621 8.1804 8.1804 8.1894 8.1894 9.9374 9.9374 9.9410 9.9410 10.1784 10.1784 10.1857 10.1857 10.6879 10.6879 10.6944 10.6944 12.2095 12.2095 12.2145 12.2145 13.4240 13.4241 13.4301 13.4301 k = 0.0000 0.0424 0.3122 ( 2914 PWs) bands (ev): -4.8905 -4.8905 -4.8902 -4.8902 -0.9356 -0.9356 -0.9355 -0.9355 3.9010 3.9010 3.9011 3.9011 5.9703 5.9703 5.9715 5.9716 7.0648 7.0648 7.0653 7.0653 7.5610 7.5610 7.5691 7.5691 8.1568 8.1568 8.1661 8.1661 9.9427 9.9427 9.9463 9.9463 10.1803 10.1803 10.1875 10.1876 10.6905 10.6906 10.6971 10.6971 12.1933 12.1933 12.1984 12.1984 13.4174 13.4174 13.4225 13.4225 k = 0.0000 0.0318 0.3122 ( 2920 PWs) bands (ev): -4.8975 -4.8975 -4.8972 -4.8972 -0.9146 -0.9146 -0.9145 -0.9145 3.8936 3.8936 3.8938 3.8938 5.9499 5.9499 5.9511 5.9511 7.0769 7.0770 7.0774 7.0774 7.5666 7.5666 7.5750 7.5750 8.1379 8.1379 8.1475 8.1475 9.9467 9.9467 9.9503 9.9503 10.1821 10.1821 10.1893 10.1893 10.6925 10.6925 10.6990 10.6990 12.1802 12.1802 12.1853 12.1853 13.4123 13.4124 13.4166 13.4166 k = 0.0000 0.0212 0.3122 ( 2916 PWs) bands (ev): -4.9025 -4.9025 -4.9022 -4.9022 -0.8994 -0.8994 -0.8993 -0.8993 3.8884 3.8884 3.8885 3.8885 5.9350 5.9350 5.9362 5.9362 7.0859 7.0859 7.0863 7.0863 7.5708 7.5708 7.5795 7.5795 8.1241 8.1241 8.1340 8.1340 9.9495 9.9496 9.9531 9.9531 10.1836 10.1836 10.1907 10.1907 10.6939 10.6940 10.7005 10.7005 12.1706 12.1706 12.1757 12.1757 13.4088 13.4088 13.4124 13.4124 k = 0.0000 0.0106 0.3122 ( 2914 PWs) bands (ev): -4.9055 -4.9055 -4.9052 -4.9052 -0.8903 -0.8903 -0.8902 -0.8902 3.8852 3.8852 3.8853 3.8853 5.9259 5.9259 5.9271 5.9271 7.0915 7.0915 7.0918 7.0918 7.5734 7.5734 7.5823 7.5823 8.1157 8.1157 8.1258 8.1258 9.9513 9.9513 9.9548 9.9548 10.1845 10.1845 10.1916 10.1917 10.6948 10.6948 10.7013 10.7013 12.1647 12.1647 12.1698 12.1698 13.4068 13.4068 13.4098 13.4098 k = 0.0000 0.0000 0.3122 ( 2918 PWs) bands (ev): -4.9065 -4.9065 -4.9062 -4.9062 -0.8872 -0.8872 -0.8871 -0.8871 3.8841 3.8841 3.8842 3.8842 5.9228 5.9228 5.9241 5.9241 7.0933 7.0933 7.0937 7.0937 7.5742 7.5742 7.5832 7.5832 8.1129 8.1129 8.1230 8.1230 9.9518 9.9518 9.9553 9.9553 10.1849 10.1849 10.1920 10.1920 10.6951 10.6951 10.7016 10.7016 12.1627 12.1627 12.1678 12.1678 13.4061 13.4061 13.4090 13.4090 k = 0.0000 0.3812-0.0000 ( 2918 PWs) bands (ev): -4.4285 -4.4285 -4.4284 -4.4284 -1.8783 -1.8783 -1.8783 -1.8783 3.3319 3.3319 3.3320 3.3320 6.6176 6.6176 6.6182 6.6182 7.2111 7.2111 7.2119 7.2119 8.0882 8.0882 8.0944 8.0944 8.9978 8.9978 9.0073 9.0073 9.8195 9.8195 9.8259 9.8259 10.3432 10.3432 10.3494 10.3494 10.9358 10.9358 10.9398 10.9398 12.7367 12.7367 12.7374 12.7374 12.9841 12.9841 12.9871 12.9871 k = 0.0000 0.3812 0.0108 ( 2898 PWs) bands (ev): -4.4277 -4.4277 -4.4277 -4.4277 -1.8802 -1.8802 -1.8802 -1.8802 3.3348 3.3348 3.3349 3.3349 6.6174 6.6174 6.6180 6.6180 7.2055 7.2055 7.2064 7.2064 8.0940 8.0940 8.1002 8.1002 8.9990 8.9990 9.0085 9.0085 9.8178 9.8178 9.8241 9.8241 10.3424 10.3424 10.3487 10.3487 10.9340 10.9340 10.9381 10.9381 12.7369 12.7369 12.7382 12.7382 12.9840 12.9840 12.9873 12.9873 k = 0.0000 0.3812 0.0215 ( 2890 PWs) bands (ev): -4.4255 -4.4255 -4.4254 -4.4254 -1.8860 -1.8860 -1.8859 -1.8859 3.3437 3.3437 3.3438 3.3438 6.6168 6.6168 6.6175 6.6175 7.1892 7.1892 7.1901 7.1902 8.1109 8.1109 8.1171 8.1171 9.0023 9.0023 9.0119 9.0119 9.8124 9.8124 9.8188 9.8188 10.3398 10.3398 10.3460 10.3460 10.9286 10.9286 10.9328 10.9328 12.7378 12.7379 12.7403 12.7403 12.9839 12.9839 12.9877 12.9877 k = 0.0000 0.3812 0.0323 ( 2892 PWs) bands (ev): -4.4217 -4.4217 -4.4217 -4.4217 -1.8954 -1.8954 -1.8954 -1.8954 3.3583 3.3583 3.3585 3.3585 6.6158 6.6158 6.6166 6.6166 7.1632 7.1632 7.1643 7.1643 8.1378 8.1378 8.1440 8.1440 9.0076 9.0076 9.0175 9.0175 9.8035 9.8035 9.8098 9.8098 10.3353 10.3353 10.3417 10.3417 10.9197 10.9197 10.9239 10.9239 12.7397 12.7397 12.7433 12.7433 12.9832 12.9832 12.9879 12.9879 k = 0.0000 0.3812 0.0431 ( 2900 PWs) bands (ev): -4.4165 -4.4165 -4.4165 -4.4164 -1.9086 -1.9086 -1.9085 -1.9085 3.3787 3.3787 3.3788 3.3788 6.6144 6.6144 6.6153 6.6153 7.1290 7.1290 7.1303 7.1303 8.1732 8.1732 8.1795 8.1795 9.0152 9.0152 9.0253 9.0253 9.7911 9.7911 9.7974 9.7974 10.3293 10.3293 10.3358 10.3358 10.9072 10.9072 10.9116 10.9116 12.7423 12.7423 12.7471 12.7472 12.9817 12.9817 12.9873 12.9873 k = 0.0000 0.3812 0.0538 ( 2896 PWs) bands (ev): -4.4099 -4.4099 -4.4098 -4.4098 -1.9252 -1.9252 -1.9251 -1.9251 3.4046 3.4046 3.4048 3.4048 6.6125 6.6126 6.6137 6.6137 7.0881 7.0881 7.0896 7.0896 8.2156 8.2156 8.2220 8.2220 9.0248 9.0248 9.0353 9.0353 9.7755 9.7755 9.7816 9.7816 10.3219 10.3219 10.3286 10.3287 10.8915 10.8915 10.8960 10.8961 12.7455 12.7456 12.7518 12.7518 12.9786 12.9786 12.9855 12.9855 k = 0.0000 0.3812 0.0646 ( 2898 PWs) bands (ev): -4.4018 -4.4018 -4.4017 -4.4017 -1.9451 -1.9450 -1.9450 -1.9450 3.4358 3.4358 3.4360 3.4360 6.6103 6.6103 6.6117 6.6117 7.0419 7.0419 7.0437 7.0437 8.2636 8.2636 8.2701 8.2701 9.0365 9.0365 9.0475 9.0475 9.7567 9.7567 9.7627 9.7627 10.3133 10.3133 10.3203 10.3203 10.8726 10.8727 10.8774 10.8774 12.7493 12.7493 12.7571 12.7571 12.9735 12.9735 12.9818 12.9818 k = 0.0000 0.3812 0.0754 ( 2894 PWs) bands (ev): -4.3924 -4.3924 -4.3923 -4.3923 -1.9680 -1.9680 -1.9679 -1.9679 3.4721 3.4721 3.4724 3.4724 6.6077 6.6077 6.6093 6.6093 6.9914 6.9914 6.9935 6.9936 8.3160 8.3160 8.3228 8.3228 9.0503 9.0503 9.0619 9.0619 9.7350 9.7350 9.7409 9.7409 10.3036 10.3036 10.3109 10.3110 10.8508 10.8508 10.8558 10.8558 12.7532 12.7532 12.7628 12.7628 12.9656 12.9656 12.9756 12.9756 k = 0.0000 0.3812 0.0861 ( 2894 PWs) bands (ev): -4.3817 -4.3817 -4.3816 -4.3816 -1.9937 -1.9937 -1.9936 -1.9936 3.5133 3.5133 3.5136 3.5136 6.6045 6.6045 6.6065 6.6065 6.9377 6.9377 6.9402 6.9403 8.3718 8.3718 8.3789 8.3789 9.0660 9.0660 9.0783 9.0783 9.7106 9.7106 9.7164 9.7164 10.2930 10.2930 10.3008 10.3008 10.8262 10.8262 10.8314 10.8314 12.7569 12.7569 12.7686 12.7686 12.9546 12.9546 12.9666 12.9666 k = 0.0000 0.3812 0.0969 ( 2890 PWs) bands (ev): -4.3697 -4.3697 -4.3696 -4.3696 -2.0219 -2.0219 -2.0218 -2.0218 3.5590 3.5590 3.5593 3.5593 6.6007 6.6007 6.6032 6.6032 6.8814 6.8814 6.8846 6.8846 8.4302 8.4302 8.4378 8.4378 9.0837 9.0837 9.0968 9.0968 9.6840 9.6840 9.6897 9.6897 10.2816 10.2816 10.2899 10.2899 10.7991 10.7991 10.8045 10.8045 12.7599 12.7599 12.7742 12.7742 12.9405 12.9405 12.9550 12.9550 k = 0.0000 0.3812 0.1077 ( 2888 PWs) bands (ev): -4.3566 -4.3566 -4.3565 -4.3565 -2.0523 -2.0523 -2.0522 -2.0521 3.6089 3.6089 3.6093 3.6093 6.5959 6.5959 6.5992 6.5992 6.8235 6.8235 6.8273 6.8273 8.4905 8.4905 8.4987 8.4987 9.1032 9.1032 9.1173 9.1173 9.6555 9.6556 9.6611 9.6611 10.2694 10.2695 10.2783 10.2784 10.7696 10.7696 10.7753 10.7754 12.7615 12.7615 12.7789 12.7790 12.9236 12.9236 12.9411 12.9411 k = 0.0000 0.3812 0.1184 ( 2888 PWs) bands (ev): -4.3424 -4.3424 -4.3424 -4.3424 -2.0845 -2.0845 -2.0844 -2.0844 3.6628 3.6628 3.6631 3.6631 6.5895 6.5895 6.5938 6.5939 6.7647 6.7647 6.7697 6.7697 8.5523 8.5523 8.5612 8.5612 9.1244 9.1245 9.1397 9.1397 9.6256 9.6256 9.6311 9.6311 10.2565 10.2565 10.2661 10.2662 10.7380 10.7381 10.7441 10.7441 12.7605 12.7605 12.7816 12.7817 12.9050 12.9050 12.9261 12.9261 k = 0.0000 0.3812 0.1292 ( 2892 PWs) bands (ev): -4.3273 -4.3273 -4.3272 -4.3272 -2.1183 -2.1183 -2.1182 -2.1181 3.7201 3.7201 3.7204 3.7205 6.5796 6.5797 6.5857 6.5857 6.7070 6.7070 6.7138 6.7138 8.6150 8.6150 8.6247 8.6247 9.1474 9.1474 9.1639 9.1640 9.5948 9.5948 9.6002 9.6002 10.2428 10.2428 10.2533 10.2533 10.7046 10.7047 10.7111 10.7111 12.7555 12.7555 12.7802 12.7802 12.8870 12.8870 12.9116 12.9116 k = 0.0000 0.3812 0.1400 ( 2890 PWs) bands (ev): -4.3113 -4.3113 -4.3112 -4.3112 -2.1532 -2.1532 -2.1531 -2.1531 3.7806 3.7806 3.7810 3.7810 6.5614 6.5614 6.5696 6.5697 6.6559 6.6559 6.6648 6.6648 8.6783 8.6783 8.6889 8.6889 9.1719 9.1719 9.1900 9.1900 9.5635 9.5635 9.5690 9.5690 10.2282 10.2283 10.2397 10.2398 10.6697 10.6697 10.6765 10.6765 12.7448 12.7448 12.7716 12.7716 12.8731 12.8731 12.8996 12.8996 k = 0.0000 0.3812 0.1507 ( 2890 PWs) bands (ev): -4.2946 -4.2946 -4.2945 -4.2945 -2.1889 -2.1889 -2.1888 -2.1888 3.8438 3.8438 3.8442 3.8442 6.5264 6.5265 6.5343 6.5343 6.6229 6.6229 6.6315 6.6315 8.7415 8.7415 8.7533 8.7533 9.1979 9.1979 9.2177 9.2177 9.5323 9.5323 9.5379 9.5379 10.2127 10.2128 10.2253 10.2254 10.6334 10.6334 10.6406 10.6406 12.7276 12.7276 12.7534 12.7534 12.8660 12.8660 12.8915 12.8915 k = 0.0000 0.3812 0.1615 ( 2890 PWs) bands (ev): -4.2774 -4.2774 -4.2773 -4.2773 -2.2250 -2.2250 -2.2249 -2.2249 3.9094 3.9094 3.9098 3.9098 6.4747 6.4748 6.4802 6.4802 6.6078 6.6078 6.6139 6.6139 8.8044 8.8044 8.8173 8.8173 9.2252 9.2252 9.2470 9.2470 9.5019 9.5019 9.5077 9.5077 10.1962 10.1962 10.2100 10.2101 10.5960 10.5960 10.6036 10.6037 12.7041 12.7042 12.7270 12.7270 12.8649 12.8650 12.8874 12.8874 k = 0.0000 0.3812 0.1723 ( 2890 PWs) bands (ev): -4.2597 -4.2597 -4.2596 -4.2596 -2.2612 -2.2612 -2.2611 -2.2611 3.9769 3.9769 3.9773 3.9773 6.4145 6.4145 6.4182 6.4182 6.5999 6.5999 6.6043 6.6043 8.8662 8.8662 8.8806 8.8806 9.2536 9.2536 9.2775 9.2775 9.4728 9.4728 9.4791 9.4791 10.1784 10.1785 10.1938 10.1938 10.5578 10.5578 10.5659 10.5659 12.6758 12.6758 12.6953 12.6953 12.8676 12.8676 12.8866 12.8866 k = 0.0000 0.3812 0.1830 ( 2888 PWs) bands (ev): -4.2419 -4.2419 -4.2418 -4.2418 -2.2970 -2.2970 -2.2969 -2.2969 4.0458 4.0458 4.0462 4.0462 6.3507 6.3507 6.3533 6.3533 6.5946 6.5947 6.5979 6.5979 8.9264 8.9264 8.9422 8.9422 9.2828 9.2828 9.3087 9.3087 9.4460 9.4460 9.4535 9.4535 10.1595 10.1595 10.1764 10.1765 10.5191 10.5191 10.5277 10.5277 12.6441 12.6441 12.6606 12.6607 12.8720 12.8720 12.8880 12.8880 k = 0.0000 0.3812 0.1938 ( 2888 PWs) bands (ev): -4.2240 -4.2240 -4.2240 -4.2239 -2.3321 -2.3321 -2.3320 -2.3320 4.1157 4.1157 4.1161 4.1161 6.2853 6.2853 6.2872 6.2872 6.5905 6.5905 6.5930 6.5930 8.9841 8.9841 9.0013 9.0013 9.3121 9.3121 9.3389 9.3389 9.4228 9.4228 9.4331 9.4331 10.1392 10.1392 10.1580 10.1580 10.4800 10.4800 10.4892 10.4892 12.6106 12.6107 12.6247 12.6247 12.8773 12.8773 12.8908 12.8908 k = 0.0000 0.3812 0.2045 ( 2880 PWs) bands (ev): -4.2064 -4.2064 -4.2063 -4.2063 -2.3660 -2.3660 -2.3659 -2.3659 4.1858 4.1858 4.1862 4.1862 6.2194 6.2195 6.2209 6.2209 6.5870 6.5871 6.5891 6.5891 9.0380 9.0381 9.0564 9.0564 9.3394 9.3394 9.3629 9.3629 9.4055 9.4056 9.4252 9.4252 10.1176 10.1176 10.1385 10.1386 10.4409 10.4409 10.4506 10.4507 12.5766 12.5767 12.5886 12.5887 12.8829 12.8829 12.8942 12.8943 k = 0.0000 0.3812 0.2153 ( 2876 PWs) bands (ev): -4.1892 -4.1892 -4.1892 -4.1892 -2.3984 -2.3984 -2.3983 -2.3983 4.2557 4.2557 4.2561 4.2561 6.1538 6.1538 6.1549 6.1549 6.5840 6.5840 6.5857 6.5857 9.0865 9.0865 9.1049 9.1050 9.3559 9.3559 9.3752 9.3752 9.4013 9.4014 9.4404 9.4404 10.0947 10.0948 10.1180 10.1180 10.4020 10.4020 10.4124 10.4124 12.5430 12.5430 12.5533 12.5533 12.8884 12.8884 12.8980 12.8981 k = 0.0000 0.3812 0.2261 ( 2880 PWs) bands (ev): -4.1728 -4.1728 -4.1728 -4.1728 -2.4289 -2.4288 -2.4288 -2.4287 4.3244 4.3244 4.3248 4.3248 6.0892 6.0892 6.0900 6.0900 6.5814 6.5814 6.5827 6.5827 9.1268 9.1269 9.1437 9.1437 9.3586 9.3586 9.3815 9.3815 9.4202 9.4202 9.4708 9.4708 10.0707 10.0707 10.0966 10.0966 10.3635 10.3635 10.3746 10.3746 12.5107 12.5107 12.5195 12.5195 12.8937 12.8937 12.9018 12.9018 k = 0.0000 0.3812 0.2368 ( 2882 PWs) bands (ev): -4.1574 -4.1574 -4.1574 -4.1574 -2.4569 -2.4569 -2.4568 -2.4568 4.3911 4.3911 4.3915 4.3915 6.0265 6.0265 6.0271 6.0271 6.5790 6.5790 6.5801 6.5801 9.1559 9.1560 9.1692 9.1692 9.3647 9.3648 9.3940 9.3940 9.4482 9.4482 9.5056 9.5056 10.0459 10.0459 10.0747 10.0747 10.3259 10.3260 10.3377 10.3377 12.4804 12.4804 12.4878 12.4879 12.8986 12.8986 12.9054 12.9054 k = 0.0000 0.3812 0.2476 ( 2888 PWs) bands (ev): -4.1433 -4.1433 -4.1433 -4.1433 -2.4822 -2.4822 -2.4822 -2.4821 4.4546 4.4547 4.4550 4.4550 5.9666 5.9666 5.9671 5.9671 6.5770 6.5770 6.5779 6.5779 9.1723 9.1724 9.1813 9.1814 9.3807 9.3807 9.4176 9.4176 9.4773 9.4773 9.5411 9.5411 10.0210 10.0210 10.0526 10.0527 10.2897 10.2897 10.3021 10.3021 12.4527 12.4528 12.4590 12.4590 12.9030 12.9030 12.9087 12.9087 k = 0.0000 0.3812 0.2584 ( 2884 PWs) bands (ev): -4.1308 -4.1308 -4.1308 -4.1308 -2.5044 -2.5044 -2.5043 -2.5043 4.5137 4.5137 4.5140 4.5140 5.9109 5.9109 5.9113 5.9113 6.5753 6.5753 6.5760 6.5760 9.1784 9.1784 9.1841 9.1841 9.4052 9.4052 9.4485 9.4485 9.5057 9.5057 9.5750 9.5750 9.9968 9.9969 10.0310 10.0311 10.2556 10.2556 10.2683 10.2683 12.4284 12.4285 12.4336 12.4336 12.9069 12.9070 12.9115 12.9115 k = 0.0000 0.3812 0.2691 ( 2888 PWs) bands (ev): -4.1201 -4.1201 -4.1201 -4.1201 -2.5231 -2.5231 -2.5230 -2.5230 4.5664 4.5665 4.5667 4.5667 5.8609 5.8609 5.8612 5.8612 6.5739 6.5739 6.5744 6.5744 9.1784 9.1784 9.1819 9.1819 9.4339 9.4339 9.4803 9.4803 9.5331 9.5331 9.6050 9.6050 9.9749 9.9749 10.0104 10.0105 10.2244 10.2245 10.2371 10.2371 12.4079 12.4079 12.4119 12.4119 12.9103 12.9103 12.9138 12.9139 k = 0.0000 0.3812 0.2799 ( 2884 PWs) bands (ev): -4.1115 -4.1115 -4.1115 -4.1115 -2.5380 -2.5380 -2.5379 -2.5379 4.6110 4.6110 4.6112 4.6113 5.8187 5.8187 5.8189 5.8189 6.5728 6.5728 6.5732 6.5732 9.1759 9.1760 9.1781 9.1781 9.4626 9.4626 9.5068 9.5068 9.5603 9.5603 9.6285 9.6285 9.9573 9.9574 9.9915 9.9915 10.1979 10.1979 10.2095 10.2095 12.3916 12.3916 12.3946 12.3947 12.9130 12.9130 12.9156 12.9156 k = 0.0000 0.3812 0.2907 ( 2884 PWs) bands (ev): -4.1052 -4.1052 -4.1052 -4.1052 -2.5488 -2.5488 -2.5488 -2.5488 4.6452 4.6452 4.6453 4.6453 5.7863 5.7863 5.7864 5.7864 6.5721 6.5721 6.5723 6.5724 9.1731 9.1732 9.1743 9.1744 9.4886 9.4886 9.5233 9.5233 9.5879 9.5879 9.6422 9.6422 9.9464 9.9464 9.9744 9.9745 10.1777 10.1777 10.1869 10.1869 12.3798 12.3799 12.3818 12.3819 12.9150 12.9151 12.9168 12.9168 k = 0.0000 0.3812 0.3014 ( 2880 PWs) bands (ev): -4.1013 -4.1013 -4.1013 -4.1013 -2.5554 -2.5554 -2.5554 -2.5554 4.6668 4.6668 4.6668 4.6669 5.7658 5.7658 5.7658 5.7659 6.5716 6.5717 6.5718 6.5718 9.1712 9.1712 9.1717 9.1718 9.5096 9.5096 9.5286 9.5286 9.6136 9.6137 9.6439 9.6439 9.9438 9.9439 9.9600 9.9600 10.1658 10.1659 10.1710 10.1710 12.3729 12.3729 12.3739 12.3739 12.9165 12.9165 12.9173 12.9173 k = 0.0000 0.3812 0.3122 ( 2872 PWs) bands (ev): -4.1000 -4.1000 -4.1000 -4.1000 -2.5576 -2.5576 -2.5576 -2.5576 4.6742 4.6742 4.6742 4.6742 5.7588 5.7588 5.7588 5.7588 6.5716 6.5716 6.5716 6.5716 9.1707 9.1707 9.1707 9.1707 9.5235 9.5235 9.5235 9.5235 9.6336 9.6336 9.6336 9.6336 9.9491 9.9491 9.9492 9.9492 10.1637 10.1637 10.1637 10.1637 12.3709 12.3709 12.3709 12.3709 12.9172 12.9172 12.9172 12.9172 k = 0.5000-0.0000 0.3122 ( 2916 PWs) bands (ev): -3.9927 -3.9927 -3.9911 -3.9911 -1.1602 -1.1602 -1.1590 -1.1590 3.7893 3.7893 3.7994 3.7994 5.2608 5.2608 5.2709 5.2709 6.5134 6.5134 6.5277 6.5277 7.3234 7.3234 7.3348 7.3348 8.2247 8.2247 8.2358 8.2358 9.2221 9.2221 9.2519 9.2519 9.6017 9.6017 9.6377 9.6377 10.6437 10.6437 10.6635 10.6635 11.8590 11.8590 11.8973 11.8973 13.1529 13.1529 13.1731 13.1731 k = 0.5000-0.0000 0.3014 ( 2916 PWs) bands (ev): -3.9932 -3.9932 -3.9915 -3.9915 -1.1592 -1.1592 -1.1581 -1.1581 3.7900 3.7900 3.8000 3.8000 5.2604 5.2604 5.2705 5.2705 6.5126 6.5126 6.5270 6.5270 7.3252 7.3252 7.3366 7.3366 8.2165 8.2165 8.2274 8.2274 9.2233 9.2233 9.2532 9.2532 9.6068 9.6068 9.6426 9.6426 10.6437 10.6437 10.6635 10.6635 11.8604 11.8604 11.8986 11.8986 13.1523 13.1523 13.1725 13.1725 k = 0.5000-0.0000 0.2907 ( 2912 PWs) bands (ev): -3.9946 -3.9946 -3.9929 -3.9929 -1.1563 -1.1563 -1.1551 -1.1551 3.7920 3.7920 3.8020 3.8020 5.2593 5.2593 5.2695 5.2695 6.5104 6.5104 6.5250 6.5250 7.3307 7.3307 7.3419 7.3419 8.1925 8.1925 8.2030 8.2030 9.2271 9.2271 9.2571 9.2571 9.6216 9.6216 9.6569 9.6569 10.6436 10.6436 10.6633 10.6633 11.8646 11.8646 11.9026 11.9026 13.1503 13.1503 13.1705 13.1705 k = 0.5000-0.0000 0.2799 ( 2910 PWs) bands (ev): -3.9968 -3.9968 -3.9952 -3.9952 -1.1514 -1.1514 -1.1502 -1.1502 3.7954 3.7954 3.8052 3.8052 5.2574 5.2574 5.2677 5.2677 6.5068 6.5068 6.5217 6.5217 7.3395 7.3395 7.3505 7.3505 8.1543 8.1543 8.1641 8.1641 9.2331 9.2331 9.2633 9.2633 9.6447 9.6447 9.6794 9.6794 10.6434 10.6434 10.6631 10.6631 11.8716 11.8716 11.9091 11.9091 13.1470 13.1470 13.1672 13.1672 k = 0.5000-0.0000 0.2691 ( 2906 PWs) bands (ev): -4.0000 -4.0000 -3.9984 -3.9984 -1.1446 -1.1446 -1.1435 -1.1435 3.8001 3.8001 3.8098 3.8098 5.2548 5.2548 5.2655 5.2655 6.5019 6.5019 6.5171 6.5171 7.3512 7.3512 7.3620 7.3620 8.1041 8.1041 8.1131 8.1131 9.2411 9.2411 9.2715 9.2715 9.6747 9.6747 9.7085 9.7085 10.6431 10.6431 10.6627 10.6627 11.8813 11.8813 11.9182 11.9182 13.1424 13.1424 13.1626 13.1626 k = 0.5000-0.0000 0.2584 ( 2898 PWs) bands (ev): -4.0040 -4.0040 -4.0024 -4.0024 -1.1361 -1.1361 -1.1350 -1.1350 3.8061 3.8061 3.8156 3.8156 5.2517 5.2517 5.2627 5.2627 6.4957 6.4957 6.5114 6.5114 7.3651 7.3651 7.3754 7.3754 8.0447 8.0447 8.0529 8.0529 9.2510 9.2510 9.2815 9.2815 9.7095 9.7095 9.7424 9.7424 10.6427 10.6427 10.6623 10.6623 11.8937 11.8937 11.9298 11.9298 13.1365 13.1365 13.1567 13.1567 k = 0.5000-0.0000 0.2476 ( 2902 PWs) bands (ev): -4.0087 -4.0087 -4.0072 -4.0072 -1.1259 -1.1259 -1.1248 -1.1248 3.8134 3.8134 3.8226 3.8226 5.2483 5.2483 5.2597 5.2597 6.4883 6.4883 6.5045 6.5045 7.3798 7.3798 7.3898 7.3898 7.9790 7.9790 7.9864 7.9864 9.2624 9.2624 9.2930 9.2930 9.7472 9.7472 9.7790 9.7790 10.6422 10.6422 10.6616 10.6616 11.9084 11.9084 11.9436 11.9436 13.1292 13.1292 13.1494 13.1494 k = 0.5000-0.0000 0.2368 ( 2892 PWs) bands (ev): -4.0141 -4.0141 -4.0126 -4.0126 -1.1141 -1.1141 -1.1131 -1.1131 3.8219 3.8219 3.8308 3.8308 5.2446 5.2446 5.2565 5.2565 6.4798 6.4798 6.4966 6.4966 7.3935 7.3935 7.4031 7.4031 7.9106 7.9106 7.9172 7.9172 9.2755 9.2755 9.3060 9.3060 9.7863 9.7863 9.8171 9.8171 10.6417 10.6417 10.6610 10.6610 11.9256 11.9256 11.9597 11.9597 13.1205 13.1205 13.1407 13.1407 k = 0.5000-0.0000 0.2261 ( 2888 PWs) bands (ev): -4.0202 -4.0202 -4.0187 -4.0187 -1.1009 -1.1009 -1.0999 -1.0999 3.8317 3.8317 3.8402 3.8402 5.2409 5.2409 5.2533 5.2533 6.4702 6.4702 6.4876 6.4876 7.4030 7.4030 7.4122 7.4122 7.8442 7.8442 7.8500 7.8500 9.2900 9.2900 9.3205 9.3205 9.8253 9.8253 9.8550 9.8550 10.6410 10.6410 10.6601 10.6601 11.9449 11.9449 11.9778 11.9778 13.1104 13.1104 13.1307 13.1307 k = 0.5000-0.0000 0.2153 ( 2884 PWs) bands (ev): -4.0268 -4.0268 -4.0254 -4.0254 -1.0865 -1.0865 -1.0856 -1.0856 3.8426 3.8426 3.8508 3.8508 5.2374 5.2374 5.2504 5.2504 6.4595 6.4595 6.4775 6.4775 7.4028 7.4028 7.4116 7.4116 7.7863 7.7863 7.7914 7.7914 9.3058 9.3058 9.3362 9.3362 9.8631 9.8631 9.8918 9.8918 10.6403 10.6403 10.6592 10.6592 11.9662 11.9662 11.9977 11.9977 13.0989 13.0989 13.1193 13.1193 k = 0.5000-0.0000 0.2045 ( 2888 PWs) bands (ev): -4.0338 -4.0338 -4.0324 -4.0324 -1.0711 -1.0711 -1.0701 -1.0701 3.8546 3.8546 3.8623 3.8623 5.2344 5.2344 5.2479 5.2479 6.4476 6.4476 6.4663 6.4663 7.3857 7.3857 7.3940 7.3940 7.7451 7.7451 7.7496 7.7496 9.3229 9.3229 9.3531 9.3531 9.8990 9.8990 9.9267 9.9267 10.6395 10.6395 10.6581 10.6581 11.9891 11.9891 12.0192 12.0192 13.0860 13.0860 13.1065 13.1065 k = 0.5000-0.0000 0.1938 ( 2898 PWs) bands (ev): -4.0412 -4.0412 -4.0399 -4.0399 -1.0547 -1.0547 -1.0538 -1.0538 3.8676 3.8676 3.8749 3.8749 5.2320 5.2320 5.2462 5.2462 6.4343 6.4343 6.4537 6.4537 7.3470 7.3470 7.3544 7.3544 7.7263 7.7263 7.7304 7.7304 9.3410 9.3410 9.3711 9.3711 9.9324 9.9324 9.9590 9.9590 10.6386 10.6386 10.6568 10.6568 12.0136 12.0136 12.0421 12.0421 13.0716 13.0716 13.0922 13.0922 k = 0.5000-0.0000 0.1830 ( 2900 PWs) bands (ev): -4.0488 -4.0488 -4.0476 -4.0476 -1.0377 -1.0377 -1.0368 -1.0368 3.8816 3.8816 3.8883 3.8883 5.2306 5.2306 5.2454 5.2454 6.4194 6.4194 6.4394 6.4394 7.2891 7.2891 7.2956 7.2956 7.7280 7.7280 7.7319 7.7319 9.3603 9.3603 9.3901 9.3901 9.9629 9.9629 9.9885 9.9885 10.6377 10.6377 10.6555 10.6555 12.0394 12.0394 12.0664 12.0664 13.0558 13.0558 13.0766 13.0766 k = 0.5000-0.0000 0.1723 ( 2900 PWs) bands (ev): -4.0566 -4.0566 -4.0554 -4.0554 -1.0202 -1.0202 -1.0194 -1.0194 3.8964 3.8964 3.9026 3.9026 5.2303 5.2303 5.2459 5.2459 6.4025 6.4025 6.4232 6.4232 7.2193 7.2193 7.2249 7.2249 7.7440 7.7440 7.7476 7.7476 9.3804 9.3804 9.4099 9.4099 9.9903 9.9903 10.0148 10.0148 10.6368 10.6368 10.6541 10.6541 12.0663 12.0663 12.0916 12.0916 13.0386 13.0386 13.0595 13.0595 k = 0.5000-0.0000 0.1615 ( 2900 PWs) bands (ev): -4.0645 -4.0645 -4.0633 -4.0633 -1.0024 -1.0024 -1.0016 -1.0016 3.9118 3.9118 3.9175 3.9175 5.2316 5.2316 5.2479 5.2479 6.3830 6.3830 6.4045 6.4045 7.1441 7.1441 7.1488 7.1488 7.7684 7.7684 7.7718 7.7718 9.4013 9.4013 9.4303 9.4303 10.0145 10.0145 10.0380 10.0380 10.6358 10.6358 10.6526 10.6526 12.0940 12.0940 12.1178 12.1178 13.0200 13.0200 13.0412 13.0412 k = 0.5000-0.0000 0.1507 ( 2902 PWs) bands (ev): -4.0723 -4.0723 -4.0712 -4.0712 -0.9845 -0.9845 -0.9838 -0.9838 3.9277 3.9277 3.9329 3.9329 5.2347 5.2347 5.2517 5.2517 6.3602 6.3602 6.3825 6.3825 7.0681 7.0681 7.0719 7.0719 7.7977 7.7977 7.8008 7.8008 9.4227 9.4227 9.4512 9.4512 10.0353 10.0353 10.0578 10.0578 10.6348 10.6348 10.6510 10.6510 12.1224 12.1224 12.1446 12.1446 13.0000 13.0000 13.0213 13.0213 k = 0.5000-0.0000 0.1400 ( 2902 PWs) bands (ev): -4.0800 -4.0800 -4.0790 -4.0790 -0.9668 -0.9668 -0.9661 -0.9661 3.9440 3.9440 3.9486 3.9486 5.2399 5.2399 5.2576 5.2576 6.3333 6.3333 6.3564 6.3564 6.9944 6.9944 6.9975 6.9975 7.8296 7.8296 7.8325 7.8325 9.4445 9.4445 9.4723 9.4723 10.0531 10.0531 10.0745 10.0745 10.6338 10.6338 10.6492 10.6492 12.1512 12.1512 12.1719 12.1719 12.9786 12.9786 13.0002 13.0002 k = 0.5000-0.0000 0.1292 ( 2902 PWs) bands (ev): -4.0875 -4.0875 -4.0866 -4.0866 -0.9494 -0.9494 -0.9488 -0.9488 3.9605 3.9605 3.9645 3.9645 5.2475 5.2475 5.2659 5.2659 6.3013 6.3013 6.3253 6.3253 6.9255 6.9255 6.9278 6.9279 7.8627 7.8627 7.8654 7.8654 9.4664 9.4664 9.4934 9.4934 10.0678 10.0678 10.0882 10.0882 10.6327 10.6327 10.6474 10.6474 12.1804 12.1804 12.1997 12.1997 12.9559 12.9559 12.9776 12.9776 k = 0.5000-0.0000 0.1184 ( 2904 PWs) bands (ev): -4.0948 -4.0948 -4.0939 -4.0939 -0.9326 -0.9326 -0.9320 -0.9320 3.9768 3.9768 3.9803 3.9803 5.2578 5.2578 5.2769 5.2769 6.2636 6.2636 6.2882 6.2882 6.8631 6.8631 6.8650 6.8650 7.8961 7.8961 7.8985 7.8985 9.4883 9.4883 9.5143 9.5143 10.0797 10.0797 10.0990 10.0990 10.6317 10.6317 10.6456 10.6456 12.2098 12.2098 12.2277 12.2277 12.9320 12.9320 12.9538 12.9538 k = 0.5000-0.0000 0.1077 ( 2900 PWs) bands (ev): -4.1016 -4.1016 -4.1008 -4.1008 -0.9165 -0.9165 -0.9160 -0.9160 3.9929 3.9929 3.9958 3.9958 5.2711 5.2711 5.2909 5.2909 6.2195 6.2195 6.2445 6.2445 6.8087 6.8088 6.8103 6.8103 7.9289 7.9289 7.9310 7.9310 9.5098 9.5098 9.5347 9.5347 10.0891 10.0891 10.1073 10.1073 10.6308 10.6308 10.6437 10.6437 12.2392 12.2392 12.2559 12.2559 12.9069 12.9069 12.9287 12.9287 k = 0.5000-0.0000 0.0969 ( 2900 PWs) bands (ev): -4.1080 -4.1080 -4.1073 -4.1073 -0.9013 -0.9013 -0.9009 -0.9009 4.0085 4.0085 4.0109 4.0109 5.2876 5.2876 5.3081 5.3081 6.1692 6.1692 6.1945 6.1945 6.7628 6.7629 6.7642 6.7643 7.9604 7.9604 7.9623 7.9623 9.5309 9.5309 9.5544 9.5544 10.0962 10.0962 10.1131 10.1131 10.6298 10.6298 10.6418 10.6418 12.2686 12.2686 12.2842 12.2843 12.8808 12.8808 12.9023 12.9023 k = 0.5000-0.0000 0.0861 ( 2900 PWs) bands (ev): -4.1140 -4.1140 -4.1134 -4.1133 -0.8872 -0.8872 -0.8868 -0.8868 4.0232 4.0232 4.0251 4.0251 5.3077 5.3077 5.3287 5.3287 6.1134 6.1134 6.1387 6.1387 6.7253 6.7253 6.7265 6.7265 7.9903 7.9903 7.9919 7.9919 9.5511 9.5511 9.5730 9.5730 10.1012 10.1012 10.1169 10.1169 10.6290 10.6290 10.6399 10.6399 12.2979 12.2979 12.3126 12.3126 12.8538 12.8538 12.8749 12.8749 k = 0.5000-0.0000 0.0754 ( 2900 PWs) bands (ev): -4.1193 -4.1193 -4.1188 -4.1188 -0.8744 -0.8744 -0.8741 -0.8741 4.0369 4.0369 4.0384 4.0384 5.3315 5.3315 5.3531 5.3531 6.0534 6.0534 6.0786 6.0786 6.6952 6.6953 6.6963 6.6964 8.0178 8.0178 8.0192 8.0192 9.5701 9.5701 9.5903 9.5903 10.1047 10.1047 10.1190 10.1190 10.6283 10.6283 10.6380 10.6380 12.3270 12.3270 12.3408 12.3408 12.8261 12.8261 12.8466 12.8466 k = 0.5000-0.0000 0.0646 ( 2908 PWs) bands (ev): -4.1241 -4.1241 -4.1236 -4.1236 -0.8630 -0.8630 -0.8627 -0.8627 4.0493 4.0493 4.0505 4.0505 5.3593 5.3593 5.3813 5.3813 5.9906 5.9906 6.0156 6.0156 6.6717 6.6717 6.6726 6.6727 8.0427 8.0427 8.0439 8.0439 9.5878 9.5878 9.6058 9.6058 10.1069 10.1069 10.1196 10.1196 10.6276 10.6276 10.6361 10.6361 12.3557 12.3557 12.3687 12.3687 12.7982 12.7982 12.8177 12.8177 k = 0.5000-0.0000 0.0538 ( 2900 PWs) bands (ev): -4.1282 -4.1282 -4.1278 -4.1278 -0.8531 -0.8531 -0.8528 -0.8528 4.0602 4.0602 4.0611 4.0611 5.3910 5.3910 5.4134 5.4134 5.9267 5.9267 5.9513 5.9513 6.6536 6.6537 6.6544 6.6544 8.0645 8.0645 8.0655 8.0655 9.6037 9.6037 9.6194 9.6194 10.1082 10.1082 10.1192 10.1192 10.6272 10.6272 10.6344 10.6344 12.3837 12.3837 12.3959 12.3959 12.7706 12.7706 12.7888 12.7888 k = 0.5000-0.0000 0.0431 ( 2904 PWs) bands (ev): -4.1316 -4.1316 -4.1313 -4.1313 -0.8448 -0.8448 -0.8446 -0.8446 4.0694 4.0694 4.0700 4.0700 5.4268 5.4268 5.4494 5.4494 5.8628 5.8628 5.8871 5.8871 6.6400 6.6400 6.6406 6.6406 8.0828 8.0829 8.0836 8.0836 9.6177 9.6177 9.6306 9.6306 10.1089 10.1089 10.1180 10.1180 10.6269 10.6269 10.6327 10.6328 12.4106 12.4107 12.4219 12.4219 12.7440 12.7440 12.7605 12.7605 k = 0.5000-0.0000 0.0323 ( 2900 PWs) bands (ev): -4.1342 -4.1342 -4.1340 -4.1340 -0.8383 -0.8383 -0.8381 -0.8381 4.0768 4.0768 4.0772 4.0772 5.4664 5.4664 5.4890 5.4890 5.8005 5.8005 5.8243 5.8243 6.6301 6.6301 6.6305 6.6306 8.0975 8.0975 8.0981 8.0981 9.6293 9.6293 9.6393 9.6393 10.1094 10.1094 10.1164 10.1164 10.6268 10.6268 10.6313 10.6313 12.4357 12.4357 12.4457 12.4457 12.7198 12.7198 12.7339 12.7339 k = 0.5000-0.0000 0.0215 ( 2902 PWs) bands (ev): -4.1361 -4.1361 -4.1360 -4.1360 -0.8336 -0.8336 -0.8335 -0.8335 4.0821 4.0821 4.0824 4.0824 5.5093 5.5093 5.5313 5.5313 5.7415 5.7415 5.7643 5.7643 6.6234 6.6234 6.6237 6.6237 8.1081 8.1081 8.1085 8.1085 9.6383 9.6383 9.6451 9.6451 10.1099 10.1099 10.1146 10.1146 10.6270 10.6270 10.6300 10.6300 12.4575 12.4575 12.4653 12.4653 12.6998 12.6998 12.7105 12.7106 k = 0.5000-0.0000 0.0108 ( 2910 PWs) bands (ev): -4.1373 -4.1373 -4.1372 -4.1372 -0.8307 -0.8307 -0.8307 -0.8307 4.0854 4.0854 4.0855 4.0855 5.5533 5.5533 5.5723 5.5723 5.6903 5.6903 5.7096 5.7096 6.6195 6.6195 6.6197 6.6197 8.1146 8.1146 8.1148 8.1148 9.6445 9.6445 9.6479 9.6479 10.1105 10.1105 10.1130 10.1130 10.6273 10.6273 10.6288 10.6288 12.4736 12.4736 12.4782 12.4782 12.6870 12.6870 12.6930 12.6930 k = 0.5000-0.0000-0.0000 ( 2906 PWs) bands (ev): -4.1376 -4.1376 -4.1376 -4.1376 -0.8297 -0.8297 -0.8297 -0.8297 4.0865 4.0865 4.0865 4.0865 5.5870 5.5870 5.5870 5.5870 5.6722 5.6722 5.6722 5.6722 6.6183 6.6183 6.6183 6.6183 8.1168 8.1168 8.1168 8.1168 9.6477 9.6477 9.6478 9.6478 10.1116 10.1116 10.1116 10.1116 10.6280 10.6280 10.6280 10.6280 12.4812 12.4812 12.4813 12.4813 12.6845 12.6845 12.6845 12.6845 k = 0.5000 0.3812-0.0000 ( 2900 PWs) bands (ev): -3.7672 -3.7672 -3.7669 -3.7669 -1.4926 -1.4926 -1.4821 -1.4821 4.6856 4.6856 4.7032 4.7032 4.8471 4.8471 4.8561 4.8561 6.0704 6.0704 6.1101 6.1101 6.3742 6.3742 6.4216 6.4216 7.3683 7.3683 7.3749 7.3749 9.9314 9.9314 10.0087 10.0087 10.2404 10.2404 10.2772 10.2772 10.6781 10.6781 10.7011 10.7011 12.5243 12.5243 12.5276 12.5276 13.0169 13.0169 13.0439 13.0439 k = 0.5000 0.3812 0.0108 ( 2904 PWs) bands (ev): -3.7669 -3.7669 -3.7665 -3.7665 -1.4930 -1.4926 -1.4826 -1.4821 4.6698 4.6760 4.6865 4.6930 4.8496 4.8549 4.8590 4.8647 6.0692 6.0733 6.1088 6.1129 6.3827 6.3842 6.4297 6.4313 7.3691 7.3694 7.3755 7.3760 9.9299 9.9342 10.0071 10.0116 10.2374 10.2417 10.2739 10.2785 10.6776 10.6784 10.7007 10.7014 12.5237 12.5250 12.5269 12.5283 13.0126 13.0200 13.0396 13.0470 k = 0.5000 0.3812 0.0215 ( 2900 PWs) bands (ev): -3.7659 -3.7659 -3.7656 -3.7655 -1.4939 -1.4930 -1.4835 -1.4826 4.6354 4.6451 4.6504 4.6604 4.8584 4.8665 4.8686 4.8771 6.0713 6.0790 6.1105 6.1183 6.4079 6.4112 6.4541 6.4578 7.3718 7.3724 7.3781 7.3790 9.9298 9.9385 10.0069 10.0160 10.2328 10.2413 10.2689 10.2781 10.6771 10.6787 10.7004 10.7016 12.5231 12.5257 12.5261 12.5289 13.0071 13.0220 13.0341 13.0487 k = 0.5000 0.3812 0.0323 ( 2896 PWs) bands (ev): -3.7643 -3.7642 -3.7639 -3.7638 -1.4952 -1.4939 -1.4849 -1.4836 4.5903 4.6017 4.6037 4.6152 4.8649 4.8741 4.8755 4.8849 6.0798 6.0904 6.1182 6.1289 6.4462 6.4520 6.4915 6.4979 7.3764 7.3773 7.3827 7.3840 9.9311 9.9443 10.0080 10.0218 10.2267 10.2392 10.2621 10.2757 10.6766 10.6790 10.7000 10.7019 12.5227 12.5252 12.5265 12.5293 13.0006 13.0228 13.0273 13.0492 k = 0.5000 0.3812 0.0431 ( 2896 PWs) bands (ev): -3.7620 -3.7619 -3.7616 -3.7615 -1.4970 -1.4952 -1.4867 -1.4850 4.5393 4.5513 4.5513 4.5634 4.8642 4.8736 4.8743 4.8839 6.0977 6.1104 6.1347 6.1476 6.4939 6.5029 6.5381 6.5479 7.3831 7.3843 7.3892 7.3909 9.9337 9.9515 10.0103 10.0289 10.2189 10.2352 10.2535 10.2714 10.6760 10.6792 10.6996 10.7021 12.5225 12.5245 12.5275 12.5299 12.9929 13.0193 13.0223 13.0483 k = 0.5000 0.3812 0.0538 ( 2900 PWs) bands (ev): -3.7590 -3.7589 -3.7587 -3.7586 -1.4991 -1.4969 -1.4890 -1.4868 4.4852 4.4960 4.4973 4.5081 4.8540 4.8632 4.8634 4.8726 6.1264 6.1406 6.1616 6.1759 6.5480 6.5607 6.5911 6.6049 7.3920 7.3934 7.3979 7.3999 9.9376 9.9602 10.0138 10.0376 10.2096 10.2294 10.2432 10.2651 10.6754 10.6793 10.6991 10.7022 12.5227 12.5239 12.5288 12.5305 12.9841 13.0101 13.0206 13.0460 k = 0.5000 0.3812 0.0646 ( 2900 PWs) bands (ev): -3.7555 -3.7554 -3.7552 -3.7551 -1.5017 -1.4990 -1.4917 -1.4891 4.4296 4.4393 4.4416 4.4512 4.8343 4.8421 4.8435 4.8513 6.1660 6.1809 6.1989 6.2141 6.6060 6.6229 6.6479 6.6663 7.4034 7.4050 7.4090 7.4112 9.9429 9.9704 10.0184 10.0478 10.1990 10.2218 10.2313 10.2568 10.6747 10.6795 10.6986 10.7024 12.5234 12.5238 12.5304 12.5314 12.9743 12.9997 13.0176 13.0424 k = 0.5000 0.3812 0.0754 ( 2904 PWs) bands (ev): -3.7515 -3.7513 -3.7512 -3.7510 -1.5046 -1.5015 -1.4948 -1.4918 4.3738 4.3825 4.3853 4.3939 4.8060 4.8122 4.8150 4.8212 6.2156 6.2307 6.2460 6.2616 6.6662 6.6877 6.7067 6.7301 7.4175 7.4193 7.4226 7.4251 9.9493 9.9822 10.0240 10.0596 10.1871 10.2122 10.2179 10.2466 10.6739 10.6795 10.6981 10.7025 12.5241 12.5247 12.5325 12.5327 12.9634 12.9882 13.0133 13.0374 k = 0.5000 0.3812 0.0861 ( 2904 PWs) bands (ev): -3.7469 -3.7467 -3.7466 -3.7464 -1.5079 -1.5044 -1.4983 -1.4949 4.3185 4.3264 4.3294 4.3372 4.7704 4.7750 4.7792 4.7838 6.2735 6.2885 6.3015 6.3169 6.7269 6.7533 6.7659 6.7946 7.4346 7.4368 7.4392 7.4420 9.9569 9.9954 10.0302 10.0731 10.1744 10.2007 10.2033 10.2344 10.6732 10.6796 10.6975 10.7026 12.5253 12.5269 12.5346 12.5352 12.9516 12.9756 13.0078 13.0311 k = 0.5000 0.3812 0.0969 ( 2904 PWs) bands (ev): -3.7418 -3.7417 -3.7416 -3.7414 -1.5115 -1.5076 -1.5021 -1.4983 4.2644 4.2717 4.2746 4.2817 4.7291 4.7322 4.7376 4.7407 6.3381 6.3525 6.3637 6.3786 6.7868 6.8183 6.8242 6.8583 7.4553 7.4578 7.4590 7.4622 9.9653 10.0100 10.0366 10.0880 10.1614 10.1873 10.1875 10.2204 10.6724 10.6796 10.6969 10.7026 12.5274 12.5302 12.5372 12.5388 12.9388 12.9620 13.0011 13.0234 k = 0.5000 0.3812 0.1077 ( 2904 PWs) bands (ev): -3.7364 -3.7362 -3.7361 -3.7359 -1.5155 -1.5111 -1.5063 -1.5021 4.2121 4.2187 4.2214 4.2278 4.6835 4.6852 4.6917 4.6934 6.4076 6.4212 6.4310 6.4451 6.8450 6.8804 6.8815 6.9199 7.4800 7.4824 7.4829 7.4863 9.9743 10.0256 10.0418 10.1044 10.1494 10.1714 10.1719 10.2046 10.6716 10.6796 10.6963 10.7026 12.5307 12.5348 12.5407 12.5434 12.9251 12.9473 12.9931 13.0144 k = 0.5000 0.3812 0.1184 ( 2900 PWs) bands (ev): -3.7305 -3.7303 -3.7303 -3.7300 -1.5197 -1.5149 -1.5108 -1.5061 4.1620 4.1680 4.1703 4.1761 4.6349 4.6355 4.6428 4.6434 6.4804 6.4931 6.5018 6.5149 6.9006 6.9337 6.9418 6.9781 7.5091 7.5097 7.5128 7.5149 9.9831 10.0417 10.0437 10.1214 10.1409 10.1552 10.1559 10.1874 10.6708 10.6796 10.6957 10.7026 12.5356 12.5410 12.5455 12.5492 12.9106 12.9317 12.9841 13.0041 k = 0.5000 0.3812 0.1292 ( 2900 PWs) bands (ev): -3.7244 -3.7242 -3.7242 -3.7239 -1.5241 -1.5189 -1.5155 -1.5105 4.1143 4.1199 4.1215 4.1269 4.5841 4.5845 4.5915 4.5920 6.5550 6.5667 6.5745 6.5867 6.9527 6.9832 6.9979 7.0317 7.5413 7.5427 7.5481 7.5484 9.9901 10.0392 10.0565 10.1279 10.1384 10.1432 10.1485 10.1696 10.6699 10.6795 10.6949 10.7025 12.5423 12.5489 12.5516 12.5564 12.8956 12.9153 12.9741 12.9928 k = 0.5000 0.3812 0.1400 ( 2908 PWs) bands (ev): -3.7180 -3.7179 -3.7178 -3.7176 -1.5287 -1.5231 -1.5205 -1.5150 4.0693 4.0745 4.0754 4.0804 4.5319 4.5331 4.5388 4.5402 6.6301 6.6409 6.6478 6.6591 7.0010 7.0285 7.0491 7.0799 7.5774 7.5811 7.5874 7.5891 9.9927 10.0269 10.0663 10.1099 10.1371 10.1416 10.1536 10.1671 10.6689 10.6794 10.6941 10.7023 12.5509 12.5588 12.5592 12.5651 12.8800 12.8983 12.9633 12.9805 k = 0.5000 0.3812 0.1507 ( 2904 PWs) bands (ev): -3.7115 -3.7113 -3.7112 -3.7110 -1.5334 -1.5274 -1.5256 -1.5197 4.0273 4.0322 4.0322 4.0368 4.4798 4.4816 4.4861 4.4881 6.7042 6.7146 6.7204 6.7312 7.0453 7.0697 7.0950 7.1225 7.6179 7.6239 7.6319 7.6360 9.9880 10.0081 10.0659 10.0864 10.1353 10.1501 10.1522 10.1895 10.6680 10.6793 10.6932 10.7021 12.5619 12.5688 12.5709 12.5756 12.8643 12.8809 12.9520 12.9675 k = 0.5000 0.3812 0.1615 ( 2920 PWs) bands (ev): -3.7049 -3.7048 -3.7046 -3.7044 -1.5382 -1.5319 -1.5308 -1.5246 3.9884 3.9921 3.9930 3.9963 4.4282 4.4306 4.4338 4.4364 6.7761 6.7866 6.7909 6.8018 7.0858 7.1069 7.1354 7.1594 7.6626 7.6709 7.6816 7.6883 9.9743 9.9845 10.0534 10.0603 10.1347 10.1650 10.1669 10.2132 10.6670 10.6791 10.6922 10.7017 12.5754 12.5803 12.5853 12.5878 12.8488 12.8634 12.9403 12.9539 k = 0.5000 0.3812 0.1723 ( 2924 PWs) bands (ev): -3.6983 -3.6982 -3.6980 -3.6978 -1.5431 -1.5364 -1.5360 -1.5295 3.9528 3.9551 3.9571 3.9590 4.3779 4.3807 4.3826 4.3856 6.8446 6.8562 6.8582 6.8700 7.1228 7.1407 7.1705 7.1910 7.7114 7.7217 7.7361 7.7451 9.9529 9.9576 10.0314 10.0321 10.1431 10.1843 10.1869 10.2379 10.6660 10.6790 10.6911 10.7014 12.5913 12.5940 12.6015 12.6023 12.8339 12.8461 12.9287 12.9403 k = 0.5000 0.3812 0.1830 ( 2924 PWs) bands (ev): -3.6918 -3.6916 -3.6914 -3.6913 -1.5479 -1.5413 -1.5408 -1.5344 3.9205 3.9214 3.9246 3.9251 4.3291 4.3322 4.3329 4.3362 6.9084 6.9211 6.9225 6.9351 7.1570 7.1718 7.2008 7.2182 7.7635 7.7755 7.7946 7.8055 9.9262 9.9281 10.0020 10.0036 10.1580 10.2034 10.2117 10.2632 10.6651 10.6789 10.6899 10.7010 12.6086 12.6111 12.6176 12.6204 12.8207 12.8297 12.9178 12.9269 k = 0.5000 0.3812 0.1938 ( 2916 PWs) bands (ev): -3.6854 -3.6853 -3.6850 -3.6849 -1.5526 -1.5465 -1.5452 -1.5392 3.8909 3.8918 3.8945 3.8955 4.2823 4.2851 4.2856 4.2887 6.9663 6.9783 6.9849 6.9963 7.1891 7.2011 7.2271 7.2414 7.8183 7.8317 7.8559 7.8684 9.8959 9.8967 9.9702 9.9725 10.1767 10.2236 10.2380 10.2887 10.6641 10.6788 10.6886 10.7005 12.6264 12.6314 12.6349 12.6396 12.8104 12.8153 12.9081 12.9144 k = 0.5000 0.3812 0.2045 ( 2916 PWs) bands (ev): -3.6792 -3.6791 -3.6788 -3.6787 -1.5571 -1.5515 -1.5495 -1.5439 3.8639 3.8663 3.8673 3.8699 4.2379 4.2396 4.2413 4.2433 7.0175 7.0288 7.0427 7.0531 7.2199 7.2293 7.2499 7.2614 7.8751 7.8893 7.9191 7.9327 9.8630 9.8636 9.9370 9.9391 10.1976 10.2442 10.2649 10.3140 10.6632 10.6787 10.6872 10.6999 12.6455 12.6527 12.6530 12.6575 12.8045 12.8057 12.9008 12.9036 k = 0.5000 0.3812 0.2153 ( 2924 PWs) bands (ev): -3.6733 -3.6732 -3.6729 -3.6728 -1.5615 -1.5563 -1.5535 -1.5485 3.8403 3.8434 3.8442 3.8477 4.1961 4.1967 4.1996 4.2004 7.0613 7.0718 7.0955 7.1050 7.2496 7.2570 7.2698 7.2786 7.9329 7.9475 7.9829 7.9971 9.8285 9.8293 9.9027 9.9042 10.2194 10.2646 10.2916 10.3384 10.6624 10.6786 10.6856 10.6992 12.6651 12.6702 12.6713 12.6714 12.8011 12.8103 12.8957 12.8970 k = 0.5000 0.3812 0.2261 ( 2920 PWs) bands (ev): -3.6678 -3.6678 -3.6674 -3.6673 -1.5655 -1.5609 -1.5573 -1.5528 3.8199 3.8228 3.8255 3.8288 4.1565 4.1575 4.1603 4.1609 7.0975 7.1073 7.1429 7.1518 7.2776 7.2842 7.2881 7.2937 7.9907 8.0053 8.0463 8.0606 9.7932 9.7944 9.8679 9.8687 10.2416 10.2845 10.3179 10.3618 10.6617 10.6787 10.6839 10.6984 12.6764 12.6827 12.6840 12.6872 12.8101 12.8271 12.8924 12.8983 k = 0.5000 0.3812 0.2368 ( 2912 PWs) bands (ev): -3.6628 -3.6627 -3.6623 -3.6623 -1.5692 -1.5651 -1.5608 -1.5568 3.8027 3.8054 3.8101 3.8132 4.1198 4.1222 4.1234 4.1254 7.1269 7.1356 7.1847 7.1930 7.2982 7.3048 7.3102 7.3124 8.0473 8.0614 8.1080 8.1219 9.7579 9.7596 9.8333 9.8333 10.2635 10.3033 10.3430 10.3834 10.6611 10.6789 10.6821 10.6974 12.6754 12.6846 12.7002 12.7004 12.8338 12.8557 12.8956 12.9064 k = 0.5000 0.3812 0.2476 ( 2912 PWs) bands (ev): -3.6583 -3.6582 -3.6578 -3.6577 -1.5725 -1.5690 -1.5639 -1.5605 3.7886 3.7911 3.7978 3.8006 4.0866 4.0900 4.0905 4.0935 7.1501 7.1577 7.2209 7.2287 7.3119 7.3160 7.3351 7.3369 8.1014 8.1145 8.1665 8.1796 9.7234 9.7255 9.7990 9.7996 10.2843 10.3204 10.3664 10.4027 10.6608 10.6793 10.6800 10.6963 12.6705 12.6800 12.7094 12.7119 12.8691 12.8928 12.9068 12.9220 k = 0.5000 0.3812 0.2584 ( 2916 PWs) bands (ev): -3.6543 -3.6543 -3.6538 -3.6538 -1.5754 -1.5724 -1.5666 -1.5637 3.7773 3.7795 3.7883 3.7909 4.0575 4.0606 4.0628 4.0656 7.1682 7.1746 7.2513 7.2587 7.3228 7.3250 7.3580 7.3593 8.1515 8.1633 8.2206 8.2324 9.6909 9.6933 9.7669 9.7679 10.3036 10.3351 10.3877 10.4193 10.6608 10.6778 10.6798 10.6950 12.6640 12.6726 12.7143 12.7185 12.9120 12.9264 12.9349 12.9450 k = 0.5000 0.3812 0.2691 ( 2920 PWs) bands (ev): -3.6511 -3.6510 -3.6505 -3.6505 -1.5777 -1.5753 -1.5688 -1.5665 3.7687 3.7706 3.7814 3.7836 4.0327 4.0354 4.0396 4.0419 7.1822 7.1873 7.2760 7.2829 7.3317 7.3322 7.3775 7.3784 8.1960 8.2060 8.2684 8.2786 9.6616 9.6640 9.7381 9.7393 10.3209 10.3472 10.4065 10.4327 10.6610 10.6755 10.6807 10.6936 12.6576 12.6647 12.7163 12.7208 12.9523 12.9591 12.9690 12.9836 k = 0.5000 0.3812 0.2799 ( 2916 PWs) bands (ev): -3.6484 -3.6484 -3.6479 -3.6479 -1.5795 -1.5777 -1.5705 -1.5687 3.7626 3.7640 3.7768 3.7786 4.0128 4.0150 4.0210 4.0229 7.1926 7.1964 7.2952 7.3014 7.3380 7.3387 7.3931 7.3937 8.2333 8.2412 8.3085 8.3166 9.6369 9.6390 9.7139 9.7151 10.3359 10.3562 10.4224 10.4427 10.6618 10.6731 10.6818 10.6920 12.6522 12.6576 12.7166 12.7206 12.9812 12.9969 13.0077 13.0294 k = 0.5000 0.3812 0.2907 ( 2912 PWs) bands (ev): -3.6465 -3.6465 -3.6460 -3.6460 -1.5808 -1.5795 -1.5716 -1.5704 3.7585 3.7595 3.7740 3.7752 3.9983 3.9998 4.0076 4.0089 7.1999 7.2025 7.3090 7.3139 7.3424 7.3437 7.4044 7.4048 8.2617 8.2672 8.3391 8.3447 9.6182 9.6198 9.6956 9.6966 10.3479 10.3618 10.4351 10.4489 10.6629 10.6708 10.6832 10.6903 12.6482 12.6519 12.7164 12.7193 13.0088 13.0212 13.0536 13.0710 k = 0.5000 0.3812 0.3014 ( 2920 PWs) bands (ev): -3.6454 -3.6454 -3.6448 -3.6448 -1.5814 -1.5808 -1.5722 -1.5716 3.7562 3.7568 3.7726 3.7733 3.9895 3.9903 3.9995 4.0002 7.2044 7.2057 7.3177 7.3205 7.3456 7.3466 7.4112 7.4114 8.2800 8.2828 8.3587 8.3616 9.6065 9.6074 9.6842 9.6848 10.3566 10.3637 10.4441 10.4512 10.6644 10.6684 10.6848 10.6884 12.6461 12.6480 12.7163 12.7178 13.0301 13.0370 13.0901 13.1004 k = 0.5000 0.3812 0.3122 ( 2920 PWs) bands (ev): -3.6450 -3.6450 -3.6445 -3.6445 -1.5814 -1.5814 -1.5722 -1.5722 3.7557 3.7557 3.7724 3.7724 3.9868 3.9868 3.9971 3.9971 7.2064 7.2064 7.3216 7.3216 7.3471 7.3471 7.4136 7.4136 8.2871 8.2871 8.3663 8.3663 9.6028 9.6028 9.6806 9.6806 10.3620 10.3620 10.4496 10.4496 10.6663 10.6663 10.6866 10.6866 12.6460 12.6460 12.7167 12.7167 13.0404 13.0404 13.1080 13.1080 Writing output data file FeS2.save init_run : 0.37s CPU 0.60s WALL ( 1 calls) electrons : 343.77s CPU 346.02s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 343.76s CPU 346.01s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.15s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.05s WALL ( 460 calls) cegterg : 320.59s CPU 322.49s WALL ( 880 calls) Called by sum_band: Called by *egterg: h_psi : 191.21s CPU 198.90s WALL ( 15367 calls) s_psi : 26.27s CPU 26.80s WALL ( 15367 calls) g_psi : 0.32s CPU 0.47s WALL ( 14027 calls) cdiaghg : 85.81s CPU 83.69s WALL ( 14487 calls) cegterg:over : 16.56s CPU 12.63s WALL ( 14027 calls) cegterg:upda : 1.88s CPU 4.12s WALL ( 14027 calls) cegterg:last : 2.05s CPU 3.00s WALL ( 2735 calls) Called by h_psi: h_psi:vloc : 166.46s CPU 169.84s WALL ( 15367 calls) h_psi:vnl : 24.68s CPU 28.80s WALL ( 15367 calls) add_vuspsi : 12.61s CPU 16.83s WALL ( 15367 calls) General routines calbec : 12.06s CPU 11.94s WALL ( 15367 calls) fft : 0.01s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 164.52s CPU 164.22s WALL ( 1614504 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.02s CPU 0.16s WALL ( 920 calls) Parallel routines fft_scatter : 147.90s CPU 111.80s WALL ( 1614527 calls) PWSCF : 6m10.35s CPU 6m25.66s WALL This run was terminated on: 16:55:22 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=